NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
634032 | 6f61 | 34212 | cing | 4-filtered-FRED | STAR | entry | full | 248 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6f61 # This FRED archive file contains, for PDB entry <6f61>: # # - 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_6f61 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6f61 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3299.94 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 $purotoxin_6 A . 1 1 stop_ save_ save_purotoxin_6 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "purotoxin 6" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GYCATKGIKCNDIHCCSGLKCDSKRKVCVKG _Entity.Number_of_monomers 31 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 TYR . 1 1 3 CYS . 1 1 4 ALA . 1 1 5 THR . 1 1 6 LYS . 1 1 7 GLY . 1 1 8 ILE . 1 1 9 LYS . 1 1 10 CYS . 1 1 11 ASN . 1 1 12 ASP . 1 1 13 ILE . 1 1 14 HIS . 1 1 15 CYS . 1 1 16 CYS . 1 1 17 SER . 1 1 18 GLY . 1 1 19 LEU . 1 1 20 LYS . 1 1 21 CYS . 1 1 22 ASP . 1 1 23 SER . 1 1 24 LYS . 1 1 25 ARG . 1 1 26 LYS . 1 1 27 VAL . 1 1 28 CYS . 1 1 29 VAL . 1 1 30 LYS . 1 1 31 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 GLY 1 1 1 1 TYR 2 2 1 1 CYS 3 3 1 1 ALA 4 4 1 1 THR 5 5 1 1 LYS 6 6 1 1 GLY 7 7 1 1 ILE 8 8 1 1 LYS 9 9 1 1 CYS 10 10 1 1 ASN 11 11 1 1 ASP 12 12 1 1 ILE 13 13 1 1 HIS 14 14 1 1 CYS 15 15 1 1 CYS 16 16 1 1 SER 17 17 1 1 GLY 18 18 1 1 LEU 19 19 1 1 LYS 20 20 1 1 CYS 21 21 1 1 ASP 22 22 1 1 SER 23 23 1 1 LYS 24 24 1 1 ARG 25 25 1 1 LYS 26 26 1 1 VAL 27 27 1 1 CYS 28 28 1 1 VAL 29 29 1 1 LYS 30 30 1 1 GLY 31 31 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 GLY QA . 1 GLY QA 1 1 1 1 2 1 1 2 TYR H . 2 TYR H 1 1 2 1 1 1 1 2 TYR H . 2 TYR H 1 1 2 1 2 1 1 2 TYR HB2 . 2 TYR HB2 1 1 3 1 1 1 1 2 TYR H . 2 TYR H 1 1 3 1 2 1 1 2 TYR HB3 . 2 TYR HB3 1 1 4 1 1 1 1 2 TYR H . 2 TYR H 1 1 4 1 2 1 1 3 CYS H . 3 CYSS H 1 1 5 1 1 1 1 2 TYR HA . 2 TYR HA 1 1 5 1 2 1 1 3 CYS H . 3 CYSS H 1 1 6 1 1 1 1 2 TYR HB2 . 2 TYR HB2 1 1 6 1 2 1 1 3 CYS H . 3 CYSS H 1 1 7 1 1 1 1 2 TYR HB3 . 2 TYR HB3 1 1 7 1 2 1 1 3 CYS H . 3 CYSS H 1 1 8 1 1 1 1 3 CYS H . 3 CYSS H 1 1 8 1 2 1 1 3 CYS HB3 . 3 CYSS HB3 1 1 9 1 1 1 1 3 CYS HA . 3 CYSS HA 1 1 9 1 2 1 1 4 ALA H . 4 ALA H 1 1 10 1 1 1 1 3 CYS HB2 . 3 CYSS HB2 1 1 10 1 2 1 1 4 ALA H . 4 ALA H 1 1 11 1 1 1 1 3 CYS HB2 . 3 CYSS HB2 1 1 11 1 2 1 1 16 CYS H . 16 CYSS H 1 1 12 1 1 1 1 3 CYS HB2 . 3 CYSS HB2 1 1 12 1 2 1 1 16 CYS HA . 16 CYSS HA 1 1 13 1 1 1 1 3 CYS HB3 . 3 CYSS HB3 1 1 13 1 2 1 1 4 ALA H . 4 ALA H 1 1 14 1 1 1 1 3 CYS HB3 . 3 CYSS HB3 1 1 14 1 2 1 1 16 CYS H . 16 CYSS H 1 1 15 1 1 1 1 3 CYS HB3 . 3 CYSS HB3 1 1 15 1 2 1 1 16 CYS HA . 16 CYSS HA 1 1 16 1 1 1 1 4 ALA H . 4 ALA H 1 1 16 1 2 1 1 4 ALA MB . 4 ALA QB 1 1 17 1 1 1 1 4 ALA H . 4 ALA H 1 1 17 1 2 1 1 13 ILE MD . 13 ILE QD1 1 1 18 1 1 1 1 4 ALA H . 4 ALA H 1 1 18 1 2 1 1 13 ILE HG12 . 13 ILE HG12 1 1 19 1 1 1 1 4 ALA H . 4 ALA H 1 1 19 1 2 1 1 13 ILE MG . 13 ILE QG2 1 1 20 1 1 1 1 4 ALA H . 4 ALA H 1 1 20 1 2 1 1 15 CYS HA . 15 CYSS HA 1 1 21 1 1 1 1 4 ALA H . 4 ALA H 1 1 21 1 2 1 1 16 CYS H . 16 CYSS H 1 1 22 1 1 1 1 4 ALA HA . 4 ALA HA 1 1 22 1 2 1 1 5 THR H . 5 THR H 1 1 23 1 1 1 1 4 ALA HA . 4 ALA HA 1 1 23 1 2 1 1 8 ILE MG . 8 ILE QG2 1 1 24 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 24 1 2 1 1 5 THR H . 5 THR H 1 1 25 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 25 1 2 1 1 10 CYS HA . 10 CYSS HA 1 1 26 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 26 1 2 1 1 15 CYS H . 15 CYSS H 1 1 27 1 1 1 1 5 THR H . 5 THR H 1 1 27 1 2 1 1 5 THR HB . 5 THR HB 1 1 28 1 1 1 1 5 THR H . 5 THR H 1 1 28 1 2 1 1 5 THR MG . 5 THR QG2 1 1 29 1 1 1 1 5 THR H . 5 THR H 1 1 29 1 2 1 1 8 ILE HB . 8 ILE HB 1 1 30 1 1 1 1 5 THR H . 5 THR H 1 1 30 1 2 1 1 8 ILE MD . 8 ILE QD1 1 1 31 1 1 1 1 5 THR H . 5 THR H 1 1 31 1 2 1 1 8 ILE HG13 . 8 ILE HG12 1 1 32 1 1 1 1 5 THR H . 5 THR H 1 1 32 1 2 1 1 8 ILE MG . 8 ILE QG2 1 1 33 1 1 1 1 5 THR HA . 5 THR HA 1 1 33 1 2 1 1 5 THR MG . 5 THR QG2 1 1 34 1 1 1 1 5 THR HA . 5 THR HA 1 1 34 1 2 1 1 6 LYS H . 6 LYS H 1 1 35 1 1 1 1 5 THR HA . 5 THR HA 1 1 35 1 2 1 1 16 CYS H . 16 CYSS H 1 1 36 1 1 1 1 5 THR HA . 5 THR HA 1 1 36 1 2 1 1 19 LEU MD1 . 19 LEU QD1 1 1 37 1 1 1 1 5 THR HB . 5 THR HB 1 1 37 1 2 1 1 6 LYS H . 6 LYS H 1 1 38 1 1 1 1 5 THR MG . 5 THR QG2 1 1 38 1 2 1 1 6 LYS H . 6 LYS H 1 1 39 1 1 1 1 5 THR MG . 5 THR QG2 1 1 39 1 2 1 1 16 CYS H . 16 CYSS H 1 1 40 1 1 1 1 6 LYS H . 6 LYS H 1 1 40 1 2 1 1 6 LYS QB . 6 LYS QB 1 1 41 1 1 1 1 6 LYS H . 6 LYS H 1 1 41 1 2 1 1 19 LEU MD1 . 19 LEU QD1 1 1 42 1 1 1 1 6 LYS H . 6 LYS H 1 1 42 1 2 1 1 19 LEU MD2 . 19 LEU QD2 1 1 43 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 43 1 2 1 1 6 LYS QG . 6 LYS QG 1 1 44 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 44 1 2 1 1 7 GLY H . 7 GLY H 1 1 45 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 45 1 2 1 1 8 ILE H . 8 ILE H 1 1 46 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 46 1 2 1 1 19 LEU MD1 . 19 LEU QD1 1 1 47 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 47 1 2 1 1 19 LEU MD2 . 19 LEU QD2 1 1 48 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 48 1 2 1 1 28 CYS HB3 . 28 CYSS HB3 1 1 49 1 1 1 1 6 LYS QB . 6 LYS QB 1 1 49 1 2 1 1 7 GLY H . 7 GLY H 1 1 50 1 1 1 1 6 LYS QG . 6 LYS QG 1 1 50 1 2 1 1 7 GLY H . 7 GLY H 1 1 51 1 1 1 1 7 GLY H . 7 GLY H 1 1 51 1 2 1 1 7 GLY HA2 . 7 GLY HA3 1 1 52 1 1 1 1 7 GLY H . 7 GLY H 1 1 52 1 2 1 1 8 ILE H . 8 ILE H 1 1 53 1 1 1 1 7 GLY H . 7 GLY H 1 1 53 1 2 1 1 28 CYS H . 28 CYSS H 1 1 54 1 1 1 1 7 GLY H . 7 GLY H 1 1 54 1 2 1 1 28 CYS HB2 . 28 CYSS HB2 1 1 55 1 1 1 1 7 GLY HA2 . 7 GLY HA3 1 1 55 1 2 1 1 8 ILE H . 8 ILE H 1 1 56 1 1 1 1 7 GLY HA2 . 7 GLY HA3 1 1 56 1 2 1 1 27 VAL HB . 27 VAL HB 1 1 57 1 1 1 1 7 GLY HA2 . 7 GLY HA3 1 1 57 1 2 1 1 27 VAL MG1 . 27 VAL QG1 1 1 58 1 1 1 1 7 GLY HA2 . 7 GLY HA3 1 1 58 1 2 1 1 27 VAL MG2 . 27 VAL QG2 1 1 59 1 1 1 1 7 GLY HA3 . 7 GLY HA2 1 1 59 1 2 1 1 8 ILE H . 8 ILE H 1 1 60 1 1 1 1 8 ILE H . 8 ILE H 1 1 60 1 2 1 1 8 ILE HB . 8 ILE HB 1 1 61 1 1 1 1 8 ILE H . 8 ILE H 1 1 61 1 2 1 1 8 ILE MD . 8 ILE QD1 1 1 62 1 1 1 1 8 ILE H . 8 ILE H 1 1 62 1 2 1 1 8 ILE HG12 . 8 ILE HG13 1 1 63 1 1 1 1 8 ILE H . 8 ILE H 1 1 63 1 2 1 1 8 ILE HG13 . 8 ILE HG12 1 1 64 1 1 1 1 8 ILE H . 8 ILE H 1 1 64 1 2 1 1 8 ILE MG . 8 ILE QG2 1 1 65 1 1 1 1 8 ILE H . 8 ILE H 1 1 65 1 2 1 1 28 CYS H . 28 CYSS H 1 1 66 1 1 1 1 8 ILE H . 8 ILE H 1 1 66 1 2 1 1 28 CYS HB2 . 28 CYSS HB2 1 1 67 1 1 1 1 8 ILE HA . 8 ILE HA 1 1 67 1 2 1 1 9 LYS H . 9 LYS H 1 1 68 1 1 1 1 8 ILE HB . 8 ILE HB 1 1 68 1 2 1 1 9 LYS H . 9 LYS H 1 1 69 1 1 1 1 8 ILE MD . 8 ILE QD1 1 1 69 1 2 1 1 9 LYS H . 9 LYS H 1 1 70 1 1 1 1 8 ILE MG . 8 ILE QG2 1 1 70 1 2 1 1 9 LYS H . 9 LYS H 1 1 71 1 1 1 1 9 LYS H . 9 LYS H 1 1 71 1 2 1 1 9 LYS HB2 . 9 LYS HB3 1 1 72 1 1 1 1 9 LYS H . 9 LYS H 1 1 72 1 2 1 1 9 LYS HB3 . 9 LYS HB2 1 1 73 1 1 1 1 9 LYS H . 9 LYS H 1 1 73 1 2 1 1 9 LYS QD . 9 LYS QD 1 1 74 1 1 1 1 9 LYS H . 9 LYS H 1 1 74 1 2 1 1 9 LYS HG2 . 9 LYS HG2 1 1 75 1 1 1 1 9 LYS H . 9 LYS H 1 1 75 1 2 1 1 9 LYS HG3 . 9 LYS HG3 1 1 76 1 1 1 1 9 LYS H . 9 LYS H 1 1 76 1 2 1 1 27 VAL HA . 27 VAL HA 1 1 77 1 1 1 1 9 LYS HA . 9 LYS HA 1 1 77 1 2 1 1 10 CYS H . 10 CYSS H 1 1 78 1 1 1 1 9 LYS HA . 9 LYS HA 1 1 78 1 2 1 1 28 CYS H . 28 CYSS H 1 1 79 1 1 1 1 9 LYS HB2 . 9 LYS HB3 1 1 79 1 2 1 1 10 CYS H . 10 CYSS H 1 1 80 1 1 1 1 9 LYS HB2 . 9 LYS HB3 1 1 80 1 2 1 1 11 ASN H . 11 ASN H 1 1 81 1 1 1 1 9 LYS HB3 . 9 LYS HB2 1 1 81 1 2 1 1 10 CYS H . 10 CYSS H 1 1 82 1 1 1 1 9 LYS HB3 . 9 LYS HB2 1 1 82 1 2 1 1 11 ASN H . 11 ASN H 1 1 83 1 1 1 1 9 LYS QD . 9 LYS QD 1 1 83 1 2 1 1 10 CYS H . 10 CYSS H 1 1 84 1 1 1 1 10 CYS H . 10 CYSS H 1 1 84 1 2 1 1 10 CYS HB3 . 10 CYSS HB3 1 1 85 1 1 1 1 10 CYS H . 10 CYSS H 1 1 85 1 2 1 1 27 VAL HA . 27 VAL HA 1 1 86 1 1 1 1 10 CYS HA . 10 CYSS HA 1 1 86 1 2 1 1 10 CYS HB2 . 10 CYSS HB2 1 1 87 1 1 1 1 10 CYS HA . 10 CYSS HA 1 1 87 1 2 1 1 10 CYS HB3 . 10 CYSS HB3 1 1 88 1 1 1 1 10 CYS HA . 10 CYSS HA 1 1 88 1 2 1 1 11 ASN H . 11 ASN H 1 1 89 1 1 1 1 10 CYS HA . 10 CYSS HA 1 1 89 1 2 1 1 12 ASP H . 12 ASP H 1 1 90 1 1 1 1 10 CYS HA . 10 CYSS HA 1 1 90 1 2 1 1 13 ILE H . 13 ILE H 1 1 91 1 1 1 1 10 CYS HA . 10 CYSS HA 1 1 91 1 2 1 1 13 ILE MG . 13 ILE QG2 1 1 92 1 1 1 1 11 ASN H . 11 ASN H 1 1 92 1 2 1 1 11 ASN QB . 11 ASN QB 1 1 93 1 1 1 1 11 ASN H . 11 ASN H 1 1 93 1 2 1 1 12 ASP H . 12 ASP H 1 1 94 1 1 1 1 11 ASN HA . 11 ASN HA 1 1 94 1 2 1 1 12 ASP H . 12 ASP H 1 1 95 1 1 1 1 11 ASN QB . 11 ASN QB 1 1 95 1 2 1 1 12 ASP H . 12 ASP H 1 1 96 1 1 1 1 12 ASP H . 12 ASP H 1 1 96 1 2 1 1 12 ASP HB2 . 12 ASP HB2 1 1 97 1 1 1 1 12 ASP H . 12 ASP H 1 1 97 1 2 1 1 12 ASP HB3 . 12 ASP HB3 1 1 98 1 1 1 1 12 ASP H . 12 ASP H 1 1 98 1 2 1 1 13 ILE H . 13 ILE H 1 1 99 1 1 1 1 12 ASP HA . 12 ASP HA 1 1 99 1 2 1 1 13 ILE H . 13 ILE H 1 1 100 1 1 1 1 13 ILE H . 13 ILE H 1 1 100 1 2 1 1 13 ILE HB . 13 ILE HB 1 1 101 1 1 1 1 13 ILE H . 13 ILE H 1 1 101 1 2 1 1 13 ILE HG12 . 13 ILE HG12 1 1 102 1 1 1 1 13 ILE H . 13 ILE H 1 1 102 1 2 1 1 13 ILE HG13 . 13 ILE HG13 1 1 103 1 1 1 1 13 ILE H . 13 ILE H 1 1 103 1 2 1 1 13 ILE MG . 13 ILE QG2 1 1 104 1 1 1 1 13 ILE HA . 13 ILE HA 1 1 104 1 2 1 1 14 HIS H . 14 HIS H 1 1 105 1 1 1 1 13 ILE HB . 13 ILE HB 1 1 105 1 2 1 1 14 HIS H . 14 HIS H 1 1 106 1 1 1 1 13 ILE MD . 13 ILE QD1 1 1 106 1 2 1 1 14 HIS H . 14 HIS H 1 1 107 1 1 1 1 13 ILE HG12 . 13 ILE HG12 1 1 107 1 2 1 1 14 HIS H . 14 HIS H 1 1 108 1 1 1 1 13 ILE HG13 . 13 ILE HG13 1 1 108 1 2 1 1 14 HIS H . 14 HIS H 1 1 109 1 1 1 1 13 ILE MG . 13 ILE QG2 1 1 109 1 2 1 1 14 HIS H . 14 HIS H 1 1 110 1 1 1 1 14 HIS H . 14 HIS H 1 1 110 1 2 1 1 14 HIS QB . 14 HIS QB 1 1 111 1 1 1 1 14 HIS HA . 14 HIS HA 1 1 111 1 2 1 1 15 CYS H . 15 CYSS H 1 1 112 1 1 1 1 14 HIS QB . 14 HIS QB 1 1 112 1 2 1 1 15 CYS H . 15 CYSS H 1 1 113 1 1 1 1 15 CYS H . 15 CYSS H 1 1 113 1 2 1 1 15 CYS HB2 . 15 CYSS HB3 1 1 114 1 1 1 1 15 CYS H . 15 CYSS H 1 1 114 1 2 1 1 15 CYS HB3 . 15 CYSS HB2 1 1 115 1 1 1 1 15 CYS HA . 15 CYSS HA 1 1 115 1 2 1 1 16 CYS H . 16 CYSS H 1 1 116 1 1 1 1 15 CYS HB2 . 15 CYSS HB3 1 1 116 1 2 1 1 19 LEU HB2 . 19 LEU HB2 1 1 117 1 1 1 1 15 CYS HB2 . 15 CYSS HB3 1 1 117 1 2 1 1 19 LEU HB3 . 19 LEU HB3 1 1 118 1 1 1 1 15 CYS HB3 . 15 CYSS HB2 1 1 118 1 2 1 1 16 CYS H . 16 CYSS H 1 1 119 1 1 1 1 15 CYS HB3 . 15 CYSS HB2 1 1 119 1 2 1 1 19 LEU HB2 . 19 LEU HB2 1 1 120 1 1 1 1 15 CYS HB3 . 15 CYSS HB2 1 1 120 1 2 1 1 19 LEU HB3 . 19 LEU HB3 1 1 121 1 1 1 1 15 CYS HB3 . 15 CYSS HB2 1 1 121 1 2 1 1 19 LEU MD1 . 19 LEU QD1 1 1 122 1 1 1 1 16 CYS H . 16 CYSS H 1 1 122 1 2 1 1 16 CYS HB2 . 16 CYSS HB3 1 1 123 1 1 1 1 16 CYS H . 16 CYSS H 1 1 123 1 2 1 1 16 CYS HB3 . 16 CYSS HB2 1 1 124 1 1 1 1 16 CYS H . 16 CYSS H 1 1 124 1 2 1 1 19 LEU HB2 . 19 LEU HB2 1 1 125 1 1 1 1 16 CYS H . 16 CYSS H 1 1 125 1 2 1 1 19 LEU MD1 . 19 LEU QD1 1 1 126 1 1 1 1 16 CYS HA . 16 CYSS HA 1 1 126 1 2 1 1 16 CYS HB3 . 16 CYSS HB2 1 1 127 1 1 1 1 16 CYS HA . 16 CYSS HA 1 1 127 1 2 1 1 17 SER H . 17 SER H 1 1 128 1 1 1 1 16 CYS HB2 . 16 CYSS HB3 1 1 128 1 2 1 1 17 SER H . 17 SER H 1 1 129 1 1 1 1 16 CYS HB2 . 16 CYSS HB3 1 1 129 1 2 1 1 19 LEU MD1 . 19 LEU QD1 1 1 130 1 1 1 1 16 CYS HB2 . 16 CYSS HB3 1 1 130 1 2 1 1 19 LEU HG . 19 LEU HG 1 1 131 1 1 1 1 16 CYS HB3 . 16 CYSS HB2 1 1 131 1 2 1 1 17 SER H . 17 SER H 1 1 132 1 1 1 1 16 CYS HB3 . 16 CYSS HB2 1 1 132 1 2 1 1 19 LEU MD1 . 19 LEU QD1 1 1 133 1 1 1 1 17 SER H . 17 SER H 1 1 133 1 2 1 1 17 SER QB . 17 SER QB 1 1 134 1 1 1 1 17 SER HA . 17 SER HA 1 1 134 1 2 1 1 18 GLY H . 18 GLY H 1 1 135 1 1 1 1 17 SER HA . 17 SER HA 1 1 135 1 2 1 1 19 LEU H . 19 LEU H 1 1 136 1 1 1 1 17 SER QB . 17 SER QB 1 1 136 1 2 1 1 18 GLY H . 18 GLY H 1 1 137 1 1 1 1 18 GLY H . 18 GLY H 1 1 137 1 2 1 1 18 GLY HA3 . 18 GLY HA3 1 1 138 1 1 1 1 18 GLY H . 18 GLY H 1 1 138 1 2 1 1 19 LEU H . 19 LEU H 1 1 139 1 1 1 1 18 GLY HA2 . 18 GLY HA2 1 1 139 1 2 1 1 19 LEU H . 19 LEU H 1 1 140 1 1 1 1 18 GLY HA3 . 18 GLY HA3 1 1 140 1 2 1 1 19 LEU H . 19 LEU H 1 1 141 1 1 1 1 19 LEU H . 19 LEU H 1 1 141 1 2 1 1 19 LEU HB2 . 19 LEU HB2 1 1 142 1 1 1 1 19 LEU H . 19 LEU H 1 1 142 1 2 1 1 19 LEU HB3 . 19 LEU HB3 1 1 143 1 1 1 1 19 LEU H . 19 LEU H 1 1 143 1 2 1 1 19 LEU MD1 . 19 LEU QD1 1 1 144 1 1 1 1 19 LEU H . 19 LEU H 1 1 144 1 2 1 1 19 LEU MD2 . 19 LEU QD2 1 1 145 1 1 1 1 19 LEU H . 19 LEU H 1 1 145 1 2 1 1 19 LEU HG . 19 LEU HG 1 1 146 1 1 1 1 19 LEU HA . 19 LEU HA 1 1 146 1 2 1 1 19 LEU HB3 . 19 LEU HB3 1 1 147 1 1 1 1 19 LEU HA . 19 LEU HA 1 1 147 1 2 1 1 19 LEU MD2 . 19 LEU QD2 1 1 148 1 1 1 1 19 LEU HA . 19 LEU HA 1 1 148 1 2 1 1 19 LEU HG . 19 LEU HG 1 1 149 1 1 1 1 19 LEU HA . 19 LEU HA 1 1 149 1 2 1 1 20 LYS H . 20 LYS H 1 1 150 1 1 1 1 19 LEU HA . 19 LEU HA 1 1 150 1 2 1 1 31 GLY H . 31 GLY H 1 1 151 1 1 1 1 19 LEU HB2 . 19 LEU HB2 1 1 151 1 2 1 1 20 LYS H . 20 LYS H 1 1 152 1 1 1 1 19 LEU HB2 . 19 LEU HB2 1 1 152 1 2 1 1 28 CYS HB3 . 28 CYSS HB3 1 1 153 1 1 1 1 19 LEU HB3 . 19 LEU HB3 1 1 153 1 2 1 1 20 LYS H . 20 LYS H 1 1 154 1 1 1 1 19 LEU HB3 . 19 LEU HB3 1 1 154 1 2 1 1 28 CYS HB3 . 28 CYSS HB3 1 1 155 1 1 1 1 19 LEU HB3 . 19 LEU HB3 1 1 155 1 2 1 1 29 VAL H . 29 VAL H 1 1 156 1 1 1 1 19 LEU MD1 . 19 LEU QD1 1 1 156 1 2 1 1 20 LYS H . 20 LYS H 1 1 157 1 1 1 1 19 LEU MD1 . 19 LEU QD1 1 1 157 1 2 1 1 28 CYS HB2 . 28 CYSS HB2 1 1 158 1 1 1 1 19 LEU MD1 . 19 LEU QD1 1 1 158 1 2 1 1 28 CYS HB3 . 28 CYSS HB3 1 1 159 1 1 1 1 19 LEU MD2 . 19 LEU QD2 1 1 159 1 2 1 1 20 LYS H . 20 LYS H 1 1 160 1 1 1 1 19 LEU MD2 . 19 LEU QD2 1 1 160 1 2 1 1 28 CYS HB3 . 28 CYSS HB3 1 1 161 1 1 1 1 19 LEU MD2 . 19 LEU QD2 1 1 161 1 2 1 1 29 VAL H . 29 VAL H 1 1 162 1 1 1 1 19 LEU MD2 . 19 LEU QD2 1 1 162 1 2 1 1 30 LYS H . 30 LYS H 1 1 163 1 1 1 1 19 LEU MD2 . 19 LEU QD2 1 1 163 1 2 1 1 30 LYS HA . 30 LYS HA 1 1 164 1 1 1 1 19 LEU MD2 . 19 LEU QD2 1 1 164 1 2 1 1 31 GLY H . 31 GLY H 1 1 165 1 1 1 1 20 LYS H . 20 LYS H 1 1 165 1 2 1 1 20 LYS QB . 20 LYS QB 1 1 166 1 1 1 1 20 LYS H . 20 LYS H 1 1 166 1 2 1 1 20 LYS QG . 20 LYS QG 1 1 167 1 1 1 1 20 LYS H . 20 LYS H 1 1 167 1 2 1 1 28 CYS HA . 28 CYSS HA 1 1 168 1 1 1 1 20 LYS H . 20 LYS H 1 1 168 1 2 1 1 29 VAL H . 29 VAL H 1 1 169 1 1 1 1 20 LYS H . 20 LYS H 1 1 169 1 2 1 1 29 VAL MG2 . 29 VAL QG2 1 1 170 1 1 1 1 20 LYS HA . 20 LYS HA 1 1 170 1 2 1 1 21 CYS H . 21 CYSS H 1 1 171 1 1 1 1 20 LYS QB . 20 LYS QB 1 1 171 1 2 1 1 21 CYS H . 21 CYSS H 1 1 172 1 1 1 1 21 CYS H . 21 CYSS H 1 1 172 1 2 1 1 21 CYS HB2 . 21 CYSS HB2 1 1 173 1 1 1 1 21 CYS H . 21 CYSS H 1 1 173 1 2 1 1 21 CYS HB3 . 21 CYSS HB3 1 1 174 1 1 1 1 21 CYS HA . 21 CYSS HA 1 1 174 1 2 1 1 22 ASP H . 22 ASP H 1 1 175 1 1 1 1 22 ASP H . 22 ASP H 1 1 175 1 2 1 1 22 ASP HB2 . 22 ASP HB2 1 1 176 1 1 1 1 22 ASP H . 22 ASP H 1 1 176 1 2 1 1 22 ASP HB3 . 22 ASP HB3 1 1 177 1 1 1 1 22 ASP H . 22 ASP H 1 1 177 1 2 1 1 27 VAL H . 27 VAL H 1 1 178 1 1 1 1 22 ASP H . 22 ASP H 1 1 178 1 2 1 1 27 VAL MG2 . 27 VAL QG2 1 1 179 1 1 1 1 22 ASP H . 22 ASP H 1 1 179 1 2 1 1 28 CYS HA . 28 CYSS HA 1 1 180 1 1 1 1 22 ASP H . 22 ASP H 1 1 180 1 2 1 1 29 VAL MG1 . 29 VAL QG1 1 1 181 1 1 1 1 22 ASP H . 22 ASP H 1 1 181 1 2 1 1 29 VAL MG2 . 29 VAL QG2 1 1 182 1 1 1 1 22 ASP HA . 22 ASP HA 1 1 182 1 2 1 1 22 ASP HB2 . 22 ASP HB2 1 1 183 1 1 1 1 22 ASP HA . 22 ASP HA 1 1 183 1 2 1 1 23 SER H . 23 SER H 1 1 184 1 1 1 1 22 ASP HB2 . 22 ASP HB2 1 1 184 1 2 1 1 27 VAL H . 27 VAL H 1 1 185 1 1 1 1 22 ASP HB2 . 22 ASP HB2 1 1 185 1 2 1 1 29 VAL MG1 . 29 VAL QG1 1 1 186 1 1 1 1 22 ASP HB2 . 22 ASP HB2 1 1 186 1 2 1 1 29 VAL MG2 . 29 VAL QG2 1 1 187 1 1 1 1 22 ASP HB3 . 22 ASP HB3 1 1 187 1 2 1 1 25 ARG H . 25 ARG H 1 1 188 1 1 1 1 22 ASP HB3 . 22 ASP HB3 1 1 188 1 2 1 1 25 ARG HB2 . 25 ARG HB2 1 1 189 1 1 1 1 22 ASP HB3 . 22 ASP HB3 1 1 189 1 2 1 1 26 LYS H . 26 LYS H 1 1 190 1 1 1 1 22 ASP HB3 . 22 ASP HB3 1 1 190 1 2 1 1 27 VAL H . 27 VAL H 1 1 191 1 1 1 1 22 ASP HB3 . 22 ASP HB3 1 1 191 1 2 1 1 29 VAL MG1 . 29 VAL QG1 1 1 192 1 1 1 1 22 ASP HB3 . 22 ASP HB3 1 1 192 1 2 1 1 29 VAL MG2 . 29 VAL QG2 1 1 193 1 1 1 1 23 SER H . 23 SER H 1 1 193 1 2 1 1 23 SER HA . 23 SER HA 1 1 194 1 1 1 1 23 SER H . 23 SER H 1 1 194 1 2 1 1 23 SER QB . 23 SER QB 1 1 195 1 1 1 1 23 SER H . 23 SER H 1 1 195 1 2 1 1 24 LYS H . 24 LYS H 1 1 196 1 1 1 1 23 SER HA . 23 SER HA 1 1 196 1 2 1 1 24 LYS H . 24 LYS H 1 1 197 1 1 1 1 23 SER QB . 23 SER QB 1 1 197 1 2 1 1 24 LYS H . 24 LYS H 1 1 198 1 1 1 1 23 SER QB . 23 SER QB 1 1 198 1 2 1 1 26 LYS H . 26 LYS H 1 1 199 1 1 1 1 24 LYS H . 24 LYS H 1 1 199 1 2 1 1 24 LYS QB . 24 LYS QB 1 1 200 1 1 1 1 24 LYS H . 24 LYS H 1 1 200 1 2 1 1 24 LYS QD . 24 LYS QD 1 1 201 1 1 1 1 24 LYS H . 24 LYS H 1 1 201 1 2 1 1 24 LYS HG2 . 24 LYS HG2 1 1 202 1 1 1 1 24 LYS H . 24 LYS H 1 1 202 1 2 1 1 25 ARG H . 25 ARG H 1 1 203 1 1 1 1 24 LYS H . 24 LYS H 1 1 203 1 2 1 1 26 LYS H . 26 LYS H 1 1 204 1 1 1 1 24 LYS HA . 24 LYS HA 1 1 204 1 2 1 1 25 ARG H . 25 ARG H 1 1 205 1 1 1 1 24 LYS QB . 24 LYS QB 1 1 205 1 2 1 1 25 ARG H . 25 ARG H 1 1 206 1 1 1 1 25 ARG H . 25 ARG H 1 1 206 1 2 1 1 25 ARG HB2 . 25 ARG HB2 1 1 207 1 1 1 1 25 ARG H . 25 ARG H 1 1 207 1 2 1 1 25 ARG HB3 . 25 ARG HB3 1 1 208 1 1 1 1 25 ARG H . 25 ARG H 1 1 208 1 2 1 1 25 ARG QG . 25 ARG QG 1 1 209 1 1 1 1 25 ARG H . 25 ARG H 1 1 209 1 2 1 1 26 LYS H . 26 LYS H 1 1 210 1 1 1 1 25 ARG HA . 25 ARG HA 1 1 210 1 2 1 1 26 LYS H . 26 LYS H 1 1 211 1 1 1 1 25 ARG HB2 . 25 ARG HB2 1 1 211 1 2 1 1 25 ARG HD2 . 25 ARG HD2 1 1 212 1 1 1 1 25 ARG HB2 . 25 ARG HB2 1 1 212 1 2 1 1 26 LYS H . 26 LYS H 1 1 213 1 1 1 1 25 ARG HB2 . 25 ARG HB2 1 1 213 1 2 1 1 27 VAL H . 27 VAL H 1 1 214 1 1 1 1 25 ARG HB3 . 25 ARG HB3 1 1 214 1 2 1 1 25 ARG HD2 . 25 ARG HD2 1 1 215 1 1 1 1 25 ARG HB3 . 25 ARG HB3 1 1 215 1 2 1 1 27 VAL MG2 . 27 VAL QG2 1 1 216 1 1 1 1 26 LYS H . 26 LYS H 1 1 216 1 2 1 1 26 LYS HA . 26 LYS HA 1 1 217 1 1 1 1 26 LYS H . 26 LYS H 1 1 217 1 2 1 1 26 LYS HB2 . 26 LYS HB2 1 1 218 1 1 1 1 26 LYS H . 26 LYS H 1 1 218 1 2 1 1 26 LYS HB3 . 26 LYS HB3 1 1 219 1 1 1 1 26 LYS H . 26 LYS H 1 1 219 1 2 1 1 26 LYS HG2 . 26 LYS HG2 1 1 220 1 1 1 1 26 LYS H . 26 LYS H 1 1 220 1 2 1 1 26 LYS HG3 . 26 LYS HG3 1 1 221 1 1 1 1 26 LYS H . 26 LYS H 1 1 221 1 2 1 1 27 VAL H . 27 VAL H 1 1 222 1 1 1 1 26 LYS HA . 26 LYS HA 1 1 222 1 2 1 1 27 VAL H . 27 VAL H 1 1 223 1 1 1 1 26 LYS HB2 . 26 LYS HB2 1 1 223 1 2 1 1 27 VAL H . 27 VAL H 1 1 224 1 1 1 1 26 LYS HB3 . 26 LYS HB3 1 1 224 1 2 1 1 27 VAL H . 27 VAL H 1 1 225 1 1 1 1 27 VAL H . 27 VAL H 1 1 225 1 2 1 1 27 VAL MG1 . 27 VAL QG1 1 1 226 1 1 1 1 27 VAL H . 27 VAL H 1 1 226 1 2 1 1 27 VAL MG2 . 27 VAL QG2 1 1 227 1 1 1 1 27 VAL HA . 27 VAL HA 1 1 227 1 2 1 1 27 VAL HB . 27 VAL HB 1 1 228 1 1 1 1 27 VAL HA . 27 VAL HA 1 1 228 1 2 1 1 28 CYS H . 28 CYSS H 1 1 229 1 1 1 1 27 VAL HB . 27 VAL HB 1 1 229 1 2 1 1 28 CYS H . 28 CYSS H 1 1 230 1 1 1 1 27 VAL MG1 . 27 VAL QG1 1 1 230 1 2 1 1 28 CYS H . 28 CYSS H 1 1 231 1 1 1 1 27 VAL MG2 . 27 VAL QG2 1 1 231 1 2 1 1 28 CYS H . 28 CYSS H 1 1 232 1 1 1 1 28 CYS H . 28 CYSS H 1 1 232 1 2 1 1 28 CYS HB2 . 28 CYSS HB2 1 1 233 1 1 1 1 28 CYS H . 28 CYSS H 1 1 233 1 2 1 1 28 CYS HB3 . 28 CYSS HB3 1 1 234 1 1 1 1 28 CYS HA . 28 CYSS HA 1 1 234 1 2 1 1 29 VAL H . 29 VAL H 1 1 235 1 1 1 1 28 CYS HB2 . 28 CYSS HB2 1 1 235 1 2 1 1 29 VAL H . 29 VAL H 1 1 236 1 1 1 1 28 CYS HB3 . 28 CYSS HB3 1 1 236 1 2 1 1 29 VAL H . 29 VAL H 1 1 237 1 1 1 1 29 VAL H . 29 VAL H 1 1 237 1 2 1 1 29 VAL MG1 . 29 VAL QG1 1 1 238 1 1 1 1 29 VAL H . 29 VAL H 1 1 238 1 2 1 1 29 VAL MG2 . 29 VAL QG2 1 1 239 1 1 1 1 29 VAL HA . 29 VAL HA 1 1 239 1 2 1 1 29 VAL HB . 29 VAL HB 1 1 240 1 1 1 1 29 VAL HA . 29 VAL HA 1 1 240 1 2 1 1 30 LYS H . 30 LYS H 1 1 241 1 1 1 1 29 VAL HB . 29 VAL HB 1 1 241 1 2 1 1 30 LYS H . 30 LYS H 1 1 242 1 1 1 1 29 VAL MG1 . 29 VAL QG1 1 1 242 1 2 1 1 30 LYS H . 30 LYS H 1 1 243 1 1 1 1 29 VAL MG2 . 29 VAL QG2 1 1 243 1 2 1 1 30 LYS H . 30 LYS H 1 1 244 1 1 1 1 30 LYS H . 30 LYS H 1 1 244 1 2 1 1 30 LYS HB2 . 30 LYS HB2 1 1 245 1 1 1 1 30 LYS H . 30 LYS H 1 1 245 1 2 1 1 30 LYS HB3 . 30 LYS HB3 1 1 246 1 1 1 1 30 LYS H . 30 LYS H 1 1 246 1 2 1 1 30 LYS QG . 30 LYS QG 1 1 247 1 1 1 1 30 LYS HA . 30 LYS HA 1 1 247 1 2 1 1 31 GLY H . 31 GLY H 1 1 248 1 1 1 1 30 LYS QG . 30 LYS QG 1 1 248 1 2 1 1 31 GLY H . 31 GLY H 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 . . . . . . . 3.25 1 1 2 1 . . . . . . . 3.58 1 1 3 1 . . . . . . . 3.54 1 1 4 1 . . . . . . . 4.11 1 1 5 1 . . . . . . . 2.82 1 1 6 1 . . . . . . . 4.56 1 1 7 1 . . . . . . . 4.52 1 1 8 1 . . . . . . . 3.96 1 1 9 1 . . . . . . . 3.7 1 1 10 1 . . . . . . . 3.26 1 1 11 1 . . . . . . . 3.69 1 1 12 1 . . . . . . . 3.15 1 1 13 1 . . . . . . . 3.98 1 1 14 1 . . . . . . . 4.97 1 1 15 1 . . . . . . . 3.49 1 1 16 1 . . . . . . . 2.84 1 1 17 1 . . . . . . . 4.48 1 1 18 1 . . . . . . . 4.55 1 1 19 1 . . . . . . . 3.84 1 1 20 1 . . . . . . . 3.16 1 1 21 1 . . . . . . . 4.02 1 1 22 1 . . . . . . . 2.62 1 1 23 1 . . . . . . . 3.84 1 1 24 1 . . . . . . . 3.26 1 1 25 1 . . . . . . . 4.04 1 1 26 1 . . . . . . . 4.95 1 1 27 1 . . . . . . . 3.5 1 1 28 1 . . . . . . . 3.2 1 1 29 1 . . . . . . . 3.53 1 1 30 1 . . . . . . . 3.89 1 1 31 1 . . . . . . . 3.55 1 1 32 1 . . . . . . . 3.92 1 1 33 1 . . . . . . . 2.95 1 1 34 1 . . . . . . . 3.12 1 1 35 1 . . . . . . . 4.43 1 1 36 1 . . . . . . . 3.16 1 1 37 1 . . . . . . . 3.12 1 1 38 1 . . . . . . . 3.74 1 1 39 1 . . . . . . . 3.84 1 1 40 1 . . . . . . . 2.68 1 1 41 1 . . . . . . . 3.36 1 1 42 1 . . . . . . . 4.53 1 1 43 1 . . . . . . . 3.14 1 1 44 1 . . . . . . . 2.54 1 1 45 1 . . . . . . . 4.22 1 1 46 1 . . . . . . . 3.36 1 1 47 1 . . . . . . . 3.64 1 1 48 1 . . . . . . . 3.71 1 1 49 1 . . . . . . . 4.01 1 1 50 1 . . . . . . . 3.64 1 1 51 1 . . . . . . . 2.84 1 1 52 1 . . . . . . . 3.32 1 1 53 1 . . . . . . . 4.69 1 1 54 1 . . . . . . . 3.55 1 1 55 1 . . . . . . . 4.31 1 1 56 1 . . . . . . . 3.68 1 1 57 1 . . . . . . . 3.82 1 1 58 1 . . . . . . . 3.9 1 1 59 1 . . . . . . . 3.9 1 1 60 1 . . . . . . . 2.74 1 1 61 1 . . . . . . . 3.92 1 1 62 1 . . . . . . . 2.99 1 1 63 1 . . . . . . . 3.77 1 1 64 1 . . . . . . . 3.92 1 1 65 1 . . . . . . . 3.78 1 1 66 1 . . . . . . . 3.7 1 1 67 1 . . . . . . . 2.68 1 1 68 1 . . . . . . . 4.46 1 1 69 1 . . . . . . . 3.89 1 1 70 1 . . . . . . . 2.97 1 1 71 1 . . . . . . . 2.97 1 1 72 1 . . . . . . . 3.7 1 1 73 1 . . . . . . . 4.06 1 1 74 1 . . . . . . . 3.44 1 1 75 1 . . . . . . . 3.78 1 1 76 1 . . . . . . . 5.27 1 1 77 1 . . . . . . . 2.58 1 1 78 1 . . . . . . . 4.35 1 1 79 1 . . . . . . . 4.77 1 1 80 1 . . . . . . . 5.02 1 1 81 1 . . . . . . . 3.83 1 1 82 1 . . . . . . . 3.73 1 1 83 1 . . . . . . . 4.24 1 1 84 1 . . . . . . . 4.02 1 1 85 1 . . . . . . . 3.32 1 1 86 1 . . . . . . . 3.13 1 1 87 1 . . . . . . . 2.96 1 1 88 1 . . . . . . . 3.62 1 1 89 1 . . . . . . . 4.54 1 1 90 1 . . . . . . . 3.84 1 1 91 1 . . . . . . . 3.53 1 1 92 1 . . . . . . . 3.17 1 1 93 1 . . . . . . . 3.17 1 1 94 1 . . . . . . . 3.88 1 1 95 1 . . . . . . . 3.46 1 1 96 1 . . . . . . . 3.95 1 1 97 1 . . . . . . . 3.64 1 1 98 1 . . . . . . . 2.95 1 1 99 1 . . . . . . . 4.17 1 1 100 1 . . . . . . . 3.6 1 1 101 1 . . . . . . . 5.5 1 1 102 1 . . . . . . . 5.5 1 1 103 1 . . . . . . . 3.73 1 1 104 1 . . . . . . . 2.77 1 1 105 1 . . . . . . . 4.35 1 1 106 1 . . . . . . . 4.31 1 1 107 1 . . . . . . . 3.9 1 1 108 1 . . . . . . . 3.78 1 1 109 1 . . . . . . . 3.97 1 1 110 1 . . . . . . . 2.93 1 1 111 1 . . . . . . . 3.44 1 1 112 1 . . . . . . . 3.21 1 1 113 1 . . . . . . . 3.02 1 1 114 1 . . . . . . . 4.13 1 1 115 1 . . . . . . . 2.64 1 1 116 1 . . . . . . . 3.43 1 1 117 1 . . . . . . . 3.44 1 1 118 1 . . . . . . . 3.39 1 1 119 1 . . . . . . . 2.67 1 1 120 1 . . . . . . . 3.18 1 1 121 1 . . . . . . . 3.67 1 1 122 1 . . . . . . . 3.02 1 1 123 1 . . . . . . . 4.03 1 1 124 1 . . . . . . . 4.74 1 1 125 1 . . . . . . . 3.38 1 1 126 1 . . . . . . . 3.12 1 1 127 1 . . . . . . . 2.85 1 1 128 1 . . . . . . . 4.07 1 1 129 1 . . . . . . . 3.04 1 1 130 1 . . . . . . . 4.37 1 1 131 1 . . . . . . . 3.01 1 1 132 1 . . . . . . . 4.35 1 1 133 1 . . . . . . . 2.9 1 1 134 1 . . . . . . . 2.6 1 1 135 1 . . . . . . . 3.94 1 1 136 1 . . . . . . . 3.73 1 1 137 1 . . . . . . . 2.9 1 1 138 1 . . . . . . . 3.21 1 1 139 1 . . . . . . . 4.45 1 1 140 1 . . . . . . . 4.45 1 1 141 1 . . . . . . . 3.13 1 1 142 1 . . . . . . . 3.81 1 1 143 1 . . . . . . . 4.52 1 1 144 1 . . . . . . . 4.61 1 1 145 1 . . . . . . . 3.97 1 1 146 1 . . . . . . . 2.78 1 1 147 1 . . . . . . . 3.2 1 1 148 1 . . . . . . . 3.72 1 1 149 1 . . . . . . . 2.75 1 1 150 1 . . . . . . . 3.27 1 1 151 1 . . . . . . . 4.24 1 1 152 1 . . . . . . . 3.83 1 1 153 1 . . . . . . . 2.92 1 1 154 1 . . . . . . . 2.89 1 1 155 1 . . . . . . . 3.88 1 1 156 1 . . . . . . . 5.5 1 1 157 1 . . . . . . . 3.78 1 1 158 1 . . . . . . . 2.95 1 1 159 1 . . . . . . . 4.27 1 1 160 1 . . . . . . . 3.96 1 1 161 1 . . . . . . . 4.83 1 1 162 1 . . . . . . . 4.13 1 1 163 1 . . . . . . . 3.01 1 1 164 1 . . . . . . . 4.65 1 1 165 1 . . . . . . . 3.29 1 1 166 1 . . . . . . . 3.6 1 1 167 1 . . . . . . . 5.0 1 1 168 1 . . . . . . . 3.31 1 1 169 1 . . . . . . . 3.88 1 1 170 1 . . . . . . . 2.75 1 1 171 1 . . . . . . . 3.26 1 1 172 1 . . . . . . . 3.16 1 1 173 1 . . . . . . . 3.1 1 1 174 1 . . . . . . . 3.32 1 1 175 1 . . . . . . . 2.9 1 1 176 1 . . . . . . . 3.02 1 1 177 1 . . . . . . . 3.64 1 1 178 1 . . . . . . . 5.44 1 1 179 1 . . . . . . . 4.16 1 1 180 1 . . . . . . . 4.45 1 1 181 1 . . . . . . . 3.94 1 1 182 1 . . . . . . . 3.04 1 1 183 1 . . . . . . . 2.68 1 1 184 1 . . . . . . . 3.92 1 1 185 1 . . . . . . . 3.15 1 1 186 1 . . . . . . . 3.08 1 1 187 1 . . . . . . . 3.69 1 1 188 1 . . . . . . . 3.22 1 1 189 1 . . . . . . . 3.51 1 1 190 1 . . . . . . . 2.99 1 1 191 1 . . . . . . . 3.94 1 1 192 1 . . . . . . . 4.19 1 1 193 1 . . . . . . . 3.08 1 1 194 1 . . . . . . . 3.52 1 1 195 1 . . . . . . . 3.52 1 1 196 1 . . . . . . . 3.98 1 1 197 1 . . . . . . . 4.43 1 1 198 1 . . . . . . . 5.15 1 1 199 1 . . . . . . . 2.88 1 1 200 1 . . . . . . . 4.62 1 1 201 1 . . . . . . . 3.99 1 1 202 1 . . . . . . . 2.96 1 1 203 1 . . . . . . . 4.35 1 1 204 1 . . . . . . . 4.9 1 1 205 1 . . . . . . . 3.14 1 1 206 1 . . . . . . . 3.01 1 1 207 1 . . . . . . . 4.12 1 1 208 1 . . . . . . . 3.08 1 1 209 1 . . . . . . . 3.01 1 1 210 1 . . . . . . . 4.38 1 1 211 1 . . . . . . . 4.23 1 1 212 1 . . . . . . . 3.96 1 1 213 1 . . . . . . . 3.77 1 1 214 1 . . . . . . . 4.32 1 1 215 1 . . . . . . . 3.33 1 1 216 1 . . . . . . . 2.67 1 1 217 1 . . . . . . . 4.39 1 1 218 1 . . . . . . . 3.92 1 1 219 1 . . . . . . . 4.62 1 1 220 1 . . . . . . . 3.66 1 1 221 1 . . . . . . . 3.45 1 1 222 1 . . . . . . . 3.08 1 1 223 1 . . . . . . . 4.9 1 1 224 1 . . . . . . . 4.68 1 1 225 1 . . . . . . . 3.82 1 1 226 1 . . . . . . . 3.23 1 1 227 1 . . . . . . . 3.06 1 1 228 1 . . . . . . . 2.77 1 1 229 1 . . . . . . . 3.14 1 1 230 1 . . . . . . . 3.86 1 1 231 1 . . . . . . . 4.14 1 1 232 1 . . . . . . . 2.97 1 1 233 1 . . . . . . . 3.88 1 1 234 1 . . . . . . . 2.55 1 1 235 1 . . . . . . . 5.5 1 1 236 1 . . . . . . . 3.83 1 1 237 1 . . . . . . . 3.61 1 1 238 1 . . . . . . . 2.91 1 1 239 1 . . . . . . . 3.03 1 1 240 1 . . . . . . . 3.01 1 1 241 1 . . . . . . . 2.89 1 1 242 1 . . . . . . . 4.41 1 1 243 1 . . . . . . . 4.17 1 1 244 1 . . . . . . . 3.31 1 1 245 1 . . . . . . . 3.02 1 1 246 1 . . . . . . . 4.55 1 1 247 1 . . . . . . . 2.83 1 1 248 1 . . . . . . . 4.14 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C 3.565 -0.141 -1.033 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 2.071 0.001 -1.247 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 1.811 -0.001 0.854 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY HA2 H 1.727 -0.819 -1.859 1.00 . A A . 1 GLY HA2 1 1 1 5 1 1 1 GLY HA3 H 1.880 0.929 -1.766 1.00 . A A . 1 GLY HA3 1 1 1 6 1 1 1 GLY N N 1.330 0.000 0.000 1.00 . A A . 1 GLY N 1 1 1 7 1 1 1 GLY O O 4.097 -1.251 -1.035 1.00 . A A . 1 GLY O 1 1 1 8 1 1 2 TYR C C 6.163 2.333 -0.110 1.00 . A A . 2 TYR C 1 1 1 9 1 1 2 TYR CA C 5.687 0.983 -0.639 1.00 . A A . 2 TYR CA 1 1 1 10 1 1 2 TYR CB C 6.414 0.649 -1.943 1.00 . A A . 2 TYR CB 1 1 1 11 1 1 2 TYR CD1 C 8.551 0.024 -0.751 1.00 . A A . 2 TYR CD1 1 1 1 12 1 1 2 TYR CD2 C 8.714 1.299 -2.758 1.00 . A A . 2 TYR CD2 1 1 1 13 1 1 2 TYR CE1 C 9.927 0.029 -0.630 1.00 . A A . 2 TYR CE1 1 1 1 14 1 1 2 TYR CE2 C 10.091 1.308 -2.645 1.00 . A A . 2 TYR CE2 1 1 1 15 1 1 2 TYR CG C 7.921 0.657 -1.815 1.00 . A A . 2 TYR CG 1 1 1 16 1 1 2 TYR CZ C 10.693 0.672 -1.580 1.00 . A A . 2 TYR CZ 1 1 1 17 1 1 2 TYR H H 3.765 1.841 -0.860 1.00 . A A . 2 TYR H 1 1 1 18 1 1 2 TYR HA H 5.914 0.222 0.093 1.00 . A A . 2 TYR HA 1 1 1 19 1 1 2 TYR HB2 H 6.115 -0.334 -2.272 1.00 . A A . 2 TYR HB2 1 1 1 20 1 1 2 TYR HB3 H 6.141 1.374 -2.696 1.00 . A A . 2 TYR HB3 1 1 1 21 1 1 2 TYR HD1 H 7.948 -0.479 -0.008 1.00 . A A . 2 TYR HD1 1 1 1 22 1 1 2 TYR HD2 H 8.240 1.797 -3.591 1.00 . A A . 2 TYR HD2 1 1 1 23 1 1 2 TYR HE1 H 10.398 -0.469 0.205 1.00 . A A . 2 TYR HE1 1 1 1 24 1 1 2 TYR HE2 H 10.691 1.812 -3.389 1.00 . A A . 2 TYR HE2 1 1 1 25 1 1 2 TYR HH H 12.408 -0.190 -1.679 1.00 . A A . 2 TYR HH 1 1 1 26 1 1 2 TYR N N 4.245 0.986 -0.851 1.00 . A A . 2 TYR N 1 1 1 27 1 1 2 TYR O O 6.158 3.332 -0.830 1.00 . A A . 2 TYR O 1 1 1 28 1 1 2 TYR OH O 12.064 0.680 -1.463 1.00 . A A . 2 TYR OH 1 1 1 29 1 1 3 CYS C C 8.579 3.614 1.810 1.00 . A A . 3 CYS C 1 1 1 30 1 1 3 CYS CA C 7.054 3.579 1.781 1.00 . A A . 3 CYS CA 1 1 1 31 1 1 3 CYS CB C 6.503 3.697 3.204 1.00 . A A . 3 CYS CB 1 1 1 32 1 1 3 CYS H H 6.555 1.525 1.676 1.00 . A A . 3 CYS H 1 1 1 33 1 1 3 CYS HA H 6.698 4.413 1.197 1.00 . A A . 3 CYS HA 1 1 1 34 1 1 3 CYS HB2 H 7.228 3.294 3.897 1.00 . A A . 3 CYS HB2 1 1 1 35 1 1 3 CYS HB3 H 6.336 4.739 3.432 1.00 . A A . 3 CYS HB3 1 1 1 36 1 1 3 CYS N N 6.574 2.354 1.153 1.00 . A A . 3 CYS N 1 1 1 37 1 1 3 CYS O O 9.241 2.756 1.228 1.00 . A A . 3 CYS O 1 1 1 38 1 1 3 CYS SG S 4.933 2.812 3.469 1.00 . A A . 3 CYS SG 1 1 1 39 1 1 4 ALA C C 11.123 3.962 3.778 1.00 . A A . 4 ALA C 1 1 1 40 1 1 4 ALA CA C 10.576 4.760 2.599 1.00 . A A . 4 ALA CA 1 1 1 41 1 1 4 ALA CB C 10.949 6.229 2.735 1.00 . A A . 4 ALA CB 1 1 1 42 1 1 4 ALA H H 8.549 5.267 2.935 1.00 . A A . 4 ALA H 1 1 1 43 1 1 4 ALA HA H 11.018 4.384 1.687 1.00 . A A . 4 ALA HA 1 1 1 44 1 1 4 ALA HB1 H 10.243 6.720 3.389 1.00 . A A . 4 ALA HB1 1 1 1 45 1 1 4 ALA HB2 H 11.942 6.311 3.151 1.00 . A A . 4 ALA HB2 1 1 1 46 1 1 4 ALA HB3 H 10.925 6.697 1.762 1.00 . A A . 4 ALA HB3 1 1 1 47 1 1 4 ALA N N 9.130 4.614 2.492 1.00 . A A . 4 ALA N 1 1 1 48 1 1 4 ALA O O 10.902 4.316 4.937 1.00 . A A . 4 ALA O 1 1 1 49 1 1 5 THR C C 13.750 2.585 4.993 1.00 . A A . 5 THR C 1 1 1 50 1 1 5 THR CA C 12.414 2.033 4.510 1.00 . A A . 5 THR CA 1 1 1 51 1 1 5 THR CB C 12.619 0.593 4.004 1.00 . A A . 5 THR CB 1 1 1 52 1 1 5 THR CG2 C 11.330 -0.207 4.110 1.00 . A A . 5 THR CG2 1 1 1 53 1 1 5 THR H H 11.978 2.652 2.534 1.00 . A A . 5 THR H 1 1 1 54 1 1 5 THR HA H 11.724 2.005 5.342 1.00 . A A . 5 THR HA 1 1 1 55 1 1 5 THR HB H 13.372 0.116 4.617 1.00 . A A . 5 THR HB 1 1 1 56 1 1 5 THR HG1 H 13.089 -0.287 2.303 1.00 . A A . 5 THR HG1 1 1 1 57 1 1 5 THR HG21 H 11.075 -0.608 3.140 1.00 . A A . 5 THR HG21 1 1 1 58 1 1 5 THR HG22 H 10.534 0.437 4.454 1.00 . A A . 5 THR HG22 1 1 1 59 1 1 5 THR HG23 H 11.465 -1.018 4.810 1.00 . A A . 5 THR HG23 1 1 1 60 1 1 5 THR N N 11.837 2.882 3.476 1.00 . A A . 5 THR N 1 1 1 61 1 1 5 THR O O 14.276 3.547 4.432 1.00 . A A . 5 THR O 1 1 1 62 1 1 5 THR OG1 O 13.066 0.610 2.644 1.00 . A A . 5 THR OG1 1 1 1 63 1 1 6 LYS C C 16.609 2.600 5.495 1.00 . A A . 6 LYS C 1 1 1 64 1 1 6 LYS CA C 15.572 2.400 6.596 1.00 . A A . 6 LYS CA 1 1 1 65 1 1 6 LYS CB C 16.080 1.371 7.609 1.00 . A A . 6 LYS CB 1 1 1 66 1 1 6 LYS CD C 17.201 -0.840 8.013 1.00 . A A . 6 LYS CD 1 1 1 67 1 1 6 LYS CE C 17.815 -2.074 7.369 1.00 . A A . 6 LYS CE 1 1 1 68 1 1 6 LYS CG C 16.749 0.167 6.969 1.00 . A A . 6 LYS CG 1 1 1 69 1 1 6 LYS H H 13.828 1.211 6.443 1.00 . A A . 6 LYS H 1 1 1 70 1 1 6 LYS HA H 15.415 3.342 7.101 1.00 . A A . 6 LYS HA 1 1 1 71 1 1 6 LYS HB2 H 16.796 1.850 8.262 1.00 . A A . 6 LYS HB2 1 1 1 72 1 1 6 LYS HB3 H 15.245 1.022 8.199 1.00 . A A . 6 LYS HB3 1 1 1 73 1 1 6 LYS HD2 H 17.939 -0.377 8.652 1.00 . A A . 6 LYS HD2 1 1 1 74 1 1 6 LYS HD3 H 16.348 -1.140 8.605 1.00 . A A . 6 LYS HD3 1 1 1 75 1 1 6 LYS HE2 H 17.531 -2.099 6.328 1.00 . A A . 6 LYS HE2 1 1 1 76 1 1 6 LYS HE3 H 18.890 -2.008 7.447 1.00 . A A . 6 LYS HE3 1 1 1 77 1 1 6 LYS HG2 H 16.046 -0.312 6.303 1.00 . A A . 6 LYS HG2 1 1 1 78 1 1 6 LYS HG3 H 17.610 0.501 6.407 1.00 . A A . 6 LYS HG3 1 1 1 79 1 1 6 LYS HZ1 H 16.818 -3.104 8.888 1.00 . A A . 6 LYS HZ1 1 1 1 80 1 1 6 LYS HZ2 H 18.175 -3.915 8.286 1.00 . A A . 6 LYS HZ2 1 1 1 81 1 1 6 LYS HZ3 H 16.747 -3.869 7.380 1.00 . A A . 6 LYS HZ3 1 1 1 82 1 1 6 LYS N N 14.295 1.972 6.038 1.00 . A A . 6 LYS N 1 1 1 83 1 1 6 LYS NZ N 17.357 -3.329 8.026 1.00 . A A . 6 LYS NZ 1 1 1 84 1 1 6 LYS O O 16.710 1.793 4.572 1.00 . A A . 6 LYS O 1 1 1 85 1 1 7 GLY C C 17.862 4.777 3.444 1.00 . A A . 7 GLY C 1 1 1 86 1 1 7 GLY CA C 18.396 3.964 4.607 1.00 . A A . 7 GLY CA 1 1 1 87 1 1 7 GLY H H 17.251 4.288 6.358 1.00 . A A . 7 GLY H 1 1 1 88 1 1 7 GLY HA2 H 19.199 4.513 5.077 1.00 . A A . 7 GLY HA2 1 1 1 89 1 1 7 GLY HA3 H 18.785 3.030 4.229 1.00 . A A . 7 GLY HA3 1 1 1 90 1 1 7 GLY N N 17.377 3.680 5.600 1.00 . A A . 7 GLY N 1 1 1 91 1 1 7 GLY O O 18.631 5.296 2.636 1.00 . A A . 7 GLY O 1 1 1 92 1 1 8 ILE C C 15.639 7.081 2.709 1.00 . A A . 8 ILE C 1 1 1 93 1 1 8 ILE CA C 15.904 5.640 2.285 1.00 . A A . 8 ILE CA 1 1 1 94 1 1 8 ILE CB C 14.576 4.991 1.852 1.00 . A A . 8 ILE CB 1 1 1 95 1 1 8 ILE CD1 C 15.689 3.256 0.358 1.00 . A A . 8 ILE CD1 1 1 1 96 1 1 8 ILE CG1 C 14.785 3.507 1.545 1.00 . A A . 8 ILE CG1 1 1 1 97 1 1 8 ILE CG2 C 14.005 5.713 0.641 1.00 . A A . 8 ILE CG2 1 1 1 98 1 1 8 ILE H H 15.980 4.449 4.033 1.00 . A A . 8 ILE H 1 1 1 99 1 1 8 ILE HA H 16.574 5.642 1.438 1.00 . A A . 8 ILE HA 1 1 1 100 1 1 8 ILE HB H 13.872 5.088 2.664 1.00 . A A . 8 ILE HB 1 1 1 101 1 1 8 ILE HD11 H 16.044 4.200 -0.030 1.00 . A A . 8 ILE HD11 1 1 1 102 1 1 8 ILE HD12 H 16.529 2.653 0.666 1.00 . A A . 8 ILE HD12 1 1 1 103 1 1 8 ILE HD13 H 15.136 2.737 -0.412 1.00 . A A . 8 ILE HD13 1 1 1 104 1 1 8 ILE HG12 H 15.225 3.026 2.404 1.00 . A A . 8 ILE HG12 1 1 1 105 1 1 8 ILE HG13 H 13.827 3.053 1.335 1.00 . A A . 8 ILE HG13 1 1 1 106 1 1 8 ILE HG21 H 14.805 6.199 0.101 1.00 . A A . 8 ILE HG21 1 1 1 107 1 1 8 ILE HG22 H 13.517 4.999 -0.006 1.00 . A A . 8 ILE HG22 1 1 1 108 1 1 8 ILE HG23 H 13.289 6.453 0.966 1.00 . A A . 8 ILE HG23 1 1 1 109 1 1 8 ILE N N 16.540 4.885 3.358 1.00 . A A . 8 ILE N 1 1 1 110 1 1 8 ILE O O 15.043 7.332 3.756 1.00 . A A . 8 ILE O 1 1 1 111 1 1 9 LYS C C 14.431 9.741 2.487 1.00 . A A . 9 LYS C 1 1 1 112 1 1 9 LYS CA C 15.893 9.441 2.172 1.00 . A A . 9 LYS CA 1 1 1 113 1 1 9 LYS CB C 16.354 10.289 0.984 1.00 . A A . 9 LYS CB 1 1 1 114 1 1 9 LYS CD C 18.695 11.193 1.089 1.00 . A A . 9 LYS CD 1 1 1 115 1 1 9 LYS CE C 20.168 10.872 0.887 1.00 . A A . 9 LYS CE 1 1 1 116 1 1 9 LYS CG C 17.806 10.061 0.602 1.00 . A A . 9 LYS CG 1 1 1 117 1 1 9 LYS H H 16.552 7.761 1.066 1.00 . A A . 9 LYS H 1 1 1 118 1 1 9 LYS HA H 16.493 9.690 3.035 1.00 . A A . 9 LYS HA 1 1 1 119 1 1 9 LYS HB2 H 15.737 10.055 0.129 1.00 . A A . 9 LYS HB2 1 1 1 120 1 1 9 LYS HB3 H 16.229 11.333 1.233 1.00 . A A . 9 LYS HB3 1 1 1 121 1 1 9 LYS HD2 H 18.456 12.091 0.538 1.00 . A A . 9 LYS HD2 1 1 1 122 1 1 9 LYS HD3 H 18.512 11.356 2.142 1.00 . A A . 9 LYS HD3 1 1 1 123 1 1 9 LYS HE2 H 20.322 9.820 1.073 1.00 . A A . 9 LYS HE2 1 1 1 124 1 1 9 LYS HE3 H 20.435 11.099 -0.135 1.00 . A A . 9 LYS HE3 1 1 1 125 1 1 9 LYS HG2 H 18.145 9.136 1.044 1.00 . A A . 9 LYS HG2 1 1 1 126 1 1 9 LYS HG3 H 17.879 9.996 -0.474 1.00 . A A . 9 LYS HG3 1 1 1 127 1 1 9 LYS HZ1 H 22.040 11.472 1.593 1.00 . A A . 9 LYS HZ1 1 1 1 128 1 1 9 LYS HZ2 H 20.848 11.397 2.791 1.00 . A A . 9 LYS HZ2 1 1 1 129 1 1 9 LYS HZ3 H 20.855 12.676 1.684 1.00 . A A . 9 LYS HZ3 1 1 1 130 1 1 9 LYS N N 16.084 8.024 1.886 1.00 . A A . 9 LYS N 1 1 1 131 1 1 9 LYS NZ N 21.039 11.660 1.803 1.00 . A A . 9 LYS NZ 1 1 1 132 1 1 9 LYS O O 13.525 9.203 1.848 1.00 . A A . 9 LYS O 1 1 1 133 1 1 10 CYS C C 12.653 12.483 3.768 1.00 . A A . 10 CYS C 1 1 1 134 1 1 10 CYS CA C 12.855 10.974 3.873 1.00 . A A . 10 CYS CA 1 1 1 135 1 1 10 CYS CB C 12.577 10.509 5.303 1.00 . A A . 10 CYS CB 1 1 1 136 1 1 10 CYS H H 14.970 10.997 3.946 1.00 . A A . 10 CYS H 1 1 1 137 1 1 10 CYS HA H 12.165 10.483 3.204 1.00 . A A . 10 CYS HA 1 1 1 138 1 1 10 CYS HB2 H 11.509 10.494 5.468 1.00 . A A . 10 CYS HB2 1 1 1 139 1 1 10 CYS HB3 H 12.970 9.512 5.433 1.00 . A A . 10 CYS HB3 1 1 1 140 1 1 10 CYS N N 14.207 10.602 3.474 1.00 . A A . 10 CYS N 1 1 1 141 1 1 10 CYS O O 11.756 13.044 4.396 1.00 . A A . 10 CYS O 1 1 1 142 1 1 10 CYS SG S 13.318 11.569 6.587 1.00 . A A . 10 CYS SG 1 1 1 143 1 1 11 ASN C C 12.013 14.982 2.312 1.00 . A A . 11 ASN C 1 1 1 144 1 1 11 ASN CA C 13.407 14.577 2.781 1.00 . A A . 11 ASN CA 1 1 1 145 1 1 11 ASN CB C 14.454 15.043 1.768 1.00 . A A . 11 ASN CB 1 1 1 146 1 1 11 ASN CG C 15.780 15.382 2.421 1.00 . A A . 11 ASN CG 1 1 1 147 1 1 11 ASN H H 14.188 12.630 2.495 1.00 . A A . 11 ASN H 1 1 1 148 1 1 11 ASN HA H 13.605 15.047 3.733 1.00 . A A . 11 ASN HA 1 1 1 149 1 1 11 ASN HB2 H 14.621 14.259 1.045 1.00 . A A . 11 ASN HB2 1 1 1 150 1 1 11 ASN HB3 H 14.089 15.923 1.261 1.00 . A A . 11 ASN HB3 1 1 1 151 1 1 11 ASN HD21 H 16.766 14.596 0.883 1.00 . A A . 11 ASN HD21 1 1 1 152 1 1 11 ASN HD22 H 17.745 15.247 2.150 1.00 . A A . 11 ASN HD22 1 1 1 153 1 1 11 ASN N N 13.493 13.133 2.969 1.00 . A A . 11 ASN N 1 1 1 154 1 1 11 ASN ND2 N 16.874 15.041 1.750 1.00 . A A . 11 ASN ND2 1 1 1 155 1 1 11 ASN O O 11.580 16.114 2.526 1.00 . A A . 11 ASN O 1 1 1 156 1 1 11 ASN OD1 O 15.820 15.943 3.516 1.00 . A A . 11 ASN OD1 1 1 1 157 1 1 12 ASP C C 9.064 13.104 1.405 1.00 . A A . 12 ASP C 1 1 1 158 1 1 12 ASP CA C 9.970 14.309 1.174 1.00 . A A . 12 ASP CA 1 1 1 159 1 1 12 ASP CB C 10.012 14.653 -0.316 1.00 . A A . 12 ASP CB 1 1 1 160 1 1 12 ASP CG C 8.738 15.323 -0.791 1.00 . A A . 12 ASP CG 1 1 1 161 1 1 12 ASP H H 11.716 13.166 1.532 1.00 . A A . 12 ASP H 1 1 1 162 1 1 12 ASP HA H 9.572 15.152 1.718 1.00 . A A . 12 ASP HA 1 1 1 163 1 1 12 ASP HB2 H 10.839 15.323 -0.501 1.00 . A A . 12 ASP HB2 1 1 1 164 1 1 12 ASP HB3 H 10.155 13.746 -0.884 1.00 . A A . 12 ASP HB3 1 1 1 165 1 1 12 ASP N N 11.316 14.050 1.672 1.00 . A A . 12 ASP N 1 1 1 166 1 1 12 ASP O O 7.942 13.243 1.894 1.00 . A A . 12 ASP O 1 1 1 167 1 1 12 ASP OD1 O 8.764 16.550 -1.026 1.00 . A A . 12 ASP OD1 1 1 1 168 1 1 12 ASP OD2 O 7.715 14.621 -0.930 1.00 . A A . 12 ASP OD2 1 1 1 169 1 1 13 ILE C C 8.751 10.268 2.681 1.00 . A A . 13 ILE C 1 1 1 170 1 1 13 ILE CA C 8.792 10.693 1.217 1.00 . A A . 13 ILE CA 1 1 1 171 1 1 13 ILE CB C 9.379 9.545 0.376 1.00 . A A . 13 ILE CB 1 1 1 172 1 1 13 ILE CD1 C 8.267 7.712 -0.996 1.00 . A A . 13 ILE CD1 1 1 1 173 1 1 13 ILE CG1 C 8.423 8.350 0.366 1.00 . A A . 13 ILE CG1 1 1 1 174 1 1 13 ILE CG2 C 10.741 9.135 0.916 1.00 . A A . 13 ILE CG2 1 1 1 175 1 1 13 ILE H H 10.457 11.876 0.664 1.00 . A A . 13 ILE H 1 1 1 176 1 1 13 ILE HA H 7.782 10.881 0.880 1.00 . A A . 13 ILE HA 1 1 1 177 1 1 13 ILE HB H 9.511 9.899 -0.635 1.00 . A A . 13 ILE HB 1 1 1 178 1 1 13 ILE HD11 H 7.219 7.541 -1.196 1.00 . A A . 13 ILE HD11 1 1 1 179 1 1 13 ILE HD12 H 8.676 8.367 -1.750 1.00 . A A . 13 ILE HD12 1 1 1 180 1 1 13 ILE HD13 H 8.794 6.769 -1.014 1.00 . A A . 13 ILE HD13 1 1 1 181 1 1 13 ILE HG12 H 8.791 7.597 1.045 1.00 . A A . 13 ILE HG12 1 1 1 182 1 1 13 ILE HG13 H 7.446 8.678 0.694 1.00 . A A . 13 ILE HG13 1 1 1 183 1 1 13 ILE HG21 H 10.619 8.666 1.881 1.00 . A A . 13 ILE HG21 1 1 1 184 1 1 13 ILE HG22 H 11.204 8.439 0.233 1.00 . A A . 13 ILE HG22 1 1 1 185 1 1 13 ILE HG23 H 11.366 10.010 1.017 1.00 . A A . 13 ILE HG23 1 1 1 186 1 1 13 ILE N N 9.557 11.922 1.049 1.00 . A A . 13 ILE N 1 1 1 187 1 1 13 ILE O O 9.731 10.421 3.411 1.00 . A A . 13 ILE O 1 1 1 188 1 1 14 HIS C C 7.729 7.784 4.601 1.00 . A A . 14 HIS C 1 1 1 189 1 1 14 HIS CA C 7.443 9.278 4.480 1.00 . A A . 14 HIS CA 1 1 1 190 1 1 14 HIS CB C 6.026 9.579 4.969 1.00 . A A . 14 HIS CB 1 1 1 191 1 1 14 HIS CD2 C 5.140 11.603 6.328 1.00 . A A . 14 HIS CD2 1 1 1 192 1 1 14 HIS CE1 C 5.924 13.210 5.058 1.00 . A A . 14 HIS CE1 1 1 1 193 1 1 14 HIS CG C 5.800 11.023 5.298 1.00 . A A . 14 HIS CG 1 1 1 194 1 1 14 HIS H H 6.866 9.634 2.475 1.00 . A A . 14 HIS H 1 1 1 195 1 1 14 HIS HA H 8.148 9.818 5.094 1.00 . A A . 14 HIS HA 1 1 1 196 1 1 14 HIS HB2 H 5.320 9.301 4.200 1.00 . A A . 14 HIS HB2 1 1 1 197 1 1 14 HIS HB3 H 5.828 9.000 5.859 1.00 . A A . 14 HIS HB3 1 1 1 198 1 1 14 HIS HD1 H 6.800 11.958 3.697 1.00 . A A . 14 HIS HD1 1 1 1 199 1 1 14 HIS HD2 H 4.636 11.093 7.136 1.00 . A A . 14 HIS HD2 1 1 1 200 1 1 14 HIS HE1 H 6.159 14.188 4.667 1.00 . A A . 14 HIS HE1 1 1 1 201 1 1 14 HIS N N 7.611 9.730 3.104 1.00 . A A . 14 HIS N 1 1 1 202 1 1 14 HIS ND1 N 6.278 12.056 4.520 1.00 . A A . 14 HIS ND1 1 1 1 203 1 1 14 HIS NE2 N 5.232 12.963 6.156 1.00 . A A . 14 HIS NE2 1 1 1 204 1 1 14 HIS O O 7.619 7.040 3.626 1.00 . A A . 14 HIS O 1 1 1 205 1 1 15 CYS C C 7.149 5.192 6.491 1.00 . A A . 15 CYS C 1 1 1 206 1 1 15 CYS CA C 8.399 5.948 6.051 1.00 . A A . 15 CYS CA 1 1 1 207 1 1 15 CYS CB C 9.488 5.821 7.119 1.00 . A A . 15 CYS CB 1 1 1 208 1 1 15 CYS H H 8.166 7.994 6.541 1.00 . A A . 15 CYS H 1 1 1 209 1 1 15 CYS HA H 8.760 5.518 5.129 1.00 . A A . 15 CYS HA 1 1 1 210 1 1 15 CYS HB2 H 9.024 5.808 8.095 1.00 . A A . 15 CYS HB2 1 1 1 211 1 1 15 CYS HB3 H 10.023 4.895 6.968 1.00 . A A . 15 CYS HB3 1 1 1 212 1 1 15 CYS N N 8.096 7.353 5.803 1.00 . A A . 15 CYS N 1 1 1 213 1 1 15 CYS O O 6.219 5.777 7.046 1.00 . A A . 15 CYS O 1 1 1 214 1 1 15 CYS SG S 10.706 7.176 7.104 1.00 . A A . 15 CYS SG 1 1 1 215 1 1 16 CYS C C 5.803 3.036 8.122 1.00 . A A . 16 CYS C 1 1 1 216 1 1 16 CYS CA C 6.001 3.049 6.609 1.00 . A A . 16 CYS CA 1 1 1 217 1 1 16 CYS CB C 6.207 1.622 6.098 1.00 . A A . 16 CYS CB 1 1 1 218 1 1 16 CYS H H 7.907 3.477 5.795 1.00 . A A . 16 CYS H 1 1 1 219 1 1 16 CYS HA H 5.118 3.463 6.146 1.00 . A A . 16 CYS HA 1 1 1 220 1 1 16 CYS HB2 H 7.266 1.426 6.018 1.00 . A A . 16 CYS HB2 1 1 1 221 1 1 16 CYS HB3 H 5.770 0.929 6.803 1.00 . A A . 16 CYS HB3 1 1 1 222 1 1 16 CYS N N 7.135 3.887 6.240 1.00 . A A . 16 CYS N 1 1 1 223 1 1 16 CYS O O 6.745 3.255 8.883 1.00 . A A . 16 CYS O 1 1 1 224 1 1 16 CYS SG S 5.461 1.300 4.468 1.00 . A A . 16 CYS SG 1 1 1 225 1 1 17 SER C C 5.217 1.832 10.724 1.00 . A A . 17 SER C 1 1 1 226 1 1 17 SER CA C 4.249 2.740 9.972 1.00 . A A . 17 SER CA 1 1 1 227 1 1 17 SER CB C 2.812 2.255 10.177 1.00 . A A . 17 SER CB 1 1 1 228 1 1 17 SER H H 3.863 2.612 7.894 1.00 . A A . 17 SER H 1 1 1 229 1 1 17 SER HA H 4.340 3.744 10.359 1.00 . A A . 17 SER HA 1 1 1 230 1 1 17 SER HB2 H 2.718 1.248 9.802 1.00 . A A . 17 SER HB2 1 1 1 231 1 1 17 SER HB3 H 2.578 2.270 11.232 1.00 . A A . 17 SER HB3 1 1 1 232 1 1 17 SER HG H 2.246 3.976 9.432 1.00 . A A . 17 SER HG 1 1 1 233 1 1 17 SER N N 4.572 2.778 8.550 1.00 . A A . 17 SER N 1 1 1 234 1 1 17 SER O O 5.176 0.610 10.584 1.00 . A A . 17 SER O 1 1 1 235 1 1 17 SER OG O 1.891 3.086 9.493 1.00 . A A . 17 SER OG 1 1 1 236 1 1 18 GLY C C 8.453 2.251 12.201 1.00 . A A . 18 GLY C 1 1 1 237 1 1 18 GLY CA C 7.054 1.672 12.288 1.00 . A A . 18 GLY CA 1 1 1 238 1 1 18 GLY H H 6.074 3.417 11.597 1.00 . A A . 18 GLY H 1 1 1 239 1 1 18 GLY HA2 H 6.747 1.654 13.323 1.00 . A A . 18 GLY HA2 1 1 1 240 1 1 18 GLY HA3 H 7.072 0.660 11.910 1.00 . A A . 18 GLY HA3 1 1 1 241 1 1 18 GLY N N 6.088 2.440 11.524 1.00 . A A . 18 GLY N 1 1 1 242 1 1 18 GLY O O 9.325 1.907 13.000 1.00 . A A . 18 GLY O 1 1 1 243 1 1 19 LEU C C 9.897 5.258 11.298 1.00 . A A . 19 LEU C 1 1 1 244 1 1 19 LEU CA C 9.972 3.757 11.040 1.00 . A A . 19 LEU CA 1 1 1 245 1 1 19 LEU CB C 10.483 3.497 9.621 1.00 . A A . 19 LEU CB 1 1 1 246 1 1 19 LEU CD1 C 11.052 1.887 7.787 1.00 . A A . 19 LEU CD1 1 1 1 247 1 1 19 LEU CD2 C 12.001 1.555 10.077 1.00 . A A . 19 LEU CD2 1 1 1 248 1 1 19 LEU CG C 10.800 2.041 9.278 1.00 . A A . 19 LEU CG 1 1 1 249 1 1 19 LEU H H 7.934 3.364 10.624 1.00 . A A . 19 LEU H 1 1 1 250 1 1 19 LEU HA H 10.657 3.316 11.747 1.00 . A A . 19 LEU HA 1 1 1 251 1 1 19 LEU HB2 H 9.730 3.843 8.930 1.00 . A A . 19 LEU HB2 1 1 1 252 1 1 19 LEU HB3 H 11.386 4.075 9.486 1.00 . A A . 19 LEU HB3 1 1 1 253 1 1 19 LEU HD11 H 11.252 0.851 7.561 1.00 . A A . 19 LEU HD11 1 1 1 254 1 1 19 LEU HD12 H 11.902 2.489 7.501 1.00 . A A . 19 LEU HD12 1 1 1 255 1 1 19 LEU HD13 H 10.180 2.214 7.239 1.00 . A A . 19 LEU HD13 1 1 1 256 1 1 19 LEU HD21 H 12.910 1.873 9.588 1.00 . A A . 19 LEU HD21 1 1 1 257 1 1 19 LEU HD22 H 11.982 0.476 10.134 1.00 . A A . 19 LEU HD22 1 1 1 258 1 1 19 LEU HD23 H 11.963 1.970 11.073 1.00 . A A . 19 LEU HD23 1 1 1 259 1 1 19 LEU HG H 9.952 1.424 9.539 1.00 . A A . 19 LEU HG 1 1 1 260 1 1 19 LEU N N 8.668 3.130 11.229 1.00 . A A . 19 LEU N 1 1 1 261 1 1 19 LEU O O 8.829 5.864 11.202 1.00 . A A . 19 LEU O 1 1 1 262 1 1 20 LYS C C 11.860 8.014 10.788 1.00 . A A . 20 LYS C 1 1 1 263 1 1 20 LYS CA C 11.104 7.286 11.896 1.00 . A A . 20 LYS CA 1 1 1 264 1 1 20 LYS CB C 11.782 7.541 13.244 1.00 . A A . 20 LYS CB 1 1 1 265 1 1 20 LYS CD C 11.748 7.147 15.724 1.00 . A A . 20 LYS CD 1 1 1 266 1 1 20 LYS CE C 11.868 8.558 16.279 1.00 . A A . 20 LYS CE 1 1 1 267 1 1 20 LYS CG C 10.941 7.122 14.437 1.00 . A A . 20 LYS CG 1 1 1 268 1 1 20 LYS H H 11.857 5.318 11.687 1.00 . A A . 20 LYS H 1 1 1 269 1 1 20 LYS HA H 10.094 7.664 11.933 1.00 . A A . 20 LYS HA 1 1 1 270 1 1 20 LYS HB2 H 12.712 6.993 13.275 1.00 . A A . 20 LYS HB2 1 1 1 271 1 1 20 LYS HB3 H 11.994 8.597 13.332 1.00 . A A . 20 LYS HB3 1 1 1 272 1 1 20 LYS HD2 H 11.258 6.524 16.458 1.00 . A A . 20 LYS HD2 1 1 1 273 1 1 20 LYS HD3 H 12.738 6.762 15.526 1.00 . A A . 20 LYS HD3 1 1 1 274 1 1 20 LYS HE2 H 12.613 8.561 17.061 1.00 . A A . 20 LYS HE2 1 1 1 275 1 1 20 LYS HE3 H 12.179 9.218 15.484 1.00 . A A . 20 LYS HE3 1 1 1 276 1 1 20 LYS HG2 H 10.107 7.801 14.534 1.00 . A A . 20 LYS HG2 1 1 1 277 1 1 20 LYS HG3 H 10.574 6.119 14.272 1.00 . A A . 20 LYS HG3 1 1 1 278 1 1 20 LYS HZ1 H 10.742 9.869 17.452 1.00 . A A . 20 LYS HZ1 1 1 1 279 1 1 20 LYS HZ2 H 10.123 8.296 17.398 1.00 . A A . 20 LYS HZ2 1 1 1 280 1 1 20 LYS HZ3 H 9.937 9.324 16.068 1.00 . A A . 20 LYS HZ3 1 1 1 281 1 1 20 LYS N N 11.038 5.855 11.626 1.00 . A A . 20 LYS N 1 1 1 282 1 1 20 LYS NZ N 10.577 9.046 16.838 1.00 . A A . 20 LYS NZ 1 1 1 283 1 1 20 LYS O O 12.791 7.468 10.195 1.00 . A A . 20 LYS O 1 1 1 284 1 1 21 CYS C C 13.163 10.962 10.081 1.00 . A A . 21 CYS C 1 1 1 285 1 1 21 CYS CA C 12.095 10.053 9.481 1.00 . A A . 21 CYS CA 1 1 1 286 1 1 21 CYS CB C 11.052 10.893 8.741 1.00 . A A . 21 CYS CB 1 1 1 287 1 1 21 CYS H H 10.707 9.631 11.023 1.00 . A A . 21 CYS H 1 1 1 288 1 1 21 CYS HA H 12.564 9.380 8.780 1.00 . A A . 21 CYS HA 1 1 1 289 1 1 21 CYS HB2 H 10.450 10.243 8.123 1.00 . A A . 21 CYS HB2 1 1 1 290 1 1 21 CYS HB3 H 10.416 11.383 9.464 1.00 . A A . 21 CYS HB3 1 1 1 291 1 1 21 CYS N N 11.455 9.250 10.516 1.00 . A A . 21 CYS N 1 1 1 292 1 1 21 CYS O O 12.867 12.063 10.547 1.00 . A A . 21 CYS O 1 1 1 293 1 1 21 CYS SG S 11.761 12.180 7.664 1.00 . A A . 21 CYS SG 1 1 1 294 1 1 22 ASP C C 15.672 12.592 9.868 1.00 . A A . 22 ASP C 1 1 1 295 1 1 22 ASP CA C 15.520 11.265 10.606 1.00 . A A . 22 ASP CA 1 1 1 296 1 1 22 ASP CB C 16.818 10.462 10.509 1.00 . A A . 22 ASP CB 1 1 1 297 1 1 22 ASP CG C 17.825 10.858 11.572 1.00 . A A . 22 ASP CG 1 1 1 298 1 1 22 ASP H H 14.580 9.610 9.679 1.00 . A A . 22 ASP H 1 1 1 299 1 1 22 ASP HA H 15.310 11.468 11.645 1.00 . A A . 22 ASP HA 1 1 1 300 1 1 22 ASP HB2 H 16.594 9.412 10.627 1.00 . A A . 22 ASP HB2 1 1 1 301 1 1 22 ASP HB3 H 17.263 10.624 9.539 1.00 . A A . 22 ASP HB3 1 1 1 302 1 1 22 ASP N N 14.407 10.495 10.065 1.00 . A A . 22 ASP N 1 1 1 303 1 1 22 ASP O O 16.193 12.638 8.754 1.00 . A A . 22 ASP O 1 1 1 304 1 1 22 ASP OD1 O 17.644 11.927 12.192 1.00 . A A . 22 ASP OD1 1 1 1 305 1 1 22 ASP OD2 O 18.793 10.099 11.784 1.00 . A A . 22 ASP OD2 1 1 1 306 1 1 23 SER C C 16.727 15.517 9.924 1.00 . A A . 23 SER C 1 1 1 307 1 1 23 SER CA C 15.294 14.996 9.899 1.00 . A A . 23 SER CA 1 1 1 308 1 1 23 SER CB C 14.372 15.969 10.638 1.00 . A A . 23 SER CB 1 1 1 309 1 1 23 SER H H 14.808 13.568 11.385 1.00 . A A . 23 SER H 1 1 1 310 1 1 23 SER HA H 14.970 14.917 8.872 1.00 . A A . 23 SER HA 1 1 1 311 1 1 23 SER HB2 H 14.691 16.981 10.442 1.00 . A A . 23 SER HB2 1 1 1 312 1 1 23 SER HB3 H 13.359 15.836 10.288 1.00 . A A . 23 SER HB3 1 1 1 313 1 1 23 SER HG H 14.445 16.583 12.497 1.00 . A A . 23 SER HG 1 1 1 314 1 1 23 SER N N 15.213 13.669 10.498 1.00 . A A . 23 SER N 1 1 1 315 1 1 23 SER O O 17.054 16.505 9.265 1.00 . A A . 23 SER O 1 1 1 316 1 1 23 SER OG O 14.407 15.741 12.036 1.00 . A A . 23 SER OG 1 1 1 317 1 1 24 LYS C C 19.806 14.642 9.668 1.00 . A A . 24 LYS C 1 1 1 318 1 1 24 LYS CA C 18.980 15.239 10.803 1.00 . A A . 24 LYS CA 1 1 1 319 1 1 24 LYS CB C 19.550 14.792 12.151 1.00 . A A . 24 LYS CB 1 1 1 320 1 1 24 LYS CD C 19.808 15.548 14.533 1.00 . A A . 24 LYS CD 1 1 1 321 1 1 24 LYS CE C 19.702 14.332 15.441 1.00 . A A . 24 LYS CE 1 1 1 322 1 1 24 LYS CG C 18.868 15.439 13.344 1.00 . A A . 24 LYS CG 1 1 1 323 1 1 24 LYS H H 17.261 14.067 11.193 1.00 . A A . 24 LYS H 1 1 1 324 1 1 24 LYS HA H 19.029 16.315 10.740 1.00 . A A . 24 LYS HA 1 1 1 325 1 1 24 LYS HB2 H 19.441 13.721 12.238 1.00 . A A . 24 LYS HB2 1 1 1 326 1 1 24 LYS HB3 H 20.601 15.042 12.185 1.00 . A A . 24 LYS HB3 1 1 1 327 1 1 24 LYS HD2 H 20.823 15.626 14.173 1.00 . A A . 24 LYS HD2 1 1 1 328 1 1 24 LYS HD3 H 19.556 16.432 15.100 1.00 . A A . 24 LYS HD3 1 1 1 329 1 1 24 LYS HE2 H 19.470 14.664 16.441 1.00 . A A . 24 LYS HE2 1 1 1 330 1 1 24 LYS HE3 H 18.907 13.697 15.078 1.00 . A A . 24 LYS HE3 1 1 1 331 1 1 24 LYS HG2 H 18.540 16.430 13.067 1.00 . A A . 24 LYS HG2 1 1 1 332 1 1 24 LYS HG3 H 18.013 14.841 13.627 1.00 . A A . 24 LYS HG3 1 1 1 333 1 1 24 LYS HZ1 H 21.111 13.137 16.416 1.00 . A A . 24 LYS HZ1 1 1 1 334 1 1 24 LYS HZ2 H 21.776 14.169 15.252 1.00 . A A . 24 LYS HZ2 1 1 1 335 1 1 24 LYS HZ3 H 20.934 12.783 14.771 1.00 . A A . 24 LYS HZ3 1 1 1 336 1 1 24 LYS N N 17.581 14.847 10.691 1.00 . A A . 24 LYS N 1 1 1 337 1 1 24 LYS NZ N 20.970 13.550 15.472 1.00 . A A . 24 LYS NZ 1 1 1 338 1 1 24 LYS O O 20.646 15.319 9.076 1.00 . A A . 24 LYS O 1 1 1 339 1 1 25 ARG C C 19.430 12.600 7.038 1.00 . A A . 25 ARG C 1 1 1 340 1 1 25 ARG CA C 20.279 12.683 8.303 1.00 . A A . 25 ARG CA 1 1 1 341 1 1 25 ARG CB C 20.680 11.278 8.755 1.00 . A A . 25 ARG CB 1 1 1 342 1 1 25 ARG CD C 22.732 10.231 9.760 1.00 . A A . 25 ARG CD 1 1 1 343 1 1 25 ARG CG C 21.634 11.267 9.938 1.00 . A A . 25 ARG CG 1 1 1 344 1 1 25 ARG CZ C 24.276 10.613 11.634 1.00 . A A . 25 ARG CZ 1 1 1 345 1 1 25 ARG H H 18.877 12.883 9.876 1.00 . A A . 25 ARG H 1 1 1 346 1 1 25 ARG HA H 21.172 13.251 8.086 1.00 . A A . 25 ARG HA 1 1 1 347 1 1 25 ARG HB2 H 19.790 10.734 9.033 1.00 . A A . 25 ARG HB2 1 1 1 348 1 1 25 ARG HB3 H 21.159 10.771 7.930 1.00 . A A . 25 ARG HB3 1 1 1 349 1 1 25 ARG HD2 H 22.427 9.315 10.244 1.00 . A A . 25 ARG HD2 1 1 1 350 1 1 25 ARG HD3 H 22.870 10.051 8.704 1.00 . A A . 25 ARG HD3 1 1 1 351 1 1 25 ARG HE H 24.677 11.028 9.725 1.00 . A A . 25 ARG HE 1 1 1 352 1 1 25 ARG HG2 H 22.087 12.243 10.032 1.00 . A A . 25 ARG HG2 1 1 1 353 1 1 25 ARG HG3 H 21.077 11.039 10.835 1.00 . A A . 25 ARG HG3 1 1 1 354 1 1 25 ARG HH11 H 22.493 9.817 12.151 1.00 . A A . 25 ARG HH11 1 1 1 355 1 1 25 ARG HH12 H 23.591 10.091 13.462 1.00 . A A . 25 ARG HH12 1 1 1 356 1 1 25 ARG HH21 H 26.131 11.394 11.443 1.00 . A A . 25 ARG HH21 1 1 1 357 1 1 25 ARG HH22 H 25.660 10.990 13.059 1.00 . A A . 25 ARG HH22 1 1 1 358 1 1 25 ARG N N 19.559 13.371 9.368 1.00 . A A . 25 ARG N 1 1 1 359 1 1 25 ARG NE N 24.000 10.671 10.336 1.00 . A A . 25 ARG NE 1 1 1 360 1 1 25 ARG NH1 N 23.380 10.135 12.486 1.00 . A A . 25 ARG NH1 1 1 1 361 1 1 25 ARG NH2 N 25.452 11.034 12.082 1.00 . A A . 25 ARG NH2 1 1 1 362 1 1 25 ARG O O 19.842 12.012 6.038 1.00 . A A . 25 ARG O 1 1 1 363 1 1 26 LYS C C 17.114 11.765 5.436 1.00 . A A . 26 LYS C 1 1 1 364 1 1 26 LYS CA C 17.333 13.185 5.949 1.00 . A A . 26 LYS CA 1 1 1 365 1 1 26 LYS CB C 17.885 14.065 4.826 1.00 . A A . 26 LYS CB 1 1 1 366 1 1 26 LYS CD C 18.888 16.277 4.184 1.00 . A A . 26 LYS CD 1 1 1 367 1 1 26 LYS CE C 20.115 16.955 4.774 1.00 . A A . 26 LYS CE 1 1 1 368 1 1 26 LYS CG C 18.114 15.508 5.242 1.00 . A A . 26 LYS CG 1 1 1 369 1 1 26 LYS H H 17.968 13.643 7.916 1.00 . A A . 26 LYS H 1 1 1 370 1 1 26 LYS HA H 16.386 13.586 6.277 1.00 . A A . 26 LYS HA 1 1 1 371 1 1 26 LYS HB2 H 18.827 13.654 4.494 1.00 . A A . 26 LYS HB2 1 1 1 372 1 1 26 LYS HB3 H 17.187 14.056 4.002 1.00 . A A . 26 LYS HB3 1 1 1 373 1 1 26 LYS HD2 H 19.207 15.591 3.413 1.00 . A A . 26 LYS HD2 1 1 1 374 1 1 26 LYS HD3 H 18.243 17.030 3.754 1.00 . A A . 26 LYS HD3 1 1 1 375 1 1 26 LYS HE2 H 19.810 17.547 5.623 1.00 . A A . 26 LYS HE2 1 1 1 376 1 1 26 LYS HE3 H 20.811 16.194 5.097 1.00 . A A . 26 LYS HE3 1 1 1 377 1 1 26 LYS HG2 H 17.158 15.987 5.391 1.00 . A A . 26 LYS HG2 1 1 1 378 1 1 26 LYS HG3 H 18.674 15.523 6.166 1.00 . A A . 26 LYS HG3 1 1 1 379 1 1 26 LYS HZ1 H 20.084 18.406 3.272 1.00 . A A . 26 LYS HZ1 1 1 1 380 1 1 26 LYS HZ2 H 21.322 17.267 3.098 1.00 . A A . 26 LYS HZ2 1 1 1 381 1 1 26 LYS HZ3 H 21.449 18.482 4.269 1.00 . A A . 26 LYS HZ3 1 1 1 382 1 1 26 LYS N N 18.241 13.191 7.090 1.00 . A A . 26 LYS N 1 1 1 383 1 1 26 LYS NZ N 20.790 17.840 3.784 1.00 . A A . 26 LYS NZ 1 1 1 384 1 1 26 LYS O O 17.102 11.526 4.228 1.00 . A A . 26 LYS O 1 1 1 385 1 1 27 VAL C C 15.869 8.721 7.050 1.00 . A A . 27 VAL C 1 1 1 386 1 1 27 VAL CA C 16.717 9.431 6.001 1.00 . A A . 27 VAL CA 1 1 1 387 1 1 27 VAL CB C 18.049 8.676 5.836 1.00 . A A . 27 VAL CB 1 1 1 388 1 1 27 VAL CG1 C 18.765 9.125 4.571 1.00 . A A . 27 VAL CG1 1 1 1 389 1 1 27 VAL CG2 C 18.931 8.879 7.058 1.00 . A A . 27 VAL CG2 1 1 1 390 1 1 27 VAL H H 16.958 11.079 7.307 1.00 . A A . 27 VAL H 1 1 1 391 1 1 27 VAL HA H 16.195 9.409 5.055 1.00 . A A . 27 VAL HA 1 1 1 392 1 1 27 VAL HB H 17.833 7.621 5.745 1.00 . A A . 27 VAL HB 1 1 1 393 1 1 27 VAL HG11 H 18.165 8.871 3.709 1.00 . A A . 27 VAL HG11 1 1 1 394 1 1 27 VAL HG12 H 18.917 10.194 4.604 1.00 . A A . 27 VAL HG12 1 1 1 395 1 1 27 VAL HG13 H 19.721 8.626 4.502 1.00 . A A . 27 VAL HG13 1 1 1 396 1 1 27 VAL HG21 H 19.624 9.686 6.871 1.00 . A A . 27 VAL HG21 1 1 1 397 1 1 27 VAL HG22 H 18.315 9.125 7.911 1.00 . A A . 27 VAL HG22 1 1 1 398 1 1 27 VAL HG23 H 19.481 7.972 7.261 1.00 . A A . 27 VAL HG23 1 1 1 399 1 1 27 VAL N N 16.939 10.826 6.360 1.00 . A A . 27 VAL N 1 1 1 400 1 1 27 VAL O O 15.725 9.200 8.176 1.00 . A A . 27 VAL O 1 1 1 401 1 1 28 CYS C C 15.332 5.915 8.487 1.00 . A A . 28 CYS C 1 1 1 402 1 1 28 CYS CA C 14.476 6.797 7.583 1.00 . A A . 28 CYS CA 1 1 1 403 1 1 28 CYS CB C 13.493 5.933 6.791 1.00 . A A . 28 CYS CB 1 1 1 404 1 1 28 CYS H H 15.462 7.245 5.764 1.00 . A A . 28 CYS H 1 1 1 405 1 1 28 CYS HA H 13.920 7.489 8.198 1.00 . A A . 28 CYS HA 1 1 1 406 1 1 28 CYS HB2 H 14.043 5.339 6.076 1.00 . A A . 28 CYS HB2 1 1 1 407 1 1 28 CYS HB3 H 12.973 5.276 7.473 1.00 . A A . 28 CYS HB3 1 1 1 408 1 1 28 CYS N N 15.310 7.575 6.675 1.00 . A A . 28 CYS N 1 1 1 409 1 1 28 CYS O O 16.339 5.355 8.053 1.00 . A A . 28 CYS O 1 1 1 410 1 1 28 CYS SG S 12.240 6.884 5.872 1.00 . A A . 28 CYS SG 1 1 1 411 1 1 29 VAL C C 14.706 4.074 11.490 1.00 . A A . 29 VAL C 1 1 1 412 1 1 29 VAL CA C 15.652 4.981 10.712 1.00 . A A . 29 VAL CA 1 1 1 413 1 1 29 VAL CB C 16.439 5.856 11.705 1.00 . A A . 29 VAL CB 1 1 1 414 1 1 29 VAL CG1 C 17.615 6.527 11.011 1.00 . A A . 29 VAL CG1 1 1 1 415 1 1 29 VAL CG2 C 15.525 6.891 12.343 1.00 . A A . 29 VAL CG2 1 1 1 416 1 1 29 VAL H H 14.114 6.266 10.033 1.00 . A A . 29 VAL H 1 1 1 417 1 1 29 VAL HA H 16.357 4.368 10.168 1.00 . A A . 29 VAL HA 1 1 1 418 1 1 29 VAL HB H 16.827 5.219 12.486 1.00 . A A . 29 VAL HB 1 1 1 419 1 1 29 VAL HG11 H 17.438 7.591 10.951 1.00 . A A . 29 VAL HG11 1 1 1 420 1 1 29 VAL HG12 H 18.519 6.342 11.573 1.00 . A A . 29 VAL HG12 1 1 1 421 1 1 29 VAL HG13 H 17.722 6.124 10.015 1.00 . A A . 29 VAL HG13 1 1 1 422 1 1 29 VAL HG21 H 14.504 6.541 12.304 1.00 . A A . 29 VAL HG21 1 1 1 423 1 1 29 VAL HG22 H 15.814 7.043 13.373 1.00 . A A . 29 VAL HG22 1 1 1 424 1 1 29 VAL HG23 H 15.607 7.824 11.806 1.00 . A A . 29 VAL HG23 1 1 1 425 1 1 29 VAL N N 14.924 5.796 9.746 1.00 . A A . 29 VAL N 1 1 1 426 1 1 29 VAL O O 13.485 4.177 11.365 1.00 . A A . 29 VAL O 1 1 1 427 1 1 30 LYS C C 13.698 3.003 14.170 1.00 . A A . 30 LYS C 1 1 1 428 1 1 30 LYS CA C 14.485 2.258 13.096 1.00 . A A . 30 LYS CA 1 1 1 429 1 1 30 LYS CB C 15.391 1.211 13.748 1.00 . A A . 30 LYS CB 1 1 1 430 1 1 30 LYS CD C 15.546 -0.605 15.476 1.00 . A A . 30 LYS CD 1 1 1 431 1 1 30 LYS CE C 15.467 -0.042 16.887 1.00 . A A . 30 LYS CE 1 1 1 432 1 1 30 LYS CG C 14.633 0.148 14.523 1.00 . A A . 30 LYS CG 1 1 1 433 1 1 30 LYS H H 16.255 3.150 12.352 1.00 . A A . 30 LYS H 1 1 1 434 1 1 30 LYS HA H 13.790 1.760 12.438 1.00 . A A . 30 LYS HA 1 1 1 435 1 1 30 LYS HB2 H 15.968 0.722 12.977 1.00 . A A . 30 LYS HB2 1 1 1 436 1 1 30 LYS HB3 H 16.066 1.711 14.428 1.00 . A A . 30 LYS HB3 1 1 1 437 1 1 30 LYS HD2 H 15.252 -1.644 15.498 1.00 . A A . 30 LYS HD2 1 1 1 438 1 1 30 LYS HD3 H 16.565 -0.525 15.123 1.00 . A A . 30 LYS HD3 1 1 1 439 1 1 30 LYS HE2 H 16.394 0.462 17.112 1.00 . A A . 30 LYS HE2 1 1 1 440 1 1 30 LYS HE3 H 14.652 0.665 16.932 1.00 . A A . 30 LYS HE3 1 1 1 441 1 1 30 LYS HG2 H 13.848 0.622 15.094 1.00 . A A . 30 LYS HG2 1 1 1 442 1 1 30 LYS HG3 H 14.199 -0.553 13.825 1.00 . A A . 30 LYS HG3 1 1 1 443 1 1 30 LYS HZ1 H 16.148 -1.448 18.272 1.00 . A A . 30 LYS HZ1 1 1 1 444 1 1 30 LYS HZ2 H 14.736 -1.912 17.465 1.00 . A A . 30 LYS HZ2 1 1 1 445 1 1 30 LYS HZ3 H 14.667 -0.742 18.685 1.00 . A A . 30 LYS HZ3 1 1 1 446 1 1 30 LYS N N 15.276 3.184 12.295 1.00 . A A . 30 LYS N 1 1 1 447 1 1 30 LYS NZ N 15.238 -1.111 17.898 1.00 . A A . 30 LYS NZ 1 1 1 448 1 1 30 LYS O O 14.213 3.922 14.806 1.00 . A A . 30 LYS O 1 1 1 449 1 1 31 GLY C C 11.920 2.767 16.771 1.00 . A A . 31 GLY C 1 1 1 450 1 1 31 GLY CA C 11.609 3.240 15.365 1.00 . A A . 31 GLY CA 1 1 1 451 1 1 31 GLY H H 12.088 1.862 13.830 1.00 . A A . 31 GLY H 1 1 1 452 1 1 31 GLY HA2 H 11.760 4.308 15.314 1.00 . A A . 31 GLY HA2 1 1 1 453 1 1 31 GLY HA3 H 10.575 3.021 15.144 1.00 . A A . 31 GLY HA3 1 1 1 454 1 1 31 GLY N N 12.446 2.600 14.367 1.00 . A A . 31 GLY N 1 1 1 455 1 1 31 GLY O O 12.000 3.570 17.700 1.00 . A A . 31 GLY O 1 1 2 456 1 1 1 GLY C C 3.463 1.564 -0.973 1.00 . A A . 1 GLY C 1 1 2 457 1 1 1 GLY CA C 2.013 1.242 -0.672 1.00 . A A . 1 GLY CA 1 1 2 458 1 1 1 GLY H1 H 1.460 2.305 -2.418 1.00 . A A . 1 GLY H1 1 1 2 459 1 1 1 GLY HA2 H 1.762 1.635 0.301 1.00 . A A . 1 GLY HA2 1 1 2 460 1 1 1 GLY HA3 H 1.890 0.169 -0.659 1.00 . A A . 1 GLY HA3 1 1 2 461 1 1 1 GLY N N 1.104 1.804 -1.654 1.00 . A A . 1 GLY N 1 1 2 462 1 1 1 GLY O O 3.765 2.593 -1.578 1.00 . A A . 1 GLY O 1 1 2 463 1 1 2 TYR C C 6.246 2.229 -0.224 1.00 . A A . 2 TYR C 1 1 2 464 1 1 2 TYR CA C 5.790 0.881 -0.774 1.00 . A A . 2 TYR CA 1 1 2 465 1 1 2 TYR CB C 6.110 0.791 -2.267 1.00 . A A . 2 TYR CB 1 1 2 466 1 1 2 TYR CD1 C 7.833 2.285 -3.352 1.00 . A A . 2 TYR CD1 1 1 2 467 1 1 2 TYR CD2 C 8.597 0.361 -2.170 1.00 . A A . 2 TYR CD2 1 1 2 468 1 1 2 TYR CE1 C 9.138 2.619 -3.661 1.00 . A A . 2 TYR CE1 1 1 2 469 1 1 2 TYR CE2 C 9.904 0.688 -2.474 1.00 . A A . 2 TYR CE2 1 1 2 470 1 1 2 TYR CG C 7.540 1.152 -2.602 1.00 . A A . 2 TYR CG 1 1 2 471 1 1 2 TYR CZ C 10.170 1.817 -3.219 1.00 . A A . 2 TYR CZ 1 1 2 472 1 1 2 TYR H H 4.061 -0.119 -0.074 1.00 . A A . 2 TYR H 1 1 2 473 1 1 2 TYR HA H 6.319 0.095 -0.255 1.00 . A A . 2 TYR HA 1 1 2 474 1 1 2 TYR HB2 H 5.936 -0.218 -2.606 1.00 . A A . 2 TYR HB2 1 1 2 475 1 1 2 TYR HB3 H 5.462 1.465 -2.808 1.00 . A A . 2 TYR HB3 1 1 2 476 1 1 2 TYR HD1 H 7.023 2.911 -3.696 1.00 . A A . 2 TYR HD1 1 1 2 477 1 1 2 TYR HD2 H 8.385 -0.524 -1.587 1.00 . A A . 2 TYR HD2 1 1 2 478 1 1 2 TYR HE1 H 9.346 3.504 -4.244 1.00 . A A . 2 TYR HE1 1 1 2 479 1 1 2 TYR HE2 H 10.713 0.060 -2.128 1.00 . A A . 2 TYR HE2 1 1 2 480 1 1 2 TYR HH H 11.708 2.962 -3.078 1.00 . A A . 2 TYR HH 1 1 2 481 1 1 2 TYR N N 4.363 0.683 -0.550 1.00 . A A . 2 TYR N 1 1 2 482 1 1 2 TYR O O 6.241 3.236 -0.933 1.00 . A A . 2 TYR O 1 1 2 483 1 1 2 TYR OH O 11.471 2.145 -3.525 1.00 . A A . 2 TYR OH 1 1 2 484 1 1 3 CYS C C 8.625 3.512 1.741 1.00 . A A . 3 CYS C 1 1 2 485 1 1 3 CYS CA C 7.101 3.463 1.692 1.00 . A A . 3 CYS CA 1 1 2 486 1 1 3 CYS CB C 6.530 3.560 3.108 1.00 . A A . 3 CYS CB 1 1 2 487 1 1 3 CYS H H 6.622 1.405 1.559 1.00 . A A . 3 CYS H 1 1 2 488 1 1 3 CYS HA H 6.745 4.300 1.111 1.00 . A A . 3 CYS HA 1 1 2 489 1 1 3 CYS HB2 H 7.249 3.157 3.806 1.00 . A A . 3 CYS HB2 1 1 2 490 1 1 3 CYS HB3 H 6.350 4.599 3.345 1.00 . A A . 3 CYS HB3 1 1 2 491 1 1 3 CYS N N 6.641 2.240 1.044 1.00 . A A . 3 CYS N 1 1 2 492 1 1 3 CYS O O 9.303 2.675 1.146 1.00 . A A . 3 CYS O 1 1 2 493 1 1 3 CYS SG S 4.965 2.658 3.343 1.00 . A A . 3 CYS SG 1 1 2 494 1 1 4 ALA C C 11.137 3.848 3.763 1.00 . A A . 4 ALA C 1 1 2 495 1 1 4 ALA CA C 10.600 4.655 2.586 1.00 . A A . 4 ALA CA 1 1 2 496 1 1 4 ALA CB C 10.959 6.125 2.744 1.00 . A A . 4 ALA CB 1 1 2 497 1 1 4 ALA H H 8.564 5.134 2.908 1.00 . A A . 4 ALA H 1 1 2 498 1 1 4 ALA HA H 11.058 4.294 1.676 1.00 . A A . 4 ALA HA 1 1 2 499 1 1 4 ALA HB1 H 10.987 6.595 1.771 1.00 . A A . 4 ALA HB1 1 1 2 500 1 1 4 ALA HB2 H 10.216 6.613 3.358 1.00 . A A . 4 ALA HB2 1 1 2 501 1 1 4 ALA HB3 H 11.927 6.210 3.214 1.00 . A A . 4 ALA HB3 1 1 2 502 1 1 4 ALA N N 9.157 4.498 2.456 1.00 . A A . 4 ALA N 1 1 2 503 1 1 4 ALA O O 10.902 4.190 4.923 1.00 . A A . 4 ALA O 1 1 2 504 1 1 5 THR C C 13.754 2.470 4.996 1.00 . A A . 5 THR C 1 1 2 505 1 1 5 THR CA C 12.426 1.916 4.491 1.00 . A A . 5 THR CA 1 1 2 506 1 1 5 THR CB C 12.644 0.482 3.974 1.00 . A A . 5 THR CB 1 1 2 507 1 1 5 THR CG2 C 11.352 -0.318 4.038 1.00 . A A . 5 THR CG2 1 1 2 508 1 1 5 THR H H 12.010 2.553 2.516 1.00 . A A . 5 THR H 1 1 2 509 1 1 5 THR HA H 11.727 1.878 5.314 1.00 . A A . 5 THR HA 1 1 2 510 1 1 5 THR HB H 13.381 -0.002 4.599 1.00 . A A . 5 THR HB 1 1 2 511 1 1 5 THR HG1 H 13.625 -0.284 2.444 1.00 . A A . 5 THR HG1 1 1 2 512 1 1 5 THR HG21 H 10.548 0.322 4.369 1.00 . A A . 5 THR HG21 1 1 2 513 1 1 5 THR HG22 H 11.470 -1.137 4.732 1.00 . A A . 5 THR HG22 1 1 2 514 1 1 5 THR HG23 H 11.121 -0.707 3.058 1.00 . A A . 5 THR HG23 1 1 2 515 1 1 5 THR N N 11.858 2.773 3.459 1.00 . A A . 5 THR N 1 1 2 516 1 1 5 THR O O 14.279 3.443 4.454 1.00 . A A . 5 THR O 1 1 2 517 1 1 5 THR OG1 O 13.125 0.515 2.626 1.00 . A A . 5 THR OG1 1 1 2 518 1 1 6 LYS C C 16.607 2.498 5.525 1.00 . A A . 6 LYS C 1 1 2 519 1 1 6 LYS CA C 15.562 2.271 6.613 1.00 . A A . 6 LYS CA 1 1 2 520 1 1 6 LYS CB C 16.069 1.228 7.612 1.00 . A A . 6 LYS CB 1 1 2 521 1 1 6 LYS CD C 18.340 0.456 8.359 1.00 . A A . 6 LYS CD 1 1 2 522 1 1 6 LYS CE C 19.347 0.509 7.220 1.00 . A A . 6 LYS CE 1 1 2 523 1 1 6 LYS CG C 17.367 1.622 8.296 1.00 . A A . 6 LYS CG 1 1 2 524 1 1 6 LYS H H 13.827 1.073 6.425 1.00 . A A . 6 LYS H 1 1 2 525 1 1 6 LYS HA H 15.394 3.202 7.133 1.00 . A A . 6 LYS HA 1 1 2 526 1 1 6 LYS HB2 H 15.317 1.080 8.372 1.00 . A A . 6 LYS HB2 1 1 2 527 1 1 6 LYS HB3 H 16.230 0.296 7.090 1.00 . A A . 6 LYS HB3 1 1 2 528 1 1 6 LYS HD2 H 18.873 0.493 9.297 1.00 . A A . 6 LYS HD2 1 1 2 529 1 1 6 LYS HD3 H 17.785 -0.469 8.294 1.00 . A A . 6 LYS HD3 1 1 2 530 1 1 6 LYS HE2 H 18.856 0.896 6.340 1.00 . A A . 6 LYS HE2 1 1 2 531 1 1 6 LYS HE3 H 20.154 1.169 7.502 1.00 . A A . 6 LYS HE3 1 1 2 532 1 1 6 LYS HG2 H 17.825 2.429 7.744 1.00 . A A . 6 LYS HG2 1 1 2 533 1 1 6 LYS HG3 H 17.148 1.950 9.302 1.00 . A A . 6 LYS HG3 1 1 2 534 1 1 6 LYS HZ1 H 20.643 -0.757 6.182 1.00 . A A . 6 LYS HZ1 1 1 2 535 1 1 6 LYS HZ2 H 19.154 -1.464 6.561 1.00 . A A . 6 LYS HZ2 1 1 2 536 1 1 6 LYS HZ3 H 20.323 -1.255 7.766 1.00 . A A . 6 LYS HZ3 1 1 2 537 1 1 6 LYS N N 14.294 1.843 6.036 1.00 . A A . 6 LYS N 1 1 2 538 1 1 6 LYS NZ N 19.906 -0.836 6.911 1.00 . A A . 6 LYS NZ 1 1 2 539 1 1 6 LYS O O 16.759 1.680 4.618 1.00 . A A . 6 LYS O 1 1 2 540 1 1 7 GLY C C 17.817 4.777 3.504 1.00 . A A . 7 GLY C 1 1 2 541 1 1 7 GLY CA C 18.347 3.925 4.640 1.00 . A A . 7 GLY CA 1 1 2 542 1 1 7 GLY H H 17.160 4.228 6.367 1.00 . A A . 7 GLY H 1 1 2 543 1 1 7 GLY HA2 H 19.150 4.455 5.129 1.00 . A A . 7 GLY HA2 1 1 2 544 1 1 7 GLY HA3 H 18.733 3.002 4.233 1.00 . A A . 7 GLY HA3 1 1 2 545 1 1 7 GLY N N 17.325 3.612 5.622 1.00 . A A . 7 GLY N 1 1 2 546 1 1 7 GLY O O 18.584 5.446 2.811 1.00 . A A . 7 GLY O 1 1 2 547 1 1 8 ILE C C 15.595 6.956 2.703 1.00 . A A . 8 ILE C 1 1 2 548 1 1 8 ILE CA C 15.872 5.527 2.249 1.00 . A A . 8 ILE CA 1 1 2 549 1 1 8 ILE CB C 14.551 4.881 1.789 1.00 . A A . 8 ILE CB 1 1 2 550 1 1 8 ILE CD1 C 15.702 3.112 0.367 1.00 . A A . 8 ILE CD1 1 1 2 551 1 1 8 ILE CG1 C 14.756 3.390 1.514 1.00 . A A . 8 ILE CG1 1 1 2 552 1 1 8 ILE CG2 C 14.021 5.587 0.550 1.00 . A A . 8 ILE CG2 1 1 2 553 1 1 8 ILE H H 15.944 4.199 3.895 1.00 . A A . 8 ILE H 1 1 2 554 1 1 8 ILE HA H 16.549 5.552 1.408 1.00 . A A . 8 ILE HA 1 1 2 555 1 1 8 ILE HB H 13.825 4.998 2.579 1.00 . A A . 8 ILE HB 1 1 2 556 1 1 8 ILE HD11 H 15.778 2.046 0.212 1.00 . A A . 8 ILE HD11 1 1 2 557 1 1 8 ILE HD12 H 15.329 3.582 -0.531 1.00 . A A . 8 ILE HD12 1 1 2 558 1 1 8 ILE HD13 H 16.679 3.510 0.602 1.00 . A A . 8 ILE HD13 1 1 2 559 1 1 8 ILE HG12 H 15.158 2.919 2.396 1.00 . A A . 8 ILE HG12 1 1 2 560 1 1 8 ILE HG13 H 13.802 2.942 1.274 1.00 . A A . 8 ILE HG13 1 1 2 561 1 1 8 ILE HG21 H 13.236 6.272 0.835 1.00 . A A . 8 ILE HG21 1 1 2 562 1 1 8 ILE HG22 H 14.822 6.135 0.078 1.00 . A A . 8 ILE HG22 1 1 2 563 1 1 8 ILE HG23 H 13.628 4.856 -0.140 1.00 . A A . 8 ILE HG23 1 1 2 564 1 1 8 ILE N N 16.503 4.751 3.310 1.00 . A A . 8 ILE N 1 1 2 565 1 1 8 ILE O O 14.962 7.180 3.735 1.00 . A A . 8 ILE O 1 1 2 566 1 1 9 LYS C C 14.404 9.625 2.515 1.00 . A A . 9 LYS C 1 1 2 567 1 1 9 LYS CA C 15.876 9.330 2.243 1.00 . A A . 9 LYS CA 1 1 2 568 1 1 9 LYS CB C 16.380 10.209 1.096 1.00 . A A . 9 LYS CB 1 1 2 569 1 1 9 LYS CD C 18.735 11.077 1.173 1.00 . A A . 9 LYS CD 1 1 2 570 1 1 9 LYS CE C 20.127 10.950 0.572 1.00 . A A . 9 LYS CE 1 1 2 571 1 1 9 LYS CG C 17.827 9.947 0.719 1.00 . A A . 9 LYS CG 1 1 2 572 1 1 9 LYS H H 16.571 7.679 1.114 1.00 . A A . 9 LYS H 1 1 2 573 1 1 9 LYS HA H 16.446 9.552 3.132 1.00 . A A . 9 LYS HA 1 1 2 574 1 1 9 LYS HB2 H 15.765 10.031 0.225 1.00 . A A . 9 LYS HB2 1 1 2 575 1 1 9 LYS HB3 H 16.287 11.246 1.385 1.00 . A A . 9 LYS HB3 1 1 2 576 1 1 9 LYS HD2 H 18.306 12.019 0.864 1.00 . A A . 9 LYS HD2 1 1 2 577 1 1 9 LYS HD3 H 18.815 11.053 2.251 1.00 . A A . 9 LYS HD3 1 1 2 578 1 1 9 LYS HE2 H 20.853 10.984 1.369 1.00 . A A . 9 LYS HE2 1 1 2 579 1 1 9 LYS HE3 H 20.198 10.002 0.060 1.00 . A A . 9 LYS HE3 1 1 2 580 1 1 9 LYS HG2 H 18.151 9.029 1.188 1.00 . A A . 9 LYS HG2 1 1 2 581 1 1 9 LYS HG3 H 17.899 9.849 -0.355 1.00 . A A . 9 LYS HG3 1 1 2 582 1 1 9 LYS HZ1 H 19.896 11.887 -1.281 1.00 . A A . 9 LYS HZ1 1 1 2 583 1 1 9 LYS HZ2 H 21.433 12.079 -0.603 1.00 . A A . 9 LYS HZ2 1 1 2 584 1 1 9 LYS HZ3 H 20.125 12.961 0.006 1.00 . A A . 9 LYS HZ3 1 1 2 585 1 1 9 LYS N N 16.073 7.921 1.924 1.00 . A A . 9 LYS N 1 1 2 586 1 1 9 LYS NZ N 20.415 12.046 -0.394 1.00 . A A . 9 LYS NZ 1 1 2 587 1 1 9 LYS O O 13.519 9.084 1.852 1.00 . A A . 9 LYS O 1 1 2 588 1 1 10 CYS C C 12.588 12.367 3.758 1.00 . A A . 10 CYS C 1 1 2 589 1 1 10 CYS CA C 12.786 10.857 3.852 1.00 . A A . 10 CYS CA 1 1 2 590 1 1 10 CYS CB C 12.461 10.376 5.268 1.00 . A A . 10 CYS CB 1 1 2 591 1 1 10 CYS H H 14.898 10.887 3.986 1.00 . A A . 10 CYS H 1 1 2 592 1 1 10 CYS HA H 12.117 10.375 3.155 1.00 . A A . 10 CYS HA 1 1 2 593 1 1 10 CYS HB2 H 11.390 10.387 5.406 1.00 . A A . 10 CYS HB2 1 1 2 594 1 1 10 CYS HB3 H 12.824 9.366 5.389 1.00 . A A . 10 CYS HB3 1 1 2 595 1 1 10 CYS N N 14.150 10.488 3.493 1.00 . A A . 10 CYS N 1 1 2 596 1 1 10 CYS O O 11.692 12.926 4.390 1.00 . A A . 10 CYS O 1 1 2 597 1 1 10 CYS SG S 13.199 11.393 6.586 1.00 . A A . 10 CYS SG 1 1 2 598 1 1 11 ASN C C 11.967 14.876 2.289 1.00 . A A . 11 ASN C 1 1 2 599 1 1 11 ASN CA C 13.349 14.466 2.788 1.00 . A A . 11 ASN CA 1 1 2 600 1 1 11 ASN CB C 14.420 14.942 1.806 1.00 . A A . 11 ASN CB 1 1 2 601 1 1 11 ASN CG C 15.720 15.304 2.498 1.00 . A A . 11 ASN CG 1 1 2 602 1 1 11 ASN H H 14.124 12.519 2.488 1.00 . A A . 11 ASN H 1 1 2 603 1 1 11 ASN HA H 13.523 14.928 3.749 1.00 . A A . 11 ASN HA 1 1 2 604 1 1 11 ASN HB2 H 14.621 14.155 1.093 1.00 . A A . 11 ASN HB2 1 1 2 605 1 1 11 ASN HB3 H 14.058 15.813 1.281 1.00 . A A . 11 ASN HB3 1 1 2 606 1 1 11 ASN HD21 H 16.765 14.576 0.970 1.00 . A A . 11 ASN HD21 1 1 2 607 1 1 11 ASN HD22 H 17.694 15.228 2.273 1.00 . A A . 11 ASN HD22 1 1 2 608 1 1 11 ASN N N 13.430 13.021 2.965 1.00 . A A . 11 ASN N 1 1 2 609 1 1 11 ASN ND2 N 16.839 15.006 1.848 1.00 . A A . 11 ASN ND2 1 1 2 610 1 1 11 ASN O O 11.539 16.014 2.479 1.00 . A A . 11 ASN O 1 1 2 611 1 1 11 ASN OD1 O 15.718 15.844 3.604 1.00 . A A . 11 ASN OD1 1 1 2 612 1 1 12 ASP C C 9.028 12.996 1.328 1.00 . A A . 12 ASP C 1 1 2 613 1 1 12 ASP CA C 9.939 14.202 1.124 1.00 . A A . 12 ASP CA 1 1 2 614 1 1 12 ASP CB C 10.013 14.555 -0.362 1.00 . A A . 12 ASP CB 1 1 2 615 1 1 12 ASP CG C 10.783 13.525 -1.164 1.00 . A A . 12 ASP CG 1 1 2 616 1 1 12 ASP H H 11.669 13.051 1.529 1.00 . A A . 12 ASP H 1 1 2 617 1 1 12 ASP HA H 9.529 15.042 1.664 1.00 . A A . 12 ASP HA 1 1 2 618 1 1 12 ASP HB2 H 9.011 14.619 -0.761 1.00 . A A . 12 ASP HB2 1 1 2 619 1 1 12 ASP HB3 H 10.502 15.512 -0.474 1.00 . A A . 12 ASP HB3 1 1 2 620 1 1 12 ASP N N 11.273 13.940 1.650 1.00 . A A . 12 ASP N 1 1 2 621 1 1 12 ASP O O 7.877 13.138 1.744 1.00 . A A . 12 ASP O 1 1 2 622 1 1 12 ASP OD1 O 12.025 13.636 -1.236 1.00 . A A . 12 ASP OD1 1 1 2 623 1 1 12 ASP OD2 O 10.144 12.608 -1.720 1.00 . A A . 12 ASP OD2 1 1 2 624 1 1 13 ILE C C 8.717 10.148 2.643 1.00 . A A . 13 ILE C 1 1 2 625 1 1 13 ILE CA C 8.782 10.580 1.182 1.00 . A A . 13 ILE CA 1 1 2 626 1 1 13 ILE CB C 9.385 9.435 0.346 1.00 . A A . 13 ILE CB 1 1 2 627 1 1 13 ILE CD1 C 8.327 7.582 -1.041 1.00 . A A . 13 ILE CD1 1 1 2 628 1 1 13 ILE CG1 C 8.432 8.238 0.318 1.00 . A A . 13 ILE CG1 1 1 2 629 1 1 13 ILE CG2 C 10.739 9.027 0.907 1.00 . A A . 13 ILE CG2 1 1 2 630 1 1 13 ILE H H 10.471 11.762 0.704 1.00 . A A . 13 ILE H 1 1 2 631 1 1 13 ILE HA H 7.779 10.767 0.827 1.00 . A A . 13 ILE HA 1 1 2 632 1 1 13 ILE HB H 9.533 9.793 -0.661 1.00 . A A . 13 ILE HB 1 1 2 633 1 1 13 ILE HD11 H 8.395 8.336 -1.812 1.00 . A A . 13 ILE HD11 1 1 2 634 1 1 13 ILE HD12 H 9.130 6.870 -1.161 1.00 . A A . 13 ILE HD12 1 1 2 635 1 1 13 ILE HD13 H 7.378 7.071 -1.122 1.00 . A A . 13 ILE HD13 1 1 2 636 1 1 13 ILE HG12 H 8.776 7.495 1.019 1.00 . A A . 13 ILE HG12 1 1 2 637 1 1 13 ILE HG13 H 7.444 8.568 0.605 1.00 . A A . 13 ILE HG13 1 1 2 638 1 1 13 ILE HG21 H 10.603 8.552 1.868 1.00 . A A . 13 ILE HG21 1 1 2 639 1 1 13 ILE HG22 H 11.215 8.334 0.229 1.00 . A A . 13 ILE HG22 1 1 2 640 1 1 13 ILE HG23 H 11.360 9.902 1.023 1.00 . A A . 13 ILE HG23 1 1 2 641 1 1 13 ILE N N 9.549 11.810 1.031 1.00 . A A . 13 ILE N 1 1 2 642 1 1 13 ILE O O 9.679 10.312 3.393 1.00 . A A . 13 ILE O 1 1 2 643 1 1 14 HIS C C 7.685 7.646 4.533 1.00 . A A . 14 HIS C 1 1 2 644 1 1 14 HIS CA C 7.384 9.137 4.412 1.00 . A A . 14 HIS CA 1 1 2 645 1 1 14 HIS CB C 5.954 9.420 4.872 1.00 . A A . 14 HIS CB 1 1 2 646 1 1 14 HIS CD2 C 4.997 11.819 5.112 1.00 . A A . 14 HIS CD2 1 1 2 647 1 1 14 HIS CE1 C 6.100 12.426 6.907 1.00 . A A . 14 HIS CE1 1 1 2 648 1 1 14 HIS CG C 5.779 10.777 5.481 1.00 . A A . 14 HIS CG 1 1 2 649 1 1 14 HIS H H 6.845 9.491 2.396 1.00 . A A . 14 HIS H 1 1 2 650 1 1 14 HIS HA H 8.071 9.682 5.042 1.00 . A A . 14 HIS HA 1 1 2 651 1 1 14 HIS HB2 H 5.289 9.349 4.024 1.00 . A A . 14 HIS HB2 1 1 2 652 1 1 14 HIS HB3 H 5.668 8.685 5.610 1.00 . A A . 14 HIS HB3 1 1 2 653 1 1 14 HIS HD1 H 7.104 10.656 7.114 1.00 . A A . 14 HIS HD1 1 1 2 654 1 1 14 HIS HD2 H 4.326 11.849 4.265 1.00 . A A . 14 HIS HD2 1 1 2 655 1 1 14 HIS HE1 H 6.468 13.007 7.739 1.00 . A A . 14 HIS HE1 1 1 2 656 1 1 14 HIS N N 7.575 9.595 3.040 1.00 . A A . 14 HIS N 1 1 2 657 1 1 14 HIS ND1 N 6.458 11.190 6.608 1.00 . A A . 14 HIS ND1 1 1 2 658 1 1 14 HIS NE2 N 5.214 12.831 6.014 1.00 . A A . 14 HIS NE2 1 1 2 659 1 1 14 HIS O O 7.591 6.901 3.557 1.00 . A A . 14 HIS O 1 1 2 660 1 1 15 CYS C C 7.115 5.044 6.411 1.00 . A A . 15 CYS C 1 1 2 661 1 1 15 CYS CA C 8.362 5.815 5.988 1.00 . A A . 15 CYS CA 1 1 2 662 1 1 15 CYS CB C 9.439 5.698 7.068 1.00 . A A . 15 CYS CB 1 1 2 663 1 1 15 CYS H H 8.104 7.858 6.477 1.00 . A A . 15 CYS H 1 1 2 664 1 1 15 CYS HA H 8.739 5.391 5.069 1.00 . A A . 15 CYS HA 1 1 2 665 1 1 15 CYS HB2 H 8.964 5.688 8.039 1.00 . A A . 15 CYS HB2 1 1 2 666 1 1 15 CYS HB3 H 9.980 4.774 6.928 1.00 . A A . 15 CYS HB3 1 1 2 667 1 1 15 CYS N N 8.047 7.217 5.738 1.00 . A A . 15 CYS N 1 1 2 668 1 1 15 CYS O O 6.177 5.616 6.966 1.00 . A A . 15 CYS O 1 1 2 669 1 1 15 CYS SG S 10.651 7.058 7.060 1.00 . A A . 15 CYS SG 1 1 2 670 1 1 16 CYS C C 5.767 2.871 8.007 1.00 . A A . 16 CYS C 1 1 2 671 1 1 16 CYS CA C 5.983 2.891 6.497 1.00 . A A . 16 CYS CA 1 1 2 672 1 1 16 CYS CB C 6.210 1.468 5.984 1.00 . A A . 16 CYS CB 1 1 2 673 1 1 16 CYS H H 7.891 3.343 5.699 1.00 . A A . 16 CYS H 1 1 2 674 1 1 16 CYS HA H 5.101 3.298 6.025 1.00 . A A . 16 CYS HA 1 1 2 675 1 1 16 CYS HB2 H 7.273 1.282 5.919 1.00 . A A . 16 CYS HB2 1 1 2 676 1 1 16 CYS HB3 H 5.770 0.768 6.679 1.00 . A A . 16 CYS HB3 1 1 2 677 1 1 16 CYS N N 7.113 3.742 6.144 1.00 . A A . 16 CYS N 1 1 2 678 1 1 16 CYS O O 6.700 3.084 8.781 1.00 . A A . 16 CYS O 1 1 2 679 1 1 16 CYS SG S 5.492 1.146 4.341 1.00 . A A . 16 CYS SG 1 1 2 680 1 1 17 SER C C 5.148 1.657 10.596 1.00 . A A . 17 SER C 1 1 2 681 1 1 17 SER CA C 4.190 2.569 9.836 1.00 . A A . 17 SER CA 1 1 2 682 1 1 17 SER CB C 2.751 2.084 10.022 1.00 . A A . 17 SER CB 1 1 2 683 1 1 17 SER H H 3.829 2.452 7.753 1.00 . A A . 17 SER H 1 1 2 684 1 1 17 SER HA H 4.277 3.571 10.230 1.00 . A A . 17 SER HA 1 1 2 685 1 1 17 SER HB2 H 2.488 2.137 11.068 1.00 . A A . 17 SER HB2 1 1 2 686 1 1 17 SER HB3 H 2.085 2.715 9.452 1.00 . A A . 17 SER HB3 1 1 2 687 1 1 17 SER HG H 2.774 0.699 8.637 1.00 . A A . 17 SER HG 1 1 2 688 1 1 17 SER N N 4.530 2.614 8.419 1.00 . A A . 17 SER N 1 1 2 689 1 1 17 SER O O 5.112 0.436 10.445 1.00 . A A . 17 SER O 1 1 2 690 1 1 17 SER OG O 2.602 0.746 9.581 1.00 . A A . 17 SER OG 1 1 2 691 1 1 18 GLY C C 8.362 2.062 12.116 1.00 . A A . 18 GLY C 1 1 2 692 1 1 18 GLY CA C 6.961 1.488 12.187 1.00 . A A . 18 GLY CA 1 1 2 693 1 1 18 GLY H H 5.988 3.236 11.495 1.00 . A A . 18 GLY H 1 1 2 694 1 1 18 GLY HA2 H 6.643 1.469 13.219 1.00 . A A . 18 GLY HA2 1 1 2 695 1 1 18 GLY HA3 H 6.980 0.476 11.808 1.00 . A A . 18 GLY HA3 1 1 2 696 1 1 18 GLY N N 6.005 2.260 11.415 1.00 . A A . 18 GLY N 1 1 2 697 1 1 18 GLY O O 9.227 1.711 12.919 1.00 . A A . 18 GLY O 1 1 2 698 1 1 19 LEU C C 9.821 5.073 11.232 1.00 . A A . 19 LEU C 1 1 2 699 1 1 19 LEU CA C 9.896 3.571 10.976 1.00 . A A . 19 LEU CA 1 1 2 700 1 1 19 LEU CB C 10.424 3.308 9.565 1.00 . A A . 19 LEU CB 1 1 2 701 1 1 19 LEU CD1 C 11.036 1.694 7.747 1.00 . A A . 19 LEU CD1 1 1 2 702 1 1 19 LEU CD2 C 11.950 1.380 10.055 1.00 . A A . 19 LEU CD2 1 1 2 703 1 1 19 LEU CG C 10.759 1.853 9.234 1.00 . A A . 19 LEU CG 1 1 2 704 1 1 19 LEU H H 7.860 3.188 10.542 1.00 . A A . 19 LEU H 1 1 2 705 1 1 19 LEU HA H 10.572 3.129 11.693 1.00 . A A . 19 LEU HA 1 1 2 706 1 1 19 LEU HB2 H 9.674 3.642 8.864 1.00 . A A . 19 LEU HB2 1 1 2 707 1 1 19 LEU HB3 H 11.323 3.893 9.434 1.00 . A A . 19 LEU HB3 1 1 2 708 1 1 19 LEU HD11 H 11.232 0.655 7.527 1.00 . A A . 19 LEU HD11 1 1 2 709 1 1 19 LEU HD12 H 11.897 2.288 7.476 1.00 . A A . 19 LEU HD12 1 1 2 710 1 1 19 LEU HD13 H 10.177 2.027 7.183 1.00 . A A . 19 LEU HD13 1 1 2 711 1 1 19 LEU HD21 H 11.866 1.760 11.062 1.00 . A A . 19 LEU HD21 1 1 2 712 1 1 19 LEU HD22 H 12.863 1.746 9.607 1.00 . A A . 19 LEU HD22 1 1 2 713 1 1 19 LEU HD23 H 11.967 0.301 10.077 1.00 . A A . 19 LEU HD23 1 1 2 714 1 1 19 LEU HG H 9.911 1.229 9.484 1.00 . A A . 19 LEU HG 1 1 2 715 1 1 19 LEU N N 8.589 2.947 11.151 1.00 . A A . 19 LEU N 1 1 2 716 1 1 19 LEU O O 8.776 5.695 11.042 1.00 . A A . 19 LEU O 1 1 2 717 1 1 20 LYS C C 11.769 7.815 10.845 1.00 . A A . 20 LYS C 1 1 2 718 1 1 20 LYS CA C 11.001 7.081 11.940 1.00 . A A . 20 LYS CA 1 1 2 719 1 1 20 LYS CB C 11.666 7.328 13.296 1.00 . A A . 20 LYS CB 1 1 2 720 1 1 20 LYS CD C 11.227 8.159 15.626 1.00 . A A . 20 LYS CD 1 1 2 721 1 1 20 LYS CE C 10.495 7.829 16.918 1.00 . A A . 20 LYS CE 1 1 2 722 1 1 20 LYS CG C 10.687 7.351 14.458 1.00 . A A . 20 LYS CG 1 1 2 723 1 1 20 LYS H H 11.739 5.102 11.794 1.00 . A A . 20 LYS H 1 1 2 724 1 1 20 LYS HA H 9.990 7.458 11.970 1.00 . A A . 20 LYS HA 1 1 2 725 1 1 20 LYS HB2 H 12.388 6.546 13.477 1.00 . A A . 20 LYS HB2 1 1 2 726 1 1 20 LYS HB3 H 12.177 8.279 13.265 1.00 . A A . 20 LYS HB3 1 1 2 727 1 1 20 LYS HD2 H 12.276 7.936 15.753 1.00 . A A . 20 LYS HD2 1 1 2 728 1 1 20 LYS HD3 H 11.105 9.211 15.412 1.00 . A A . 20 LYS HD3 1 1 2 729 1 1 20 LYS HE2 H 9.492 8.222 16.858 1.00 . A A . 20 LYS HE2 1 1 2 730 1 1 20 LYS HE3 H 10.455 6.755 17.029 1.00 . A A . 20 LYS HE3 1 1 2 731 1 1 20 LYS HG2 H 9.759 7.794 14.126 1.00 . A A . 20 LYS HG2 1 1 2 732 1 1 20 LYS HG3 H 10.507 6.337 14.785 1.00 . A A . 20 LYS HG3 1 1 2 733 1 1 20 LYS HZ1 H 11.928 9.065 17.802 1.00 . A A . 20 LYS HZ1 1 1 2 734 1 1 20 LYS HZ2 H 11.598 7.660 18.684 1.00 . A A . 20 LYS HZ2 1 1 2 735 1 1 20 LYS HZ3 H 10.491 8.940 18.687 1.00 . A A . 20 LYS HZ3 1 1 2 736 1 1 20 LYS N N 10.938 5.651 11.662 1.00 . A A . 20 LYS N 1 1 2 737 1 1 20 LYS NZ N 11.175 8.414 18.106 1.00 . A A . 20 LYS NZ 1 1 2 738 1 1 20 LYS O O 12.729 7.285 10.284 1.00 . A A . 20 LYS O 1 1 2 739 1 1 21 CYS C C 13.020 10.783 10.136 1.00 . A A . 21 CYS C 1 1 2 740 1 1 21 CYS CA C 11.987 9.844 9.519 1.00 . A A . 21 CYS CA 1 1 2 741 1 1 21 CYS CB C 10.945 10.653 8.744 1.00 . A A . 21 CYS CB 1 1 2 742 1 1 21 CYS H H 10.569 9.405 11.028 1.00 . A A . 21 CYS H 1 1 2 743 1 1 21 CYS HA H 12.490 9.174 8.837 1.00 . A A . 21 CYS HA 1 1 2 744 1 1 21 CYS HB2 H 10.383 9.985 8.108 1.00 . A A . 21 CYS HB2 1 1 2 745 1 1 21 CYS HB3 H 10.272 11.124 9.446 1.00 . A A . 21 CYS HB3 1 1 2 746 1 1 21 CYS N N 11.340 9.036 10.546 1.00 . A A . 21 CYS N 1 1 2 747 1 1 21 CYS O O 12.684 11.871 10.604 1.00 . A A . 21 CYS O 1 1 2 748 1 1 21 CYS SG S 11.651 11.958 7.688 1.00 . A A . 21 CYS SG 1 1 2 749 1 1 22 ASP C C 15.501 12.477 9.939 1.00 . A A . 22 ASP C 1 1 2 750 1 1 22 ASP CA C 15.360 11.157 10.690 1.00 . A A . 22 ASP CA 1 1 2 751 1 1 22 ASP CB C 16.678 10.382 10.635 1.00 . A A . 22 ASP CB 1 1 2 752 1 1 22 ASP CG C 17.630 10.781 11.746 1.00 . A A . 22 ASP CG 1 1 2 753 1 1 22 ASP H H 14.483 9.478 9.744 1.00 . A A . 22 ASP H 1 1 2 754 1 1 22 ASP HA H 15.119 11.368 11.721 1.00 . A A . 22 ASP HA 1 1 2 755 1 1 22 ASP HB2 H 16.471 9.326 10.726 1.00 . A A . 22 ASP HB2 1 1 2 756 1 1 22 ASP HB3 H 17.160 10.570 9.687 1.00 . A A . 22 ASP HB3 1 1 2 757 1 1 22 ASP N N 14.277 10.355 10.132 1.00 . A A . 22 ASP N 1 1 2 758 1 1 22 ASP O O 16.042 12.520 8.834 1.00 . A A . 22 ASP O 1 1 2 759 1 1 22 ASP OD1 O 17.359 10.431 12.914 1.00 . A A . 22 ASP OD1 1 1 2 760 1 1 22 ASP OD2 O 18.646 11.442 11.447 1.00 . A A . 22 ASP OD2 1 1 2 761 1 1 23 SER C C 16.497 15.423 9.976 1.00 . A A . 23 SER C 1 1 2 762 1 1 23 SER CA C 15.074 14.874 9.931 1.00 . A A . 23 SER CA 1 1 2 763 1 1 23 SER CB C 14.121 15.837 10.641 1.00 . A A . 23 SER CB 1 1 2 764 1 1 23 SER H H 14.588 13.454 11.425 1.00 . A A . 23 SER H 1 1 2 765 1 1 23 SER HA H 14.771 14.776 8.900 1.00 . A A . 23 SER HA 1 1 2 766 1 1 23 SER HB2 H 13.189 15.333 10.846 1.00 . A A . 23 SER HB2 1 1 2 767 1 1 23 SER HB3 H 14.567 16.161 11.571 1.00 . A A . 23 SER HB3 1 1 2 768 1 1 23 SER HG H 14.672 17.273 9.427 1.00 . A A . 23 SER HG 1 1 2 769 1 1 23 SER N N 15.008 13.553 10.545 1.00 . A A . 23 SER N 1 1 2 770 1 1 23 SER O O 16.817 16.407 9.309 1.00 . A A . 23 SER O 1 1 2 771 1 1 23 SER OG O 13.858 16.977 9.841 1.00 . A A . 23 SER OG 1 1 2 772 1 1 24 LYS C C 19.595 14.604 9.787 1.00 . A A . 24 LYS C 1 1 2 773 1 1 24 LYS CA C 18.738 15.199 10.899 1.00 . A A . 24 LYS CA 1 1 2 774 1 1 24 LYS CB C 19.291 14.781 12.264 1.00 . A A . 24 LYS CB 1 1 2 775 1 1 24 LYS CD C 19.869 15.736 14.514 1.00 . A A . 24 LYS CD 1 1 2 776 1 1 24 LYS CE C 19.433 16.672 15.631 1.00 . A A . 24 LYS CE 1 1 2 777 1 1 24 LYS CG C 18.831 15.670 13.405 1.00 . A A . 24 LYS CG 1 1 2 778 1 1 24 LYS H H 17.034 14.000 11.273 1.00 . A A . 24 LYS H 1 1 2 779 1 1 24 LYS HA H 18.768 16.276 10.823 1.00 . A A . 24 LYS HA 1 1 2 780 1 1 24 LYS HB2 H 18.974 13.769 12.472 1.00 . A A . 24 LYS HB2 1 1 2 781 1 1 24 LYS HB3 H 20.371 14.809 12.225 1.00 . A A . 24 LYS HB3 1 1 2 782 1 1 24 LYS HD2 H 20.010 14.747 14.923 1.00 . A A . 24 LYS HD2 1 1 2 783 1 1 24 LYS HD3 H 20.802 16.093 14.101 1.00 . A A . 24 LYS HD3 1 1 2 784 1 1 24 LYS HE2 H 19.538 17.691 15.291 1.00 . A A . 24 LYS HE2 1 1 2 785 1 1 24 LYS HE3 H 18.397 16.475 15.863 1.00 . A A . 24 LYS HE3 1 1 2 786 1 1 24 LYS HG2 H 18.661 16.667 13.027 1.00 . A A . 24 LYS HG2 1 1 2 787 1 1 24 LYS HG3 H 17.911 15.274 13.810 1.00 . A A . 24 LYS HG3 1 1 2 788 1 1 24 LYS HZ1 H 19.641 16.526 17.704 1.00 . A A . 24 LYS HZ1 1 1 2 789 1 1 24 LYS HZ2 H 20.968 17.233 16.931 1.00 . A A . 24 LYS HZ2 1 1 2 790 1 1 24 LYS HZ3 H 20.728 15.562 16.837 1.00 . A A . 24 LYS HZ3 1 1 2 791 1 1 24 LYS N N 17.348 14.779 10.767 1.00 . A A . 24 LYS N 1 1 2 792 1 1 24 LYS NZ N 20.250 16.485 16.862 1.00 . A A . 24 LYS NZ 1 1 2 793 1 1 24 LYS O O 20.441 15.287 9.209 1.00 . A A . 24 LYS O 1 1 2 794 1 1 25 ARG C C 19.302 12.538 7.165 1.00 . A A . 25 ARG C 1 1 2 795 1 1 25 ARG CA C 20.122 12.641 8.448 1.00 . A A . 25 ARG CA 1 1 2 796 1 1 25 ARG CB C 20.530 11.244 8.919 1.00 . A A . 25 ARG CB 1 1 2 797 1 1 25 ARG CD C 22.430 10.026 10.025 1.00 . A A . 25 ARG CD 1 1 2 798 1 1 25 ARG CG C 21.535 11.255 10.059 1.00 . A A . 25 ARG CG 1 1 2 799 1 1 25 ARG CZ C 22.136 9.010 12.244 1.00 . A A . 25 ARG CZ 1 1 2 800 1 1 25 ARG H H 18.682 12.836 9.987 1.00 . A A . 25 ARG H 1 1 2 801 1 1 25 ARG HA H 21.012 13.218 8.246 1.00 . A A . 25 ARG HA 1 1 2 802 1 1 25 ARG HB2 H 19.648 10.717 9.251 1.00 . A A . 25 ARG HB2 1 1 2 803 1 1 25 ARG HB3 H 20.967 10.711 8.088 1.00 . A A . 25 ARG HB3 1 1 2 804 1 1 25 ARG HD2 H 22.447 9.638 9.017 1.00 . A A . 25 ARG HD2 1 1 2 805 1 1 25 ARG HD3 H 23.428 10.317 10.315 1.00 . A A . 25 ARG HD3 1 1 2 806 1 1 25 ARG HE H 21.486 8.218 10.533 1.00 . A A . 25 ARG HE 1 1 2 807 1 1 25 ARG HG2 H 22.151 12.138 9.975 1.00 . A A . 25 ARG HG2 1 1 2 808 1 1 25 ARG HG3 H 21.000 11.274 10.997 1.00 . A A . 25 ARG HG3 1 1 2 809 1 1 25 ARG HH11 H 23.117 10.776 12.240 1.00 . A A . 25 ARG HH11 1 1 2 810 1 1 25 ARG HH12 H 22.903 10.049 13.798 1.00 . A A . 25 ARG HH12 1 1 2 811 1 1 25 ARG HH21 H 21.198 7.251 12.578 1.00 . A A . 25 ARG HH21 1 1 2 812 1 1 25 ARG HH22 H 21.812 8.044 13.989 1.00 . A A . 25 ARG HH22 1 1 2 813 1 1 25 ARG N N 19.370 13.328 9.491 1.00 . A A . 25 ARG N 1 1 2 814 1 1 25 ARG NE N 21.958 8.980 10.928 1.00 . A A . 25 ARG NE 1 1 2 815 1 1 25 ARG NH1 N 22.771 10.028 12.807 1.00 . A A . 25 ARG NH1 1 1 2 816 1 1 25 ARG NH2 N 21.677 8.020 12.999 1.00 . A A . 25 ARG NH2 1 1 2 817 1 1 25 ARG O O 19.746 11.955 6.176 1.00 . A A . 25 ARG O 1 1 2 818 1 1 26 LYS C C 17.025 11.655 5.525 1.00 . A A . 26 LYS C 1 1 2 819 1 1 26 LYS CA C 17.218 13.082 6.029 1.00 . A A . 26 LYS CA 1 1 2 820 1 1 26 LYS CB C 17.787 13.957 4.910 1.00 . A A . 26 LYS CB 1 1 2 821 1 1 26 LYS CD C 19.389 15.604 5.925 1.00 . A A . 26 LYS CD 1 1 2 822 1 1 26 LYS CE C 19.913 17.007 5.662 1.00 . A A . 26 LYS CE 1 1 2 823 1 1 26 LYS CG C 18.009 15.402 5.321 1.00 . A A . 26 LYS CG 1 1 2 824 1 1 26 LYS H H 17.803 13.558 8.007 1.00 . A A . 26 LYS H 1 1 2 825 1 1 26 LYS HA H 16.261 13.477 6.332 1.00 . A A . 26 LYS HA 1 1 2 826 1 1 26 LYS HB2 H 18.733 13.545 4.592 1.00 . A A . 26 LYS HB2 1 1 2 827 1 1 26 LYS HB3 H 17.100 13.944 4.075 1.00 . A A . 26 LYS HB3 1 1 2 828 1 1 26 LYS HD2 H 19.332 15.447 6.992 1.00 . A A . 26 LYS HD2 1 1 2 829 1 1 26 LYS HD3 H 20.071 14.887 5.490 1.00 . A A . 26 LYS HD3 1 1 2 830 1 1 26 LYS HE2 H 19.202 17.721 6.050 1.00 . A A . 26 LYS HE2 1 1 2 831 1 1 26 LYS HE3 H 20.857 17.126 6.172 1.00 . A A . 26 LYS HE3 1 1 2 832 1 1 26 LYS HG2 H 17.914 16.034 4.450 1.00 . A A . 26 LYS HG2 1 1 2 833 1 1 26 LYS HG3 H 17.263 15.678 6.052 1.00 . A A . 26 LYS HG3 1 1 2 834 1 1 26 LYS HZ1 H 20.996 17.788 4.056 1.00 . A A . 26 LYS HZ1 1 1 2 835 1 1 26 LYS HZ2 H 19.320 17.821 3.832 1.00 . A A . 26 LYS HZ2 1 1 2 836 1 1 26 LYS HZ3 H 20.162 16.361 3.691 1.00 . A A . 26 LYS HZ3 1 1 2 837 1 1 26 LYS N N 18.102 13.108 7.189 1.00 . A A . 26 LYS N 1 1 2 838 1 1 26 LYS NZ N 20.112 17.262 4.208 1.00 . A A . 26 LYS NZ 1 1 2 839 1 1 26 LYS O O 17.023 11.407 4.319 1.00 . A A . 26 LYS O 1 1 2 840 1 1 27 VAL C C 15.827 8.602 7.159 1.00 . A A . 27 VAL C 1 1 2 841 1 1 27 VAL CA C 16.663 9.319 6.105 1.00 . A A . 27 VAL CA 1 1 2 842 1 1 27 VAL CB C 18.008 8.586 5.946 1.00 . A A . 27 VAL CB 1 1 2 843 1 1 27 VAL CG1 C 18.737 9.071 4.702 1.00 . A A . 27 VAL CG1 1 1 2 844 1 1 27 VAL CG2 C 18.868 8.776 7.186 1.00 . A A . 27 VAL CG2 1 1 2 845 1 1 27 VAL H H 16.871 10.980 7.400 1.00 . A A . 27 VAL H 1 1 2 846 1 1 27 VAL HA H 16.142 9.282 5.159 1.00 . A A . 27 VAL HA 1 1 2 847 1 1 27 VAL HB H 17.808 7.531 5.830 1.00 . A A . 27 VAL HB 1 1 2 848 1 1 27 VAL HG11 H 18.153 8.830 3.826 1.00 . A A . 27 VAL HG11 1 1 2 849 1 1 27 VAL HG12 H 18.876 10.141 4.761 1.00 . A A . 27 VAL HG12 1 1 2 850 1 1 27 VAL HG13 H 19.699 8.585 4.637 1.00 . A A . 27 VAL HG13 1 1 2 851 1 1 27 VAL HG21 H 19.511 9.632 7.049 1.00 . A A . 27 VAL HG21 1 1 2 852 1 1 27 VAL HG22 H 18.231 8.937 8.045 1.00 . A A . 27 VAL HG22 1 1 2 853 1 1 27 VAL HG23 H 19.470 7.894 7.346 1.00 . A A . 27 VAL HG23 1 1 2 854 1 1 27 VAL N N 16.860 10.721 6.455 1.00 . A A . 27 VAL N 1 1 2 855 1 1 27 VAL O O 15.678 9.082 8.282 1.00 . A A . 27 VAL O 1 1 2 856 1 1 28 CYS C C 15.330 5.793 8.605 1.00 . A A . 28 CYS C 1 1 2 857 1 1 28 CYS CA C 14.460 6.662 7.701 1.00 . A A . 28 CYS CA 1 1 2 858 1 1 28 CYS CB C 13.486 5.783 6.914 1.00 . A A . 28 CYS CB 1 1 2 859 1 1 28 CYS H H 15.436 7.116 5.878 1.00 . A A . 28 CYS H 1 1 2 860 1 1 28 CYS HA H 13.897 7.348 8.315 1.00 . A A . 28 CYS HA 1 1 2 861 1 1 28 CYS HB2 H 14.045 5.164 6.227 1.00 . A A . 28 CYS HB2 1 1 2 862 1 1 28 CYS HB3 H 12.947 5.149 7.604 1.00 . A A . 28 CYS HB3 1 1 2 863 1 1 28 CYS N N 15.282 7.448 6.788 1.00 . A A . 28 CYS N 1 1 2 864 1 1 28 CYS O O 16.300 5.185 8.154 1.00 . A A . 28 CYS O 1 1 2 865 1 1 28 CYS SG S 12.259 6.717 5.944 1.00 . A A . 28 CYS SG 1 1 2 866 1 1 29 VAL C C 14.781 4.118 11.725 1.00 . A A . 29 VAL C 1 1 2 867 1 1 29 VAL CA C 15.720 4.944 10.853 1.00 . A A . 29 VAL CA 1 1 2 868 1 1 29 VAL CB C 16.592 5.835 11.757 1.00 . A A . 29 VAL CB 1 1 2 869 1 1 29 VAL CG1 C 17.703 6.490 10.950 1.00 . A A . 29 VAL CG1 1 1 2 870 1 1 29 VAL CG2 C 15.739 6.884 12.454 1.00 . A A . 29 VAL CG2 1 1 2 871 1 1 29 VAL H H 14.190 6.246 10.185 1.00 . A A . 29 VAL H 1 1 2 872 1 1 29 VAL HA H 16.370 4.276 10.307 1.00 . A A . 29 VAL HA 1 1 2 873 1 1 29 VAL HB H 17.047 5.211 12.513 1.00 . A A . 29 VAL HB 1 1 2 874 1 1 29 VAL HG11 H 18.221 7.209 11.568 1.00 . A A . 29 VAL HG11 1 1 2 875 1 1 29 VAL HG12 H 18.398 5.734 10.615 1.00 . A A . 29 VAL HG12 1 1 2 876 1 1 29 VAL HG13 H 17.277 6.993 10.094 1.00 . A A . 29 VAL HG13 1 1 2 877 1 1 29 VAL HG21 H 14.702 6.585 12.418 1.00 . A A . 29 VAL HG21 1 1 2 878 1 1 29 VAL HG22 H 16.051 6.976 13.485 1.00 . A A . 29 VAL HG22 1 1 2 879 1 1 29 VAL HG23 H 15.858 7.835 11.956 1.00 . A A . 29 VAL HG23 1 1 2 880 1 1 29 VAL N N 14.974 5.739 9.885 1.00 . A A . 29 VAL N 1 1 2 881 1 1 29 VAL O O 13.590 4.413 11.828 1.00 . A A . 29 VAL O 1 1 2 882 1 1 30 LYS C C 14.246 2.893 14.553 1.00 . A A . 30 LYS C 1 1 2 883 1 1 30 LYS CA C 14.539 2.212 13.220 1.00 . A A . 30 LYS CA 1 1 2 884 1 1 30 LYS CB C 15.277 0.893 13.459 1.00 . A A . 30 LYS CB 1 1 2 885 1 1 30 LYS CD C 15.105 -1.547 14.029 1.00 . A A . 30 LYS CD 1 1 2 886 1 1 30 LYS CE C 14.865 -2.310 12.736 1.00 . A A . 30 LYS CE 1 1 2 887 1 1 30 LYS CG C 14.393 -0.205 14.025 1.00 . A A . 30 LYS CG 1 1 2 888 1 1 30 LYS H H 16.281 2.897 12.232 1.00 . A A . 30 LYS H 1 1 2 889 1 1 30 LYS HA H 13.604 2.006 12.722 1.00 . A A . 30 LYS HA 1 1 2 890 1 1 30 LYS HB2 H 15.688 0.549 12.522 1.00 . A A . 30 LYS HB2 1 1 2 891 1 1 30 LYS HB3 H 16.086 1.069 14.154 1.00 . A A . 30 LYS HB3 1 1 2 892 1 1 30 LYS HD2 H 16.166 -1.382 14.145 1.00 . A A . 30 LYS HD2 1 1 2 893 1 1 30 LYS HD3 H 14.739 -2.136 14.858 1.00 . A A . 30 LYS HD3 1 1 2 894 1 1 30 LYS HE2 H 13.931 -1.981 12.307 1.00 . A A . 30 LYS HE2 1 1 2 895 1 1 30 LYS HE3 H 15.672 -2.094 12.051 1.00 . A A . 30 LYS HE3 1 1 2 896 1 1 30 LYS HG2 H 14.122 0.050 15.038 1.00 . A A . 30 LYS HG2 1 1 2 897 1 1 30 LYS HG3 H 13.501 -0.283 13.420 1.00 . A A . 30 LYS HG3 1 1 2 898 1 1 30 LYS HZ1 H 15.611 -4.247 12.503 1.00 . A A . 30 LYS HZ1 1 1 2 899 1 1 30 LYS HZ2 H 13.923 -4.167 12.565 1.00 . A A . 30 LYS HZ2 1 1 2 900 1 1 30 LYS HZ3 H 14.831 -3.987 13.981 1.00 . A A . 30 LYS HZ3 1 1 2 901 1 1 30 LYS N N 15.326 3.082 12.353 1.00 . A A . 30 LYS N 1 1 2 902 1 1 30 LYS NZ N 14.803 -3.781 12.962 1.00 . A A . 30 LYS NZ 1 1 2 903 1 1 30 LYS O O 14.796 2.516 15.587 1.00 . A A . 30 LYS O 1 1 2 904 1 1 31 GLY C C 13.904 5.823 15.969 1.00 . A A . 31 GLY C 1 1 2 905 1 1 31 GLY CA C 13.023 4.612 15.734 1.00 . A A . 31 GLY CA 1 1 2 906 1 1 31 GLY H H 12.967 4.153 13.668 1.00 . A A . 31 GLY H 1 1 2 907 1 1 31 GLY HA2 H 11.996 4.936 15.663 1.00 . A A . 31 GLY HA2 1 1 2 908 1 1 31 GLY HA3 H 13.122 3.942 16.575 1.00 . A A . 31 GLY HA3 1 1 2 909 1 1 31 GLY N N 13.375 3.896 14.522 1.00 . A A . 31 GLY N 1 1 2 910 1 1 31 GLY O O 14.023 6.303 17.096 1.00 . A A . 31 GLY O 1 1 3 911 1 1 1 GLY C C 3.900 0.363 0.634 1.00 . A A . 1 GLY C 1 1 3 912 1 1 1 GLY CA C 2.395 0.212 0.722 1.00 . A A . 1 GLY CA 1 1 3 913 1 1 1 GLY H1 H 0.730 1.458 0.323 1.00 . A A . 1 GLY H1 1 1 3 914 1 1 1 GLY HA2 H 2.113 0.108 1.759 1.00 . A A . 1 GLY HA2 1 1 3 915 1 1 1 GLY HA3 H 2.103 -0.682 0.189 1.00 . A A . 1 GLY HA3 1 1 3 916 1 1 1 GLY N N 1.689 1.346 0.154 1.00 . A A . 1 GLY N 1 1 3 917 1 1 1 GLY O O 4.618 0.062 1.589 1.00 . A A . 1 GLY O 1 1 3 918 1 1 2 TYR C C 6.271 2.364 -0.179 1.00 . A A . 2 TYR C 1 1 3 919 1 1 2 TYR CA C 5.812 1.015 -0.723 1.00 . A A . 2 TYR CA 1 1 3 920 1 1 2 TYR CB C 6.148 0.911 -2.212 1.00 . A A . 2 TYR CB 1 1 3 921 1 1 2 TYR CD1 C 8.614 0.390 -2.050 1.00 . A A . 2 TYR CD1 1 1 3 922 1 1 2 TYR CD2 C 7.948 2.307 -3.302 1.00 . A A . 2 TYR CD2 1 1 3 923 1 1 2 TYR CE1 C 9.938 0.658 -2.336 1.00 . A A . 2 TYR CE1 1 1 3 924 1 1 2 TYR CE2 C 9.270 2.581 -3.593 1.00 . A A . 2 TYR CE2 1 1 3 925 1 1 2 TYR CG C 7.596 1.208 -2.527 1.00 . A A . 2 TYR CG 1 1 3 926 1 1 2 TYR CZ C 10.261 1.755 -3.108 1.00 . A A . 2 TYR CZ 1 1 3 927 1 1 2 TYR H H 3.759 1.051 -1.237 1.00 . A A . 2 TYR H 1 1 3 928 1 1 2 TYR HA H 6.330 0.230 -0.191 1.00 . A A . 2 TYR HA 1 1 3 929 1 1 2 TYR HB2 H 5.933 -0.090 -2.553 1.00 . A A . 2 TYR HB2 1 1 3 930 1 1 2 TYR HB3 H 5.537 1.612 -2.761 1.00 . A A . 2 TYR HB3 1 1 3 931 1 1 2 TYR HD1 H 8.357 -0.468 -1.446 1.00 . A A . 2 TYR HD1 1 1 3 932 1 1 2 TYR HD2 H 7.169 2.953 -3.680 1.00 . A A . 2 TYR HD2 1 1 3 933 1 1 2 TYR HE1 H 10.715 0.011 -1.956 1.00 . A A . 2 TYR HE1 1 1 3 934 1 1 2 TYR HE2 H 9.523 3.440 -4.197 1.00 . A A . 2 TYR HE2 1 1 3 935 1 1 2 TYR HH H 11.781 1.728 -4.285 1.00 . A A . 2 TYR HH 1 1 3 936 1 1 2 TYR N N 4.381 0.828 -0.513 1.00 . A A . 2 TYR N 1 1 3 937 1 1 2 TYR O O 6.268 3.368 -0.893 1.00 . A A . 2 TYR O 1 1 3 938 1 1 2 TYR OH O 11.580 2.026 -3.395 1.00 . A A . 2 TYR OH 1 1 3 939 1 1 3 CYS C C 8.653 3.651 1.780 1.00 . A A . 3 CYS C 1 1 3 940 1 1 3 CYS CA C 7.129 3.605 1.731 1.00 . A A . 3 CYS CA 1 1 3 941 1 1 3 CYS CB C 6.559 3.710 3.147 1.00 . A A . 3 CYS CB 1 1 3 942 1 1 3 CYS H H 6.645 1.548 1.607 1.00 . A A . 3 CYS H 1 1 3 943 1 1 3 CYS HA H 6.774 4.440 1.147 1.00 . A A . 3 CYS HA 1 1 3 944 1 1 3 CYS HB2 H 7.278 3.308 3.847 1.00 . A A . 3 CYS HB2 1 1 3 945 1 1 3 CYS HB3 H 6.381 4.749 3.379 1.00 . A A . 3 CYS HB3 1 1 3 946 1 1 3 CYS N N 6.666 2.380 1.089 1.00 . A A . 3 CYS N 1 1 3 947 1 1 3 CYS O O 9.329 2.810 1.188 1.00 . A A . 3 CYS O 1 1 3 948 1 1 3 CYS SG S 4.993 2.811 3.387 1.00 . A A . 3 CYS SG 1 1 3 949 1 1 4 ALA C C 11.168 3.981 3.791 1.00 . A A . 4 ALA C 1 1 3 950 1 1 4 ALA CA C 10.631 4.794 2.618 1.00 . A A . 4 ALA CA 1 1 3 951 1 1 4 ALA CB C 10.992 6.263 2.781 1.00 . A A . 4 ALA CB 1 1 3 952 1 1 4 ALA H H 8.597 5.278 2.939 1.00 . A A . 4 ALA H 1 1 3 953 1 1 4 ALA HA H 11.087 4.435 1.706 1.00 . A A . 4 ALA HA 1 1 3 954 1 1 4 ALA HB1 H 10.258 6.745 3.410 1.00 . A A . 4 ALA HB1 1 1 3 955 1 1 4 ALA HB2 H 11.967 6.345 3.237 1.00 . A A . 4 ALA HB2 1 1 3 956 1 1 4 ALA HB3 H 11.006 6.739 1.812 1.00 . A A . 4 ALA HB3 1 1 3 957 1 1 4 ALA N N 9.187 4.639 2.489 1.00 . A A . 4 ALA N 1 1 3 958 1 1 4 ALA O O 10.937 4.320 4.952 1.00 . A A . 4 ALA O 1 1 3 959 1 1 5 THR C C 13.786 2.591 5.012 1.00 . A A . 5 THR C 1 1 3 960 1 1 5 THR CA C 12.454 2.044 4.510 1.00 . A A . 5 THR CA 1 1 3 961 1 1 5 THR CB C 12.665 0.610 3.988 1.00 . A A . 5 THR CB 1 1 3 962 1 1 5 THR CG2 C 11.371 -0.187 4.059 1.00 . A A . 5 THR CG2 1 1 3 963 1 1 5 THR H H 12.036 2.688 2.538 1.00 . A A . 5 THR H 1 1 3 964 1 1 5 THR HA H 11.758 2.006 5.335 1.00 . A A . 5 THR HA 1 1 3 965 1 1 5 THR HB H 13.405 0.123 4.608 1.00 . A A . 5 THR HB 1 1 3 966 1 1 5 THR HG1 H 13.951 0.141 2.569 1.00 . A A . 5 THR HG1 1 1 3 967 1 1 5 THR HG21 H 11.492 -1.009 4.748 1.00 . A A . 5 THR HG21 1 1 3 968 1 1 5 THR HG22 H 11.131 -0.570 3.079 1.00 . A A . 5 THR HG22 1 1 3 969 1 1 5 THR HG23 H 10.572 0.454 4.401 1.00 . A A . 5 THR HG23 1 1 3 970 1 1 5 THR N N 11.886 2.906 3.481 1.00 . A A . 5 THR N 1 1 3 971 1 1 5 THR O O 14.320 3.554 4.462 1.00 . A A . 5 THR O 1 1 3 972 1 1 5 THR OG1 O 13.137 0.645 2.637 1.00 . A A . 5 THR OG1 1 1 3 973 1 1 6 LYS C C 16.640 2.595 5.545 1.00 . A A . 6 LYS C 1 1 3 974 1 1 6 LYS CA C 15.590 2.392 6.634 1.00 . A A . 6 LYS CA 1 1 3 975 1 1 6 LYS CB C 16.085 1.357 7.646 1.00 . A A . 6 LYS CB 1 1 3 976 1 1 6 LYS CD C 17.658 0.838 9.534 1.00 . A A . 6 LYS CD 1 1 3 977 1 1 6 LYS CE C 19.145 0.829 9.855 1.00 . A A . 6 LYS CE 1 1 3 978 1 1 6 LYS CG C 17.341 1.781 8.386 1.00 . A A . 6 LYS CG 1 1 3 979 1 1 6 LYS H H 13.845 1.207 6.453 1.00 . A A . 6 LYS H 1 1 3 980 1 1 6 LYS HA H 15.429 3.331 7.141 1.00 . A A . 6 LYS HA 1 1 3 981 1 1 6 LYS HB2 H 15.305 1.182 8.373 1.00 . A A . 6 LYS HB2 1 1 3 982 1 1 6 LYS HB3 H 16.293 0.433 7.126 1.00 . A A . 6 LYS HB3 1 1 3 983 1 1 6 LYS HD2 H 17.114 1.156 10.411 1.00 . A A . 6 LYS HD2 1 1 3 984 1 1 6 LYS HD3 H 17.352 -0.163 9.261 1.00 . A A . 6 LYS HD3 1 1 3 985 1 1 6 LYS HE2 H 19.699 0.825 8.929 1.00 . A A . 6 LYS HE2 1 1 3 986 1 1 6 LYS HE3 H 19.384 1.722 10.414 1.00 . A A . 6 LYS HE3 1 1 3 987 1 1 6 LYS HG2 H 18.172 1.783 7.696 1.00 . A A . 6 LYS HG2 1 1 3 988 1 1 6 LYS HG3 H 17.197 2.777 8.781 1.00 . A A . 6 LYS HG3 1 1 3 989 1 1 6 LYS HZ1 H 20.569 -0.439 10.707 1.00 . A A . 6 LYS HZ1 1 1 3 990 1 1 6 LYS HZ2 H 19.156 -1.228 10.218 1.00 . A A . 6 LYS HZ2 1 1 3 991 1 1 6 LYS HZ3 H 19.154 -0.284 11.622 1.00 . A A . 6 LYS HZ3 1 1 3 992 1 1 6 LYS N N 14.319 1.970 6.058 1.00 . A A . 6 LYS N 1 1 3 993 1 1 6 LYS NZ N 19.533 -0.364 10.657 1.00 . A A . 6 LYS NZ 1 1 3 994 1 1 6 LYS O O 16.787 1.765 4.649 1.00 . A A . 6 LYS O 1 1 3 995 1 1 7 GLY C C 17.873 4.830 3.494 1.00 . A A . 7 GLY C 1 1 3 996 1 1 7 GLY CA C 18.394 3.995 4.647 1.00 . A A . 7 GLY CA 1 1 3 997 1 1 7 GLY H H 17.206 4.331 6.366 1.00 . A A . 7 GLY H 1 1 3 998 1 1 7 GLY HA2 H 19.199 4.529 5.129 1.00 . A A . 7 GLY HA2 1 1 3 999 1 1 7 GLY HA3 H 18.777 3.063 4.257 1.00 . A A . 7 GLY HA3 1 1 3 1000 1 1 7 GLY N N 17.367 3.705 5.630 1.00 . A A . 7 GLY N 1 1 3 1001 1 1 7 GLY O O 18.648 5.473 2.785 1.00 . A A . 7 GLY O 1 1 3 1002 1 1 8 ILE C C 15.668 7.020 2.657 1.00 . A A . 8 ILE C 1 1 3 1003 1 1 8 ILE CA C 15.936 5.581 2.229 1.00 . A A . 8 ILE CA 1 1 3 1004 1 1 8 ILE CB C 14.612 4.937 1.777 1.00 . A A . 8 ILE CB 1 1 3 1005 1 1 8 ILE CD1 C 15.753 3.137 0.386 1.00 . A A . 8 ILE CD1 1 1 3 1006 1 1 8 ILE CG1 C 14.806 3.440 1.526 1.00 . A A . 8 ILE CG1 1 1 3 1007 1 1 8 ILE CG2 C 14.088 5.626 0.525 1.00 . A A . 8 ILE CG2 1 1 3 1008 1 1 8 ILE H H 15.994 4.287 3.902 1.00 . A A . 8 ILE H 1 1 3 1009 1 1 8 ILE HA H 16.615 5.587 1.388 1.00 . A A . 8 ILE HA 1 1 3 1010 1 1 8 ILE HB H 13.885 5.072 2.563 1.00 . A A . 8 ILE HB 1 1 3 1011 1 1 8 ILE HD11 H 15.200 2.710 -0.438 1.00 . A A . 8 ILE HD11 1 1 3 1012 1 1 8 ILE HD12 H 16.235 4.048 0.065 1.00 . A A . 8 ILE HD12 1 1 3 1013 1 1 8 ILE HD13 H 16.502 2.432 0.718 1.00 . A A . 8 ILE HD13 1 1 3 1014 1 1 8 ILE HG12 H 15.203 2.981 2.417 1.00 . A A . 8 ILE HG12 1 1 3 1015 1 1 8 ILE HG13 H 13.850 2.995 1.292 1.00 . A A . 8 ILE HG13 1 1 3 1016 1 1 8 ILE HG21 H 14.882 5.701 -0.203 1.00 . A A . 8 ILE HG21 1 1 3 1017 1 1 8 ILE HG22 H 13.275 5.049 0.111 1.00 . A A . 8 ILE HG22 1 1 3 1018 1 1 8 ILE HG23 H 13.736 6.614 0.778 1.00 . A A . 8 ILE HG23 1 1 3 1019 1 1 8 ILE N N 16.558 4.819 3.304 1.00 . A A . 8 ILE N 1 1 3 1020 1 1 8 ILE O O 15.043 7.266 3.688 1.00 . A A . 8 ILE O 1 1 3 1021 1 1 9 LYS C C 14.484 9.695 2.400 1.00 . A A . 9 LYS C 1 1 3 1022 1 1 9 LYS CA C 15.956 9.383 2.150 1.00 . A A . 9 LYS CA 1 1 3 1023 1 1 9 LYS CB C 16.481 10.239 0.995 1.00 . A A . 9 LYS CB 1 1 3 1024 1 1 9 LYS CD C 18.731 11.319 1.274 1.00 . A A . 9 LYS CD 1 1 3 1025 1 1 9 LYS CE C 20.213 11.236 0.939 1.00 . A A . 9 LYS CE 1 1 3 1026 1 1 9 LYS CG C 17.976 10.102 0.767 1.00 . A A . 9 LYS CG 1 1 3 1027 1 1 9 LYS H H 16.636 7.708 1.049 1.00 . A A . 9 LYS H 1 1 3 1028 1 1 9 LYS HA H 16.517 9.615 3.043 1.00 . A A . 9 LYS HA 1 1 3 1029 1 1 9 LYS HB2 H 15.971 9.949 0.088 1.00 . A A . 9 LYS HB2 1 1 3 1030 1 1 9 LYS HB3 H 16.263 11.277 1.204 1.00 . A A . 9 LYS HB3 1 1 3 1031 1 1 9 LYS HD2 H 18.319 12.205 0.814 1.00 . A A . 9 LYS HD2 1 1 3 1032 1 1 9 LYS HD3 H 18.617 11.382 2.347 1.00 . A A . 9 LYS HD3 1 1 3 1033 1 1 9 LYS HE2 H 20.334 10.639 0.048 1.00 . A A . 9 LYS HE2 1 1 3 1034 1 1 9 LYS HE3 H 20.584 12.233 0.757 1.00 . A A . 9 LYS HE3 1 1 3 1035 1 1 9 LYS HG2 H 18.332 9.227 1.291 1.00 . A A . 9 LYS HG2 1 1 3 1036 1 1 9 LYS HG3 H 18.161 9.990 -0.292 1.00 . A A . 9 LYS HG3 1 1 3 1037 1 1 9 LYS HZ1 H 20.396 9.971 2.591 1.00 . A A . 9 LYS HZ1 1 1 3 1038 1 1 9 LYS HZ2 H 21.357 11.359 2.682 1.00 . A A . 9 LYS HZ2 1 1 3 1039 1 1 9 LYS HZ3 H 21.803 10.088 1.658 1.00 . A A . 9 LYS HZ3 1 1 3 1040 1 1 9 LYS N N 16.145 7.967 1.857 1.00 . A A . 9 LYS N 1 1 3 1041 1 1 9 LYS NZ N 20.997 10.620 2.045 1.00 . A A . 9 LYS NZ 1 1 3 1042 1 1 9 LYS O O 13.602 9.159 1.727 1.00 . A A . 9 LYS O 1 1 3 1043 1 1 10 CYS C C 12.679 12.462 3.603 1.00 . A A . 10 CYS C 1 1 3 1044 1 1 10 CYS CA C 12.860 10.950 3.708 1.00 . A A . 10 CYS CA 1 1 3 1045 1 1 10 CYS CB C 12.510 10.480 5.121 1.00 . A A . 10 CYS CB 1 1 3 1046 1 1 10 CYS H H 14.970 10.959 3.871 1.00 . A A . 10 CYS H 1 1 3 1047 1 1 10 CYS HA H 12.196 10.471 3.004 1.00 . A A . 10 CYS HA 1 1 3 1048 1 1 10 CYS HB2 H 11.439 10.531 5.255 1.00 . A A . 10 CYS HB2 1 1 3 1049 1 1 10 CYS HB3 H 12.834 9.458 5.243 1.00 . A A . 10 CYS HB3 1 1 3 1050 1 1 10 CYS N N 14.225 10.566 3.370 1.00 . A A . 10 CYS N 1 1 3 1051 1 1 10 CYS O O 11.810 13.040 4.255 1.00 . A A . 10 CYS O 1 1 3 1052 1 1 10 CYS SG S 13.280 11.468 6.445 1.00 . A A . 10 CYS SG 1 1 3 1053 1 1 11 ASN C C 12.038 14.967 2.159 1.00 . A A . 11 ASN C 1 1 3 1054 1 1 11 ASN CA C 13.438 14.540 2.589 1.00 . A A . 11 ASN CA 1 1 3 1055 1 1 11 ASN CB C 14.463 14.987 1.543 1.00 . A A . 11 ASN CB 1 1 3 1056 1 1 11 ASN CG C 15.876 14.576 1.907 1.00 . A A . 11 ASN CG 1 1 3 1057 1 1 11 ASN H H 14.179 12.580 2.287 1.00 . A A . 11 ASN H 1 1 3 1058 1 1 11 ASN HA H 13.672 15.010 3.532 1.00 . A A . 11 ASN HA 1 1 3 1059 1 1 11 ASN HB2 H 14.213 14.542 0.591 1.00 . A A . 11 ASN HB2 1 1 3 1060 1 1 11 ASN HB3 H 14.432 16.062 1.454 1.00 . A A . 11 ASN HB3 1 1 3 1061 1 1 11 ASN HD21 H 16.471 16.472 1.839 1.00 . A A . 11 ASN HD21 1 1 3 1062 1 1 11 ASN HD22 H 17.692 15.315 2.238 1.00 . A A . 11 ASN HD22 1 1 3 1063 1 1 11 ASN N N 13.506 13.096 2.779 1.00 . A A . 11 ASN N 1 1 3 1064 1 1 11 ASN ND2 N 16.770 15.553 2.005 1.00 . A A . 11 ASN ND2 1 1 3 1065 1 1 11 ASN O O 11.630 16.107 2.382 1.00 . A A . 11 ASN O 1 1 3 1066 1 1 11 ASN OD1 O 16.161 13.393 2.098 1.00 . A A . 11 ASN OD1 1 1 3 1067 1 1 12 ASP C C 9.042 13.120 1.309 1.00 . A A . 12 ASP C 1 1 3 1068 1 1 12 ASP CA C 9.952 14.324 1.084 1.00 . A A . 12 ASP CA 1 1 3 1069 1 1 12 ASP CB C 9.960 14.701 -0.398 1.00 . A A . 12 ASP CB 1 1 3 1070 1 1 12 ASP CG C 8.804 15.607 -0.772 1.00 . A A . 12 ASP CG 1 1 3 1071 1 1 12 ASP H H 11.688 13.153 1.395 1.00 . A A . 12 ASP H 1 1 3 1072 1 1 12 ASP HA H 9.573 15.157 1.656 1.00 . A A . 12 ASP HA 1 1 3 1073 1 1 12 ASP HB2 H 10.883 15.214 -0.627 1.00 . A A . 12 ASP HB2 1 1 3 1074 1 1 12 ASP HB3 H 9.897 13.802 -0.993 1.00 . A A . 12 ASP HB3 1 1 3 1075 1 1 12 ASP N N 11.307 14.044 1.543 1.00 . A A . 12 ASP N 1 1 3 1076 1 1 12 ASP O O 7.898 13.266 1.739 1.00 . A A . 12 ASP O 1 1 3 1077 1 1 12 ASP OD1 O 9.059 16.768 -1.156 1.00 . A A . 12 ASP OD1 1 1 3 1078 1 1 12 ASP OD2 O 7.643 15.155 -0.681 1.00 . A A . 12 ASP OD2 1 1 3 1079 1 1 13 ILE C C 8.757 10.277 2.651 1.00 . A A . 13 ILE C 1 1 3 1080 1 1 13 ILE CA C 8.794 10.703 1.187 1.00 . A A . 13 ILE CA 1 1 3 1081 1 1 13 ILE CB C 9.378 9.553 0.345 1.00 . A A . 13 ILE CB 1 1 3 1082 1 1 13 ILE CD1 C 8.528 7.507 -0.908 1.00 . A A . 13 ILE CD1 1 1 3 1083 1 1 13 ILE CG1 C 8.421 8.360 0.337 1.00 . A A . 13 ILE CG1 1 1 3 1084 1 1 13 ILE CG2 C 10.741 9.143 0.881 1.00 . A A . 13 ILE CG2 1 1 3 1085 1 1 13 ILE H H 10.477 11.879 0.678 1.00 . A A . 13 ILE H 1 1 3 1086 1 1 13 ILE HA H 7.784 10.890 0.852 1.00 . A A . 13 ILE HA 1 1 3 1087 1 1 13 ILE HB H 9.508 9.908 -0.666 1.00 . A A . 13 ILE HB 1 1 3 1088 1 1 13 ILE HD11 H 8.952 8.093 -1.710 1.00 . A A . 13 ILE HD11 1 1 3 1089 1 1 13 ILE HD12 H 9.162 6.656 -0.708 1.00 . A A . 13 ILE HD12 1 1 3 1090 1 1 13 ILE HD13 H 7.544 7.164 -1.194 1.00 . A A . 13 ILE HD13 1 1 3 1091 1 1 13 ILE HG12 H 8.633 7.731 1.188 1.00 . A A . 13 ILE HG12 1 1 3 1092 1 1 13 ILE HG13 H 7.406 8.722 0.406 1.00 . A A . 13 ILE HG13 1 1 3 1093 1 1 13 ILE HG21 H 11.191 8.426 0.210 1.00 . A A . 13 ILE HG21 1 1 3 1094 1 1 13 ILE HG22 H 11.376 10.014 0.954 1.00 . A A . 13 ILE HG22 1 1 3 1095 1 1 13 ILE HG23 H 10.625 8.699 1.858 1.00 . A A . 13 ILE HG23 1 1 3 1096 1 1 13 ILE N N 9.559 11.931 1.016 1.00 . A A . 13 ILE N 1 1 3 1097 1 1 13 ILE O O 9.737 10.435 3.379 1.00 . A A . 13 ILE O 1 1 3 1098 1 1 14 HIS C C 7.747 7.790 4.574 1.00 . A A . 14 HIS C 1 1 3 1099 1 1 14 HIS CA C 7.456 9.283 4.453 1.00 . A A . 14 HIS CA 1 1 3 1100 1 1 14 HIS CB C 6.039 9.580 4.943 1.00 . A A . 14 HIS CB 1 1 3 1101 1 1 14 HIS CD2 C 5.853 12.067 5.654 1.00 . A A . 14 HIS CD2 1 1 3 1102 1 1 14 HIS CE1 C 4.769 12.821 3.904 1.00 . A A . 14 HIS CE1 1 1 3 1103 1 1 14 HIS CG C 5.651 11.021 4.819 1.00 . A A . 14 HIS CG 1 1 3 1104 1 1 14 HIS H H 6.875 9.636 2.448 1.00 . A A . 14 HIS H 1 1 3 1105 1 1 14 HIS HA H 8.160 9.825 5.066 1.00 . A A . 14 HIS HA 1 1 3 1106 1 1 14 HIS HB2 H 5.336 8.997 4.366 1.00 . A A . 14 HIS HB2 1 1 3 1107 1 1 14 HIS HB3 H 5.960 9.303 5.985 1.00 . A A . 14 HIS HB3 1 1 3 1108 1 1 14 HIS HD1 H 4.676 11.013 2.952 1.00 . A A . 14 HIS HD1 1 1 3 1109 1 1 14 HIS HD2 H 6.359 12.038 6.609 1.00 . A A . 14 HIS HD2 1 1 3 1110 1 1 14 HIS HE1 H 4.261 13.479 3.215 1.00 . A A . 14 HIS HE1 1 1 3 1111 1 1 14 HIS N N 7.620 9.735 3.076 1.00 . A A . 14 HIS N 1 1 3 1112 1 1 14 HIS ND1 N 4.969 11.526 3.733 1.00 . A A . 14 HIS ND1 1 1 3 1113 1 1 14 HIS NE2 N 5.296 13.174 5.063 1.00 . A A . 14 HIS NE2 1 1 3 1114 1 1 14 HIS O O 7.649 7.047 3.597 1.00 . A A . 14 HIS O 1 1 3 1115 1 1 15 CYS C C 7.160 5.191 6.449 1.00 . A A . 15 CYS C 1 1 3 1116 1 1 15 CYS CA C 8.412 5.955 6.027 1.00 . A A . 15 CYS CA 1 1 3 1117 1 1 15 CYS CB C 9.487 5.830 7.108 1.00 . A A . 15 CYS CB 1 1 3 1118 1 1 15 CYS H H 8.165 7.999 6.518 1.00 . A A . 15 CYS H 1 1 3 1119 1 1 15 CYS HA H 8.786 5.528 5.108 1.00 . A A . 15 CYS HA 1 1 3 1120 1 1 15 CYS HB2 H 9.011 5.819 8.078 1.00 . A A . 15 CYS HB2 1 1 3 1121 1 1 15 CYS HB3 H 10.024 4.904 6.966 1.00 . A A . 15 CYS HB3 1 1 3 1122 1 1 15 CYS N N 8.105 7.358 5.778 1.00 . A A . 15 CYS N 1 1 3 1123 1 1 15 CYS O O 6.222 5.769 6.998 1.00 . A A . 15 CYS O 1 1 3 1124 1 1 15 CYS SG S 10.705 7.184 7.105 1.00 . A A . 15 CYS SG 1 1 3 1125 1 1 16 CYS C C 5.799 3.026 8.049 1.00 . A A . 16 CYS C 1 1 3 1126 1 1 16 CYS CA C 6.017 3.044 6.539 1.00 . A A . 16 CYS CA 1 1 3 1127 1 1 16 CYS CB C 6.237 1.618 6.028 1.00 . A A . 16 CYS CB 1 1 3 1128 1 1 16 CYS H H 7.930 3.484 5.747 1.00 . A A . 16 CYS H 1 1 3 1129 1 1 16 CYS HA H 5.138 3.455 6.066 1.00 . A A . 16 CYS HA 1 1 3 1130 1 1 16 CYS HB2 H 7.298 1.427 5.964 1.00 . A A . 16 CYS HB2 1 1 3 1131 1 1 16 CYS HB3 H 5.791 0.922 6.723 1.00 . A A . 16 CYS HB3 1 1 3 1132 1 1 16 CYS N N 7.152 3.888 6.188 1.00 . A A . 16 CYS N 1 1 3 1133 1 1 16 CYS O O 6.732 3.235 8.824 1.00 . A A . 16 CYS O 1 1 3 1134 1 1 16 CYS SG S 5.518 1.299 4.385 1.00 . A A . 16 CYS SG 1 1 3 1135 1 1 17 SER C C 5.171 1.818 10.639 1.00 . A A . 17 SER C 1 1 3 1136 1 1 17 SER CA C 4.218 2.733 9.877 1.00 . A A . 17 SER CA 1 1 3 1137 1 1 17 SER CB C 2.776 2.255 10.061 1.00 . A A . 17 SER CB 1 1 3 1138 1 1 17 SER H H 3.859 2.616 7.794 1.00 . A A . 17 SER H 1 1 3 1139 1 1 17 SER HA H 4.309 3.735 10.269 1.00 . A A . 17 SER HA 1 1 3 1140 1 1 17 SER HB2 H 2.638 1.325 9.532 1.00 . A A . 17 SER HB2 1 1 3 1141 1 1 17 SER HB3 H 2.583 2.103 11.113 1.00 . A A . 17 SER HB3 1 1 3 1142 1 1 17 SER HG H 1.060 3.199 10.099 1.00 . A A . 17 SER HG 1 1 3 1143 1 1 17 SER N N 4.560 2.775 8.460 1.00 . A A . 17 SER N 1 1 3 1144 1 1 17 SER O O 5.111 0.595 10.512 1.00 . A A . 17 SER O 1 1 3 1145 1 1 17 SER OG O 1.855 3.208 9.560 1.00 . A A . 17 SER OG 1 1 3 1146 1 1 18 GLY C C 8.410 2.209 12.125 1.00 . A A . 18 GLY C 1 1 3 1147 1 1 18 GLY CA C 7.006 1.645 12.205 1.00 . A A . 18 GLY CA 1 1 3 1148 1 1 18 GLY H H 6.053 3.398 11.495 1.00 . A A . 18 GLY H 1 1 3 1149 1 1 18 GLY HA2 H 6.691 1.632 13.238 1.00 . A A . 18 GLY HA2 1 1 3 1150 1 1 18 GLY HA3 H 7.016 0.632 11.830 1.00 . A A . 18 GLY HA3 1 1 3 1151 1 1 18 GLY N N 6.052 2.419 11.433 1.00 . A A . 18 GLY N 1 1 3 1152 1 1 18 GLY O O 9.282 1.837 12.912 1.00 . A A . 18 GLY O 1 1 3 1153 1 1 19 LEU C C 9.875 5.228 11.239 1.00 . A A . 19 LEU C 1 1 3 1154 1 1 19 LEU CA C 9.942 3.724 10.992 1.00 . A A . 19 LEU CA 1 1 3 1155 1 1 19 LEU CB C 10.466 3.451 9.581 1.00 . A A . 19 LEU CB 1 1 3 1156 1 1 19 LEU CD1 C 11.078 1.824 7.775 1.00 . A A . 19 LEU CD1 1 1 3 1157 1 1 19 LEU CD2 C 11.993 1.527 10.084 1.00 . A A . 19 LEU CD2 1 1 3 1158 1 1 19 LEU CG C 10.801 1.994 9.261 1.00 . A A . 19 LEU CG 1 1 3 1159 1 1 19 LEU H H 7.898 3.364 10.577 1.00 . A A . 19 LEU H 1 1 3 1160 1 1 19 LEU HA H 10.617 3.284 11.710 1.00 . A A . 19 LEU HA 1 1 3 1161 1 1 19 LEU HB2 H 9.714 3.779 8.880 1.00 . A A . 19 LEU HB2 1 1 3 1162 1 1 19 LEU HB3 H 11.364 4.036 9.444 1.00 . A A . 19 LEU HB3 1 1 3 1163 1 1 19 LEU HD11 H 11.288 0.786 7.565 1.00 . A A . 19 LEU HD11 1 1 3 1164 1 1 19 LEU HD12 H 11.929 2.428 7.496 1.00 . A A . 19 LEU HD12 1 1 3 1165 1 1 19 LEU HD13 H 10.213 2.138 7.210 1.00 . A A . 19 LEU HD13 1 1 3 1166 1 1 19 LEU HD21 H 11.893 1.888 11.097 1.00 . A A . 19 LEU HD21 1 1 3 1167 1 1 19 LEU HD22 H 12.903 1.916 9.651 1.00 . A A . 19 LEU HD22 1 1 3 1168 1 1 19 LEU HD23 H 12.027 0.448 10.088 1.00 . A A . 19 LEU HD23 1 1 3 1169 1 1 19 LEU HG H 9.954 1.372 9.515 1.00 . A A . 19 LEU HG 1 1 3 1170 1 1 19 LEU N N 8.632 3.108 11.173 1.00 . A A . 19 LEU N 1 1 3 1171 1 1 19 LEU O O 8.825 5.850 11.071 1.00 . A A . 19 LEU O 1 1 3 1172 1 1 20 LYS C C 11.859 7.958 10.812 1.00 . A A . 20 LYS C 1 1 3 1173 1 1 20 LYS CA C 11.074 7.239 11.905 1.00 . A A . 20 LYS CA 1 1 3 1174 1 1 20 LYS CB C 11.725 7.493 13.267 1.00 . A A . 20 LYS CB 1 1 3 1175 1 1 20 LYS CD C 10.019 8.789 14.579 1.00 . A A . 20 LYS CD 1 1 3 1176 1 1 20 LYS CE C 10.668 9.657 15.646 1.00 . A A . 20 LYS CE 1 1 3 1177 1 1 20 LYS CG C 10.743 7.462 14.425 1.00 . A A . 20 LYS CG 1 1 3 1178 1 1 20 LYS H H 11.806 5.259 11.754 1.00 . A A . 20 LYS H 1 1 3 1179 1 1 20 LYS HA H 10.066 7.625 11.920 1.00 . A A . 20 LYS HA 1 1 3 1180 1 1 20 LYS HB2 H 12.477 6.737 13.439 1.00 . A A . 20 LYS HB2 1 1 3 1181 1 1 20 LYS HB3 H 12.199 8.464 13.250 1.00 . A A . 20 LYS HB3 1 1 3 1182 1 1 20 LYS HD2 H 10.047 9.315 13.636 1.00 . A A . 20 LYS HD2 1 1 3 1183 1 1 20 LYS HD3 H 8.992 8.599 14.857 1.00 . A A . 20 LYS HD3 1 1 3 1184 1 1 20 LYS HE2 H 11.551 9.156 16.012 1.00 . A A . 20 LYS HE2 1 1 3 1185 1 1 20 LYS HE3 H 10.948 10.601 15.201 1.00 . A A . 20 LYS HE3 1 1 3 1186 1 1 20 LYS HG2 H 10.014 6.685 14.247 1.00 . A A . 20 LYS HG2 1 1 3 1187 1 1 20 LYS HG3 H 11.283 7.249 15.337 1.00 . A A . 20 LYS HG3 1 1 3 1188 1 1 20 LYS HZ1 H 8.780 9.625 16.538 1.00 . A A . 20 LYS HZ1 1 1 3 1189 1 1 20 LYS HZ2 H 9.745 10.926 17.024 1.00 . A A . 20 LYS HZ2 1 1 3 1190 1 1 20 LYS HZ3 H 10.054 9.374 17.622 1.00 . A A . 20 LYS HZ3 1 1 3 1191 1 1 20 LYS N N 11.002 5.808 11.638 1.00 . A A . 20 LYS N 1 1 3 1192 1 1 20 LYS NZ N 9.747 9.913 16.788 1.00 . A A . 20 LYS NZ 1 1 3 1193 1 1 20 LYS O O 12.850 7.436 10.301 1.00 . A A . 20 LYS O 1 1 3 1194 1 1 21 CYS C C 13.092 10.903 10.046 1.00 . A A . 21 CYS C 1 1 3 1195 1 1 21 CYS CA C 12.072 9.949 9.429 1.00 . A A . 21 CYS CA 1 1 3 1196 1 1 21 CYS CB C 11.040 10.741 8.624 1.00 . A A . 21 CYS CB 1 1 3 1197 1 1 21 CYS H H 10.615 9.521 10.904 1.00 . A A . 21 CYS H 1 1 3 1198 1 1 21 CYS HA H 12.587 9.269 8.768 1.00 . A A . 21 CYS HA 1 1 3 1199 1 1 21 CYS HB2 H 10.498 10.061 7.982 1.00 . A A . 21 CYS HB2 1 1 3 1200 1 1 21 CYS HB3 H 10.348 11.213 9.305 1.00 . A A . 21 CYS HB3 1 1 3 1201 1 1 21 CYS N N 11.411 9.158 10.460 1.00 . A A . 21 CYS N 1 1 3 1202 1 1 21 CYS O O 12.743 11.992 10.502 1.00 . A A . 21 CYS O 1 1 3 1203 1 1 21 CYS SG S 11.757 12.042 7.571 1.00 . A A . 21 CYS SG 1 1 3 1204 1 1 22 ASP C C 15.568 12.611 9.845 1.00 . A A . 22 ASP C 1 1 3 1205 1 1 22 ASP CA C 15.424 11.302 10.614 1.00 . A A . 22 ASP CA 1 1 3 1206 1 1 22 ASP CB C 16.746 10.533 10.589 1.00 . A A . 22 ASP CB 1 1 3 1207 1 1 22 ASP CG C 17.677 10.944 11.713 1.00 . A A . 22 ASP CG 1 1 3 1208 1 1 22 ASP H H 14.569 9.607 9.677 1.00 . A A . 22 ASP H 1 1 3 1209 1 1 22 ASP HA H 15.169 11.527 11.639 1.00 . A A . 22 ASP HA 1 1 3 1210 1 1 22 ASP HB2 H 16.543 9.476 10.685 1.00 . A A . 22 ASP HB2 1 1 3 1211 1 1 22 ASP HB3 H 17.244 10.716 9.649 1.00 . A A . 22 ASP HB3 1 1 3 1212 1 1 22 ASP N N 14.353 10.485 10.055 1.00 . A A . 22 ASP N 1 1 3 1213 1 1 22 ASP O O 16.119 12.638 8.744 1.00 . A A . 22 ASP O 1 1 3 1214 1 1 22 ASP OD1 O 17.732 12.152 12.026 1.00 . A A . 22 ASP OD1 1 1 3 1215 1 1 22 ASP OD2 O 18.349 10.058 12.280 1.00 . A A . 22 ASP OD2 1 1 3 1216 1 1 23 SER C C 16.559 15.556 9.840 1.00 . A A . 23 SER C 1 1 3 1217 1 1 23 SER CA C 15.136 15.006 9.797 1.00 . A A . 23 SER CA 1 1 3 1218 1 1 23 SER CB C 14.180 15.979 10.489 1.00 . A A . 23 SER CB 1 1 3 1219 1 1 23 SER H H 14.640 13.608 11.308 1.00 . A A . 23 SER H 1 1 3 1220 1 1 23 SER HA H 14.838 14.892 8.766 1.00 . A A . 23 SER HA 1 1 3 1221 1 1 23 SER HB2 H 13.167 15.619 10.386 1.00 . A A . 23 SER HB2 1 1 3 1222 1 1 23 SER HB3 H 14.433 16.046 11.537 1.00 . A A . 23 SER HB3 1 1 3 1223 1 1 23 SER HG H 14.481 17.912 10.597 1.00 . A A . 23 SER HG 1 1 3 1224 1 1 23 SER N N 15.068 13.694 10.430 1.00 . A A . 23 SER N 1 1 3 1225 1 1 23 SER O O 16.880 16.531 9.161 1.00 . A A . 23 SER O 1 1 3 1226 1 1 23 SER OG O 14.265 17.272 9.915 1.00 . A A . 23 SER OG 1 1 3 1227 1 1 24 LYS C C 19.657 14.739 9.674 1.00 . A A . 24 LYS C 1 1 3 1228 1 1 24 LYS CA C 18.796 15.346 10.776 1.00 . A A . 24 LYS CA 1 1 3 1229 1 1 24 LYS CB C 19.345 14.944 12.147 1.00 . A A . 24 LYS CB 1 1 3 1230 1 1 24 LYS CD C 19.432 15.741 14.527 1.00 . A A . 24 LYS CD 1 1 3 1231 1 1 24 LYS CE C 18.771 16.680 15.525 1.00 . A A . 24 LYS CE 1 1 3 1232 1 1 24 LYS CG C 18.551 15.513 13.310 1.00 . A A . 24 LYS CG 1 1 3 1233 1 1 24 LYS H H 17.091 14.152 11.160 1.00 . A A . 24 LYS H 1 1 3 1234 1 1 24 LYS HA H 18.825 16.422 10.687 1.00 . A A . 24 LYS HA 1 1 3 1235 1 1 24 LYS HB2 H 19.334 13.867 12.223 1.00 . A A . 24 LYS HB2 1 1 3 1236 1 1 24 LYS HB3 H 20.364 15.292 12.229 1.00 . A A . 24 LYS HB3 1 1 3 1237 1 1 24 LYS HD2 H 19.617 14.793 15.010 1.00 . A A . 24 LYS HD2 1 1 3 1238 1 1 24 LYS HD3 H 20.370 16.173 14.207 1.00 . A A . 24 LYS HD3 1 1 3 1239 1 1 24 LYS HE2 H 18.867 17.692 15.165 1.00 . A A . 24 LYS HE2 1 1 3 1240 1 1 24 LYS HE3 H 17.725 16.422 15.604 1.00 . A A . 24 LYS HE3 1 1 3 1241 1 1 24 LYS HG2 H 18.117 16.456 13.012 1.00 . A A . 24 LYS HG2 1 1 3 1242 1 1 24 LYS HG3 H 17.765 14.819 13.571 1.00 . A A . 24 LYS HG3 1 1 3 1243 1 1 24 LYS HZ1 H 20.061 15.785 16.904 1.00 . A A . 24 LYS HZ1 1 1 3 1244 1 1 24 LYS HZ2 H 18.664 16.439 17.598 1.00 . A A . 24 LYS HZ2 1 1 3 1245 1 1 24 LYS HZ3 H 19.914 17.460 17.091 1.00 . A A . 24 LYS HZ3 1 1 3 1246 1 1 24 LYS N N 17.407 14.923 10.643 1.00 . A A . 24 LYS N 1 1 3 1247 1 1 24 LYS NZ N 19.396 16.585 16.874 1.00 . A A . 24 LYS NZ 1 1 3 1248 1 1 24 LYS O O 20.504 15.416 9.090 1.00 . A A . 24 LYS O 1 1 3 1249 1 1 25 ARG C C 19.374 12.640 7.077 1.00 . A A . 25 ARG C 1 1 3 1250 1 1 25 ARG CA C 20.191 12.761 8.360 1.00 . A A . 25 ARG CA 1 1 3 1251 1 1 25 ARG CB C 20.600 11.370 8.850 1.00 . A A . 25 ARG CB 1 1 3 1252 1 1 25 ARG CD C 22.823 10.620 9.751 1.00 . A A . 25 ARG CD 1 1 3 1253 1 1 25 ARG CG C 21.548 11.398 10.038 1.00 . A A . 25 ARG CG 1 1 3 1254 1 1 25 ARG CZ C 24.149 10.836 11.810 1.00 . A A . 25 ARG CZ 1 1 3 1255 1 1 25 ARG H H 18.747 12.972 9.893 1.00 . A A . 25 ARG H 1 1 3 1256 1 1 25 ARG HA H 21.081 13.336 8.154 1.00 . A A . 25 ARG HA 1 1 3 1257 1 1 25 ARG HB2 H 19.713 10.827 9.138 1.00 . A A . 25 ARG HB2 1 1 3 1258 1 1 25 ARG HB3 H 21.086 10.846 8.041 1.00 . A A . 25 ARG HB3 1 1 3 1259 1 1 25 ARG HD2 H 22.587 9.795 9.096 1.00 . A A . 25 ARG HD2 1 1 3 1260 1 1 25 ARG HD3 H 23.527 11.277 9.261 1.00 . A A . 25 ARG HD3 1 1 3 1261 1 1 25 ARG HE H 23.299 9.148 11.174 1.00 . A A . 25 ARG HE 1 1 3 1262 1 1 25 ARG HG2 H 21.807 12.423 10.257 1.00 . A A . 25 ARG HG2 1 1 3 1263 1 1 25 ARG HG3 H 21.053 10.959 10.891 1.00 . A A . 25 ARG HG3 1 1 3 1264 1 1 25 ARG HH11 H 23.954 12.540 10.742 1.00 . A A . 25 ARG HH11 1 1 3 1265 1 1 25 ARG HH12 H 24.886 12.678 12.195 1.00 . A A . 25 ARG HH12 1 1 3 1266 1 1 25 ARG HH21 H 24.524 9.318 13.090 1.00 . A A . 25 ARG HH21 1 1 3 1267 1 1 25 ARG HH22 H 25.210 10.845 13.530 1.00 . A A . 25 ARG HH22 1 1 3 1268 1 1 25 ARG N N 19.435 13.459 9.393 1.00 . A A . 25 ARG N 1 1 3 1269 1 1 25 ARG NE N 23.432 10.097 10.971 1.00 . A A . 25 ARG NE 1 1 3 1270 1 1 25 ARG NH1 N 24.346 12.124 11.562 1.00 . A A . 25 ARG NH1 1 1 3 1271 1 1 25 ARG NH2 N 24.670 10.288 12.900 1.00 . A A . 25 ARG NH2 1 1 3 1272 1 1 25 ARG O O 19.821 12.042 6.097 1.00 . A A . 25 ARG O 1 1 3 1273 1 1 26 LYS C C 17.102 11.736 5.443 1.00 . A A . 26 LYS C 1 1 3 1274 1 1 26 LYS CA C 17.295 13.169 5.927 1.00 . A A . 26 LYS CA 1 1 3 1275 1 1 26 LYS CB C 17.867 14.028 4.797 1.00 . A A . 26 LYS CB 1 1 3 1276 1 1 26 LYS CD C 17.234 16.241 5.803 1.00 . A A . 26 LYS CD 1 1 3 1277 1 1 26 LYS CE C 17.439 17.712 5.475 1.00 . A A . 26 LYS CE 1 1 3 1278 1 1 26 LYS CG C 18.366 15.386 5.259 1.00 . A A . 26 LYS CG 1 1 3 1279 1 1 26 LYS H H 17.874 13.673 7.900 1.00 . A A . 26 LYS H 1 1 3 1280 1 1 26 LYS HA H 16.337 13.569 6.222 1.00 . A A . 26 LYS HA 1 1 3 1281 1 1 26 LYS HB2 H 18.692 13.500 4.342 1.00 . A A . 26 LYS HB2 1 1 3 1282 1 1 26 LYS HB3 H 17.097 14.184 4.055 1.00 . A A . 26 LYS HB3 1 1 3 1283 1 1 26 LYS HD2 H 16.303 15.912 5.365 1.00 . A A . 26 LYS HD2 1 1 3 1284 1 1 26 LYS HD3 H 17.190 16.123 6.877 1.00 . A A . 26 LYS HD3 1 1 3 1285 1 1 26 LYS HE2 H 18.419 18.010 5.815 1.00 . A A . 26 LYS HE2 1 1 3 1286 1 1 26 LYS HE3 H 17.374 17.841 4.405 1.00 . A A . 26 LYS HE3 1 1 3 1287 1 1 26 LYS HG2 H 19.102 15.244 6.036 1.00 . A A . 26 LYS HG2 1 1 3 1288 1 1 26 LYS HG3 H 18.820 15.896 4.421 1.00 . A A . 26 LYS HG3 1 1 3 1289 1 1 26 LYS HZ1 H 15.598 18.000 6.418 1.00 . A A . 26 LYS HZ1 1 1 3 1290 1 1 26 LYS HZ2 H 16.093 19.310 5.470 1.00 . A A . 26 LYS HZ2 1 1 3 1291 1 1 26 LYS HZ3 H 16.820 19.031 6.972 1.00 . A A . 26 LYS HZ3 1 1 3 1292 1 1 26 LYS N N 18.175 13.211 7.089 1.00 . A A . 26 LYS N 1 1 3 1293 1 1 26 LYS NZ N 16.416 18.574 6.130 1.00 . A A . 26 LYS NZ 1 1 3 1294 1 1 26 LYS O O 17.096 11.472 4.240 1.00 . A A . 26 LYS O 1 1 3 1295 1 1 27 VAL C C 15.919 8.701 7.123 1.00 . A A . 27 VAL C 1 1 3 1296 1 1 27 VAL CA C 16.746 9.407 6.055 1.00 . A A . 27 VAL CA 1 1 3 1297 1 1 27 VAL CB C 18.092 8.674 5.896 1.00 . A A . 27 VAL CB 1 1 3 1298 1 1 27 VAL CG1 C 18.809 9.141 4.639 1.00 . A A . 27 VAL CG1 1 1 3 1299 1 1 27 VAL CG2 C 18.962 8.887 7.126 1.00 . A A . 27 VAL CG2 1 1 3 1300 1 1 27 VAL H H 16.957 11.085 7.328 1.00 . A A . 27 VAL H 1 1 3 1301 1 1 27 VAL HA H 16.219 9.356 5.113 1.00 . A A . 27 VAL HA 1 1 3 1302 1 1 27 VAL HB H 17.894 7.617 5.799 1.00 . A A . 27 VAL HB 1 1 3 1303 1 1 27 VAL HG11 H 18.951 10.211 4.682 1.00 . A A . 27 VAL HG11 1 1 3 1304 1 1 27 VAL HG12 H 19.769 8.651 4.568 1.00 . A A . 27 VAL HG12 1 1 3 1305 1 1 27 VAL HG13 H 18.213 8.893 3.772 1.00 . A A . 27 VAL HG13 1 1 3 1306 1 1 27 VAL HG21 H 19.505 7.979 7.343 1.00 . A A . 27 VAL HG21 1 1 3 1307 1 1 27 VAL HG22 H 19.661 9.688 6.938 1.00 . A A . 27 VAL HG22 1 1 3 1308 1 1 27 VAL HG23 H 18.338 9.144 7.969 1.00 . A A . 27 VAL HG23 1 1 3 1309 1 1 27 VAL N N 16.942 10.813 6.386 1.00 . A A . 27 VAL N 1 1 3 1310 1 1 27 VAL O O 15.800 9.182 8.251 1.00 . A A . 27 VAL O 1 1 3 1311 1 1 28 CYS C C 15.404 5.913 8.588 1.00 . A A . 28 CYS C 1 1 3 1312 1 1 28 CYS CA C 14.531 6.783 7.689 1.00 . A A . 28 CYS CA 1 1 3 1313 1 1 28 CYS CB C 13.540 5.907 6.919 1.00 . A A . 28 CYS CB 1 1 3 1314 1 1 28 CYS H H 15.479 7.224 5.848 1.00 . A A . 28 CYS H 1 1 3 1315 1 1 28 CYS HA H 13.980 7.477 8.305 1.00 . A A . 28 CYS HA 1 1 3 1316 1 1 28 CYS HB2 H 14.086 5.285 6.224 1.00 . A A . 28 CYS HB2 1 1 3 1317 1 1 28 CYS HB3 H 13.010 5.277 7.618 1.00 . A A . 28 CYS HB3 1 1 3 1318 1 1 28 CYS N N 15.348 7.557 6.762 1.00 . A A . 28 CYS N 1 1 3 1319 1 1 28 CYS O O 16.411 5.359 8.146 1.00 . A A . 28 CYS O 1 1 3 1320 1 1 28 CYS SG S 12.302 6.845 5.967 1.00 . A A . 28 CYS SG 1 1 3 1321 1 1 29 VAL C C 14.830 4.061 11.586 1.00 . A A . 29 VAL C 1 1 3 1322 1 1 29 VAL CA C 15.757 4.994 10.814 1.00 . A A . 29 VAL CA 1 1 3 1323 1 1 29 VAL CB C 16.523 5.881 11.812 1.00 . A A . 29 VAL CB 1 1 3 1324 1 1 29 VAL CG1 C 17.630 6.648 11.105 1.00 . A A . 29 VAL CG1 1 1 3 1325 1 1 29 VAL CG2 C 15.570 6.833 12.519 1.00 . A A . 29 VAL CG2 1 1 3 1326 1 1 29 VAL H H 14.201 6.263 10.145 1.00 . A A . 29 VAL H 1 1 3 1327 1 1 29 VAL HA H 16.475 4.400 10.267 1.00 . A A . 29 VAL HA 1 1 3 1328 1 1 29 VAL HB H 16.977 5.242 12.556 1.00 . A A . 29 VAL HB 1 1 3 1329 1 1 29 VAL HG11 H 18.242 5.959 10.541 1.00 . A A . 29 VAL HG11 1 1 3 1330 1 1 29 VAL HG12 H 17.193 7.375 10.436 1.00 . A A . 29 VAL HG12 1 1 3 1331 1 1 29 VAL HG13 H 18.241 7.155 11.837 1.00 . A A . 29 VAL HG13 1 1 3 1332 1 1 29 VAL HG21 H 14.558 6.627 12.204 1.00 . A A . 29 VAL HG21 1 1 3 1333 1 1 29 VAL HG22 H 15.650 6.697 13.587 1.00 . A A . 29 VAL HG22 1 1 3 1334 1 1 29 VAL HG23 H 15.826 7.852 12.267 1.00 . A A . 29 VAL HG23 1 1 3 1335 1 1 29 VAL N N 15.012 5.797 9.852 1.00 . A A . 29 VAL N 1 1 3 1336 1 1 29 VAL O O 13.611 4.232 11.578 1.00 . A A . 29 VAL O 1 1 3 1337 1 1 30 LYS C C 13.738 2.828 14.032 1.00 . A A . 30 LYS C 1 1 3 1338 1 1 30 LYS CA C 14.645 2.114 13.035 1.00 . A A . 30 LYS CA 1 1 3 1339 1 1 30 LYS CB C 15.583 1.158 13.777 1.00 . A A . 30 LYS CB 1 1 3 1340 1 1 30 LYS CD C 15.342 -1.341 13.859 1.00 . A A . 30 LYS CD 1 1 3 1341 1 1 30 LYS CE C 15.336 -2.434 14.917 1.00 . A A . 30 LYS CE 1 1 3 1342 1 1 30 LYS CG C 14.867 -0.014 14.426 1.00 . A A . 30 LYS CG 1 1 3 1343 1 1 30 LYS H H 16.393 2.990 12.223 1.00 . A A . 30 LYS H 1 1 3 1344 1 1 30 LYS HA H 14.033 1.546 12.351 1.00 . A A . 30 LYS HA 1 1 3 1345 1 1 30 LYS HB2 H 16.307 0.768 13.076 1.00 . A A . 30 LYS HB2 1 1 3 1346 1 1 30 LYS HB3 H 16.102 1.708 14.548 1.00 . A A . 30 LYS HB3 1 1 3 1347 1 1 30 LYS HD2 H 14.686 -1.634 13.052 1.00 . A A . 30 LYS HD2 1 1 3 1348 1 1 30 LYS HD3 H 16.348 -1.222 13.482 1.00 . A A . 30 LYS HD3 1 1 3 1349 1 1 30 LYS HE2 H 16.235 -3.021 14.814 1.00 . A A . 30 LYS HE2 1 1 3 1350 1 1 30 LYS HE3 H 15.317 -1.971 15.893 1.00 . A A . 30 LYS HE3 1 1 3 1351 1 1 30 LYS HG2 H 15.061 0.001 15.488 1.00 . A A . 30 LYS HG2 1 1 3 1352 1 1 30 LYS HG3 H 13.805 0.083 14.250 1.00 . A A . 30 LYS HG3 1 1 3 1353 1 1 30 LYS HZ1 H 13.276 -2.778 14.871 1.00 . A A . 30 LYS HZ1 1 1 3 1354 1 1 30 LYS HZ2 H 14.169 -4.055 15.527 1.00 . A A . 30 LYS HZ2 1 1 3 1355 1 1 30 LYS HZ3 H 14.164 -3.799 13.855 1.00 . A A . 30 LYS HZ3 1 1 3 1356 1 1 30 LYS N N 15.417 3.074 12.255 1.00 . A A . 30 LYS N 1 1 3 1357 1 1 30 LYS NZ N 14.154 -3.329 14.783 1.00 . A A . 30 LYS NZ 1 1 3 1358 1 1 30 LYS O O 14.161 3.757 14.717 1.00 . A A . 30 LYS O 1 1 3 1359 1 1 31 GLY C C 10.753 1.962 15.813 1.00 . A A . 31 GLY C 1 1 3 1360 1 1 31 GLY CA C 11.539 2.991 15.026 1.00 . A A . 31 GLY CA 1 1 3 1361 1 1 31 GLY H H 12.204 1.639 13.538 1.00 . A A . 31 GLY H 1 1 3 1362 1 1 31 GLY HA2 H 12.078 3.623 15.717 1.00 . A A . 31 GLY HA2 1 1 3 1363 1 1 31 GLY HA3 H 10.849 3.600 14.461 1.00 . A A . 31 GLY HA3 1 1 3 1364 1 1 31 GLY N N 12.486 2.384 14.109 1.00 . A A . 31 GLY N 1 1 3 1365 1 1 31 GLY O O 10.775 1.962 17.043 1.00 . A A . 31 GLY O 1 1 4 1366 1 1 1 GLY C C 3.583 -0.145 -1.377 1.00 . A A . 1 GLY C 1 1 4 1367 1 1 1 GLY CA C 2.153 0.067 -1.831 1.00 . A A . 1 GLY CA 1 1 4 1368 1 1 1 GLY H1 H 1.497 -0.557 0.083 1.00 . A A . 1 GLY H1 1 1 4 1369 1 1 1 GLY HA2 H 1.965 -0.554 -2.695 1.00 . A A . 1 GLY HA2 1 1 4 1370 1 1 1 GLY HA3 H 2.027 1.103 -2.111 1.00 . A A . 1 GLY HA3 1 1 4 1371 1 1 1 GLY N N 1.187 -0.260 -0.799 1.00 . A A . 1 GLY N 1 1 4 1372 1 1 1 GLY O O 4.067 -1.277 -1.333 1.00 . A A . 1 GLY O 1 1 4 1373 1 1 2 TYR C C 6.127 2.230 -0.083 1.00 . A A . 2 TYR C 1 1 4 1374 1 1 2 TYR CA C 5.648 0.873 -0.589 1.00 . A A . 2 TYR CA 1 1 4 1375 1 1 2 TYR CB C 6.551 0.392 -1.726 1.00 . A A . 2 TYR CB 1 1 4 1376 1 1 2 TYR CD1 C 8.417 -0.428 -0.235 1.00 . A A . 2 TYR CD1 1 1 4 1377 1 1 2 TYR CD2 C 8.985 0.956 -2.090 1.00 . A A . 2 TYR CD2 1 1 4 1378 1 1 2 TYR CE1 C 9.750 -0.510 0.119 1.00 . A A . 2 TYR CE1 1 1 4 1379 1 1 2 TYR CE2 C 10.321 0.878 -1.745 1.00 . A A . 2 TYR CE2 1 1 4 1380 1 1 2 TYR CG C 8.011 0.305 -1.343 1.00 . A A . 2 TYR CG 1 1 4 1381 1 1 2 TYR CZ C 10.698 0.144 -0.640 1.00 . A A . 2 TYR CZ 1 1 4 1382 1 1 2 TYR H H 3.823 1.819 -1.094 1.00 . A A . 2 TYR H 1 1 4 1383 1 1 2 TYR HA H 5.697 0.161 0.223 1.00 . A A . 2 TYR HA 1 1 4 1384 1 1 2 TYR HB2 H 6.232 -0.590 -2.039 1.00 . A A . 2 TYR HB2 1 1 4 1385 1 1 2 TYR HB3 H 6.466 1.076 -2.558 1.00 . A A . 2 TYR HB3 1 1 4 1386 1 1 2 TYR HD1 H 7.672 -0.940 0.357 1.00 . A A . 2 TYR HD1 1 1 4 1387 1 1 2 TYR HD2 H 8.686 1.531 -2.955 1.00 . A A . 2 TYR HD2 1 1 4 1388 1 1 2 TYR HE1 H 10.045 -1.085 0.984 1.00 . A A . 2 TYR HE1 1 1 4 1389 1 1 2 TYR HE2 H 11.063 1.391 -2.338 1.00 . A A . 2 TYR HE2 1 1 4 1390 1 1 2 TYR HH H 12.535 -0.258 -1.039 1.00 . A A . 2 TYR HH 1 1 4 1391 1 1 2 TYR N N 4.263 0.945 -1.038 1.00 . A A . 2 TYR N 1 1 4 1392 1 1 2 TYR O O 6.113 3.220 -0.816 1.00 . A A . 2 TYR O 1 1 4 1393 1 1 2 TYR OH O 12.027 0.066 -0.292 1.00 . A A . 2 TYR OH 1 1 4 1394 1 1 3 CYS C C 8.562 3.540 1.795 1.00 . A A . 3 CYS C 1 1 4 1395 1 1 3 CYS CA C 7.036 3.503 1.782 1.00 . A A . 3 CYS CA 1 1 4 1396 1 1 3 CYS CB C 6.500 3.639 3.209 1.00 . A A . 3 CYS CB 1 1 4 1397 1 1 3 CYS H H 6.539 1.447 1.711 1.00 . A A . 3 CYS H 1 1 4 1398 1 1 3 CYS HA H 6.673 4.329 1.190 1.00 . A A . 3 CYS HA 1 1 4 1399 1 1 3 CYS HB2 H 7.233 3.247 3.899 1.00 . A A . 3 CYS HB2 1 1 4 1400 1 1 3 CYS HB3 H 6.334 4.684 3.424 1.00 . A A . 3 CYS HB3 1 1 4 1401 1 1 3 CYS N N 6.552 2.269 1.176 1.00 . A A . 3 CYS N 1 1 4 1402 1 1 3 CYS O O 9.219 2.684 1.203 1.00 . A A . 3 CYS O 1 1 4 1403 1 1 3 CYS SG S 4.935 2.756 3.502 1.00 . A A . 3 CYS SG 1 1 4 1404 1 1 4 ALA C C 11.123 3.908 3.752 1.00 . A A . 4 ALA C 1 1 4 1405 1 1 4 ALA CA C 10.565 4.687 2.565 1.00 . A A . 4 ALA CA 1 1 4 1406 1 1 4 ALA CB C 10.939 6.158 2.674 1.00 . A A . 4 ALA CB 1 1 4 1407 1 1 4 ALA H H 8.541 5.190 2.924 1.00 . A A . 4 ALA H 1 1 4 1408 1 1 4 ALA HA H 10.999 4.297 1.656 1.00 . A A . 4 ALA HA 1 1 4 1409 1 1 4 ALA HB1 H 10.862 6.621 1.701 1.00 . A A . 4 ALA HB1 1 1 4 1410 1 1 4 ALA HB2 H 10.268 6.649 3.362 1.00 . A A . 4 ALA HB2 1 1 4 1411 1 1 4 ALA HB3 H 11.953 6.245 3.035 1.00 . A A . 4 ALA HB3 1 1 4 1412 1 1 4 ALA N N 9.118 4.539 2.473 1.00 . A A . 4 ALA N 1 1 4 1413 1 1 4 ALA O O 10.917 4.283 4.907 1.00 . A A . 4 ALA O 1 1 4 1414 1 1 5 THR C C 13.757 2.543 4.962 1.00 . A A . 5 THR C 1 1 4 1415 1 1 5 THR CA C 12.414 1.987 4.503 1.00 . A A . 5 THR CA 1 1 4 1416 1 1 5 THR CB C 12.610 0.537 4.020 1.00 . A A . 5 THR CB 1 1 4 1417 1 1 5 THR CG2 C 11.318 -0.255 4.149 1.00 . A A . 5 THR CG2 1 1 4 1418 1 1 5 THR H H 11.958 2.572 2.521 1.00 . A A . 5 THR H 1 1 4 1419 1 1 5 THR HA H 11.734 1.976 5.342 1.00 . A A . 5 THR HA 1 1 4 1420 1 1 5 THR HB H 13.366 0.068 4.634 1.00 . A A . 5 THR HB 1 1 4 1421 1 1 5 THR HG1 H 13.107 -0.377 2.344 1.00 . A A . 5 THR HG1 1 1 4 1422 1 1 5 THR HG21 H 10.526 0.399 4.484 1.00 . A A . 5 THR HG21 1 1 4 1423 1 1 5 THR HG22 H 11.454 -1.052 4.865 1.00 . A A . 5 THR HG22 1 1 4 1424 1 1 5 THR HG23 H 11.056 -0.675 3.189 1.00 . A A . 5 THR HG23 1 1 4 1425 1 1 5 THR N N 11.829 2.820 3.460 1.00 . A A . 5 THR N 1 1 4 1426 1 1 5 THR O O 14.270 3.506 4.391 1.00 . A A . 5 THR O 1 1 4 1427 1 1 5 THR OG1 O 13.046 0.530 2.656 1.00 . A A . 5 THR OG1 1 1 4 1428 1 1 6 LYS C C 16.622 2.573 5.412 1.00 . A A . 6 LYS C 1 1 4 1429 1 1 6 LYS CA C 15.609 2.364 6.532 1.00 . A A . 6 LYS CA 1 1 4 1430 1 1 6 LYS CB C 16.141 1.333 7.530 1.00 . A A . 6 LYS CB 1 1 4 1431 1 1 6 LYS CD C 18.604 0.843 7.444 1.00 . A A . 6 LYS CD 1 1 4 1432 1 1 6 LYS CE C 19.012 -0.322 8.332 1.00 . A A . 6 LYS CE 1 1 4 1433 1 1 6 LYS CG C 17.511 1.679 8.089 1.00 . A A . 6 LYS CG 1 1 4 1434 1 1 6 LYS H H 13.865 1.169 6.410 1.00 . A A . 6 LYS H 1 1 4 1435 1 1 6 LYS HA H 15.457 3.302 7.044 1.00 . A A . 6 LYS HA 1 1 4 1436 1 1 6 LYS HB2 H 15.448 1.256 8.355 1.00 . A A . 6 LYS HB2 1 1 4 1437 1 1 6 LYS HB3 H 16.209 0.374 7.037 1.00 . A A . 6 LYS HB3 1 1 4 1438 1 1 6 LYS HD2 H 18.240 0.454 6.504 1.00 . A A . 6 LYS HD2 1 1 4 1439 1 1 6 LYS HD3 H 19.467 1.469 7.267 1.00 . A A . 6 LYS HD3 1 1 4 1440 1 1 6 LYS HE2 H 19.725 0.030 9.061 1.00 . A A . 6 LYS HE2 1 1 4 1441 1 1 6 LYS HE3 H 18.134 -0.696 8.838 1.00 . A A . 6 LYS HE3 1 1 4 1442 1 1 6 LYS HG2 H 17.713 2.723 7.902 1.00 . A A . 6 LYS HG2 1 1 4 1443 1 1 6 LYS HG3 H 17.512 1.495 9.154 1.00 . A A . 6 LYS HG3 1 1 4 1444 1 1 6 LYS HZ1 H 20.521 -1.725 7.990 1.00 . A A . 6 LYS HZ1 1 1 4 1445 1 1 6 LYS HZ2 H 19.823 -1.112 6.577 1.00 . A A . 6 LYS HZ2 1 1 4 1446 1 1 6 LYS HZ3 H 18.983 -2.243 7.512 1.00 . A A . 6 LYS HZ3 1 1 4 1447 1 1 6 LYS N N 14.323 1.931 5.997 1.00 . A A . 6 LYS N 1 1 4 1448 1 1 6 LYS NZ N 19.628 -1.428 7.548 1.00 . A A . 6 LYS NZ 1 1 4 1449 1 1 6 LYS O O 16.770 1.728 4.529 1.00 . A A . 6 LYS O 1 1 4 1450 1 1 7 GLY C C 17.764 4.888 3.336 1.00 . A A . 7 GLY C 1 1 4 1451 1 1 7 GLY CA C 18.312 4.002 4.438 1.00 . A A . 7 GLY CA 1 1 4 1452 1 1 7 GLY H H 17.160 4.341 6.182 1.00 . A A . 7 GLY H 1 1 4 1453 1 1 7 GLY HA2 H 19.150 4.500 4.903 1.00 . A A . 7 GLY HA2 1 1 4 1454 1 1 7 GLY HA3 H 18.654 3.075 4.002 1.00 . A A . 7 GLY HA3 1 1 4 1455 1 1 7 GLY N N 17.320 3.704 5.454 1.00 . A A . 7 GLY N 1 1 4 1456 1 1 7 GLY O O 18.522 5.564 2.639 1.00 . A A . 7 GLY O 1 1 4 1457 1 1 8 ILE C C 15.550 7.113 2.646 1.00 . A A . 8 ILE C 1 1 4 1458 1 1 8 ILE CA C 15.798 5.692 2.151 1.00 . A A . 8 ILE CA 1 1 4 1459 1 1 8 ILE CB C 14.458 5.074 1.709 1.00 . A A . 8 ILE CB 1 1 4 1460 1 1 8 ILE CD1 C 15.555 3.316 0.230 1.00 . A A . 8 ILE CD1 1 1 4 1461 1 1 8 ILE CG1 C 14.635 3.586 1.401 1.00 . A A . 8 ILE CG1 1 1 4 1462 1 1 8 ILE CG2 C 13.909 5.810 0.496 1.00 . A A . 8 ILE CG2 1 1 4 1463 1 1 8 ILE H H 15.894 4.324 3.763 1.00 . A A . 8 ILE H 1 1 4 1464 1 1 8 ILE HA H 16.454 5.730 1.293 1.00 . A A . 8 ILE HA 1 1 4 1465 1 1 8 ILE HB H 13.752 5.185 2.518 1.00 . A A . 8 ILE HB 1 1 4 1466 1 1 8 ILE HD11 H 16.401 2.735 0.563 1.00 . A A . 8 ILE HD11 1 1 4 1467 1 1 8 ILE HD12 H 15.019 2.770 -0.531 1.00 . A A . 8 ILE HD12 1 1 4 1468 1 1 8 ILE HD13 H 15.902 4.255 -0.178 1.00 . A A . 8 ILE HD13 1 1 4 1469 1 1 8 ILE HG12 H 15.048 3.091 2.266 1.00 . A A . 8 ILE HG12 1 1 4 1470 1 1 8 ILE HG13 H 13.671 3.156 1.172 1.00 . A A . 8 ILE HG13 1 1 4 1471 1 1 8 ILE HG21 H 13.087 5.249 0.076 1.00 . A A . 8 ILE HG21 1 1 4 1472 1 1 8 ILE HG22 H 13.561 6.787 0.796 1.00 . A A . 8 ILE HG22 1 1 4 1473 1 1 8 ILE HG23 H 14.688 5.916 -0.244 1.00 . A A . 8 ILE HG23 1 1 4 1474 1 1 8 ILE N N 16.445 4.884 3.176 1.00 . A A . 8 ILE N 1 1 4 1475 1 1 8 ILE O O 15.014 7.319 3.735 1.00 . A A . 8 ILE O 1 1 4 1476 1 1 9 LYS C C 14.318 9.771 2.598 1.00 . A A . 9 LYS C 1 1 4 1477 1 1 9 LYS CA C 15.761 9.495 2.190 1.00 . A A . 9 LYS CA 1 1 4 1478 1 1 9 LYS CB C 16.151 10.392 1.013 1.00 . A A . 9 LYS CB 1 1 4 1479 1 1 9 LYS CD C 18.427 11.348 0.549 1.00 . A A . 9 LYS CD 1 1 4 1480 1 1 9 LYS CE C 18.096 12.342 -0.553 1.00 . A A . 9 LYS CE 1 1 4 1481 1 1 9 LYS CG C 17.543 10.115 0.472 1.00 . A A . 9 LYS CG 1 1 4 1482 1 1 9 LYS H H 16.364 7.865 0.982 1.00 . A A . 9 LYS H 1 1 4 1483 1 1 9 LYS HA H 16.407 9.713 3.027 1.00 . A A . 9 LYS HA 1 1 4 1484 1 1 9 LYS HB2 H 15.440 10.246 0.214 1.00 . A A . 9 LYS HB2 1 1 4 1485 1 1 9 LYS HB3 H 16.111 11.423 1.334 1.00 . A A . 9 LYS HB3 1 1 4 1486 1 1 9 LYS HD2 H 18.280 11.827 1.506 1.00 . A A . 9 LYS HD2 1 1 4 1487 1 1 9 LYS HD3 H 19.461 11.046 0.451 1.00 . A A . 9 LYS HD3 1 1 4 1488 1 1 9 LYS HE2 H 17.165 12.050 -1.015 1.00 . A A . 9 LYS HE2 1 1 4 1489 1 1 9 LYS HE3 H 17.988 13.323 -0.114 1.00 . A A . 9 LYS HE3 1 1 4 1490 1 1 9 LYS HG2 H 17.994 9.324 1.052 1.00 . A A . 9 LYS HG2 1 1 4 1491 1 1 9 LYS HG3 H 17.462 9.805 -0.561 1.00 . A A . 9 LYS HG3 1 1 4 1492 1 1 9 LYS HZ1 H 20.098 12.356 -1.147 1.00 . A A . 9 LYS HZ1 1 1 4 1493 1 1 9 LYS HZ2 H 19.083 13.271 -2.143 1.00 . A A . 9 LYS HZ2 1 1 4 1494 1 1 9 LYS HZ3 H 19.065 11.582 -2.241 1.00 . A A . 9 LYS HZ3 1 1 4 1495 1 1 9 LYS N N 15.943 8.092 1.838 1.00 . A A . 9 LYS N 1 1 4 1496 1 1 9 LYS NZ N 19.160 12.391 -1.594 1.00 . A A . 9 LYS NZ 1 1 4 1497 1 1 9 LYS O O 13.381 9.231 2.009 1.00 . A A . 9 LYS O 1 1 4 1498 1 1 10 CYS C C 12.586 12.473 4.014 1.00 . A A . 10 CYS C 1 1 4 1499 1 1 10 CYS CA C 12.815 10.967 4.094 1.00 . A A . 10 CYS CA 1 1 4 1500 1 1 10 CYS CB C 12.635 10.488 5.536 1.00 . A A . 10 CYS CB 1 1 4 1501 1 1 10 CYS H H 14.931 11.017 4.037 1.00 . A A . 10 CYS H 1 1 4 1502 1 1 10 CYS HA H 12.091 10.471 3.466 1.00 . A A . 10 CYS HA 1 1 4 1503 1 1 10 CYS HB2 H 11.579 10.377 5.740 1.00 . A A . 10 CYS HB2 1 1 4 1504 1 1 10 CYS HB3 H 13.121 9.531 5.653 1.00 . A A . 10 CYS HB3 1 1 4 1505 1 1 10 CYS N N 14.145 10.617 3.608 1.00 . A A . 10 CYS N 1 1 4 1506 1 1 10 CYS O O 11.647 13.001 4.609 1.00 . A A . 10 CYS O 1 1 4 1507 1 1 10 CYS SG S 13.324 11.618 6.787 1.00 . A A . 10 CYS SG 1 1 4 1508 1 1 11 ASN C C 12.011 14.985 2.478 1.00 . A A . 11 ASN C 1 1 4 1509 1 1 11 ASN CA C 13.343 14.606 3.117 1.00 . A A . 11 ASN CA 1 1 4 1510 1 1 11 ASN CB C 14.499 15.134 2.265 1.00 . A A . 11 ASN CB 1 1 4 1511 1 1 11 ASN CG C 14.512 16.649 2.184 1.00 . A A . 11 ASN CG 1 1 4 1512 1 1 11 ASN H H 14.179 12.683 2.824 1.00 . A A . 11 ASN H 1 1 4 1513 1 1 11 ASN HA H 13.398 15.051 4.099 1.00 . A A . 11 ASN HA 1 1 4 1514 1 1 11 ASN HB2 H 15.434 14.808 2.696 1.00 . A A . 11 ASN HB2 1 1 4 1515 1 1 11 ASN HB3 H 14.411 14.739 1.264 1.00 . A A . 11 ASN HB3 1 1 4 1516 1 1 11 ASN HD21 H 15.712 16.578 0.600 1.00 . A A . 11 ASN HD21 1 1 4 1517 1 1 11 ASN HD22 H 15.261 18.159 1.132 1.00 . A A . 11 ASN HD22 1 1 4 1518 1 1 11 ASN N N 13.451 13.160 3.274 1.00 . A A . 11 ASN N 1 1 4 1519 1 1 11 ASN ND2 N 15.235 17.183 1.207 1.00 . A A . 11 ASN ND2 1 1 4 1520 1 1 11 ASN O O 11.561 16.126 2.587 1.00 . A A . 11 ASN O 1 1 4 1521 1 1 11 ASN OD1 O 13.880 17.330 2.992 1.00 . A A . 11 ASN OD1 1 1 4 1522 1 1 12 ASP C C 9.156 13.078 1.383 1.00 . A A . 12 ASP C 1 1 4 1523 1 1 12 ASP CA C 10.102 14.253 1.157 1.00 . A A . 12 ASP CA 1 1 4 1524 1 1 12 ASP CB C 10.305 14.480 -0.342 1.00 . A A . 12 ASP CB 1 1 4 1525 1 1 12 ASP CG C 9.070 15.046 -1.014 1.00 . A A . 12 ASP CG 1 1 4 1526 1 1 12 ASP H H 11.794 13.132 1.760 1.00 . A A . 12 ASP H 1 1 4 1527 1 1 12 ASP HA H 9.664 15.140 1.589 1.00 . A A . 12 ASP HA 1 1 4 1528 1 1 12 ASP HB2 H 11.121 15.173 -0.488 1.00 . A A . 12 ASP HB2 1 1 4 1529 1 1 12 ASP HB3 H 10.550 13.539 -0.812 1.00 . A A . 12 ASP HB3 1 1 4 1530 1 1 12 ASP N N 11.384 14.022 1.812 1.00 . A A . 12 ASP N 1 1 4 1531 1 1 12 ASP O O 8.038 13.254 1.867 1.00 . A A . 12 ASP O 1 1 4 1532 1 1 12 ASP OD1 O 8.541 16.066 -0.524 1.00 . A A . 12 ASP OD1 1 1 4 1533 1 1 12 ASP OD2 O 8.632 14.470 -2.032 1.00 . A A . 12 ASP OD2 1 1 4 1534 1 1 13 ILE C C 8.745 10.253 2.656 1.00 . A A . 13 ILE C 1 1 4 1535 1 1 13 ILE CA C 8.806 10.678 1.192 1.00 . A A . 13 ILE CA 1 1 4 1536 1 1 13 ILE CB C 9.359 9.511 0.353 1.00 . A A . 13 ILE CB 1 1 4 1537 1 1 13 ILE CD1 C 8.683 7.288 -0.686 1.00 . A A . 13 ILE CD1 1 1 4 1538 1 1 13 ILE CG1 C 8.374 8.341 0.356 1.00 . A A . 13 ILE CG1 1 1 4 1539 1 1 13 ILE CG2 C 10.715 9.071 0.887 1.00 . A A . 13 ILE CG2 1 1 4 1540 1 1 13 ILE H H 10.512 11.806 0.648 1.00 . A A . 13 ILE H 1 1 4 1541 1 1 13 ILE HA H 7.805 10.899 0.850 1.00 . A A . 13 ILE HA 1 1 4 1542 1 1 13 ILE HB H 9.493 9.858 -0.660 1.00 . A A . 13 ILE HB 1 1 4 1543 1 1 13 ILE HD11 H 9.551 6.723 -0.381 1.00 . A A . 13 ILE HD11 1 1 4 1544 1 1 13 ILE HD12 H 7.838 6.625 -0.790 1.00 . A A . 13 ILE HD12 1 1 4 1545 1 1 13 ILE HD13 H 8.883 7.768 -1.634 1.00 . A A . 13 ILE HD13 1 1 4 1546 1 1 13 ILE HG12 H 8.393 7.864 1.323 1.00 . A A . 13 ILE HG12 1 1 4 1547 1 1 13 ILE HG13 H 7.380 8.717 0.164 1.00 . A A . 13 ILE HG13 1 1 4 1548 1 1 13 ILE HG21 H 11.355 9.934 0.998 1.00 . A A . 13 ILE HG21 1 1 4 1549 1 1 13 ILE HG22 H 10.586 8.594 1.847 1.00 . A A . 13 ILE HG22 1 1 4 1550 1 1 13 ILE HG23 H 11.165 8.375 0.196 1.00 . A A . 13 ILE HG23 1 1 4 1551 1 1 13 ILE N N 9.612 11.882 1.028 1.00 . A A . 13 ILE N 1 1 4 1552 1 1 13 ILE O O 9.711 10.414 3.401 1.00 . A A . 13 ILE O 1 1 4 1553 1 1 14 HIS C C 7.708 7.765 4.561 1.00 . A A . 14 HIS C 1 1 4 1554 1 1 14 HIS CA C 7.415 9.257 4.435 1.00 . A A . 14 HIS CA 1 1 4 1555 1 1 14 HIS CB C 5.988 9.550 4.900 1.00 . A A . 14 HIS CB 1 1 4 1556 1 1 14 HIS CD2 C 4.367 11.412 4.104 1.00 . A A . 14 HIS CD2 1 1 4 1557 1 1 14 HIS CE1 C 5.664 13.142 4.466 1.00 . A A . 14 HIS CE1 1 1 4 1558 1 1 14 HIS CG C 5.536 10.947 4.604 1.00 . A A . 14 HIS CG 1 1 4 1559 1 1 14 HIS H H 6.868 9.607 2.420 1.00 . A A . 14 HIS H 1 1 4 1560 1 1 14 HIS HA H 8.106 9.801 5.060 1.00 . A A . 14 HIS HA 1 1 4 1561 1 1 14 HIS HB2 H 5.309 8.870 4.407 1.00 . A A . 14 HIS HB2 1 1 4 1562 1 1 14 HIS HB3 H 5.927 9.400 5.968 1.00 . A A . 14 HIS HB3 1 1 4 1563 1 1 14 HIS HD1 H 7.238 12.047 5.179 1.00 . A A . 14 HIS HD1 1 1 4 1564 1 1 14 HIS HD2 H 3.510 10.818 3.818 1.00 . A A . 14 HIS HD2 1 1 4 1565 1 1 14 HIS HE1 H 6.033 14.155 4.525 1.00 . A A . 14 HIS HE1 1 1 4 1566 1 1 14 HIS N N 7.602 9.708 3.060 1.00 . A A . 14 HIS N 1 1 4 1567 1 1 14 HIS ND1 N 6.327 12.055 4.819 1.00 . A A . 14 HIS ND1 1 1 4 1568 1 1 14 HIS NE2 N 4.472 12.779 4.028 1.00 . A A . 14 HIS NE2 1 1 4 1569 1 1 14 HIS O O 7.591 7.014 3.592 1.00 . A A . 14 HIS O 1 1 4 1570 1 1 15 CYS C C 7.158 5.181 6.472 1.00 . A A . 15 CYS C 1 1 4 1571 1 1 15 CYS CA C 8.401 5.940 6.016 1.00 . A A . 15 CYS CA 1 1 4 1572 1 1 15 CYS CB C 9.500 5.824 7.073 1.00 . A A . 15 CYS CB 1 1 4 1573 1 1 15 CYS H H 8.164 7.988 6.496 1.00 . A A . 15 CYS H 1 1 4 1574 1 1 15 CYS HA H 8.754 5.506 5.093 1.00 . A A . 15 CYS HA 1 1 4 1575 1 1 15 CYS HB2 H 9.046 5.815 8.054 1.00 . A A . 15 CYS HB2 1 1 4 1576 1 1 15 CYS HB3 H 10.037 4.899 6.923 1.00 . A A . 15 CYS HB3 1 1 4 1577 1 1 15 CYS N N 8.089 7.342 5.762 1.00 . A A . 15 CYS N 1 1 4 1578 1 1 15 CYS O O 6.225 5.768 7.022 1.00 . A A . 15 CYS O 1 1 4 1579 1 1 15 CYS SG S 10.713 7.183 7.038 1.00 . A A . 15 CYS SG 1 1 4 1580 1 1 16 CYS C C 5.839 3.036 8.141 1.00 . A A . 16 CYS C 1 1 4 1581 1 1 16 CYS CA C 6.026 3.032 6.627 1.00 . A A . 16 CYS CA 1 1 4 1582 1 1 16 CYS CB C 6.238 1.600 6.132 1.00 . A A . 16 CYS CB 1 1 4 1583 1 1 16 CYS H H 7.926 3.462 5.798 1.00 . A A . 16 CYS H 1 1 4 1584 1 1 16 CYS HA H 5.137 3.435 6.166 1.00 . A A . 16 CYS HA 1 1 4 1585 1 1 16 CYS HB2 H 7.298 1.410 6.047 1.00 . A A . 16 CYS HB2 1 1 4 1586 1 1 16 CYS HB3 H 5.811 0.913 6.848 1.00 . A A . 16 CYS HB3 1 1 4 1587 1 1 16 CYS N N 7.153 3.873 6.241 1.00 . A A . 16 CYS N 1 1 4 1588 1 1 16 CYS O O 6.786 3.262 8.894 1.00 . A A . 16 CYS O 1 1 4 1589 1 1 16 CYS SG S 5.483 1.254 4.511 1.00 . A A . 16 CYS SG 1 1 4 1590 1 1 17 SER C C 5.268 1.861 10.761 1.00 . A A . 17 SER C 1 1 4 1591 1 1 17 SER CA C 4.297 2.762 10.005 1.00 . A A . 17 SER CA 1 1 4 1592 1 1 17 SER CB C 2.861 2.281 10.225 1.00 . A A . 17 SER CB 1 1 4 1593 1 1 17 SER H H 3.896 2.612 7.931 1.00 . A A . 17 SER H 1 1 4 1594 1 1 17 SER HA H 4.392 3.770 10.381 1.00 . A A . 17 SER HA 1 1 4 1595 1 1 17 SER HB2 H 2.645 1.475 9.541 1.00 . A A . 17 SER HB2 1 1 4 1596 1 1 17 SER HB3 H 2.754 1.930 11.242 1.00 . A A . 17 SER HB3 1 1 4 1597 1 1 17 SER HG H 1.256 3.307 10.685 1.00 . A A . 17 SER HG 1 1 4 1598 1 1 17 SER N N 4.610 2.784 8.581 1.00 . A A . 17 SER N 1 1 4 1599 1 1 17 SER O O 5.244 0.640 10.612 1.00 . A A . 17 SER O 1 1 4 1600 1 1 17 SER OG O 1.933 3.329 10.004 1.00 . A A . 17 SER OG 1 1 4 1601 1 1 18 GLY C C 8.489 2.296 12.252 1.00 . A A . 18 GLY C 1 1 4 1602 1 1 18 GLY CA C 7.093 1.713 12.341 1.00 . A A . 18 GLY CA 1 1 4 1603 1 1 18 GLY H H 6.098 3.450 11.652 1.00 . A A . 18 GLY H 1 1 4 1604 1 1 18 GLY HA2 H 6.785 1.699 13.376 1.00 . A A . 18 GLY HA2 1 1 4 1605 1 1 18 GLY HA3 H 7.114 0.699 11.968 1.00 . A A . 18 GLY HA3 1 1 4 1606 1 1 18 GLY N N 6.124 2.474 11.573 1.00 . A A . 18 GLY N 1 1 4 1607 1 1 18 GLY O O 9.354 1.984 13.072 1.00 . A A . 18 GLY O 1 1 4 1608 1 1 19 LEU C C 9.944 5.270 11.327 1.00 . A A . 19 LEU C 1 1 4 1609 1 1 19 LEU CA C 10.015 3.770 11.059 1.00 . A A . 19 LEU CA 1 1 4 1610 1 1 19 LEU CB C 10.517 3.518 9.636 1.00 . A A . 19 LEU CB 1 1 4 1611 1 1 19 LEU CD1 C 11.083 1.917 7.792 1.00 . A A . 19 LEU CD1 1 1 4 1612 1 1 19 LEU CD2 C 12.056 1.588 10.073 1.00 . A A . 19 LEU CD2 1 1 4 1613 1 1 19 LEU CG C 10.844 2.066 9.286 1.00 . A A . 19 LEU CG 1 1 4 1614 1 1 19 LEU H H 7.985 3.353 10.632 1.00 . A A . 19 LEU H 1 1 4 1615 1 1 19 LEU HA H 10.706 3.324 11.759 1.00 . A A . 19 LEU HA 1 1 4 1616 1 1 19 LEU HB2 H 9.755 3.859 8.952 1.00 . A A . 19 LEU HB2 1 1 4 1617 1 1 19 LEU HB3 H 11.414 4.104 9.494 1.00 . A A . 19 LEU HB3 1 1 4 1618 1 1 19 LEU HD11 H 11.273 0.881 7.559 1.00 . A A . 19 LEU HD11 1 1 4 1619 1 1 19 LEU HD12 H 11.936 2.513 7.503 1.00 . A A . 19 LEU HD12 1 1 4 1620 1 1 19 LEU HD13 H 10.210 2.254 7.252 1.00 . A A . 19 LEU HD13 1 1 4 1621 1 1 19 LEU HD21 H 12.958 1.901 9.569 1.00 . A A . 19 LEU HD21 1 1 4 1622 1 1 19 LEU HD22 H 12.038 0.509 10.141 1.00 . A A . 19 LEU HD22 1 1 4 1623 1 1 19 LEU HD23 H 12.031 2.013 11.065 1.00 . A A . 19 LEU HD23 1 1 4 1624 1 1 19 LEU HG H 10.003 1.440 9.553 1.00 . A A . 19 LEU HG 1 1 4 1625 1 1 19 LEU N N 8.713 3.143 11.253 1.00 . A A . 19 LEU N 1 1 4 1626 1 1 19 LEU O O 8.880 5.881 11.220 1.00 . A A . 19 LEU O 1 1 4 1627 1 1 20 LYS C C 11.870 8.029 10.832 1.00 . A A . 20 LYS C 1 1 4 1628 1 1 20 LYS CA C 11.152 7.288 11.955 1.00 . A A . 20 LYS CA 1 1 4 1629 1 1 20 LYS CB C 11.870 7.534 13.284 1.00 . A A . 20 LYS CB 1 1 4 1630 1 1 20 LYS CD C 11.120 8.235 15.576 1.00 . A A . 20 LYS CD 1 1 4 1631 1 1 20 LYS CE C 10.131 7.971 16.701 1.00 . A A . 20 LYS CE 1 1 4 1632 1 1 20 LYS CG C 11.041 7.164 14.501 1.00 . A A . 20 LYS CG 1 1 4 1633 1 1 20 LYS H H 11.898 5.318 11.744 1.00 . A A . 20 LYS H 1 1 4 1634 1 1 20 LYS HA H 10.141 7.660 12.028 1.00 . A A . 20 LYS HA 1 1 4 1635 1 1 20 LYS HB2 H 12.778 6.949 13.302 1.00 . A A . 20 LYS HB2 1 1 4 1636 1 1 20 LYS HB3 H 12.125 8.581 13.353 1.00 . A A . 20 LYS HB3 1 1 4 1637 1 1 20 LYS HD2 H 12.119 8.248 15.986 1.00 . A A . 20 LYS HD2 1 1 4 1638 1 1 20 LYS HD3 H 10.899 9.196 15.132 1.00 . A A . 20 LYS HD3 1 1 4 1639 1 1 20 LYS HE2 H 9.604 7.053 16.490 1.00 . A A . 20 LYS HE2 1 1 4 1640 1 1 20 LYS HE3 H 10.678 7.867 17.627 1.00 . A A . 20 LYS HE3 1 1 4 1641 1 1 20 LYS HG2 H 10.010 7.046 14.202 1.00 . A A . 20 LYS HG2 1 1 4 1642 1 1 20 LYS HG3 H 11.409 6.232 14.907 1.00 . A A . 20 LYS HG3 1 1 4 1643 1 1 20 LYS HZ1 H 8.742 9.317 15.915 1.00 . A A . 20 LYS HZ1 1 1 4 1644 1 1 20 LYS HZ2 H 9.607 9.920 17.237 1.00 . A A . 20 LYS HZ2 1 1 4 1645 1 1 20 LYS HZ3 H 8.373 8.788 17.478 1.00 . A A . 20 LYS HZ3 1 1 4 1646 1 1 20 LYS N N 11.083 5.858 11.675 1.00 . A A . 20 LYS N 1 1 4 1647 1 1 20 LYS NZ N 9.144 9.076 16.843 1.00 . A A . 20 LYS NZ 1 1 4 1648 1 1 20 LYS O O 12.763 7.481 10.185 1.00 . A A . 20 LYS O 1 1 4 1649 1 1 21 CYS C C 13.193 10.970 10.133 1.00 . A A . 21 CYS C 1 1 4 1650 1 1 21 CYS CA C 12.082 10.094 9.562 1.00 . A A . 21 CYS CA 1 1 4 1651 1 1 21 CYS CB C 11.022 10.970 8.891 1.00 . A A . 21 CYS CB 1 1 4 1652 1 1 21 CYS H H 10.758 9.659 11.155 1.00 . A A . 21 CYS H 1 1 4 1653 1 1 21 CYS HA H 12.506 9.430 8.825 1.00 . A A . 21 CYS HA 1 1 4 1654 1 1 21 CYS HB2 H 10.370 10.343 8.300 1.00 . A A . 21 CYS HB2 1 1 4 1655 1 1 21 CYS HB3 H 10.441 11.467 9.653 1.00 . A A . 21 CYS HB3 1 1 4 1656 1 1 21 CYS N N 11.475 9.277 10.606 1.00 . A A . 21 CYS N 1 1 4 1657 1 1 21 CYS O O 12.942 12.072 10.619 1.00 . A A . 21 CYS O 1 1 4 1658 1 1 21 CYS SG S 11.704 12.251 7.790 1.00 . A A . 21 CYS SG 1 1 4 1659 1 1 22 ASP C C 15.721 12.547 9.866 1.00 . A A . 22 ASP C 1 1 4 1660 1 1 22 ASP CA C 15.574 11.207 10.580 1.00 . A A . 22 ASP CA 1 1 4 1661 1 1 22 ASP CB C 16.850 10.381 10.409 1.00 . A A . 22 ASP CB 1 1 4 1662 1 1 22 ASP CG C 17.926 10.767 11.405 1.00 . A A . 22 ASP CG 1 1 4 1663 1 1 22 ASP H H 14.560 9.586 9.671 1.00 . A A . 22 ASP H 1 1 4 1664 1 1 22 ASP HA H 15.412 11.389 11.631 1.00 . A A . 22 ASP HA 1 1 4 1665 1 1 22 ASP HB2 H 16.616 9.336 10.548 1.00 . A A . 22 ASP HB2 1 1 4 1666 1 1 22 ASP HB3 H 17.237 10.531 9.412 1.00 . A A . 22 ASP HB3 1 1 4 1667 1 1 22 ASP N N 14.423 10.470 10.070 1.00 . A A . 22 ASP N 1 1 4 1668 1 1 22 ASP O O 16.210 12.610 8.738 1.00 . A A . 22 ASP O 1 1 4 1669 1 1 22 ASP OD1 O 17.876 11.902 11.925 1.00 . A A . 22 ASP OD1 1 1 4 1670 1 1 22 ASP OD2 O 18.818 9.933 11.667 1.00 . A A . 22 ASP OD2 1 1 4 1671 1 1 23 SER C C 16.812 15.463 9.962 1.00 . A A . 23 SER C 1 1 4 1672 1 1 23 SER CA C 15.373 14.954 9.957 1.00 . A A . 23 SER CA 1 1 4 1673 1 1 23 SER CB C 14.477 15.919 10.736 1.00 . A A . 23 SER CB 1 1 4 1674 1 1 23 SER H H 14.913 13.501 11.426 1.00 . A A . 23 SER H 1 1 4 1675 1 1 23 SER HA H 15.027 14.899 8.936 1.00 . A A . 23 SER HA 1 1 4 1676 1 1 23 SER HB2 H 14.811 15.970 11.761 1.00 . A A . 23 SER HB2 1 1 4 1677 1 1 23 SER HB3 H 14.536 16.901 10.289 1.00 . A A . 23 SER HB3 1 1 4 1678 1 1 23 SER HG H 12.870 15.200 11.595 1.00 . A A . 23 SER HG 1 1 4 1679 1 1 23 SER N N 15.294 13.616 10.530 1.00 . A A . 23 SER N 1 1 4 1680 1 1 23 SER O O 17.133 16.459 9.314 1.00 . A A . 23 SER O 1 1 4 1681 1 1 23 SER OG O 13.127 15.489 10.717 1.00 . A A . 23 SER OG 1 1 4 1682 1 1 24 LYS C C 19.878 14.557 9.631 1.00 . A A . 24 LYS C 1 1 4 1683 1 1 24 LYS CA C 19.080 15.149 10.789 1.00 . A A . 24 LYS CA 1 1 4 1684 1 1 24 LYS CB C 19.671 14.681 12.121 1.00 . A A . 24 LYS CB 1 1 4 1685 1 1 24 LYS CD C 19.599 15.872 14.331 1.00 . A A . 24 LYS CD 1 1 4 1686 1 1 24 LYS CE C 18.685 16.467 15.392 1.00 . A A . 24 LYS CE 1 1 4 1687 1 1 24 LYS CG C 18.818 15.044 13.325 1.00 . A A . 24 LYS CG 1 1 4 1688 1 1 24 LYS H H 17.358 13.985 11.193 1.00 . A A . 24 LYS H 1 1 4 1689 1 1 24 LYS HA H 19.138 16.225 10.737 1.00 . A A . 24 LYS HA 1 1 4 1690 1 1 24 LYS HB2 H 19.781 13.607 12.095 1.00 . A A . 24 LYS HB2 1 1 4 1691 1 1 24 LYS HB3 H 20.645 15.132 12.247 1.00 . A A . 24 LYS HB3 1 1 4 1692 1 1 24 LYS HD2 H 20.329 15.241 14.815 1.00 . A A . 24 LYS HD2 1 1 4 1693 1 1 24 LYS HD3 H 20.103 16.675 13.811 1.00 . A A . 24 LYS HD3 1 1 4 1694 1 1 24 LYS HE2 H 18.695 17.542 15.295 1.00 . A A . 24 LYS HE2 1 1 4 1695 1 1 24 LYS HE3 H 17.682 16.101 15.230 1.00 . A A . 24 LYS HE3 1 1 4 1696 1 1 24 LYS HG2 H 17.964 15.614 12.991 1.00 . A A . 24 LYS HG2 1 1 4 1697 1 1 24 LYS HG3 H 18.482 14.135 13.803 1.00 . A A . 24 LYS HG3 1 1 4 1698 1 1 24 LYS HZ1 H 20.124 16.336 16.900 1.00 . A A . 24 LYS HZ1 1 1 4 1699 1 1 24 LYS HZ2 H 18.992 15.080 16.923 1.00 . A A . 24 LYS HZ2 1 1 4 1700 1 1 24 LYS HZ3 H 18.558 16.620 17.471 1.00 . A A . 24 LYS HZ3 1 1 4 1701 1 1 24 LYS N N 17.675 14.771 10.698 1.00 . A A . 24 LYS N 1 1 4 1702 1 1 24 LYS NZ N 19.120 16.100 16.768 1.00 . A A . 24 LYS NZ 1 1 4 1703 1 1 24 LYS O O 20.716 15.233 9.033 1.00 . A A . 24 LYS O 1 1 4 1704 1 1 25 ARG C C 19.434 12.557 6.982 1.00 . A A . 25 ARG C 1 1 4 1705 1 1 25 ARG CA C 20.305 12.611 8.234 1.00 . A A . 25 ARG CA 1 1 4 1706 1 1 25 ARG CB C 20.695 11.194 8.659 1.00 . A A . 25 ARG CB 1 1 4 1707 1 1 25 ARG CD C 23.030 10.871 9.531 1.00 . A A . 25 ARG CD 1 1 4 1708 1 1 25 ARG CG C 21.580 11.151 9.894 1.00 . A A . 25 ARG CG 1 1 4 1709 1 1 25 ARG CZ C 25.250 11.840 9.949 1.00 . A A . 25 ARG CZ 1 1 4 1710 1 1 25 ARG H H 18.933 12.806 9.833 1.00 . A A . 25 ARG H 1 1 4 1711 1 1 25 ARG HA H 21.202 13.170 8.010 1.00 . A A . 25 ARG HA 1 1 4 1712 1 1 25 ARG HB2 H 19.796 10.633 8.867 1.00 . A A . 25 ARG HB2 1 1 4 1713 1 1 25 ARG HB3 H 21.225 10.721 7.846 1.00 . A A . 25 ARG HB3 1 1 4 1714 1 1 25 ARG HD2 H 23.267 9.855 9.810 1.00 . A A . 25 ARG HD2 1 1 4 1715 1 1 25 ARG HD3 H 23.149 10.988 8.464 1.00 . A A . 25 ARG HD3 1 1 4 1716 1 1 25 ARG HE H 23.579 12.367 10.902 1.00 . A A . 25 ARG HE 1 1 4 1717 1 1 25 ARG HG2 H 21.525 12.104 10.399 1.00 . A A . 25 ARG HG2 1 1 4 1718 1 1 25 ARG HG3 H 21.225 10.371 10.552 1.00 . A A . 25 ARG HG3 1 1 4 1719 1 1 25 ARG HH11 H 25.201 10.413 8.520 1.00 . A A . 25 ARG HH11 1 1 4 1720 1 1 25 ARG HH12 H 26.760 11.105 8.825 1.00 . A A . 25 ARG HH12 1 1 4 1721 1 1 25 ARG HH21 H 25.626 13.285 11.312 1.00 . A A . 25 ARG HH21 1 1 4 1722 1 1 25 ARG HH22 H 27.001 12.737 10.414 1.00 . A A . 25 ARG HH22 1 1 4 1723 1 1 25 ARG N N 19.612 13.293 9.320 1.00 . A A . 25 ARG N 1 1 4 1724 1 1 25 ARG NE N 23.950 11.777 10.213 1.00 . A A . 25 ARG NE 1 1 4 1725 1 1 25 ARG NH1 N 25.781 11.054 9.022 1.00 . A A . 25 ARG NH1 1 1 4 1726 1 1 25 ARG NH2 N 26.023 12.691 10.613 1.00 . A A . 25 ARG NH2 1 1 4 1727 1 1 25 ARG O O 19.824 11.983 5.965 1.00 . A A . 25 ARG O 1 1 4 1728 1 1 26 LYS C C 17.087 11.770 5.403 1.00 . A A . 26 LYS C 1 1 4 1729 1 1 26 LYS CA C 17.324 13.178 5.939 1.00 . A A . 26 LYS CA 1 1 4 1730 1 1 26 LYS CB C 17.864 14.076 4.823 1.00 . A A . 26 LYS CB 1 1 4 1731 1 1 26 LYS CD C 18.980 16.279 4.362 1.00 . A A . 26 LYS CD 1 1 4 1732 1 1 26 LYS CE C 20.052 16.937 5.217 1.00 . A A . 26 LYS CE 1 1 4 1733 1 1 26 LYS CG C 17.963 15.541 5.215 1.00 . A A . 26 LYS CG 1 1 4 1734 1 1 26 LYS H H 17.997 13.598 7.902 1.00 . A A . 26 LYS H 1 1 4 1735 1 1 26 LYS HA H 16.386 13.580 6.290 1.00 . A A . 26 LYS HA 1 1 4 1736 1 1 26 LYS HB2 H 18.850 13.732 4.546 1.00 . A A . 26 LYS HB2 1 1 4 1737 1 1 26 LYS HB3 H 17.211 13.998 3.966 1.00 . A A . 26 LYS HB3 1 1 4 1738 1 1 26 LYS HD2 H 19.452 15.577 3.690 1.00 . A A . 26 LYS HD2 1 1 4 1739 1 1 26 LYS HD3 H 18.471 17.041 3.789 1.00 . A A . 26 LYS HD3 1 1 4 1740 1 1 26 LYS HE2 H 20.387 16.228 5.959 1.00 . A A . 26 LYS HE2 1 1 4 1741 1 1 26 LYS HE3 H 20.881 17.212 4.582 1.00 . A A . 26 LYS HE3 1 1 4 1742 1 1 26 LYS HG2 H 16.996 16.004 5.085 1.00 . A A . 26 LYS HG2 1 1 4 1743 1 1 26 LYS HG3 H 18.260 15.607 6.252 1.00 . A A . 26 LYS HG3 1 1 4 1744 1 1 26 LYS HZ1 H 18.718 17.915 6.491 1.00 . A A . 26 LYS HZ1 1 1 4 1745 1 1 26 LYS HZ2 H 19.259 18.869 5.204 1.00 . A A . 26 LYS HZ2 1 1 4 1746 1 1 26 LYS HZ3 H 20.283 18.557 6.514 1.00 . A A . 26 LYS HZ3 1 1 4 1747 1 1 26 LYS N N 18.252 13.157 7.064 1.00 . A A . 26 LYS N 1 1 4 1748 1 1 26 LYS NZ N 19.543 18.155 5.905 1.00 . A A . 26 LYS NZ 1 1 4 1749 1 1 26 LYS O O 17.076 11.550 4.191 1.00 . A A . 26 LYS O 1 1 4 1750 1 1 27 VAL C C 15.795 8.719 6.966 1.00 . A A . 27 VAL C 1 1 4 1751 1 1 27 VAL CA C 16.656 9.433 5.930 1.00 . A A . 27 VAL CA 1 1 4 1752 1 1 27 VAL CB C 17.978 8.662 5.758 1.00 . A A . 27 VAL CB 1 1 4 1753 1 1 27 VAL CG1 C 18.711 9.130 4.509 1.00 . A A . 27 VAL CG1 1 1 4 1754 1 1 27 VAL CG2 C 18.854 8.823 6.991 1.00 . A A . 27 VAL CG2 1 1 4 1755 1 1 27 VAL H H 16.917 11.057 7.263 1.00 . A A . 27 VAL H 1 1 4 1756 1 1 27 VAL HA H 16.137 9.433 4.982 1.00 . A A . 27 VAL HA 1 1 4 1757 1 1 27 VAL HB H 17.747 7.613 5.641 1.00 . A A . 27 VAL HB 1 1 4 1758 1 1 27 VAL HG11 H 19.660 8.619 4.437 1.00 . A A . 27 VAL HG11 1 1 4 1759 1 1 27 VAL HG12 H 18.114 8.908 3.637 1.00 . A A . 27 VAL HG12 1 1 4 1760 1 1 27 VAL HG13 H 18.879 10.195 4.569 1.00 . A A . 27 VAL HG13 1 1 4 1761 1 1 27 VAL HG21 H 19.396 7.907 7.169 1.00 . A A . 27 VAL HG21 1 1 4 1762 1 1 27 VAL HG22 H 19.554 9.631 6.833 1.00 . A A . 27 VAL HG22 1 1 4 1763 1 1 27 VAL HG23 H 18.234 9.047 7.846 1.00 . A A . 27 VAL HG23 1 1 4 1764 1 1 27 VAL N N 16.896 10.820 6.312 1.00 . A A . 27 VAL N 1 1 4 1765 1 1 27 VAL O O 15.629 9.198 8.088 1.00 . A A . 27 VAL O 1 1 4 1766 1 1 28 CYS C C 15.249 5.884 8.370 1.00 . A A . 28 CYS C 1 1 4 1767 1 1 28 CYS CA C 14.405 6.788 7.477 1.00 . A A . 28 CYS CA 1 1 4 1768 1 1 28 CYS CB C 13.415 5.945 6.670 1.00 . A A . 28 CYS CB 1 1 4 1769 1 1 28 CYS H H 15.419 7.239 5.674 1.00 . A A . 28 CYS H 1 1 4 1770 1 1 28 CYS HA H 13.854 7.476 8.100 1.00 . A A . 28 CYS HA 1 1 4 1771 1 1 28 CYS HB2 H 13.962 5.339 5.963 1.00 . A A . 28 CYS HB2 1 1 4 1772 1 1 28 CYS HB3 H 12.871 5.299 7.344 1.00 . A A . 28 CYS HB3 1 1 4 1773 1 1 28 CYS N N 15.249 7.570 6.582 1.00 . A A . 28 CYS N 1 1 4 1774 1 1 28 CYS O O 16.240 5.304 7.926 1.00 . A A . 28 CYS O 1 1 4 1775 1 1 28 CYS SG S 12.196 6.923 5.733 1.00 . A A . 28 CYS SG 1 1 4 1776 1 1 29 VAL C C 14.601 4.132 11.453 1.00 . A A . 29 VAL C 1 1 4 1777 1 1 29 VAL CA C 15.567 4.935 10.589 1.00 . A A . 29 VAL CA 1 1 4 1778 1 1 29 VAL CB C 16.474 5.781 11.503 1.00 . A A . 29 VAL CB 1 1 4 1779 1 1 29 VAL CG1 C 17.663 6.322 10.723 1.00 . A A . 29 VAL CG1 1 1 4 1780 1 1 29 VAL CG2 C 15.681 6.915 12.136 1.00 . A A . 29 VAL CG2 1 1 4 1781 1 1 29 VAL H H 14.052 6.256 9.928 1.00 . A A . 29 VAL H 1 1 4 1782 1 1 29 VAL HA H 16.191 4.250 10.033 1.00 . A A . 29 VAL HA 1 1 4 1783 1 1 29 VAL HB H 16.848 5.147 12.293 1.00 . A A . 29 VAL HB 1 1 4 1784 1 1 29 VAL HG11 H 18.272 6.931 11.374 1.00 . A A . 29 VAL HG11 1 1 4 1785 1 1 29 VAL HG12 H 18.250 5.498 10.344 1.00 . A A . 29 VAL HG12 1 1 4 1786 1 1 29 VAL HG13 H 17.309 6.921 9.897 1.00 . A A . 29 VAL HG13 1 1 4 1787 1 1 29 VAL HG21 H 16.127 7.180 13.083 1.00 . A A . 29 VAL HG21 1 1 4 1788 1 1 29 VAL HG22 H 15.693 7.774 11.480 1.00 . A A . 29 VAL HG22 1 1 4 1789 1 1 29 VAL HG23 H 14.661 6.598 12.293 1.00 . A A . 29 VAL HG23 1 1 4 1790 1 1 29 VAL N N 14.849 5.769 9.633 1.00 . A A . 29 VAL N 1 1 4 1791 1 1 29 VAL O O 13.383 4.261 11.325 1.00 . A A . 29 VAL O 1 1 4 1792 1 1 30 LYS C C 13.799 3.305 14.386 1.00 . A A . 30 LYS C 1 1 4 1793 1 1 30 LYS CA C 14.340 2.480 13.222 1.00 . A A . 30 LYS CA 1 1 4 1794 1 1 30 LYS CB C 15.162 1.305 13.754 1.00 . A A . 30 LYS CB 1 1 4 1795 1 1 30 LYS CD C 14.952 -0.625 15.349 1.00 . A A . 30 LYS CD 1 1 4 1796 1 1 30 LYS CE C 14.645 0.051 16.676 1.00 . A A . 30 LYS CE 1 1 4 1797 1 1 30 LYS CG C 14.318 0.118 14.185 1.00 . A A . 30 LYS CG 1 1 4 1798 1 1 30 LYS H H 16.129 3.246 12.389 1.00 . A A . 30 LYS H 1 1 4 1799 1 1 30 LYS HA H 13.508 2.097 12.650 1.00 . A A . 30 LYS HA 1 1 4 1800 1 1 30 LYS HB2 H 15.840 0.976 12.981 1.00 . A A . 30 LYS HB2 1 1 4 1801 1 1 30 LYS HB3 H 15.736 1.639 14.606 1.00 . A A . 30 LYS HB3 1 1 4 1802 1 1 30 LYS HD2 H 14.567 -1.634 15.374 1.00 . A A . 30 LYS HD2 1 1 4 1803 1 1 30 LYS HD3 H 16.024 -0.650 15.207 1.00 . A A . 30 LYS HD3 1 1 4 1804 1 1 30 LYS HE2 H 15.457 0.718 16.921 1.00 . A A . 30 LYS HE2 1 1 4 1805 1 1 30 LYS HE3 H 13.732 0.618 16.573 1.00 . A A . 30 LYS HE3 1 1 4 1806 1 1 30 LYS HG2 H 13.343 0.471 14.487 1.00 . A A . 30 LYS HG2 1 1 4 1807 1 1 30 LYS HG3 H 14.214 -0.561 13.350 1.00 . A A . 30 LYS HG3 1 1 4 1808 1 1 30 LYS HZ1 H 15.238 -0.818 18.481 1.00 . A A . 30 LYS HZ1 1 1 4 1809 1 1 30 LYS HZ2 H 14.525 -1.905 17.399 1.00 . A A . 30 LYS HZ2 1 1 4 1810 1 1 30 LYS HZ3 H 13.562 -0.802 18.245 1.00 . A A . 30 LYS HZ3 1 1 4 1811 1 1 30 LYS N N 15.152 3.304 12.334 1.00 . A A . 30 LYS N 1 1 4 1812 1 1 30 LYS NZ N 14.481 -0.938 17.777 1.00 . A A . 30 LYS NZ 1 1 4 1813 1 1 30 LYS O O 14.452 4.236 14.856 1.00 . A A . 30 LYS O 1 1 4 1814 1 1 31 GLY C C 11.910 2.832 17.212 1.00 . A A . 31 GLY C 1 1 4 1815 1 1 31 GLY CA C 11.995 3.672 15.953 1.00 . A A . 31 GLY CA 1 1 4 1816 1 1 31 GLY H H 12.127 2.204 14.433 1.00 . A A . 31 GLY H 1 1 4 1817 1 1 31 GLY HA2 H 12.582 4.555 16.161 1.00 . A A . 31 GLY HA2 1 1 4 1818 1 1 31 GLY HA3 H 10.998 3.974 15.668 1.00 . A A . 31 GLY HA3 1 1 4 1819 1 1 31 GLY N N 12.602 2.955 14.847 1.00 . A A . 31 GLY N 1 1 4 1820 1 1 31 GLY O O 10.946 2.936 17.971 1.00 . A A . 31 GLY O 1 1 5 1821 1 1 1 GLY C C 3.511 1.410 -1.093 1.00 . A A . 1 GLY C 1 1 5 1822 1 1 1 GLY CA C 2.041 1.134 -0.842 1.00 . A A . 1 GLY CA 1 1 5 1823 1 1 1 GLY H1 H 1.633 3.002 0.067 1.00 . A A . 1 GLY H1 1 1 5 1824 1 1 1 GLY HA2 H 1.932 0.121 -0.487 1.00 . A A . 1 GLY HA2 1 1 5 1825 1 1 1 GLY HA3 H 1.503 1.239 -1.773 1.00 . A A . 1 GLY HA3 1 1 5 1826 1 1 1 GLY N N 1.466 2.039 0.136 1.00 . A A . 1 GLY N 1 1 5 1827 1 1 1 GLY O O 3.861 2.373 -1.776 1.00 . A A . 1 GLY O 1 1 5 1828 1 1 2 TYR C C 6.272 2.084 -0.183 1.00 . A A . 2 TYR C 1 1 5 1829 1 1 2 TYR CA C 5.813 0.725 -0.702 1.00 . A A . 2 TYR CA 1 1 5 1830 1 1 2 TYR CB C 6.200 0.572 -2.174 1.00 . A A . 2 TYR CB 1 1 5 1831 1 1 2 TYR CD1 C 8.139 1.857 -3.157 1.00 . A A . 2 TYR CD1 1 1 5 1832 1 1 2 TYR CD2 C 8.611 -0.150 -1.960 1.00 . A A . 2 TYR CD2 1 1 5 1833 1 1 2 TYR CE1 C 9.488 2.035 -3.398 1.00 . A A . 2 TYR CE1 1 1 5 1834 1 1 2 TYR CE2 C 9.961 0.021 -2.195 1.00 . A A . 2 TYR CE2 1 1 5 1835 1 1 2 TYR CG C 7.677 0.763 -2.435 1.00 . A A . 2 TYR CG 1 1 5 1836 1 1 2 TYR CZ C 10.395 1.115 -2.914 1.00 . A A . 2 TYR CZ 1 1 5 1837 1 1 2 TYR H H 4.033 -0.184 -0.006 1.00 . A A . 2 TYR H 1 1 5 1838 1 1 2 TYR HA H 6.300 -0.050 -0.129 1.00 . A A . 2 TYR HA 1 1 5 1839 1 1 2 TYR HB2 H 5.931 -0.418 -2.509 1.00 . A A . 2 TYR HB2 1 1 5 1840 1 1 2 TYR HB3 H 5.662 1.303 -2.759 1.00 . A A . 2 TYR HB3 1 1 5 1841 1 1 2 TYR HD1 H 7.426 2.576 -3.534 1.00 . A A . 2 TYR HD1 1 1 5 1842 1 1 2 TYR HD2 H 8.267 -1.006 -1.397 1.00 . A A . 2 TYR HD2 1 1 5 1843 1 1 2 TYR HE1 H 9.828 2.892 -3.961 1.00 . A A . 2 TYR HE1 1 1 5 1844 1 1 2 TYR HE2 H 10.671 -0.699 -1.817 1.00 . A A . 2 TYR HE2 1 1 5 1845 1 1 2 TYR HH H 12.224 0.534 -2.811 1.00 . A A . 2 TYR HH 1 1 5 1846 1 1 2 TYR N N 4.373 0.565 -0.539 1.00 . A A . 2 TYR N 1 1 5 1847 1 1 2 TYR O O 6.259 3.077 -0.911 1.00 . A A . 2 TYR O 1 1 5 1848 1 1 2 TYR OH O 11.739 1.289 -3.152 1.00 . A A . 2 TYR OH 1 1 5 1849 1 1 3 CYS C C 8.668 3.408 1.734 1.00 . A A . 3 CYS C 1 1 5 1850 1 1 3 CYS CA C 7.143 3.356 1.701 1.00 . A A . 3 CYS CA 1 1 5 1851 1 1 3 CYS CB C 6.587 3.480 3.120 1.00 . A A . 3 CYS CB 1 1 5 1852 1 1 3 CYS H H 6.666 1.296 1.612 1.00 . A A . 3 CYS H 1 1 5 1853 1 1 3 CYS HA H 6.780 4.181 1.108 1.00 . A A . 3 CYS HA 1 1 5 1854 1 1 3 CYS HB2 H 7.313 3.090 3.819 1.00 . A A . 3 CYS HB2 1 1 5 1855 1 1 3 CYS HB3 H 6.408 4.522 3.339 1.00 . A A . 3 CYS HB3 1 1 5 1856 1 1 3 CYS N N 6.679 2.121 1.081 1.00 . A A . 3 CYS N 1 1 5 1857 1 1 3 CYS O O 9.341 2.558 1.152 1.00 . A A . 3 CYS O 1 1 5 1858 1 1 3 CYS SG S 5.025 2.581 3.388 1.00 . A A . 3 CYS SG 1 1 5 1859 1 1 4 ALA C C 11.198 3.802 3.725 1.00 . A A . 4 ALA C 1 1 5 1860 1 1 4 ALA CA C 10.650 4.575 2.530 1.00 . A A . 4 ALA CA 1 1 5 1861 1 1 4 ALA CB C 11.008 6.049 2.643 1.00 . A A . 4 ALA CB 1 1 5 1862 1 1 4 ALA H H 8.616 5.059 2.861 1.00 . A A . 4 ALA H 1 1 5 1863 1 1 4 ALA HA H 11.099 4.188 1.627 1.00 . A A . 4 ALA HA 1 1 5 1864 1 1 4 ALA HB1 H 10.320 6.535 3.320 1.00 . A A . 4 ALA HB1 1 1 5 1865 1 1 4 ALA HB2 H 12.015 6.147 3.021 1.00 . A A . 4 ALA HB2 1 1 5 1866 1 1 4 ALA HB3 H 10.942 6.511 1.669 1.00 . A A . 4 ALA HB3 1 1 5 1867 1 1 4 ALA N N 9.205 4.412 2.419 1.00 . A A . 4 ALA N 1 1 5 1868 1 1 4 ALA O O 10.970 4.174 4.876 1.00 . A A . 4 ALA O 1 1 5 1869 1 1 5 THR C C 13.830 2.470 4.976 1.00 . A A . 5 THR C 1 1 5 1870 1 1 5 THR CA C 12.502 1.896 4.495 1.00 . A A . 5 THR CA 1 1 5 1871 1 1 5 THR CB C 12.724 0.450 4.014 1.00 . A A . 5 THR CB 1 1 5 1872 1 1 5 THR CG2 C 11.440 -0.359 4.120 1.00 . A A . 5 THR CG2 1 1 5 1873 1 1 5 THR H H 12.069 2.478 2.506 1.00 . A A . 5 THR H 1 1 5 1874 1 1 5 THR HA H 11.809 1.876 5.324 1.00 . A A . 5 THR HA 1 1 5 1875 1 1 5 THR HB H 13.474 -0.010 4.641 1.00 . A A . 5 THR HB 1 1 5 1876 1 1 5 THR HG1 H 13.934 1.043 2.574 1.00 . A A . 5 THR HG1 1 1 5 1877 1 1 5 THR HG21 H 11.196 -0.776 3.154 1.00 . A A . 5 THR HG21 1 1 5 1878 1 1 5 THR HG22 H 10.636 0.284 4.449 1.00 . A A . 5 THR HG22 1 1 5 1879 1 1 5 THR HG23 H 11.576 -1.158 4.833 1.00 . A A . 5 THR HG23 1 1 5 1880 1 1 5 THR N N 11.922 2.723 3.444 1.00 . A A . 5 THR N 1 1 5 1881 1 1 5 THR O O 14.341 3.438 4.412 1.00 . A A . 5 THR O 1 1 5 1882 1 1 5 THR OG1 O 13.184 0.449 2.658 1.00 . A A . 5 THR OG1 1 1 5 1883 1 1 6 LYS C C 16.687 2.536 5.472 1.00 . A A . 6 LYS C 1 1 5 1884 1 1 6 LYS CA C 15.658 2.314 6.576 1.00 . A A . 6 LYS CA 1 1 5 1885 1 1 6 LYS CB C 16.188 1.289 7.582 1.00 . A A . 6 LYS CB 1 1 5 1886 1 1 6 LYS CD C 18.687 1.100 7.413 1.00 . A A . 6 LYS CD 1 1 5 1887 1 1 6 LYS CE C 19.157 -0.222 8.002 1.00 . A A . 6 LYS CE 1 1 5 1888 1 1 6 LYS CG C 17.521 1.676 8.199 1.00 . A A . 6 LYS CG 1 1 5 1889 1 1 6 LYS H H 13.932 1.098 6.426 1.00 . A A . 6 LYS H 1 1 5 1890 1 1 6 LYS HA H 15.486 3.250 7.085 1.00 . A A . 6 LYS HA 1 1 5 1891 1 1 6 LYS HB2 H 15.466 1.177 8.377 1.00 . A A . 6 LYS HB2 1 1 5 1892 1 1 6 LYS HB3 H 16.309 0.340 7.080 1.00 . A A . 6 LYS HB3 1 1 5 1893 1 1 6 LYS HD2 H 18.376 0.936 6.392 1.00 . A A . 6 LYS HD2 1 1 5 1894 1 1 6 LYS HD3 H 19.507 1.804 7.434 1.00 . A A . 6 LYS HD3 1 1 5 1895 1 1 6 LYS HE2 H 20.221 -0.311 7.848 1.00 . A A . 6 LYS HE2 1 1 5 1896 1 1 6 LYS HE3 H 18.944 -0.225 9.061 1.00 . A A . 6 LYS HE3 1 1 5 1897 1 1 6 LYS HG2 H 17.604 2.753 8.208 1.00 . A A . 6 LYS HG2 1 1 5 1898 1 1 6 LYS HG3 H 17.561 1.301 9.212 1.00 . A A . 6 LYS HG3 1 1 5 1899 1 1 6 LYS HZ1 H 17.695 -1.055 6.764 1.00 . A A . 6 LYS HZ1 1 1 5 1900 1 1 6 LYS HZ2 H 18.090 -2.015 8.099 1.00 . A A . 6 LYS HZ2 1 1 5 1901 1 1 6 LYS HZ3 H 19.150 -1.919 6.784 1.00 . A A . 6 LYS HZ3 1 1 5 1902 1 1 6 LYS N N 14.387 1.865 6.020 1.00 . A A . 6 LYS N 1 1 5 1903 1 1 6 LYS NZ N 18.476 -1.384 7.368 1.00 . A A . 6 LYS NZ 1 1 5 1904 1 1 6 LYS O O 16.861 1.693 4.593 1.00 . A A . 6 LYS O 1 1 5 1905 1 1 7 GLY C C 17.830 4.867 3.413 1.00 . A A . 7 GLY C 1 1 5 1906 1 1 7 GLY CA C 18.371 3.989 4.523 1.00 . A A . 7 GLY CA 1 1 5 1907 1 1 7 GLY H H 17.186 4.313 6.248 1.00 . A A . 7 GLY H 1 1 5 1908 1 1 7 GLY HA2 H 19.195 4.498 5.002 1.00 . A A . 7 GLY HA2 1 1 5 1909 1 1 7 GLY HA3 H 18.733 3.067 4.093 1.00 . A A . 7 GLY HA3 1 1 5 1910 1 1 7 GLY N N 17.367 3.678 5.524 1.00 . A A . 7 GLY N 1 1 5 1911 1 1 7 GLY O O 18.589 5.553 2.728 1.00 . A A . 7 GLY O 1 1 5 1912 1 1 8 ILE C C 15.597 7.063 2.687 1.00 . A A . 8 ILE C 1 1 5 1913 1 1 8 ILE CA C 15.872 5.645 2.196 1.00 . A A . 8 ILE CA 1 1 5 1914 1 1 8 ILE CB C 14.548 5.009 1.733 1.00 . A A . 8 ILE CB 1 1 5 1915 1 1 8 ILE CD1 C 15.692 3.267 0.271 1.00 . A A . 8 ILE CD1 1 1 5 1916 1 1 8 ILE CG1 C 14.750 3.523 1.427 1.00 . A A . 8 ILE CG1 1 1 5 1917 1 1 8 ILE CG2 C 14.009 5.738 0.511 1.00 . A A . 8 ILE CG2 1 1 5 1918 1 1 8 ILE H H 15.961 4.279 3.810 1.00 . A A . 8 ILE H 1 1 5 1919 1 1 8 ILE HA H 16.541 5.692 1.349 1.00 . A A . 8 ILE HA 1 1 5 1920 1 1 8 ILE HB H 13.827 5.110 2.530 1.00 . A A . 8 ILE HB 1 1 5 1921 1 1 8 ILE HD11 H 16.037 4.210 -0.128 1.00 . A A . 8 ILE HD11 1 1 5 1922 1 1 8 ILE HD12 H 16.537 2.690 0.616 1.00 . A A . 8 ILE HD12 1 1 5 1923 1 1 8 ILE HD13 H 15.173 2.719 -0.501 1.00 . A A . 8 ILE HD13 1 1 5 1924 1 1 8 ILE HG12 H 15.156 3.035 2.299 1.00 . A A . 8 ILE HG12 1 1 5 1925 1 1 8 ILE HG13 H 13.795 3.081 1.182 1.00 . A A . 8 ILE HG13 1 1 5 1926 1 1 8 ILE HG21 H 14.829 6.007 -0.138 1.00 . A A . 8 ILE HG21 1 1 5 1927 1 1 8 ILE HG22 H 13.327 5.092 -0.021 1.00 . A A . 8 ILE HG22 1 1 5 1928 1 1 8 ILE HG23 H 13.489 6.631 0.825 1.00 . A A . 8 ILE HG23 1 1 5 1929 1 1 8 ILE N N 16.513 4.846 3.232 1.00 . A A . 8 ILE N 1 1 5 1930 1 1 8 ILE O O 15.038 7.261 3.766 1.00 . A A . 8 ILE O 1 1 5 1931 1 1 9 LYS C C 14.333 9.705 2.617 1.00 . A A . 9 LYS C 1 1 5 1932 1 1 9 LYS CA C 15.787 9.447 2.237 1.00 . A A . 9 LYS CA 1 1 5 1933 1 1 9 LYS CB C 16.187 10.350 1.067 1.00 . A A . 9 LYS CB 1 1 5 1934 1 1 9 LYS CD C 18.528 11.260 1.006 1.00 . A A . 9 LYS CD 1 1 5 1935 1 1 9 LYS CE C 19.965 11.000 0.582 1.00 . A A . 9 LYS CE 1 1 5 1936 1 1 9 LYS CG C 17.609 10.125 0.584 1.00 . A A . 9 LYS CG 1 1 5 1937 1 1 9 LYS H H 16.433 7.826 1.039 1.00 . A A . 9 LYS H 1 1 5 1938 1 1 9 LYS HA H 16.414 9.673 3.085 1.00 . A A . 9 LYS HA 1 1 5 1939 1 1 9 LYS HB2 H 15.515 10.169 0.242 1.00 . A A . 9 LYS HB2 1 1 5 1940 1 1 9 LYS HB3 H 16.093 11.382 1.376 1.00 . A A . 9 LYS HB3 1 1 5 1941 1 1 9 LYS HD2 H 18.189 12.176 0.547 1.00 . A A . 9 LYS HD2 1 1 5 1942 1 1 9 LYS HD3 H 18.491 11.359 2.082 1.00 . A A . 9 LYS HD3 1 1 5 1943 1 1 9 LYS HE2 H 20.070 9.956 0.330 1.00 . A A . 9 LYS HE2 1 1 5 1944 1 1 9 LYS HE3 H 20.184 11.603 -0.287 1.00 . A A . 9 LYS HE3 1 1 5 1945 1 1 9 LYS HG2 H 17.980 9.202 1.002 1.00 . A A . 9 LYS HG2 1 1 5 1946 1 1 9 LYS HG3 H 17.607 10.059 -0.495 1.00 . A A . 9 LYS HG3 1 1 5 1947 1 1 9 LYS HZ1 H 20.442 11.385 2.579 1.00 . A A . 9 LYS HZ1 1 1 5 1948 1 1 9 LYS HZ2 H 21.373 12.260 1.472 1.00 . A A . 9 LYS HZ2 1 1 5 1949 1 1 9 LYS HZ3 H 21.676 10.614 1.716 1.00 . A A . 9 LYS HZ3 1 1 5 1950 1 1 9 LYS N N 15.993 8.047 1.887 1.00 . A A . 9 LYS N 1 1 5 1951 1 1 9 LYS NZ N 20.932 11.338 1.662 1.00 . A A . 9 LYS NZ 1 1 5 1952 1 1 9 LYS O O 13.414 9.151 2.013 1.00 . A A . 9 LYS O 1 1 5 1953 1 1 10 CYS C C 12.540 12.386 3.998 1.00 . A A . 10 CYS C 1 1 5 1954 1 1 10 CYS CA C 12.788 10.883 4.084 1.00 . A A . 10 CYS CA 1 1 5 1955 1 1 10 CYS CB C 12.587 10.404 5.523 1.00 . A A . 10 CYS CB 1 1 5 1956 1 1 10 CYS H H 14.903 10.961 4.066 1.00 . A A . 10 CYS H 1 1 5 1957 1 1 10 CYS HA H 12.082 10.377 3.444 1.00 . A A . 10 CYS HA 1 1 5 1958 1 1 10 CYS HB2 H 11.530 10.280 5.709 1.00 . A A . 10 CYS HB2 1 1 5 1959 1 1 10 CYS HB3 H 13.083 9.453 5.651 1.00 . A A . 10 CYS HB3 1 1 5 1960 1 1 10 CYS N N 14.130 10.550 3.623 1.00 . A A . 10 CYS N 1 1 5 1961 1 1 10 CYS O O 11.584 12.902 4.576 1.00 . A A . 10 CYS O 1 1 5 1962 1 1 10 CYS SG S 13.240 11.544 6.785 1.00 . A A . 10 CYS SG 1 1 5 1963 1 1 11 ASN C C 11.958 14.887 2.445 1.00 . A A . 11 ASN C 1 1 5 1964 1 1 11 ASN CA C 13.283 14.526 3.109 1.00 . A A . 11 ASN CA 1 1 5 1965 1 1 11 ASN CB C 14.447 15.069 2.276 1.00 . A A . 11 ASN CB 1 1 5 1966 1 1 11 ASN CG C 14.425 16.582 2.168 1.00 . A A . 11 ASN CG 1 1 5 1967 1 1 11 ASN H H 14.150 12.615 2.834 1.00 . A A . 11 ASN H 1 1 5 1968 1 1 11 ASN HA H 13.315 14.974 4.090 1.00 . A A . 11 ASN HA 1 1 5 1969 1 1 11 ASN HB2 H 15.379 14.775 2.737 1.00 . A A . 11 ASN HB2 1 1 5 1970 1 1 11 ASN HB3 H 14.395 14.654 1.281 1.00 . A A . 11 ASN HB3 1 1 5 1971 1 1 11 ASN HD21 H 13.452 16.467 0.437 1.00 . A A . 11 ASN HD21 1 1 5 1972 1 1 11 ASN HD22 H 13.806 18.064 0.996 1.00 . A A . 11 ASN HD22 1 1 5 1973 1 1 11 ASN N N 13.408 13.082 3.271 1.00 . A A . 11 ASN N 1 1 5 1974 1 1 11 ASN ND2 N 13.834 17.089 1.092 1.00 . A A . 11 ASN ND2 1 1 5 1975 1 1 11 ASN O O 11.493 16.023 2.541 1.00 . A A . 11 ASN O 1 1 5 1976 1 1 11 ASN OD1 O 14.932 17.285 3.042 1.00 . A A . 11 ASN OD1 1 1 5 1977 1 1 12 ASP C C 9.147 12.939 1.308 1.00 . A A . 12 ASP C 1 1 5 1978 1 1 12 ASP CA C 10.081 14.126 1.096 1.00 . A A . 12 ASP CA 1 1 5 1979 1 1 12 ASP CB C 10.307 14.353 -0.400 1.00 . A A . 12 ASP CB 1 1 5 1980 1 1 12 ASP CG C 10.581 15.807 -0.729 1.00 . A A . 12 ASP CG 1 1 5 1981 1 1 12 ASP H H 11.775 13.028 1.734 1.00 . A A . 12 ASP H 1 1 5 1982 1 1 12 ASP HA H 9.623 15.008 1.519 1.00 . A A . 12 ASP HA 1 1 5 1983 1 1 12 ASP HB2 H 11.153 13.764 -0.723 1.00 . A A . 12 ASP HB2 1 1 5 1984 1 1 12 ASP HB3 H 9.427 14.040 -0.941 1.00 . A A . 12 ASP HB3 1 1 5 1985 1 1 12 ASP N N 11.354 13.913 1.774 1.00 . A A . 12 ASP N 1 1 5 1986 1 1 12 ASP O O 8.018 13.100 1.771 1.00 . A A . 12 ASP O 1 1 5 1987 1 1 12 ASP OD1 O 11.714 16.269 -0.477 1.00 . A A . 12 ASP OD1 1 1 5 1988 1 1 12 ASP OD2 O 9.664 16.483 -1.241 1.00 . A A . 12 ASP OD2 1 1 5 1989 1 1 13 ILE C C 8.751 10.110 2.579 1.00 . A A . 13 ILE C 1 1 5 1990 1 1 13 ILE CA C 8.833 10.534 1.116 1.00 . A A . 13 ILE CA 1 1 5 1991 1 1 13 ILE CB C 9.416 9.373 0.289 1.00 . A A . 13 ILE CB 1 1 5 1992 1 1 13 ILE CD1 C 8.436 7.427 -1.026 1.00 . A A . 13 ILE CD1 1 1 5 1993 1 1 13 ILE CG1 C 8.450 8.187 0.281 1.00 . A A . 13 ILE CG1 1 1 5 1994 1 1 13 ILE CG2 C 10.771 8.956 0.843 1.00 . A A . 13 ILE CG2 1 1 5 1995 1 1 13 ILE H H 10.532 11.684 0.599 1.00 . A A . 13 ILE H 1 1 5 1996 1 1 13 ILE HA H 7.835 10.740 0.756 1.00 . A A . 13 ILE HA 1 1 5 1997 1 1 13 ILE HB H 9.559 9.718 -0.724 1.00 . A A . 13 ILE HB 1 1 5 1998 1 1 13 ILE HD11 H 9.424 7.038 -1.228 1.00 . A A . 13 ILE HD11 1 1 5 1999 1 1 13 ILE HD12 H 7.733 6.610 -0.962 1.00 . A A . 13 ILE HD12 1 1 5 2000 1 1 13 ILE HD13 H 8.142 8.092 -1.826 1.00 . A A . 13 ILE HD13 1 1 5 2001 1 1 13 ILE HG12 H 8.730 7.497 1.062 1.00 . A A . 13 ILE HG12 1 1 5 2002 1 1 13 ILE HG13 H 7.448 8.547 0.467 1.00 . A A . 13 ILE HG13 1 1 5 2003 1 1 13 ILE HG21 H 10.635 8.479 1.802 1.00 . A A . 13 ILE HG21 1 1 5 2004 1 1 13 ILE HG22 H 11.241 8.264 0.161 1.00 . A A . 13 ILE HG22 1 1 5 2005 1 1 13 ILE HG23 H 11.396 9.829 0.960 1.00 . A A . 13 ILE HG23 1 1 5 2006 1 1 13 ILE N N 9.625 11.748 0.964 1.00 . A A . 13 ILE N 1 1 5 2007 1 1 13 ILE O O 9.702 10.286 3.341 1.00 . A A . 13 ILE O 1 1 5 2008 1 1 14 HIS C C 7.716 7.611 4.470 1.00 . A A . 14 HIS C 1 1 5 2009 1 1 14 HIS CA C 7.404 9.098 4.336 1.00 . A A . 14 HIS CA 1 1 5 2010 1 1 14 HIS CB C 5.966 9.371 4.775 1.00 . A A . 14 HIS CB 1 1 5 2011 1 1 14 HIS CD2 C 4.163 9.102 2.931 1.00 . A A . 14 HIS CD2 1 1 5 2012 1 1 14 HIS CE1 C 3.688 6.986 3.253 1.00 . A A . 14 HIS CE1 1 1 5 2013 1 1 14 HIS CG C 4.941 8.661 3.946 1.00 . A A . 14 HIS CG 1 1 5 2014 1 1 14 HIS H H 6.888 9.437 2.311 1.00 . A A . 14 HIS H 1 1 5 2015 1 1 14 HIS HA H 8.077 9.653 4.972 1.00 . A A . 14 HIS HA 1 1 5 2016 1 1 14 HIS HB2 H 5.843 9.052 5.800 1.00 . A A . 14 HIS HB2 1 1 5 2017 1 1 14 HIS HB3 H 5.771 10.432 4.708 1.00 . A A . 14 HIS HB3 1 1 5 2018 1 1 14 HIS HD1 H 5.015 6.731 4.789 1.00 . A A . 14 HIS HD1 1 1 5 2019 1 1 14 HIS HD2 H 4.149 10.102 2.521 1.00 . A A . 14 HIS HD2 1 1 5 2020 1 1 14 HIS HE1 H 3.243 6.007 3.158 1.00 . A A . 14 HIS HE1 1 1 5 2021 1 1 14 HIS N N 7.610 9.550 2.964 1.00 . A A . 14 HIS N 1 1 5 2022 1 1 14 HIS ND1 N 4.619 7.332 4.124 1.00 . A A . 14 HIS ND1 1 1 5 2023 1 1 14 HIS NE2 N 3.393 8.042 2.517 1.00 . A A . 14 HIS NE2 1 1 5 2024 1 1 14 HIS O O 7.625 6.856 3.501 1.00 . A A . 14 HIS O 1 1 5 2025 1 1 15 CYS C C 7.172 5.023 6.378 1.00 . A A . 15 CYS C 1 1 5 2026 1 1 15 CYS CA C 8.411 5.799 5.940 1.00 . A A . 15 CYS CA 1 1 5 2027 1 1 15 CYS CB C 9.495 5.700 7.015 1.00 . A A . 15 CYS CB 1 1 5 2028 1 1 15 CYS H H 8.139 7.844 6.411 1.00 . A A . 15 CYS H 1 1 5 2029 1 1 15 CYS HA H 8.785 5.368 5.023 1.00 . A A . 15 CYS HA 1 1 5 2030 1 1 15 CYS HB2 H 9.026 5.687 7.988 1.00 . A A . 15 CYS HB2 1 1 5 2031 1 1 15 CYS HB3 H 10.047 4.782 6.875 1.00 . A A . 15 CYS HB3 1 1 5 2032 1 1 15 CYS N N 8.085 7.195 5.678 1.00 . A A . 15 CYS N 1 1 5 2033 1 1 15 CYS O O 6.221 5.599 6.906 1.00 . A A . 15 CYS O 1 1 5 2034 1 1 15 CYS SG S 10.690 7.075 6.994 1.00 . A A . 15 CYS SG 1 1 5 2035 1 1 16 CYS C C 5.867 2.854 8.040 1.00 . A A . 16 CYS C 1 1 5 2036 1 1 16 CYS CA C 6.071 2.858 6.527 1.00 . A A . 16 CYS CA 1 1 5 2037 1 1 16 CYS CB C 6.306 1.430 6.030 1.00 . A A . 16 CYS CB 1 1 5 2038 1 1 16 CYS H H 7.979 3.312 5.731 1.00 . A A . 16 CYS H 1 1 5 2039 1 1 16 CYS HA H 5.183 3.251 6.057 1.00 . A A . 16 CYS HA 1 1 5 2040 1 1 16 CYS HB2 H 7.370 1.254 5.955 1.00 . A A . 16 CYS HB2 1 1 5 2041 1 1 16 CYS HB3 H 5.881 0.735 6.739 1.00 . A A . 16 CYS HB3 1 1 5 2042 1 1 16 CYS N N 7.192 3.713 6.156 1.00 . A A . 16 CYS N 1 1 5 2043 1 1 16 CYS O O 6.802 3.098 8.803 1.00 . A A . 16 CYS O 1 1 5 2044 1 1 16 CYS SG S 5.572 1.080 4.400 1.00 . A A . 16 CYS SG 1 1 5 2045 1 1 17 SER C C 5.291 1.662 10.650 1.00 . A A . 17 SER C 1 1 5 2046 1 1 17 SER CA C 4.310 2.545 9.885 1.00 . A A . 17 SER CA 1 1 5 2047 1 1 17 SER CB C 2.882 2.036 10.089 1.00 . A A . 17 SER CB 1 1 5 2048 1 1 17 SER H H 3.936 2.391 7.807 1.00 . A A . 17 SER H 1 1 5 2049 1 1 17 SER HA H 4.381 3.554 10.264 1.00 . A A . 17 SER HA 1 1 5 2050 1 1 17 SER HB2 H 2.882 0.956 10.073 1.00 . A A . 17 SER HB2 1 1 5 2051 1 1 17 SER HB3 H 2.512 2.382 11.043 1.00 . A A . 17 SER HB3 1 1 5 2052 1 1 17 SER HG H 1.559 1.765 8.670 1.00 . A A . 17 SER HG 1 1 5 2053 1 1 17 SER N N 4.639 2.577 8.465 1.00 . A A . 17 SER N 1 1 5 2054 1 1 17 SER O O 5.305 0.443 10.485 1.00 . A A . 17 SER O 1 1 5 2055 1 1 17 SER OG O 2.022 2.507 9.066 1.00 . A A . 17 SER OG 1 1 5 2056 1 1 18 GLY C C 8.472 2.152 12.194 1.00 . A A . 18 GLY C 1 1 5 2057 1 1 18 GLY CA C 7.085 1.544 12.267 1.00 . A A . 18 GLY CA 1 1 5 2058 1 1 18 GLY H H 6.055 3.262 11.580 1.00 . A A . 18 GLY H 1 1 5 2059 1 1 18 GLY HA2 H 6.766 1.524 13.298 1.00 . A A . 18 GLY HA2 1 1 5 2060 1 1 18 GLY HA3 H 7.129 0.531 11.895 1.00 . A A . 18 GLY HA3 1 1 5 2061 1 1 18 GLY N N 6.112 2.287 11.489 1.00 . A A . 18 GLY N 1 1 5 2062 1 1 18 GLY O O 9.332 1.857 13.025 1.00 . A A . 18 GLY O 1 1 5 2063 1 1 19 LEU C C 9.883 5.150 11.280 1.00 . A A . 19 LEU C 1 1 5 2064 1 1 19 LEU CA C 9.985 3.651 11.016 1.00 . A A . 19 LEU CA 1 1 5 2065 1 1 19 LEU CB C 10.508 3.406 9.599 1.00 . A A . 19 LEU CB 1 1 5 2066 1 1 19 LEU CD1 C 11.117 1.814 7.762 1.00 . A A . 19 LEU CD1 1 1 5 2067 1 1 19 LEU CD2 C 12.058 1.490 10.057 1.00 . A A . 19 LEU CD2 1 1 5 2068 1 1 19 LEU CG C 10.854 1.957 9.253 1.00 . A A . 19 LEU CG 1 1 5 2069 1 1 19 LEU H H 7.968 3.197 10.566 1.00 . A A . 19 LEU H 1 1 5 2070 1 1 19 LEU HA H 10.675 3.219 11.725 1.00 . A A . 19 LEU HA 1 1 5 2071 1 1 19 LEU HB2 H 9.753 3.741 8.906 1.00 . A A . 19 LEU HB2 1 1 5 2072 1 1 19 LEU HB3 H 11.402 4.001 9.470 1.00 . A A . 19 LEU HB3 1 1 5 2073 1 1 19 LEU HD11 H 10.249 2.140 7.210 1.00 . A A . 19 LEU HD11 1 1 5 2074 1 1 19 LEU HD12 H 11.322 0.779 7.531 1.00 . A A . 19 LEU HD12 1 1 5 2075 1 1 19 LEU HD13 H 11.969 2.419 7.487 1.00 . A A . 19 LEU HD13 1 1 5 2076 1 1 19 LEU HD21 H 12.013 1.911 11.050 1.00 . A A . 19 LEU HD21 1 1 5 2077 1 1 19 LEU HD22 H 12.965 1.816 9.568 1.00 . A A . 19 LEU HD22 1 1 5 2078 1 1 19 LEU HD23 H 12.051 0.412 10.122 1.00 . A A . 19 LEU HD23 1 1 5 2079 1 1 19 LEU HG H 10.015 1.323 9.506 1.00 . A A . 19 LEU HG 1 1 5 2080 1 1 19 LEU N N 8.692 3.001 11.196 1.00 . A A . 19 LEU N 1 1 5 2081 1 1 19 LEU O O 8.810 5.741 11.158 1.00 . A A . 19 LEU O 1 1 5 2082 1 1 20 LYS C C 11.771 7.942 10.808 1.00 . A A . 20 LYS C 1 1 5 2083 1 1 20 LYS CA C 11.046 7.190 11.920 1.00 . A A . 20 LYS CA 1 1 5 2084 1 1 20 LYS CB C 11.737 7.451 13.260 1.00 . A A . 20 LYS CB 1 1 5 2085 1 1 20 LYS CD C 11.152 8.474 15.478 1.00 . A A . 20 LYS CD 1 1 5 2086 1 1 20 LYS CE C 9.996 8.741 16.430 1.00 . A A . 20 LYS CE 1 1 5 2087 1 1 20 LYS CG C 10.792 7.416 14.449 1.00 . A A . 20 LYS CG 1 1 5 2088 1 1 20 LYS H H 11.831 5.234 11.722 1.00 . A A . 20 LYS H 1 1 5 2089 1 1 20 LYS HA H 10.029 7.546 11.974 1.00 . A A . 20 LYS HA 1 1 5 2090 1 1 20 LYS HB2 H 12.500 6.701 13.411 1.00 . A A . 20 LYS HB2 1 1 5 2091 1 1 20 LYS HB3 H 12.205 8.425 13.227 1.00 . A A . 20 LYS HB3 1 1 5 2092 1 1 20 LYS HD2 H 12.003 8.134 16.050 1.00 . A A . 20 LYS HD2 1 1 5 2093 1 1 20 LYS HD3 H 11.404 9.392 14.966 1.00 . A A . 20 LYS HD3 1 1 5 2094 1 1 20 LYS HE2 H 9.098 8.308 16.016 1.00 . A A . 20 LYS HE2 1 1 5 2095 1 1 20 LYS HE3 H 10.215 8.277 17.380 1.00 . A A . 20 LYS HE3 1 1 5 2096 1 1 20 LYS HG2 H 9.785 7.594 14.102 1.00 . A A . 20 LYS HG2 1 1 5 2097 1 1 20 LYS HG3 H 10.848 6.442 14.913 1.00 . A A . 20 LYS HG3 1 1 5 2098 1 1 20 LYS HZ1 H 10.087 10.471 17.597 1.00 . A A . 20 LYS HZ1 1 1 5 2099 1 1 20 LYS HZ2 H 8.769 10.428 16.539 1.00 . A A . 20 LYS HZ2 1 1 5 2100 1 1 20 LYS HZ3 H 10.320 10.747 15.944 1.00 . A A . 20 LYS HZ3 1 1 5 2101 1 1 20 LYS N N 11.007 5.760 11.641 1.00 . A A . 20 LYS N 1 1 5 2102 1 1 20 LYS NZ N 9.778 10.199 16.642 1.00 . A A . 20 LYS NZ 1 1 5 2103 1 1 20 LYS O O 12.681 7.407 10.174 1.00 . A A . 20 LYS O 1 1 5 2104 1 1 21 CYS C C 13.064 10.901 10.129 1.00 . A A . 21 CYS C 1 1 5 2105 1 1 21 CYS CA C 11.974 10.010 9.541 1.00 . A A . 21 CYS CA 1 1 5 2106 1 1 21 CYS CB C 10.912 10.872 8.854 1.00 . A A . 21 CYS CB 1 1 5 2107 1 1 21 CYS H H 10.632 9.556 11.114 1.00 . A A . 21 CYS H 1 1 5 2108 1 1 21 CYS HA H 12.418 9.352 8.811 1.00 . A A . 21 CYS HA 1 1 5 2109 1 1 21 CYS HB2 H 10.275 10.236 8.256 1.00 . A A . 21 CYS HB2 1 1 5 2110 1 1 21 CYS HB3 H 10.315 11.363 9.608 1.00 . A A . 21 CYS HB3 1 1 5 2111 1 1 21 CYS N N 11.363 9.185 10.576 1.00 . A A . 21 CYS N 1 1 5 2112 1 1 21 CYS O O 12.791 12.003 10.606 1.00 . A A . 21 CYS O 1 1 5 2113 1 1 21 CYS SG S 11.593 12.158 7.759 1.00 . A A . 21 CYS SG 1 1 5 2114 1 1 22 ASP C C 15.575 12.509 9.906 1.00 . A A . 22 ASP C 1 1 5 2115 1 1 22 ASP CA C 15.433 11.167 10.619 1.00 . A A . 22 ASP CA 1 1 5 2116 1 1 22 ASP CB C 16.723 10.358 10.471 1.00 . A A . 22 ASP CB 1 1 5 2117 1 1 22 ASP CG C 17.739 10.686 11.548 1.00 . A A . 22 ASP CG 1 1 5 2118 1 1 22 ASP H H 14.455 9.531 9.699 1.00 . A A . 22 ASP H 1 1 5 2119 1 1 22 ASP HA H 15.252 11.349 11.668 1.00 . A A . 22 ASP HA 1 1 5 2120 1 1 22 ASP HB2 H 16.489 9.305 10.532 1.00 . A A . 22 ASP HB2 1 1 5 2121 1 1 22 ASP HB3 H 17.164 10.570 9.508 1.00 . A A . 22 ASP HB3 1 1 5 2122 1 1 22 ASP N N 14.300 10.416 10.092 1.00 . A A . 22 ASP N 1 1 5 2123 1 1 22 ASP O O 16.079 12.577 8.786 1.00 . A A . 22 ASP O 1 1 5 2124 1 1 22 ASP OD1 O 18.569 9.809 11.866 1.00 . A A . 22 ASP OD1 1 1 5 2125 1 1 22 ASP OD2 O 17.703 11.819 12.071 1.00 . A A . 22 ASP OD2 1 1 5 2126 1 1 23 SER C C 16.629 15.438 10.019 1.00 . A A . 23 SER C 1 1 5 2127 1 1 23 SER CA C 15.197 14.912 9.991 1.00 . A A . 23 SER CA 1 1 5 2128 1 1 23 SER CB C 14.276 15.866 10.754 1.00 . A A . 23 SER CB 1 1 5 2129 1 1 23 SER H H 14.734 13.454 11.455 1.00 . A A . 23 SER H 1 1 5 2130 1 1 23 SER HA H 14.868 14.851 8.964 1.00 . A A . 23 SER HA 1 1 5 2131 1 1 23 SER HB2 H 13.325 15.385 10.925 1.00 . A A . 23 SER HB2 1 1 5 2132 1 1 23 SER HB3 H 14.728 16.117 11.703 1.00 . A A . 23 SER HB3 1 1 5 2133 1 1 23 SER HG H 13.138 17.110 9.756 1.00 . A A . 23 SER HG 1 1 5 2134 1 1 23 SER N N 15.125 13.573 10.564 1.00 . A A . 23 SER N 1 1 5 2135 1 1 23 SER O O 16.948 16.438 9.375 1.00 . A A . 23 SER O 1 1 5 2136 1 1 23 SER OG O 14.059 17.060 10.022 1.00 . A A . 23 SER OG 1 1 5 2137 1 1 24 LYS C C 19.711 14.572 9.739 1.00 . A A . 24 LYS C 1 1 5 2138 1 1 24 LYS CA C 18.887 15.154 10.883 1.00 . A A . 24 LYS CA 1 1 5 2139 1 1 24 LYS CB C 19.461 14.696 12.225 1.00 . A A . 24 LYS CB 1 1 5 2140 1 1 24 LYS CD C 19.545 16.795 13.602 1.00 . A A . 24 LYS CD 1 1 5 2141 1 1 24 LYS CE C 20.238 16.901 14.952 1.00 . A A . 24 LYS CE 1 1 5 2142 1 1 24 LYS CG C 18.886 15.438 13.418 1.00 . A A . 24 LYS CG 1 1 5 2143 1 1 24 LYS H H 17.174 13.969 11.260 1.00 . A A . 24 LYS H 1 1 5 2144 1 1 24 LYS HA H 18.932 16.232 10.830 1.00 . A A . 24 LYS HA 1 1 5 2145 1 1 24 LYS HB2 H 19.257 13.643 12.350 1.00 . A A . 24 LYS HB2 1 1 5 2146 1 1 24 LYS HB3 H 20.531 14.847 12.215 1.00 . A A . 24 LYS HB3 1 1 5 2147 1 1 24 LYS HD2 H 20.277 16.939 12.822 1.00 . A A . 24 LYS HD2 1 1 5 2148 1 1 24 LYS HD3 H 18.789 17.565 13.534 1.00 . A A . 24 LYS HD3 1 1 5 2149 1 1 24 LYS HE2 H 19.567 17.378 15.650 1.00 . A A . 24 LYS HE2 1 1 5 2150 1 1 24 LYS HE3 H 20.471 15.905 15.300 1.00 . A A . 24 LYS HE3 1 1 5 2151 1 1 24 LYS HG2 H 17.827 15.583 13.265 1.00 . A A . 24 LYS HG2 1 1 5 2152 1 1 24 LYS HG3 H 19.045 14.848 14.309 1.00 . A A . 24 LYS HG3 1 1 5 2153 1 1 24 LYS HZ1 H 21.316 18.679 15.148 1.00 . A A . 24 LYS HZ1 1 1 5 2154 1 1 24 LYS HZ2 H 21.862 17.681 13.895 1.00 . A A . 24 LYS HZ2 1 1 5 2155 1 1 24 LYS HZ3 H 22.215 17.290 15.503 1.00 . A A . 24 LYS HZ3 1 1 5 2156 1 1 24 LYS N N 17.488 14.758 10.770 1.00 . A A . 24 LYS N 1 1 5 2157 1 1 24 LYS NZ N 21.496 17.693 14.869 1.00 . A A . 24 LYS NZ 1 1 5 2158 1 1 24 LYS O O 20.550 15.257 9.155 1.00 . A A . 24 LYS O 1 1 5 2159 1 1 25 ARG C C 19.335 12.563 7.085 1.00 . A A . 25 ARG C 1 1 5 2160 1 1 25 ARG CA C 20.185 12.630 8.351 1.00 . A A . 25 ARG CA 1 1 5 2161 1 1 25 ARG CB C 20.586 11.219 8.784 1.00 . A A . 25 ARG CB 1 1 5 2162 1 1 25 ARG CD C 22.261 9.848 10.062 1.00 . A A . 25 ARG CD 1 1 5 2163 1 1 25 ARG CG C 21.562 11.194 9.950 1.00 . A A . 25 ARG CG 1 1 5 2164 1 1 25 ARG CZ C 24.185 8.716 9.032 1.00 . A A . 25 ARG CZ 1 1 5 2165 1 1 25 ARG H H 18.784 12.810 9.927 1.00 . A A . 25 ARG H 1 1 5 2166 1 1 25 ARG HA H 21.078 13.200 8.141 1.00 . A A . 25 ARG HA 1 1 5 2167 1 1 25 ARG HB2 H 19.698 10.678 9.076 1.00 . A A . 25 ARG HB2 1 1 5 2168 1 1 25 ARG HB3 H 21.046 10.715 7.947 1.00 . A A . 25 ARG HB3 1 1 5 2169 1 1 25 ARG HD2 H 22.444 9.638 11.105 1.00 . A A . 25 ARG HD2 1 1 5 2170 1 1 25 ARG HD3 H 21.615 9.087 9.650 1.00 . A A . 25 ARG HD3 1 1 5 2171 1 1 25 ARG HE H 23.919 10.692 9.085 1.00 . A A . 25 ARG HE 1 1 5 2172 1 1 25 ARG HG2 H 22.306 11.962 9.801 1.00 . A A . 25 ARG HG2 1 1 5 2173 1 1 25 ARG HG3 H 21.021 11.386 10.864 1.00 . A A . 25 ARG HG3 1 1 5 2174 1 1 25 ARG HH11 H 22.818 7.482 9.863 1.00 . A A . 25 ARG HH11 1 1 5 2175 1 1 25 ARG HH12 H 24.179 6.697 9.134 1.00 . A A . 25 ARG HH12 1 1 5 2176 1 1 25 ARG HH21 H 25.716 9.670 8.121 1.00 . A A . 25 ARG HH21 1 1 5 2177 1 1 25 ARG HH22 H 25.828 7.943 8.144 1.00 . A A . 25 ARG HH22 1 1 5 2178 1 1 25 ARG N N 19.465 13.304 9.425 1.00 . A A . 25 ARG N 1 1 5 2179 1 1 25 ARG NE N 23.533 9.830 9.345 1.00 . A A . 25 ARG NE 1 1 5 2180 1 1 25 ARG NH1 N 23.687 7.535 9.371 1.00 . A A . 25 ARG NH1 1 1 5 2181 1 1 25 ARG NH2 N 25.338 8.782 8.378 1.00 . A A . 25 ARG NH2 1 1 5 2182 1 1 25 ARG O O 19.750 11.994 6.075 1.00 . A A . 25 ARG O 1 1 5 2183 1 1 26 LYS C C 17.024 11.743 5.470 1.00 . A A . 26 LYS C 1 1 5 2184 1 1 26 LYS CA C 17.234 13.154 6.008 1.00 . A A . 26 LYS CA 1 1 5 2185 1 1 26 LYS CB C 17.780 14.058 4.900 1.00 . A A . 26 LYS CB 1 1 5 2186 1 1 26 LYS CD C 18.236 16.402 4.120 1.00 . A A . 26 LYS CD 1 1 5 2187 1 1 26 LYS CE C 19.739 16.591 3.978 1.00 . A A . 26 LYS CE 1 1 5 2188 1 1 26 LYS CG C 17.896 15.517 5.307 1.00 . A A . 26 LYS CG 1 1 5 2189 1 1 26 LYS H H 17.869 13.584 7.981 1.00 . A A . 26 LYS H 1 1 5 2190 1 1 26 LYS HA H 16.285 13.544 6.343 1.00 . A A . 26 LYS HA 1 1 5 2191 1 1 26 LYS HB2 H 18.761 13.706 4.616 1.00 . A A . 26 LYS HB2 1 1 5 2192 1 1 26 LYS HB3 H 17.123 13.996 4.045 1.00 . A A . 26 LYS HB3 1 1 5 2193 1 1 26 LYS HD2 H 17.857 15.943 3.219 1.00 . A A . 26 LYS HD2 1 1 5 2194 1 1 26 LYS HD3 H 17.772 17.368 4.257 1.00 . A A . 26 LYS HD3 1 1 5 2195 1 1 26 LYS HE2 H 19.930 17.587 3.609 1.00 . A A . 26 LYS HE2 1 1 5 2196 1 1 26 LYS HE3 H 20.196 16.474 4.950 1.00 . A A . 26 LYS HE3 1 1 5 2197 1 1 26 LYS HG2 H 16.954 15.841 5.725 1.00 . A A . 26 LYS HG2 1 1 5 2198 1 1 26 LYS HG3 H 18.674 15.613 6.051 1.00 . A A . 26 LYS HG3 1 1 5 2199 1 1 26 LYS HZ1 H 21.361 15.763 2.956 1.00 . A A . 26 LYS HZ1 1 1 5 2200 1 1 26 LYS HZ2 H 19.906 15.700 2.097 1.00 . A A . 26 LYS HZ2 1 1 5 2201 1 1 26 LYS HZ3 H 20.173 14.636 3.385 1.00 . A A . 26 LYS HZ3 1 1 5 2202 1 1 26 LYS N N 18.143 13.146 7.148 1.00 . A A . 26 LYS N 1 1 5 2203 1 1 26 LYS NZ N 20.336 15.603 3.038 1.00 . A A . 26 LYS NZ 1 1 5 2204 1 1 26 LYS O O 17.036 11.521 4.259 1.00 . A A . 26 LYS O 1 1 5 2205 1 1 27 VAL C C 15.747 8.677 7.015 1.00 . A A . 27 VAL C 1 1 5 2206 1 1 27 VAL CA C 16.615 9.401 5.993 1.00 . A A . 27 VAL CA 1 1 5 2207 1 1 27 VAL CB C 17.950 8.647 5.843 1.00 . A A . 27 VAL CB 1 1 5 2208 1 1 27 VAL CG1 C 18.699 9.128 4.610 1.00 . A A . 27 VAL CG1 1 1 5 2209 1 1 27 VAL CG2 C 18.800 8.815 7.093 1.00 . A A . 27 VAL CG2 1 1 5 2210 1 1 27 VAL H H 16.832 11.029 7.327 1.00 . A A . 27 VAL H 1 1 5 2211 1 1 27 VAL HA H 16.112 9.393 5.037 1.00 . A A . 27 VAL HA 1 1 5 2212 1 1 27 VAL HB H 17.734 7.596 5.719 1.00 . A A . 27 VAL HB 1 1 5 2213 1 1 27 VAL HG11 H 19.656 8.630 4.554 1.00 . A A . 27 VAL HG11 1 1 5 2214 1 1 27 VAL HG12 H 18.122 8.900 3.726 1.00 . A A . 27 VAL HG12 1 1 5 2215 1 1 27 VAL HG13 H 18.853 10.195 4.675 1.00 . A A . 27 VAL HG13 1 1 5 2216 1 1 27 VAL HG21 H 19.490 9.633 6.950 1.00 . A A . 27 VAL HG21 1 1 5 2217 1 1 27 VAL HG22 H 18.161 9.027 7.938 1.00 . A A . 27 VAL HG22 1 1 5 2218 1 1 27 VAL HG23 H 19.352 7.906 7.279 1.00 . A A . 27 VAL HG23 1 1 5 2219 1 1 27 VAL N N 16.831 10.791 6.377 1.00 . A A . 27 VAL N 1 1 5 2220 1 1 27 VAL O O 15.552 9.157 8.132 1.00 . A A . 27 VAL O 1 1 5 2221 1 1 28 CYS C C 15.221 5.833 8.416 1.00 . A A . 28 CYS C 1 1 5 2222 1 1 28 CYS CA C 14.379 6.725 7.508 1.00 . A A . 28 CYS CA 1 1 5 2223 1 1 28 CYS CB C 13.413 5.868 6.687 1.00 . A A . 28 CYS CB 1 1 5 2224 1 1 28 CYS H H 15.418 7.186 5.723 1.00 . A A . 28 CYS H 1 1 5 2225 1 1 28 CYS HA H 13.809 7.406 8.121 1.00 . A A . 28 CYS HA 1 1 5 2226 1 1 28 CYS HB2 H 13.980 5.265 5.992 1.00 . A A . 28 CYS HB2 1 1 5 2227 1 1 28 CYS HB3 H 12.864 5.219 7.353 1.00 . A A . 28 CYS HB3 1 1 5 2228 1 1 28 CYS N N 15.227 7.517 6.626 1.00 . A A . 28 CYS N 1 1 5 2229 1 1 28 CYS O O 16.214 5.249 7.983 1.00 . A A . 28 CYS O 1 1 5 2230 1 1 28 CYS SG S 12.202 6.829 5.723 1.00 . A A . 28 CYS SG 1 1 5 2231 1 1 29 VAL C C 14.565 4.080 11.484 1.00 . A A . 29 VAL C 1 1 5 2232 1 1 29 VAL CA C 15.532 4.911 10.647 1.00 . A A . 29 VAL CA 1 1 5 2233 1 1 29 VAL CB C 16.394 5.775 11.587 1.00 . A A . 29 VAL CB 1 1 5 2234 1 1 29 VAL CG1 C 17.521 6.443 10.813 1.00 . A A . 29 VAL CG1 1 1 5 2235 1 1 29 VAL CG2 C 15.535 6.811 12.296 1.00 . A A . 29 VAL CG2 1 1 5 2236 1 1 29 VAL H H 14.017 6.222 9.964 1.00 . A A . 29 VAL H 1 1 5 2237 1 1 29 VAL HA H 16.186 4.245 10.103 1.00 . A A . 29 VAL HA 1 1 5 2238 1 1 29 VAL HB H 16.834 5.130 12.333 1.00 . A A . 29 VAL HB 1 1 5 2239 1 1 29 VAL HG11 H 18.141 5.687 10.355 1.00 . A A . 29 VAL HG11 1 1 5 2240 1 1 29 VAL HG12 H 17.103 7.080 10.047 1.00 . A A . 29 VAL HG12 1 1 5 2241 1 1 29 VAL HG13 H 18.118 7.037 11.489 1.00 . A A . 29 VAL HG13 1 1 5 2242 1 1 29 VAL HG21 H 15.874 6.920 13.316 1.00 . A A . 29 VAL HG21 1 1 5 2243 1 1 29 VAL HG22 H 15.619 7.759 11.785 1.00 . A A . 29 VAL HG22 1 1 5 2244 1 1 29 VAL HG23 H 14.505 6.489 12.290 1.00 . A A . 29 VAL HG23 1 1 5 2245 1 1 29 VAL N N 14.816 5.732 9.678 1.00 . A A . 29 VAL N 1 1 5 2246 1 1 29 VAL O O 13.351 4.281 11.432 1.00 . A A . 29 VAL O 1 1 5 2247 1 1 30 LYS C C 13.899 3.005 14.388 1.00 . A A . 30 LYS C 1 1 5 2248 1 1 30 LYS CA C 14.298 2.284 13.105 1.00 . A A . 30 LYS CA 1 1 5 2249 1 1 30 LYS CB C 15.062 1.002 13.444 1.00 . A A . 30 LYS CB 1 1 5 2250 1 1 30 LYS CD C 14.765 -1.413 14.070 1.00 . A A . 30 LYS CD 1 1 5 2251 1 1 30 LYS CE C 16.060 -1.635 14.836 1.00 . A A . 30 LYS CE 1 1 5 2252 1 1 30 LYS CG C 14.247 0.004 14.250 1.00 . A A . 30 LYS CG 1 1 5 2253 1 1 30 LYS H H 16.085 3.034 12.252 1.00 . A A . 30 LYS H 1 1 5 2254 1 1 30 LYS HA H 13.404 2.026 12.558 1.00 . A A . 30 LYS HA 1 1 5 2255 1 1 30 LYS HB2 H 15.368 0.525 12.525 1.00 . A A . 30 LYS HB2 1 1 5 2256 1 1 30 LYS HB3 H 15.941 1.262 14.016 1.00 . A A . 30 LYS HB3 1 1 5 2257 1 1 30 LYS HD2 H 14.021 -2.107 14.433 1.00 . A A . 30 LYS HD2 1 1 5 2258 1 1 30 LYS HD3 H 14.943 -1.591 13.019 1.00 . A A . 30 LYS HD3 1 1 5 2259 1 1 30 LYS HE2 H 16.487 -2.578 14.529 1.00 . A A . 30 LYS HE2 1 1 5 2260 1 1 30 LYS HE3 H 16.745 -0.835 14.598 1.00 . A A . 30 LYS HE3 1 1 5 2261 1 1 30 LYS HG2 H 14.306 0.267 15.296 1.00 . A A . 30 LYS HG2 1 1 5 2262 1 1 30 LYS HG3 H 13.218 0.047 13.924 1.00 . A A . 30 LYS HG3 1 1 5 2263 1 1 30 LYS HZ1 H 15.064 -1.012 16.563 1.00 . A A . 30 LYS HZ1 1 1 5 2264 1 1 30 LYS HZ2 H 16.700 -1.364 16.806 1.00 . A A . 30 LYS HZ2 1 1 5 2265 1 1 30 LYS HZ3 H 15.584 -2.621 16.615 1.00 . A A . 30 LYS HZ3 1 1 5 2266 1 1 30 LYS N N 15.111 3.146 12.254 1.00 . A A . 30 LYS N 1 1 5 2267 1 1 30 LYS NZ N 15.836 -1.660 16.308 1.00 . A A . 30 LYS NZ 1 1 5 2268 1 1 30 LYS O O 14.719 3.196 15.285 1.00 . A A . 30 LYS O 1 1 5 2269 1 1 31 GLY C C 13.003 5.298 16.006 1.00 . A A . 31 GLY C 1 1 5 2270 1 1 31 GLY CA C 12.148 4.099 15.646 1.00 . A A . 31 GLY CA 1 1 5 2271 1 1 31 GLY H H 12.024 3.225 13.721 1.00 . A A . 31 GLY H 1 1 5 2272 1 1 31 GLY HA2 H 11.137 4.432 15.463 1.00 . A A . 31 GLY HA2 1 1 5 2273 1 1 31 GLY HA3 H 12.144 3.412 16.479 1.00 . A A . 31 GLY HA3 1 1 5 2274 1 1 31 GLY N N 12.633 3.404 14.468 1.00 . A A . 31 GLY N 1 1 5 2275 1 1 31 GLY O O 12.802 5.921 17.048 1.00 . A A . 31 GLY O 1 1 6 2276 1 1 1 GLY C C 3.433 1.681 -0.823 1.00 . A A . 1 GLY C 1 1 6 2277 1 1 1 GLY CA C 2.012 1.317 -0.441 1.00 . A A . 1 GLY CA 1 1 6 2278 1 1 1 GLY H1 H 1.678 0.707 -2.441 1.00 . A A . 1 GLY H1 1 1 6 2279 1 1 1 GLY HA2 H 1.513 2.199 -0.070 1.00 . A A . 1 GLY HA2 1 1 6 2280 1 1 1 GLY HA3 H 2.042 0.575 0.344 1.00 . A A . 1 GLY HA3 1 1 6 2281 1 1 1 GLY N N 1.256 0.784 -1.559 1.00 . A A . 1 GLY N 1 1 6 2282 1 1 1 GLY O O 3.670 2.717 -1.445 1.00 . A A . 1 GLY O 1 1 6 2283 1 1 2 TYR C C 6.249 2.404 -0.175 1.00 . A A . 2 TYR C 1 1 6 2284 1 1 2 TYR CA C 5.788 1.070 -0.752 1.00 . A A . 2 TYR CA 1 1 6 2285 1 1 2 TYR CB C 6.015 1.049 -2.264 1.00 . A A . 2 TYR CB 1 1 6 2286 1 1 2 TYR CD1 C 7.683 2.638 -3.299 1.00 . A A . 2 TYR CD1 1 1 6 2287 1 1 2 TYR CD2 C 8.490 0.573 -2.425 1.00 . A A . 2 TYR CD2 1 1 6 2288 1 1 2 TYR CE1 C 8.966 2.988 -3.673 1.00 . A A . 2 TYR CE1 1 1 6 2289 1 1 2 TYR CE2 C 9.777 0.915 -2.793 1.00 . A A . 2 TYR CE2 1 1 6 2290 1 1 2 TYR CG C 7.422 1.427 -2.670 1.00 . A A . 2 TYR CG 1 1 6 2291 1 1 2 TYR CZ C 10.010 2.123 -3.417 1.00 . A A . 2 TYR CZ 1 1 6 2292 1 1 2 TYR H H 4.131 0.021 0.045 1.00 . A A . 2 TYR H 1 1 6 2293 1 1 2 TYR HA H 6.365 0.276 -0.300 1.00 . A A . 2 TYR HA 1 1 6 2294 1 1 2 TYR HB2 H 5.819 0.056 -2.638 1.00 . A A . 2 TYR HB2 1 1 6 2295 1 1 2 TYR HB3 H 5.336 1.746 -2.733 1.00 . A A . 2 TYR HB3 1 1 6 2296 1 1 2 TYR HD1 H 6.863 3.314 -3.499 1.00 . A A . 2 TYR HD1 1 1 6 2297 1 1 2 TYR HD2 H 8.304 -0.372 -1.936 1.00 . A A . 2 TYR HD2 1 1 6 2298 1 1 2 TYR HE1 H 9.149 3.934 -4.161 1.00 . A A . 2 TYR HE1 1 1 6 2299 1 1 2 TYR HE2 H 10.594 0.238 -2.593 1.00 . A A . 2 TYR HE2 1 1 6 2300 1 1 2 TYR HH H 11.259 3.015 -4.573 1.00 . A A . 2 TYR HH 1 1 6 2301 1 1 2 TYR N N 4.382 0.830 -0.448 1.00 . A A . 2 TYR N 1 1 6 2302 1 1 2 TYR O O 6.235 3.428 -0.858 1.00 . A A . 2 TYR O 1 1 6 2303 1 1 2 TYR OH O 11.290 2.466 -3.786 1.00 . A A . 2 TYR OH 1 1 6 2304 1 1 3 CYS C C 8.650 3.641 1.793 1.00 . A A . 3 CYS C 1 1 6 2305 1 1 3 CYS CA C 7.126 3.591 1.761 1.00 . A A . 3 CYS CA 1 1 6 2306 1 1 3 CYS CB C 6.572 3.653 3.186 1.00 . A A . 3 CYS CB 1 1 6 2307 1 1 3 CYS H H 6.647 1.537 1.583 1.00 . A A . 3 CYS H 1 1 6 2308 1 1 3 CYS HA H 6.762 4.442 1.206 1.00 . A A . 3 CYS HA 1 1 6 2309 1 1 3 CYS HB2 H 7.300 3.232 3.865 1.00 . A A . 3 CYS HB2 1 1 6 2310 1 1 3 CYS HB3 H 6.396 4.685 3.451 1.00 . A A . 3 CYS HB3 1 1 6 2311 1 1 3 CYS N N 6.659 2.385 1.089 1.00 . A A . 3 CYS N 1 1 6 2312 1 1 3 CYS O O 9.322 2.831 1.155 1.00 . A A . 3 CYS O 1 1 6 2313 1 1 3 CYS SG S 5.010 2.745 3.418 1.00 . A A . 3 CYS SG 1 1 6 2314 1 1 4 ALA C C 11.185 3.911 3.806 1.00 . A A . 4 ALA C 1 1 6 2315 1 1 4 ALA CA C 10.635 4.752 2.659 1.00 . A A . 4 ALA CA 1 1 6 2316 1 1 4 ALA CB C 10.995 6.217 2.855 1.00 . A A . 4 ALA CB 1 1 6 2317 1 1 4 ALA H H 8.603 5.214 3.027 1.00 . A A . 4 ALA H 1 1 6 2318 1 1 4 ALA HA H 11.083 4.418 1.734 1.00 . A A . 4 ALA HA 1 1 6 2319 1 1 4 ALA HB1 H 10.932 6.733 1.908 1.00 . A A . 4 ALA HB1 1 1 6 2320 1 1 4 ALA HB2 H 10.307 6.666 3.556 1.00 . A A . 4 ALA HB2 1 1 6 2321 1 1 4 ALA HB3 H 12.001 6.292 3.240 1.00 . A A . 4 ALA HB3 1 1 6 2322 1 1 4 ALA N N 9.190 4.598 2.541 1.00 . A A . 4 ALA N 1 1 6 2323 1 1 4 ALA O O 10.969 4.223 4.978 1.00 . A A . 4 ALA O 1 1 6 2324 1 1 5 THR C C 13.816 2.490 4.961 1.00 . A A . 5 THR C 1 1 6 2325 1 1 5 THR CA C 12.478 1.957 4.463 1.00 . A A . 5 THR CA 1 1 6 2326 1 1 5 THR CB C 12.680 0.535 3.905 1.00 . A A . 5 THR CB 1 1 6 2327 1 1 5 THR CG2 C 11.386 -0.262 3.972 1.00 . A A . 5 THR CG2 1 1 6 2328 1 1 5 THR H H 12.036 2.648 2.512 1.00 . A A . 5 THR H 1 1 6 2329 1 1 5 THR HA H 11.792 1.900 5.295 1.00 . A A . 5 THR HA 1 1 6 2330 1 1 5 THR HB H 13.427 0.033 4.503 1.00 . A A . 5 THR HB 1 1 6 2331 1 1 5 THR HG1 H 13.219 -0.287 2.195 1.00 . A A . 5 THR HG1 1 1 6 2332 1 1 5 THR HG21 H 11.136 -0.627 2.987 1.00 . A A . 5 THR HG21 1 1 6 2333 1 1 5 THR HG22 H 10.591 0.373 4.334 1.00 . A A . 5 THR HG22 1 1 6 2334 1 1 5 THR HG23 H 11.513 -1.097 4.644 1.00 . A A . 5 THR HG23 1 1 6 2335 1 1 5 THR N N 11.898 2.843 3.462 1.00 . A A . 5 THR N 1 1 6 2336 1 1 5 THR O O 14.340 3.471 4.434 1.00 . A A . 5 THR O 1 1 6 2337 1 1 5 THR OG1 O 13.135 0.602 2.549 1.00 . A A . 5 THR OG1 1 1 6 2338 1 1 6 LYS C C 16.677 2.486 5.450 1.00 . A A . 6 LYS C 1 1 6 2339 1 1 6 LYS CA C 15.646 2.244 6.548 1.00 . A A . 6 LYS CA 1 1 6 2340 1 1 6 LYS CB C 16.159 1.177 7.517 1.00 . A A . 6 LYS CB 1 1 6 2341 1 1 6 LYS CD C 17.725 0.741 9.432 1.00 . A A . 6 LYS CD 1 1 6 2342 1 1 6 LYS CE C 18.552 1.539 10.429 1.00 . A A . 6 LYS CE 1 1 6 2343 1 1 6 LYS CG C 17.497 1.520 8.147 1.00 . A A . 6 LYS CG 1 1 6 2344 1 1 6 LYS H H 13.900 1.062 6.357 1.00 . A A . 6 LYS H 1 1 6 2345 1 1 6 LYS HA H 15.491 3.165 7.089 1.00 . A A . 6 LYS HA 1 1 6 2346 1 1 6 LYS HB2 H 15.434 1.048 8.308 1.00 . A A . 6 LYS HB2 1 1 6 2347 1 1 6 LYS HB3 H 16.265 0.243 6.983 1.00 . A A . 6 LYS HB3 1 1 6 2348 1 1 6 LYS HD2 H 16.769 0.511 9.878 1.00 . A A . 6 LYS HD2 1 1 6 2349 1 1 6 LYS HD3 H 18.246 -0.177 9.198 1.00 . A A . 6 LYS HD3 1 1 6 2350 1 1 6 LYS HE2 H 18.218 2.565 10.413 1.00 . A A . 6 LYS HE2 1 1 6 2351 1 1 6 LYS HE3 H 18.400 1.126 11.415 1.00 . A A . 6 LYS HE3 1 1 6 2352 1 1 6 LYS HG2 H 18.286 1.281 7.449 1.00 . A A . 6 LYS HG2 1 1 6 2353 1 1 6 LYS HG3 H 17.519 2.578 8.370 1.00 . A A . 6 LYS HG3 1 1 6 2354 1 1 6 LYS HZ1 H 20.221 0.644 9.548 1.00 . A A . 6 LYS HZ1 1 1 6 2355 1 1 6 LYS HZ2 H 20.566 1.477 10.979 1.00 . A A . 6 LYS HZ2 1 1 6 2356 1 1 6 LYS HZ3 H 20.272 2.336 9.551 1.00 . A A . 6 LYS HZ3 1 1 6 2357 1 1 6 LYS N N 14.366 1.837 5.979 1.00 . A A . 6 LYS N 1 1 6 2358 1 1 6 LYS NZ N 20.005 1.496 10.104 1.00 . A A . 6 LYS NZ 1 1 6 2359 1 1 6 LYS O O 16.827 1.675 4.537 1.00 . A A . 6 LYS O 1 1 6 2360 1 1 7 GLY C C 17.843 4.781 3.426 1.00 . A A . 7 GLY C 1 1 6 2361 1 1 7 GLY CA C 18.394 3.934 4.556 1.00 . A A . 7 GLY CA 1 1 6 2362 1 1 7 GLY H H 17.222 4.216 6.297 1.00 . A A . 7 GLY H 1 1 6 2363 1 1 7 GLY HA2 H 19.196 4.473 5.038 1.00 . A A . 7 GLY HA2 1 1 6 2364 1 1 7 GLY HA3 H 18.788 3.017 4.143 1.00 . A A . 7 GLY HA3 1 1 6 2365 1 1 7 GLY N N 17.386 3.607 5.547 1.00 . A A . 7 GLY N 1 1 6 2366 1 1 7 GLY O O 18.598 5.446 2.715 1.00 . A A . 7 GLY O 1 1 6 2367 1 1 8 ILE C C 15.604 6.959 2.661 1.00 . A A . 8 ILE C 1 1 6 2368 1 1 8 ILE CA C 15.875 5.529 2.207 1.00 . A A . 8 ILE CA 1 1 6 2369 1 1 8 ILE CB C 14.548 4.880 1.772 1.00 . A A . 8 ILE CB 1 1 6 2370 1 1 8 ILE CD1 C 15.680 3.119 0.324 1.00 . A A . 8 ILE CD1 1 1 6 2371 1 1 8 ILE CG1 C 14.752 3.391 1.487 1.00 . A A . 8 ILE CG1 1 1 6 2372 1 1 8 ILE CG2 C 13.989 5.587 0.546 1.00 . A A . 8 ILE CG2 1 1 6 2373 1 1 8 ILE H H 15.978 4.209 3.858 1.00 . A A . 8 ILE H 1 1 6 2374 1 1 8 ILE HA H 16.538 5.553 1.353 1.00 . A A . 8 ILE HA 1 1 6 2375 1 1 8 ILE HB H 13.838 4.992 2.577 1.00 . A A . 8 ILE HB 1 1 6 2376 1 1 8 ILE HD11 H 15.145 2.583 -0.446 1.00 . A A . 8 ILE HD11 1 1 6 2377 1 1 8 ILE HD12 H 16.043 4.055 -0.073 1.00 . A A . 8 ILE HD12 1 1 6 2378 1 1 8 ILE HD13 H 16.515 2.523 0.662 1.00 . A A . 8 ILE HD13 1 1 6 2379 1 1 8 ILE HG12 H 15.170 2.917 2.362 1.00 . A A . 8 ILE HG12 1 1 6 2380 1 1 8 ILE HG13 H 13.796 2.941 1.262 1.00 . A A . 8 ILE HG13 1 1 6 2381 1 1 8 ILE HG21 H 13.312 4.926 0.026 1.00 . A A . 8 ILE HG21 1 1 6 2382 1 1 8 ILE HG22 H 13.458 6.475 0.854 1.00 . A A . 8 ILE HG22 1 1 6 2383 1 1 8 ILE HG23 H 14.800 5.863 -0.112 1.00 . A A . 8 ILE HG23 1 1 6 2384 1 1 8 ILE N N 16.526 4.757 3.259 1.00 . A A . 8 ILE N 1 1 6 2385 1 1 8 ILE O O 14.979 7.185 3.697 1.00 . A A . 8 ILE O 1 1 6 2386 1 1 9 LYS C C 14.414 9.633 2.465 1.00 . A A . 9 LYS C 1 1 6 2387 1 1 9 LYS CA C 15.885 9.332 2.196 1.00 . A A . 9 LYS CA 1 1 6 2388 1 1 9 LYS CB C 16.395 10.209 1.051 1.00 . A A . 9 LYS CB 1 1 6 2389 1 1 9 LYS CD C 18.650 11.228 1.481 1.00 . A A . 9 LYS CD 1 1 6 2390 1 1 9 LYS CE C 19.685 11.831 0.544 1.00 . A A . 9 LYS CE 1 1 6 2391 1 1 9 LYS CG C 17.891 10.093 0.815 1.00 . A A . 9 LYS CG 1 1 6 2392 1 1 9 LYS H H 16.568 7.679 1.064 1.00 . A A . 9 LYS H 1 1 6 2393 1 1 9 LYS HA H 16.453 9.552 3.087 1.00 . A A . 9 LYS HA 1 1 6 2394 1 1 9 LYS HB2 H 15.885 9.926 0.142 1.00 . A A . 9 LYS HB2 1 1 6 2395 1 1 9 LYS HB3 H 16.166 11.241 1.275 1.00 . A A . 9 LYS HB3 1 1 6 2396 1 1 9 LYS HD2 H 17.950 11.998 1.769 1.00 . A A . 9 LYS HD2 1 1 6 2397 1 1 9 LYS HD3 H 19.152 10.847 2.359 1.00 . A A . 9 LYS HD3 1 1 6 2398 1 1 9 LYS HE2 H 20.600 11.265 0.626 1.00 . A A . 9 LYS HE2 1 1 6 2399 1 1 9 LYS HE3 H 19.314 11.770 -0.469 1.00 . A A . 9 LYS HE3 1 1 6 2400 1 1 9 LYS HG2 H 18.238 9.154 1.221 1.00 . A A . 9 LYS HG2 1 1 6 2401 1 1 9 LYS HG3 H 18.081 10.119 -0.249 1.00 . A A . 9 LYS HG3 1 1 6 2402 1 1 9 LYS HZ1 H 20.695 13.316 1.611 1.00 . A A . 9 LYS HZ1 1 1 6 2403 1 1 9 LYS HZ2 H 19.101 13.721 1.215 1.00 . A A . 9 LYS HZ2 1 1 6 2404 1 1 9 LYS HZ3 H 20.304 13.758 0.025 1.00 . A A . 9 LYS HZ3 1 1 6 2405 1 1 9 LYS N N 16.078 7.922 1.878 1.00 . A A . 9 LYS N 1 1 6 2406 1 1 9 LYS NZ N 19.966 13.257 0.871 1.00 . A A . 9 LYS NZ 1 1 6 2407 1 1 9 LYS O O 13.527 9.072 1.820 1.00 . A A . 9 LYS O 1 1 6 2408 1 1 10 CYS C C 12.608 12.410 3.673 1.00 . A A . 10 CYS C 1 1 6 2409 1 1 10 CYS CA C 12.798 10.899 3.772 1.00 . A A . 10 CYS CA 1 1 6 2410 1 1 10 CYS CB C 12.466 10.424 5.188 1.00 . A A . 10 CYS CB 1 1 6 2411 1 1 10 CYS H H 14.910 10.936 3.899 1.00 . A A . 10 CYS H 1 1 6 2412 1 1 10 CYS HA H 12.129 10.418 3.075 1.00 . A A . 10 CYS HA 1 1 6 2413 1 1 10 CYS HB2 H 11.395 10.460 5.330 1.00 . A A . 10 CYS HB2 1 1 6 2414 1 1 10 CYS HB3 H 12.805 9.406 5.307 1.00 . A A . 10 CYS HB3 1 1 6 2415 1 1 10 CYS N N 14.161 10.522 3.419 1.00 . A A . 10 CYS N 1 1 6 2416 1 1 10 CYS O O 11.737 12.981 4.329 1.00 . A A . 10 CYS O 1 1 6 2417 1 1 10 CYS SG S 13.232 11.422 6.506 1.00 . A A . 10 CYS SG 1 1 6 2418 1 1 11 ASN C C 11.946 14.917 2.250 1.00 . A A . 11 ASN C 1 1 6 2419 1 1 11 ASN CA C 13.353 14.495 2.663 1.00 . A A . 11 ASN CA 1 1 6 2420 1 1 11 ASN CB C 14.364 14.950 1.609 1.00 . A A . 11 ASN CB 1 1 6 2421 1 1 11 ASN CG C 15.785 14.555 1.962 1.00 . A A . 11 ASN CG 1 1 6 2422 1 1 11 ASN H H 14.104 12.541 2.353 1.00 . A A . 11 ASN H 1 1 6 2423 1 1 11 ASN HA H 13.594 14.964 3.606 1.00 . A A . 11 ASN HA 1 1 6 2424 1 1 11 ASN HB2 H 14.112 14.500 0.659 1.00 . A A . 11 ASN HB2 1 1 6 2425 1 1 11 ASN HB3 H 14.320 16.024 1.515 1.00 . A A . 11 ASN HB3 1 1 6 2426 1 1 11 ASN HD21 H 16.349 16.462 1.929 1.00 . A A . 11 ASN HD21 1 1 6 2427 1 1 11 ASN HD22 H 17.588 15.319 2.304 1.00 . A A . 11 ASN HD22 1 1 6 2428 1 1 11 ASN N N 13.430 13.051 2.848 1.00 . A A . 11 ASN N 1 1 6 2429 1 1 11 ASN ND2 N 16.662 15.545 2.077 1.00 . A A . 11 ASN ND2 1 1 6 2430 1 1 11 ASN O O 11.533 16.053 2.485 1.00 . A A . 11 ASN O 1 1 6 2431 1 1 11 ASN OD1 O 16.089 13.374 2.130 1.00 . A A . 11 ASN OD1 1 1 6 2432 1 1 12 ASP C C 8.951 13.062 1.425 1.00 . A A . 12 ASP C 1 1 6 2433 1 1 12 ASP CA C 9.854 14.269 1.189 1.00 . A A . 12 ASP CA 1 1 6 2434 1 1 12 ASP CB C 9.845 14.645 -0.294 1.00 . A A . 12 ASP CB 1 1 6 2435 1 1 12 ASP CG C 8.650 15.500 -0.667 1.00 . A A . 12 ASP CG 1 1 6 2436 1 1 12 ASP H H 11.600 13.107 1.475 1.00 . A A . 12 ASP H 1 1 6 2437 1 1 12 ASP HA H 9.478 15.102 1.764 1.00 . A A . 12 ASP HA 1 1 6 2438 1 1 12 ASP HB2 H 10.745 15.198 -0.524 1.00 . A A . 12 ASP HB2 1 1 6 2439 1 1 12 ASP HB3 H 9.820 13.743 -0.887 1.00 . A A . 12 ASP HB3 1 1 6 2440 1 1 12 ASP N N 11.215 13.994 1.634 1.00 . A A . 12 ASP N 1 1 6 2441 1 1 12 ASP O O 7.825 13.202 1.905 1.00 . A A . 12 ASP O 1 1 6 2442 1 1 12 ASP OD1 O 8.809 16.735 -0.760 1.00 . A A . 12 ASP OD1 1 1 6 2443 1 1 12 ASP OD2 O 7.555 14.933 -0.868 1.00 . A A . 12 ASP OD2 1 1 6 2444 1 1 13 ILE C C 8.684 10.210 2.721 1.00 . A A . 13 ILE C 1 1 6 2445 1 1 13 ILE CA C 8.690 10.649 1.261 1.00 . A A . 13 ILE CA 1 1 6 2446 1 1 13 ILE CB C 9.257 9.508 0.395 1.00 . A A . 13 ILE CB 1 1 6 2447 1 1 13 ILE CD1 C 8.023 7.756 -0.979 1.00 . A A . 13 ILE CD1 1 1 6 2448 1 1 13 ILE CG1 C 8.302 8.313 0.400 1.00 . A A . 13 ILE CG1 1 1 6 2449 1 1 13 ILE CG2 C 10.633 9.096 0.897 1.00 . A A . 13 ILE CG2 1 1 6 2450 1 1 13 ILE H H 10.355 11.833 0.708 1.00 . A A . 13 ILE H 1 1 6 2451 1 1 13 ILE HA H 7.673 10.840 0.949 1.00 . A A . 13 ILE HA 1 1 6 2452 1 1 13 ILE HB H 9.362 9.871 -0.616 1.00 . A A . 13 ILE HB 1 1 6 2453 1 1 13 ILE HD11 H 7.312 6.946 -0.904 1.00 . A A . 13 ILE HD11 1 1 6 2454 1 1 13 ILE HD12 H 7.619 8.535 -1.607 1.00 . A A . 13 ILE HD12 1 1 6 2455 1 1 13 ILE HD13 H 8.943 7.387 -1.410 1.00 . A A . 13 ILE HD13 1 1 6 2456 1 1 13 ILE HG12 H 8.728 7.522 0.996 1.00 . A A . 13 ILE HG12 1 1 6 2457 1 1 13 ILE HG13 H 7.359 8.616 0.833 1.00 . A A . 13 ILE HG13 1 1 6 2458 1 1 13 ILE HG21 H 10.546 8.691 1.894 1.00 . A A . 13 ILE HG21 1 1 6 2459 1 1 13 ILE HG22 H 11.045 8.345 0.239 1.00 . A A . 13 ILE HG22 1 1 6 2460 1 1 13 ILE HG23 H 11.283 9.957 0.913 1.00 . A A . 13 ILE HG23 1 1 6 2461 1 1 13 ILE N N 9.452 11.879 1.085 1.00 . A A . 13 ILE N 1 1 6 2462 1 1 13 ILE O O 9.676 10.370 3.433 1.00 . A A . 13 ILE O 1 1 6 2463 1 1 14 HIS C C 7.733 7.696 4.638 1.00 . A A . 14 HIS C 1 1 6 2464 1 1 14 HIS CA C 7.426 9.187 4.537 1.00 . A A . 14 HIS CA 1 1 6 2465 1 1 14 HIS CB C 6.015 9.466 5.056 1.00 . A A . 14 HIS CB 1 1 6 2466 1 1 14 HIS CD2 C 6.692 10.509 7.333 1.00 . A A . 14 HIS CD2 1 1 6 2467 1 1 14 HIS CE1 C 5.245 9.464 8.606 1.00 . A A . 14 HIS CE1 1 1 6 2468 1 1 14 HIS CG C 5.957 9.700 6.534 1.00 . A A . 14 HIS CG 1 1 6 2469 1 1 14 HIS H H 6.804 9.552 2.546 1.00 . A A . 14 HIS H 1 1 6 2470 1 1 14 HIS HA H 8.137 9.729 5.141 1.00 . A A . 14 HIS HA 1 1 6 2471 1 1 14 HIS HB2 H 5.626 10.346 4.566 1.00 . A A . 14 HIS HB2 1 1 6 2472 1 1 14 HIS HB3 H 5.381 8.622 4.828 1.00 . A A . 14 HIS HB3 1 1 6 2473 1 1 14 HIS HD1 H 4.387 8.405 7.081 1.00 . A A . 14 HIS HD1 1 1 6 2474 1 1 14 HIS HD2 H 7.493 11.163 7.019 1.00 . A A . 14 HIS HD2 1 1 6 2475 1 1 14 HIS HE1 H 4.687 9.133 9.469 1.00 . A A . 14 HIS HE1 1 1 6 2476 1 1 14 HIS N N 7.561 9.653 3.161 1.00 . A A . 14 HIS N 1 1 6 2477 1 1 14 HIS ND1 N 5.060 9.058 7.363 1.00 . A A . 14 HIS ND1 1 1 6 2478 1 1 14 HIS NE2 N 6.230 10.345 8.615 1.00 . A A . 14 HIS NE2 1 1 6 2479 1 1 14 HIS O O 7.643 6.964 3.651 1.00 . A A . 14 HIS O 1 1 6 2480 1 1 15 CYS C C 7.173 5.066 6.482 1.00 . A A . 15 CYS C 1 1 6 2481 1 1 15 CYS CA C 8.416 5.848 6.067 1.00 . A A . 15 CYS CA 1 1 6 2482 1 1 15 CYS CB C 9.495 5.720 7.145 1.00 . A A . 15 CYS CB 1 1 6 2483 1 1 15 CYS H H 8.148 7.883 6.585 1.00 . A A . 15 CYS H 1 1 6 2484 1 1 15 CYS HA H 8.793 5.437 5.143 1.00 . A A . 15 CYS HA 1 1 6 2485 1 1 15 CYS HB2 H 9.021 5.690 8.115 1.00 . A A . 15 CYS HB2 1 1 6 2486 1 1 15 CYS HB3 H 10.043 4.803 6.988 1.00 . A A . 15 CYS HB3 1 1 6 2487 1 1 15 CYS N N 8.095 7.251 5.837 1.00 . A A . 15 CYS N 1 1 6 2488 1 1 15 CYS O O 6.224 5.631 7.025 1.00 . A A . 15 CYS O 1 1 6 2489 1 1 15 CYS SG S 10.697 7.089 7.159 1.00 . A A . 15 CYS SG 1 1 6 2490 1 1 16 CYS C C 5.862 2.846 8.078 1.00 . A A . 16 CYS C 1 1 6 2491 1 1 16 CYS CA C 6.061 2.903 6.566 1.00 . A A . 16 CYS CA 1 1 6 2492 1 1 16 CYS CB C 6.284 1.492 6.017 1.00 . A A . 16 CYS CB 1 1 6 2493 1 1 16 CYS H H 7.972 3.370 5.785 1.00 . A A . 16 CYS H 1 1 6 2494 1 1 16 CYS HA H 5.174 3.319 6.114 1.00 . A A . 16 CYS HA 1 1 6 2495 1 1 16 CYS HB2 H 7.346 1.310 5.935 1.00 . A A . 16 CYS HB2 1 1 6 2496 1 1 16 CYS HB3 H 5.852 0.776 6.700 1.00 . A A . 16 CYS HB3 1 1 6 2497 1 1 16 CYS N N 7.186 3.763 6.221 1.00 . A A . 16 CYS N 1 1 6 2498 1 1 16 CYS O O 6.797 3.073 8.846 1.00 . A A . 16 CYS O 1 1 6 2499 1 1 16 CYS SG S 5.547 1.208 4.375 1.00 . A A . 16 CYS SG 1 1 6 2500 1 1 17 SER C C 5.308 1.561 10.648 1.00 . A A . 17 SER C 1 1 6 2501 1 1 17 SER CA C 4.315 2.460 9.917 1.00 . A A . 17 SER CA 1 1 6 2502 1 1 17 SER CB C 2.893 1.930 10.108 1.00 . A A . 17 SER CB 1 1 6 2503 1 1 17 SER H H 3.935 2.373 7.836 1.00 . A A . 17 SER H 1 1 6 2504 1 1 17 SER HA H 4.378 3.456 10.329 1.00 . A A . 17 SER HA 1 1 6 2505 1 1 17 SER HB2 H 2.848 0.902 9.780 1.00 . A A . 17 SER HB2 1 1 6 2506 1 1 17 SER HB3 H 2.629 1.986 11.154 1.00 . A A . 17 SER HB3 1 1 6 2507 1 1 17 SER HG H 1.523 3.319 9.937 1.00 . A A . 17 SER HG 1 1 6 2508 1 1 17 SER N N 4.638 2.543 8.497 1.00 . A A . 17 SER N 1 1 6 2509 1 1 17 SER O O 5.283 0.340 10.501 1.00 . A A . 17 SER O 1 1 6 2510 1 1 17 SER OG O 1.961 2.690 9.359 1.00 . A A . 17 SER OG 1 1 6 2511 1 1 18 GLY C C 8.562 2.015 12.071 1.00 . A A . 18 GLY C 1 1 6 2512 1 1 18 GLY CA C 7.172 1.418 12.181 1.00 . A A . 18 GLY CA 1 1 6 2513 1 1 18 GLY H H 6.156 3.153 11.517 1.00 . A A . 18 GLY H 1 1 6 2514 1 1 18 GLY HA2 H 6.884 1.393 13.221 1.00 . A A . 18 GLY HA2 1 1 6 2515 1 1 18 GLY HA3 H 7.196 0.408 11.800 1.00 . A A . 18 GLY HA3 1 1 6 2516 1 1 18 GLY N N 6.183 2.177 11.438 1.00 . A A . 18 GLY N 1 1 6 2517 1 1 18 GLY O O 9.471 1.628 12.807 1.00 . A A . 18 GLY O 1 1 6 2518 1 1 19 LEU C C 9.910 5.113 11.163 1.00 . A A . 19 LEU C 1 1 6 2519 1 1 19 LEU CA C 10.018 3.607 10.945 1.00 . A A . 19 LEU CA 1 1 6 2520 1 1 19 LEU CB C 10.537 3.320 9.535 1.00 . A A . 19 LEU CB 1 1 6 2521 1 1 19 LEU CD1 C 11.142 1.678 7.740 1.00 . A A . 19 LEU CD1 1 1 6 2522 1 1 19 LEU CD2 C 12.052 1.391 10.051 1.00 . A A . 19 LEU CD2 1 1 6 2523 1 1 19 LEU CG C 10.864 1.859 9.224 1.00 . A A . 19 LEU CG 1 1 6 2524 1 1 19 LEU H H 7.967 3.222 10.594 1.00 . A A . 19 LEU H 1 1 6 2525 1 1 19 LEU HA H 10.712 3.200 11.665 1.00 . A A . 19 LEU HA 1 1 6 2526 1 1 19 LEU HB2 H 9.785 3.647 8.833 1.00 . A A . 19 LEU HB2 1 1 6 2527 1 1 19 LEU HB3 H 11.438 3.900 9.391 1.00 . A A . 19 LEU HB3 1 1 6 2528 1 1 19 LEU HD11 H 11.985 2.288 7.454 1.00 . A A . 19 LEU HD11 1 1 6 2529 1 1 19 LEU HD12 H 10.273 1.977 7.172 1.00 . A A . 19 LEU HD12 1 1 6 2530 1 1 19 LEU HD13 H 11.363 0.640 7.539 1.00 . A A . 19 LEU HD13 1 1 6 2531 1 1 19 LEU HD21 H 11.966 1.779 11.056 1.00 . A A . 19 LEU HD21 1 1 6 2532 1 1 19 LEU HD22 H 12.967 1.752 9.604 1.00 . A A . 19 LEU HD22 1 1 6 2533 1 1 19 LEU HD23 H 12.067 0.312 10.082 1.00 . A A . 19 LEU HD23 1 1 6 2534 1 1 19 LEU HG H 10.013 1.244 9.481 1.00 . A A . 19 LEU HG 1 1 6 2535 1 1 19 LEU N N 8.728 2.957 11.150 1.00 . A A . 19 LEU N 1 1 6 2536 1 1 19 LEU O O 8.867 5.715 10.906 1.00 . A A . 19 LEU O 1 1 6 2537 1 1 20 LYS C C 11.796 7.880 10.789 1.00 . A A . 20 LYS C 1 1 6 2538 1 1 20 LYS CA C 11.024 7.152 11.886 1.00 . A A . 20 LYS CA 1 1 6 2539 1 1 20 LYS CB C 11.660 7.441 13.248 1.00 . A A . 20 LYS CB 1 1 6 2540 1 1 20 LYS CD C 13.871 7.847 14.368 1.00 . A A . 20 LYS CD 1 1 6 2541 1 1 20 LYS CE C 13.277 7.688 15.759 1.00 . A A . 20 LYS CE 1 1 6 2542 1 1 20 LYS CG C 13.116 7.019 13.342 1.00 . A A . 20 LYS CG 1 1 6 2543 1 1 20 LYS H H 11.796 5.182 11.821 1.00 . A A . 20 LYS H 1 1 6 2544 1 1 20 LYS HA H 10.006 7.509 11.890 1.00 . A A . 20 LYS HA 1 1 6 2545 1 1 20 LYS HB2 H 11.601 8.502 13.442 1.00 . A A . 20 LYS HB2 1 1 6 2546 1 1 20 LYS HB3 H 11.104 6.913 14.010 1.00 . A A . 20 LYS HB3 1 1 6 2547 1 1 20 LYS HD2 H 14.902 7.524 14.390 1.00 . A A . 20 LYS HD2 1 1 6 2548 1 1 20 LYS HD3 H 13.824 8.888 14.082 1.00 . A A . 20 LYS HD3 1 1 6 2549 1 1 20 LYS HE2 H 12.735 8.587 16.009 1.00 . A A . 20 LYS HE2 1 1 6 2550 1 1 20 LYS HE3 H 12.597 6.849 15.752 1.00 . A A . 20 LYS HE3 1 1 6 2551 1 1 20 LYS HG2 H 13.162 5.979 13.629 1.00 . A A . 20 LYS HG2 1 1 6 2552 1 1 20 LYS HG3 H 13.581 7.148 12.375 1.00 . A A . 20 LYS HG3 1 1 6 2553 1 1 20 LYS HZ1 H 15.220 7.899 16.495 1.00 . A A . 20 LYS HZ1 1 1 6 2554 1 1 20 LYS HZ2 H 14.488 6.432 16.907 1.00 . A A . 20 LYS HZ2 1 1 6 2555 1 1 20 LYS HZ3 H 14.032 7.855 17.699 1.00 . A A . 20 LYS HZ3 1 1 6 2556 1 1 20 LYS N N 10.995 5.716 11.636 1.00 . A A . 20 LYS N 1 1 6 2557 1 1 20 LYS NZ N 14.328 7.452 16.787 1.00 . A A . 20 LYS NZ 1 1 6 2558 1 1 20 LYS O O 12.758 7.347 10.236 1.00 . A A . 20 LYS O 1 1 6 2559 1 1 21 CYS C C 13.058 10.834 10.065 1.00 . A A . 21 CYS C 1 1 6 2560 1 1 21 CYS CA C 12.019 9.901 9.451 1.00 . A A . 21 CYS CA 1 1 6 2561 1 1 21 CYS CB C 10.980 10.714 8.677 1.00 . A A . 21 CYS CB 1 1 6 2562 1 1 21 CYS H H 10.595 9.470 10.957 1.00 . A A . 21 CYS H 1 1 6 2563 1 1 21 CYS HA H 12.516 9.227 8.771 1.00 . A A . 21 CYS HA 1 1 6 2564 1 1 21 CYS HB2 H 10.415 10.049 8.041 1.00 . A A . 21 CYS HB2 1 1 6 2565 1 1 21 CYS HB3 H 10.310 11.190 9.378 1.00 . A A . 21 CYS HB3 1 1 6 2566 1 1 21 CYS N N 11.368 9.099 10.481 1.00 . A A . 21 CYS N 1 1 6 2567 1 1 21 CYS O O 12.730 11.925 10.531 1.00 . A A . 21 CYS O 1 1 6 2568 1 1 21 CYS SG S 11.693 12.016 7.620 1.00 . A A . 21 CYS SG 1 1 6 2569 1 1 22 ASP C C 15.546 12.515 9.864 1.00 . A A . 22 ASP C 1 1 6 2570 1 1 22 ASP CA C 15.401 11.195 10.615 1.00 . A A . 22 ASP CA 1 1 6 2571 1 1 22 ASP CB C 16.715 10.413 10.556 1.00 . A A . 22 ASP CB 1 1 6 2572 1 1 22 ASP CG C 17.667 10.796 11.672 1.00 . A A . 22 ASP CG 1 1 6 2573 1 1 22 ASP H H 14.512 9.519 9.674 1.00 . A A . 22 ASP H 1 1 6 2574 1 1 22 ASP HA H 15.165 11.406 11.647 1.00 . A A . 22 ASP HA 1 1 6 2575 1 1 22 ASP HB2 H 16.502 9.357 10.636 1.00 . A A . 22 ASP HB2 1 1 6 2576 1 1 22 ASP HB3 H 17.200 10.608 9.610 1.00 . A A . 22 ASP HB3 1 1 6 2577 1 1 22 ASP N N 14.313 10.398 10.060 1.00 . A A . 22 ASP N 1 1 6 2578 1 1 22 ASP O O 16.087 12.556 8.759 1.00 . A A . 22 ASP O 1 1 6 2579 1 1 22 ASP OD1 O 18.536 9.969 12.021 1.00 . A A . 22 ASP OD1 1 1 6 2580 1 1 22 ASP OD2 O 17.544 11.923 12.196 1.00 . A A . 22 ASP OD2 1 1 6 2581 1 1 23 SER C C 16.553 15.455 9.898 1.00 . A A . 23 SER C 1 1 6 2582 1 1 23 SER CA C 15.128 14.913 9.858 1.00 . A A . 23 SER CA 1 1 6 2583 1 1 23 SER CB C 14.182 15.880 10.572 1.00 . A A . 23 SER CB 1 1 6 2584 1 1 23 SER H H 14.637 13.494 11.352 1.00 . A A . 23 SER H 1 1 6 2585 1 1 23 SER HA H 14.821 14.817 8.828 1.00 . A A . 23 SER HA 1 1 6 2586 1 1 23 SER HB2 H 14.463 16.895 10.335 1.00 . A A . 23 SER HB2 1 1 6 2587 1 1 23 SER HB3 H 13.170 15.700 10.240 1.00 . A A . 23 SER HB3 1 1 6 2588 1 1 23 SER HG H 14.885 16.313 12.348 1.00 . A A . 23 SER HG 1 1 6 2589 1 1 23 SER N N 15.057 13.591 10.471 1.00 . A A . 23 SER N 1 1 6 2590 1 1 23 SER O O 16.875 16.440 9.233 1.00 . A A . 23 SER O 1 1 6 2591 1 1 23 SER OG O 14.240 15.707 11.977 1.00 . A A . 23 SER OG 1 1 6 2592 1 1 24 LYS C C 19.646 14.627 9.691 1.00 . A A . 24 LYS C 1 1 6 2593 1 1 24 LYS CA C 18.797 15.218 10.812 1.00 . A A . 24 LYS CA 1 1 6 2594 1 1 24 LYS CB C 19.356 14.788 12.170 1.00 . A A . 24 LYS CB 1 1 6 2595 1 1 24 LYS CD C 19.522 15.670 14.516 1.00 . A A . 24 LYS CD 1 1 6 2596 1 1 24 LYS CE C 19.401 17.120 14.959 1.00 . A A . 24 LYS CE 1 1 6 2597 1 1 24 LYS CG C 18.595 15.365 13.351 1.00 . A A . 24 LYS CG 1 1 6 2598 1 1 24 LYS H H 17.089 14.026 11.189 1.00 . A A . 24 LYS H 1 1 6 2599 1 1 24 LYS HA H 18.831 16.295 10.743 1.00 . A A . 24 LYS HA 1 1 6 2600 1 1 24 LYS HB2 H 19.319 13.710 12.236 1.00 . A A . 24 LYS HB2 1 1 6 2601 1 1 24 LYS HB3 H 20.385 15.109 12.240 1.00 . A A . 24 LYS HB3 1 1 6 2602 1 1 24 LYS HD2 H 19.265 15.029 15.347 1.00 . A A . 24 LYS HD2 1 1 6 2603 1 1 24 LYS HD3 H 20.541 15.479 14.213 1.00 . A A . 24 LYS HD3 1 1 6 2604 1 1 24 LYS HE2 H 18.355 17.374 15.036 1.00 . A A . 24 LYS HE2 1 1 6 2605 1 1 24 LYS HE3 H 19.870 17.227 15.926 1.00 . A A . 24 LYS HE3 1 1 6 2606 1 1 24 LYS HG2 H 18.109 16.279 13.043 1.00 . A A . 24 LYS HG2 1 1 6 2607 1 1 24 LYS HG3 H 17.851 14.650 13.672 1.00 . A A . 24 LYS HG3 1 1 6 2608 1 1 24 LYS HZ1 H 19.370 18.364 13.282 1.00 . A A . 24 LYS HZ1 1 1 6 2609 1 1 24 LYS HZ2 H 20.845 17.571 13.518 1.00 . A A . 24 LYS HZ2 1 1 6 2610 1 1 24 LYS HZ3 H 20.423 18.883 14.500 1.00 . A A . 24 LYS HZ3 1 1 6 2611 1 1 24 LYS N N 17.405 14.804 10.684 1.00 . A A . 24 LYS N 1 1 6 2612 1 1 24 LYS NZ N 20.056 18.050 13.998 1.00 . A A . 24 LYS NZ 1 1 6 2613 1 1 24 LYS O O 20.484 15.313 9.105 1.00 . A A . 24 LYS O 1 1 6 2614 1 1 25 ARG C C 19.334 12.559 7.071 1.00 . A A . 25 ARG C 1 1 6 2615 1 1 25 ARG CA C 20.167 12.667 8.345 1.00 . A A . 25 ARG CA 1 1 6 2616 1 1 25 ARG CB C 20.587 11.272 8.812 1.00 . A A . 25 ARG CB 1 1 6 2617 1 1 25 ARG CD C 22.889 11.530 9.786 1.00 . A A . 25 ARG CD 1 1 6 2618 1 1 25 ARG CG C 21.419 11.280 10.084 1.00 . A A . 25 ARG CG 1 1 6 2619 1 1 25 ARG CZ C 23.490 12.974 11.682 1.00 . A A . 25 ARG CZ 1 1 6 2620 1 1 25 ARG H H 18.742 12.855 9.898 1.00 . A A . 25 ARG H 1 1 6 2621 1 1 25 ARG HA H 21.052 13.248 8.134 1.00 . A A . 25 ARG HA 1 1 6 2622 1 1 25 ARG HB2 H 19.699 10.683 8.993 1.00 . A A . 25 ARG HB2 1 1 6 2623 1 1 25 ARG HB3 H 21.167 10.804 8.031 1.00 . A A . 25 ARG HB3 1 1 6 2624 1 1 25 ARG HD2 H 23.468 10.712 10.189 1.00 . A A . 25 ARG HD2 1 1 6 2625 1 1 25 ARG HD3 H 23.023 11.573 8.716 1.00 . A A . 25 ARG HD3 1 1 6 2626 1 1 25 ARG HE H 23.595 13.509 9.764 1.00 . A A . 25 ARG HE 1 1 6 2627 1 1 25 ARG HG2 H 21.057 12.062 10.735 1.00 . A A . 25 ARG HG2 1 1 6 2628 1 1 25 ARG HG3 H 21.317 10.324 10.575 1.00 . A A . 25 ARG HG3 1 1 6 2629 1 1 25 ARG HH11 H 22.854 11.126 12.190 1.00 . A A . 25 ARG HH11 1 1 6 2630 1 1 25 ARG HH12 H 23.281 12.154 13.518 1.00 . A A . 25 ARG HH12 1 1 6 2631 1 1 25 ARG HH21 H 24.160 14.873 11.503 1.00 . A A . 25 ARG HH21 1 1 6 2632 1 1 25 ARG HH22 H 24.023 14.286 13.125 1.00 . A A . 25 ARG HH22 1 1 6 2633 1 1 25 ARG N N 19.423 13.350 9.396 1.00 . A A . 25 ARG N 1 1 6 2634 1 1 25 ARG NE N 23.362 12.780 10.374 1.00 . A A . 25 ARG NE 1 1 6 2635 1 1 25 ARG NH1 N 23.182 12.005 12.533 1.00 . A A . 25 ARG NH1 1 1 6 2636 1 1 25 ARG NH2 N 23.927 14.140 12.141 1.00 . A A . 25 ARG NH2 1 1 6 2637 1 1 25 ARG O O 19.767 11.969 6.081 1.00 . A A . 25 ARG O 1 1 6 2638 1 1 26 LYS C C 17.047 11.676 5.451 1.00 . A A . 26 LYS C 1 1 6 2639 1 1 26 LYS CA C 17.242 13.104 5.952 1.00 . A A . 26 LYS CA 1 1 6 2640 1 1 26 LYS CB C 17.796 13.980 4.827 1.00 . A A . 26 LYS CB 1 1 6 2641 1 1 26 LYS CD C 19.813 15.411 5.268 1.00 . A A . 26 LYS CD 1 1 6 2642 1 1 26 LYS CE C 20.349 16.320 6.364 1.00 . A A . 26 LYS CE 1 1 6 2643 1 1 26 LYS CG C 18.296 15.334 5.301 1.00 . A A . 26 LYS CG 1 1 6 2644 1 1 26 LYS H H 17.847 13.589 7.922 1.00 . A A . 26 LYS H 1 1 6 2645 1 1 26 LYS HA H 16.286 13.496 6.265 1.00 . A A . 26 LYS HA 1 1 6 2646 1 1 26 LYS HB2 H 18.617 13.462 4.355 1.00 . A A . 26 LYS HB2 1 1 6 2647 1 1 26 LYS HB3 H 17.017 14.143 4.097 1.00 . A A . 26 LYS HB3 1 1 6 2648 1 1 26 LYS HD2 H 20.219 14.420 5.408 1.00 . A A . 26 LYS HD2 1 1 6 2649 1 1 26 LYS HD3 H 20.125 15.797 4.308 1.00 . A A . 26 LYS HD3 1 1 6 2650 1 1 26 LYS HE2 H 19.558 16.512 7.073 1.00 . A A . 26 LYS HE2 1 1 6 2651 1 1 26 LYS HE3 H 21.165 15.818 6.862 1.00 . A A . 26 LYS HE3 1 1 6 2652 1 1 26 LYS HG2 H 17.894 16.102 4.656 1.00 . A A . 26 LYS HG2 1 1 6 2653 1 1 26 LYS HG3 H 17.958 15.498 6.314 1.00 . A A . 26 LYS HG3 1 1 6 2654 1 1 26 LYS HZ1 H 21.336 17.461 4.920 1.00 . A A . 26 LYS HZ1 1 1 6 2655 1 1 26 LYS HZ2 H 21.493 18.063 6.492 1.00 . A A . 26 LYS HZ2 1 1 6 2656 1 1 26 LYS HZ3 H 20.037 18.259 5.653 1.00 . A A . 26 LYS HZ3 1 1 6 2657 1 1 26 LYS N N 18.136 13.133 7.104 1.00 . A A . 26 LYS N 1 1 6 2658 1 1 26 LYS NZ N 20.838 17.617 5.819 1.00 . A A . 26 LYS NZ 1 1 6 2659 1 1 26 LYS O O 17.040 11.427 4.245 1.00 . A A . 26 LYS O 1 1 6 2660 1 1 27 VAL C C 15.862 8.623 7.094 1.00 . A A . 27 VAL C 1 1 6 2661 1 1 27 VAL CA C 16.692 9.340 6.036 1.00 . A A . 27 VAL CA 1 1 6 2662 1 1 27 VAL CB C 18.037 8.609 5.871 1.00 . A A . 27 VAL CB 1 1 6 2663 1 1 27 VAL CG1 C 18.762 9.097 4.626 1.00 . A A . 27 VAL CG1 1 1 6 2664 1 1 27 VAL CG2 C 18.901 8.797 7.109 1.00 . A A . 27 VAL CG2 1 1 6 2665 1 1 27 VAL H H 16.904 11.003 7.328 1.00 . A A . 27 VAL H 1 1 6 2666 1 1 27 VAL HA H 16.167 9.301 5.092 1.00 . A A . 27 VAL HA 1 1 6 2667 1 1 27 VAL HB H 17.838 7.554 5.754 1.00 . A A . 27 VAL HB 1 1 6 2668 1 1 27 VAL HG11 H 19.727 8.617 4.560 1.00 . A A . 27 VAL HG11 1 1 6 2669 1 1 27 VAL HG12 H 18.177 8.854 3.750 1.00 . A A . 27 VAL HG12 1 1 6 2670 1 1 27 VAL HG13 H 18.896 10.167 4.684 1.00 . A A . 27 VAL HG13 1 1 6 2671 1 1 27 VAL HG21 H 18.271 9.030 7.954 1.00 . A A . 27 VAL HG21 1 1 6 2672 1 1 27 VAL HG22 H 19.449 7.888 7.308 1.00 . A A . 27 VAL HG22 1 1 6 2673 1 1 27 VAL HG23 H 19.596 9.607 6.944 1.00 . A A . 27 VAL HG23 1 1 6 2674 1 1 27 VAL N N 16.889 10.743 6.383 1.00 . A A . 27 VAL N 1 1 6 2675 1 1 27 VAL O O 15.698 9.117 8.210 1.00 . A A . 27 VAL O 1 1 6 2676 1 1 28 CYS C C 15.402 5.769 8.524 1.00 . A A . 28 CYS C 1 1 6 2677 1 1 28 CYS CA C 14.526 6.667 7.656 1.00 . A A . 28 CYS CA 1 1 6 2678 1 1 28 CYS CB C 13.519 5.818 6.878 1.00 . A A . 28 CYS CB 1 1 6 2679 1 1 28 CYS H H 15.506 7.112 5.833 1.00 . A A . 28 CYS H 1 1 6 2680 1 1 28 CYS HA H 13.990 7.352 8.294 1.00 . A A . 28 CYS HA 1 1 6 2681 1 1 28 CYS HB2 H 14.050 5.217 6.154 1.00 . A A . 28 CYS HB2 1 1 6 2682 1 1 28 CYS HB3 H 13.000 5.168 7.566 1.00 . A A . 28 CYS HB3 1 1 6 2683 1 1 28 CYS N N 15.340 7.454 6.737 1.00 . A A . 28 CYS N 1 1 6 2684 1 1 28 CYS O O 16.423 5.251 8.071 1.00 . A A . 28 CYS O 1 1 6 2685 1 1 28 CYS SG S 12.266 6.788 5.979 1.00 . A A . 28 CYS SG 1 1 6 2686 1 1 29 VAL C C 14.812 4.108 11.734 1.00 . A A . 29 VAL C 1 1 6 2687 1 1 29 VAL CA C 15.740 4.751 10.710 1.00 . A A . 29 VAL CA 1 1 6 2688 1 1 29 VAL CB C 16.821 5.561 11.449 1.00 . A A . 29 VAL CB 1 1 6 2689 1 1 29 VAL CG1 C 17.805 6.167 10.460 1.00 . A A . 29 VAL CG1 1 1 6 2690 1 1 29 VAL CG2 C 16.182 6.641 12.309 1.00 . A A . 29 VAL CG2 1 1 6 2691 1 1 29 VAL H H 14.173 6.026 10.080 1.00 . A A . 29 VAL H 1 1 6 2692 1 1 29 VAL HA H 16.229 3.972 10.142 1.00 . A A . 29 VAL HA 1 1 6 2693 1 1 29 VAL HB H 17.365 4.890 12.098 1.00 . A A . 29 VAL HB 1 1 6 2694 1 1 29 VAL HG11 H 17.298 6.905 9.855 1.00 . A A . 29 VAL HG11 1 1 6 2695 1 1 29 VAL HG12 H 18.615 6.637 10.999 1.00 . A A . 29 VAL HG12 1 1 6 2696 1 1 29 VAL HG13 H 18.199 5.390 9.823 1.00 . A A . 29 VAL HG13 1 1 6 2697 1 1 29 VAL HG21 H 15.569 6.180 13.068 1.00 . A A . 29 VAL HG21 1 1 6 2698 1 1 29 VAL HG22 H 16.955 7.231 12.780 1.00 . A A . 29 VAL HG22 1 1 6 2699 1 1 29 VAL HG23 H 15.570 7.280 11.689 1.00 . A A . 29 VAL HG23 1 1 6 2700 1 1 29 VAL N N 14.995 5.587 9.777 1.00 . A A . 29 VAL N 1 1 6 2701 1 1 29 VAL O O 13.672 4.537 11.911 1.00 . A A . 29 VAL O 1 1 6 2702 1 1 30 LYS C C 14.252 3.274 14.619 1.00 . A A . 30 LYS C 1 1 6 2703 1 1 30 LYS CA C 14.525 2.374 13.418 1.00 . A A . 30 LYS CA 1 1 6 2704 1 1 30 LYS CB C 15.257 1.109 13.872 1.00 . A A . 30 LYS CB 1 1 6 2705 1 1 30 LYS CD C 14.863 -1.368 14.008 1.00 . A A . 30 LYS CD 1 1 6 2706 1 1 30 LYS CE C 14.118 -1.971 12.826 1.00 . A A . 30 LYS CE 1 1 6 2707 1 1 30 LYS CG C 14.328 0.010 14.358 1.00 . A A . 30 LYS CG 1 1 6 2708 1 1 30 LYS H H 16.225 2.781 12.223 1.00 . A A . 30 LYS H 1 1 6 2709 1 1 30 LYS HA H 13.583 2.094 12.972 1.00 . A A . 30 LYS HA 1 1 6 2710 1 1 30 LYS HB2 H 15.833 0.724 13.043 1.00 . A A . 30 LYS HB2 1 1 6 2711 1 1 30 LYS HB3 H 15.929 1.366 14.677 1.00 . A A . 30 LYS HB3 1 1 6 2712 1 1 30 LYS HD2 H 15.909 -1.286 13.754 1.00 . A A . 30 LYS HD2 1 1 6 2713 1 1 30 LYS HD3 H 14.748 -2.018 14.864 1.00 . A A . 30 LYS HD3 1 1 6 2714 1 1 30 LYS HE2 H 14.286 -3.037 12.818 1.00 . A A . 30 LYS HE2 1 1 6 2715 1 1 30 LYS HE3 H 13.063 -1.774 12.944 1.00 . A A . 30 LYS HE3 1 1 6 2716 1 1 30 LYS HG2 H 14.228 0.084 15.431 1.00 . A A . 30 LYS HG2 1 1 6 2717 1 1 30 LYS HG3 H 13.359 0.139 13.895 1.00 . A A . 30 LYS HG3 1 1 6 2718 1 1 30 LYS HZ1 H 15.533 -1.003 11.634 1.00 . A A . 30 LYS HZ1 1 1 6 2719 1 1 30 LYS HZ2 H 13.932 -0.641 11.227 1.00 . A A . 30 LYS HZ2 1 1 6 2720 1 1 30 LYS HZ3 H 14.596 -2.137 10.799 1.00 . A A . 30 LYS HZ3 1 1 6 2721 1 1 30 LYS N N 15.308 3.077 12.409 1.00 . A A . 30 LYS N 1 1 6 2722 1 1 30 LYS NZ N 14.577 -1.398 11.531 1.00 . A A . 30 LYS NZ 1 1 6 2723 1 1 30 LYS O O 15.172 3.858 15.191 1.00 . A A . 30 LYS O 1 1 6 2724 1 1 31 GLY C C 11.208 4.768 16.005 1.00 . A A . 31 GLY C 1 1 6 2725 1 1 31 GLY CA C 12.612 4.210 16.129 1.00 . A A . 31 GLY CA 1 1 6 2726 1 1 31 GLY H H 12.291 2.891 14.504 1.00 . A A . 31 GLY H 1 1 6 2727 1 1 31 GLY HA2 H 12.675 3.619 17.031 1.00 . A A . 31 GLY HA2 1 1 6 2728 1 1 31 GLY HA3 H 13.309 5.032 16.201 1.00 . A A . 31 GLY HA3 1 1 6 2729 1 1 31 GLY N N 12.982 3.380 14.997 1.00 . A A . 31 GLY N 1 1 6 2730 1 1 31 GLY O O 10.667 5.323 16.961 1.00 . A A . 31 GLY O 1 1 7 2731 1 1 1 GLY C C 3.390 1.692 -0.842 1.00 . A A . 1 GLY C 1 1 7 2732 1 1 1 GLY CA C 1.968 1.345 -0.448 1.00 . A A . 1 GLY CA 1 1 7 2733 1 1 1 GLY H1 H 1.023 1.101 1.431 1.00 . A A . 1 GLY H1 1 1 7 2734 1 1 1 GLY HA2 H 1.801 0.294 -0.631 1.00 . A A . 1 GLY HA2 1 1 7 2735 1 1 1 GLY HA3 H 1.288 1.919 -1.060 1.00 . A A . 1 GLY HA3 1 1 7 2736 1 1 1 GLY N N 1.694 1.628 0.949 1.00 . A A . 1 GLY N 1 1 7 2737 1 1 1 GLY O O 3.643 2.754 -1.410 1.00 . A A . 1 GLY O 1 1 7 2738 1 1 2 TYR C C 6.217 2.340 -0.288 1.00 . A A . 2 TYR C 1 1 7 2739 1 1 2 TYR CA C 5.727 1.013 -0.860 1.00 . A A . 2 TYR CA 1 1 7 2740 1 1 2 TYR CB C 5.934 0.991 -2.375 1.00 . A A . 2 TYR CB 1 1 7 2741 1 1 2 TYR CD1 C 7.575 2.405 -3.673 1.00 . A A . 2 TYR CD1 1 1 7 2742 1 1 2 TYR CD2 C 8.434 0.634 -2.328 1.00 . A A . 2 TYR CD2 1 1 7 2743 1 1 2 TYR CE1 C 8.858 2.737 -4.064 1.00 . A A . 2 TYR CE1 1 1 7 2744 1 1 2 TYR CE2 C 9.720 0.959 -2.713 1.00 . A A . 2 TYR CE2 1 1 7 2745 1 1 2 TYR CG C 7.340 1.350 -2.800 1.00 . A A . 2 TYR CG 1 1 7 2746 1 1 2 TYR CZ C 9.927 2.011 -3.581 1.00 . A A . 2 TYR CZ 1 1 7 2747 1 1 2 TYR H H 4.059 -0.033 -0.085 1.00 . A A . 2 TYR H 1 1 7 2748 1 1 2 TYR HA H 6.298 0.210 -0.417 1.00 . A A . 2 TYR HA 1 1 7 2749 1 1 2 TYR HB2 H 5.719 0.001 -2.747 1.00 . A A . 2 TYR HB2 1 1 7 2750 1 1 2 TYR HB3 H 5.258 1.698 -2.834 1.00 . A A . 2 TYR HB3 1 1 7 2751 1 1 2 TYR HD1 H 6.736 2.972 -4.049 1.00 . A A . 2 TYR HD1 1 1 7 2752 1 1 2 TYR HD2 H 8.268 -0.190 -1.649 1.00 . A A . 2 TYR HD2 1 1 7 2753 1 1 2 TYR HE1 H 9.021 3.560 -4.743 1.00 . A A . 2 TYR HE1 1 1 7 2754 1 1 2 TYR HE2 H 10.557 0.391 -2.335 1.00 . A A . 2 TYR HE2 1 1 7 2755 1 1 2 TYR HH H 11.837 1.838 -3.442 1.00 . A A . 2 TYR HH 1 1 7 2756 1 1 2 TYR N N 4.322 0.795 -0.538 1.00 . A A . 2 TYR N 1 1 7 2757 1 1 2 TYR O O 6.208 3.365 -0.969 1.00 . A A . 2 TYR O 1 1 7 2758 1 1 2 TYR OH O 11.207 2.337 -3.967 1.00 . A A . 2 TYR OH 1 1 7 2759 1 1 3 CYS C C 8.667 3.537 1.645 1.00 . A A . 3 CYS C 1 1 7 2760 1 1 3 CYS CA C 7.141 3.510 1.637 1.00 . A A . 3 CYS CA 1 1 7 2761 1 1 3 CYS CB C 6.611 3.577 3.070 1.00 . A A . 3 CYS CB 1 1 7 2762 1 1 3 CYS H H 6.630 1.463 1.462 1.00 . A A . 3 CYS H 1 1 7 2763 1 1 3 CYS HA H 6.781 4.367 1.089 1.00 . A A . 3 CYS HA 1 1 7 2764 1 1 3 CYS HB2 H 7.342 3.142 3.737 1.00 . A A . 3 CYS HB2 1 1 7 2765 1 1 3 CYS HB3 H 6.456 4.610 3.340 1.00 . A A . 3 CYS HB3 1 1 7 2766 1 1 3 CYS N N 6.646 2.311 0.970 1.00 . A A . 3 CYS N 1 1 7 2767 1 1 3 CYS O O 9.316 2.718 0.995 1.00 . A A . 3 CYS O 1 1 7 2768 1 1 3 CYS SG S 5.038 2.693 3.323 1.00 . A A . 3 CYS SG 1 1 7 2769 1 1 4 ALA C C 11.229 3.819 3.660 1.00 . A A . 4 ALA C 1 1 7 2770 1 1 4 ALA CA C 10.681 4.616 2.481 1.00 . A A . 4 ALA CA 1 1 7 2771 1 1 4 ALA CB C 11.070 6.082 2.607 1.00 . A A . 4 ALA CB 1 1 7 2772 1 1 4 ALA H H 8.662 5.107 2.882 1.00 . A A . 4 ALA H 1 1 7 2773 1 1 4 ALA HA H 11.112 4.232 1.568 1.00 . A A . 4 ALA HA 1 1 7 2774 1 1 4 ALA HB1 H 12.079 6.155 2.986 1.00 . A A . 4 ALA HB1 1 1 7 2775 1 1 4 ALA HB2 H 11.014 6.553 1.637 1.00 . A A . 4 ALA HB2 1 1 7 2776 1 1 4 ALA HB3 H 10.393 6.577 3.287 1.00 . A A . 4 ALA HB3 1 1 7 2777 1 1 4 ALA N N 9.232 4.484 2.386 1.00 . A A . 4 ALA N 1 1 7 2778 1 1 4 ALA O O 11.009 4.173 4.819 1.00 . A A . 4 ALA O 1 1 7 2779 1 1 5 THR C C 13.853 2.448 4.880 1.00 . A A . 5 THR C 1 1 7 2780 1 1 5 THR CA C 12.521 1.891 4.392 1.00 . A A . 5 THR CA 1 1 7 2781 1 1 5 THR CB C 12.734 0.452 3.884 1.00 . A A . 5 THR CB 1 1 7 2782 1 1 5 THR CG2 C 11.443 -0.348 3.968 1.00 . A A . 5 THR CG2 1 1 7 2783 1 1 5 THR H H 12.083 2.509 2.416 1.00 . A A . 5 THR H 1 1 7 2784 1 1 5 THR HA H 11.829 1.859 5.222 1.00 . A A . 5 THR HA 1 1 7 2785 1 1 5 THR HB H 13.478 -0.026 4.506 1.00 . A A . 5 THR HB 1 1 7 2786 1 1 5 THR HG1 H 13.607 -0.369 2.318 1.00 . A A . 5 THR HG1 1 1 7 2787 1 1 5 THR HG21 H 10.642 0.294 4.303 1.00 . A A . 5 THR HG21 1 1 7 2788 1 1 5 THR HG22 H 11.568 -1.161 4.668 1.00 . A A . 5 THR HG22 1 1 7 2789 1 1 5 THR HG23 H 11.202 -0.745 2.994 1.00 . A A . 5 THR HG23 1 1 7 2790 1 1 5 THR N N 11.943 2.739 3.358 1.00 . A A . 5 THR N 1 1 7 2791 1 1 5 THR O O 14.366 3.425 4.335 1.00 . A A . 5 THR O 1 1 7 2792 1 1 5 THR OG1 O 13.200 0.474 2.531 1.00 . A A . 5 THR OG1 1 1 7 2793 1 1 6 LYS C C 16.709 2.499 5.368 1.00 . A A . 6 LYS C 1 1 7 2794 1 1 6 LYS CA C 15.685 2.251 6.471 1.00 . A A . 6 LYS CA 1 1 7 2795 1 1 6 LYS CB C 16.217 1.201 7.449 1.00 . A A . 6 LYS CB 1 1 7 2796 1 1 6 LYS CD C 17.698 0.705 9.416 1.00 . A A . 6 LYS CD 1 1 7 2797 1 1 6 LYS CE C 18.976 -0.051 9.091 1.00 . A A . 6 LYS CE 1 1 7 2798 1 1 6 LYS CG C 17.349 1.705 8.326 1.00 . A A . 6 LYS CG 1 1 7 2799 1 1 6 LYS H H 13.953 1.046 6.302 1.00 . A A . 6 LYS H 1 1 7 2800 1 1 6 LYS HA H 15.518 3.175 7.004 1.00 . A A . 6 LYS HA 1 1 7 2801 1 1 6 LYS HB2 H 15.408 0.880 8.089 1.00 . A A . 6 LYS HB2 1 1 7 2802 1 1 6 LYS HB3 H 16.577 0.352 6.885 1.00 . A A . 6 LYS HB3 1 1 7 2803 1 1 6 LYS HD2 H 17.833 1.234 10.348 1.00 . A A . 6 LYS HD2 1 1 7 2804 1 1 6 LYS HD3 H 16.887 -0.002 9.516 1.00 . A A . 6 LYS HD3 1 1 7 2805 1 1 6 LYS HE2 H 19.155 0.010 8.028 1.00 . A A . 6 LYS HE2 1 1 7 2806 1 1 6 LYS HE3 H 19.797 0.411 9.620 1.00 . A A . 6 LYS HE3 1 1 7 2807 1 1 6 LYS HG2 H 18.222 1.871 7.713 1.00 . A A . 6 LYS HG2 1 1 7 2808 1 1 6 LYS HG3 H 17.048 2.636 8.787 1.00 . A A . 6 LYS HG3 1 1 7 2809 1 1 6 LYS HZ1 H 18.656 -2.069 8.658 1.00 . A A . 6 LYS HZ1 1 1 7 2810 1 1 6 LYS HZ2 H 18.150 -1.612 10.206 1.00 . A A . 6 LYS HZ2 1 1 7 2811 1 1 6 LYS HZ3 H 19.798 -1.803 9.878 1.00 . A A . 6 LYS HZ3 1 1 7 2812 1 1 6 LYS N N 14.410 1.820 5.910 1.00 . A A . 6 LYS N 1 1 7 2813 1 1 6 LYS NZ N 18.889 -1.484 9.486 1.00 . A A . 6 LYS NZ 1 1 7 2814 1 1 6 LYS O O 16.893 1.667 4.480 1.00 . A A . 6 LYS O 1 1 7 2815 1 1 7 GLY C C 17.819 4.867 3.333 1.00 . A A . 7 GLY C 1 1 7 2816 1 1 7 GLY CA C 18.373 3.983 4.432 1.00 . A A . 7 GLY CA 1 1 7 2817 1 1 7 GLY H H 17.186 4.273 6.162 1.00 . A A . 7 GLY H 1 1 7 2818 1 1 7 GLY HA2 H 19.191 4.497 4.915 1.00 . A A . 7 GLY HA2 1 1 7 2819 1 1 7 GLY HA3 H 18.745 3.070 3.991 1.00 . A A . 7 GLY HA3 1 1 7 2820 1 1 7 GLY N N 17.375 3.648 5.431 1.00 . A A . 7 GLY N 1 1 7 2821 1 1 7 GLY O O 18.571 5.561 2.647 1.00 . A A . 7 GLY O 1 1 7 2822 1 1 8 ILE C C 15.574 7.060 2.641 1.00 . A A . 8 ILE C 1 1 7 2823 1 1 8 ILE CA C 15.848 5.647 2.138 1.00 . A A . 8 ILE CA 1 1 7 2824 1 1 8 ILE CB C 14.522 5.010 1.682 1.00 . A A . 8 ILE CB 1 1 7 2825 1 1 8 ILE CD1 C 15.653 3.339 0.131 1.00 . A A . 8 ILE CD1 1 1 7 2826 1 1 8 ILE CG1 C 14.736 3.540 1.317 1.00 . A A . 8 ILE CG1 1 1 7 2827 1 1 8 ILE CG2 C 13.945 5.776 0.502 1.00 . A A . 8 ILE CG2 1 1 7 2828 1 1 8 ILE H H 15.956 4.269 3.741 1.00 . A A . 8 ILE H 1 1 7 2829 1 1 8 ILE HA H 16.510 5.702 1.286 1.00 . A A . 8 ILE HA 1 1 7 2830 1 1 8 ILE HB H 13.819 5.072 2.499 1.00 . A A . 8 ILE HB 1 1 7 2831 1 1 8 ILE HD11 H 16.046 4.294 -0.187 1.00 . A A . 8 ILE HD11 1 1 7 2832 1 1 8 ILE HD12 H 16.468 2.689 0.410 1.00 . A A . 8 ILE HD12 1 1 7 2833 1 1 8 ILE HD13 H 15.098 2.892 -0.682 1.00 . A A . 8 ILE HD13 1 1 7 2834 1 1 8 ILE HG12 H 15.169 3.025 2.160 1.00 . A A . 8 ILE HG12 1 1 7 2835 1 1 8 ILE HG13 H 13.782 3.093 1.079 1.00 . A A . 8 ILE HG13 1 1 7 2836 1 1 8 ILE HG21 H 13.207 5.165 0.002 1.00 . A A . 8 ILE HG21 1 1 7 2837 1 1 8 ILE HG22 H 13.479 6.684 0.855 1.00 . A A . 8 ILE HG22 1 1 7 2838 1 1 8 ILE HG23 H 14.736 6.023 -0.190 1.00 . A A . 8 ILE HG23 1 1 7 2839 1 1 8 ILE N N 16.501 4.842 3.163 1.00 . A A . 8 ILE N 1 1 7 2840 1 1 8 ILE O O 15.000 7.249 3.714 1.00 . A A . 8 ILE O 1 1 7 2841 1 1 9 LYS C C 14.325 9.710 2.585 1.00 . A A . 9 LYS C 1 1 7 2842 1 1 9 LYS CA C 15.783 9.449 2.221 1.00 . A A . 9 LYS CA 1 1 7 2843 1 1 9 LYS CB C 16.203 10.363 1.068 1.00 . A A . 9 LYS CB 1 1 7 2844 1 1 9 LYS CD C 18.523 11.265 0.730 1.00 . A A . 9 LYS CD 1 1 7 2845 1 1 9 LYS CE C 19.803 11.110 -0.077 1.00 . A A . 9 LYS CE 1 1 7 2846 1 1 9 LYS CG C 17.598 10.074 0.540 1.00 . A A . 9 LYS CG 1 1 7 2847 1 1 9 LYS H H 16.437 7.837 1.014 1.00 . A A . 9 LYS H 1 1 7 2848 1 1 9 LYS HA H 16.400 9.661 3.081 1.00 . A A . 9 LYS HA 1 1 7 2849 1 1 9 LYS HB2 H 15.501 10.243 0.255 1.00 . A A . 9 LYS HB2 1 1 7 2850 1 1 9 LYS HB3 H 16.175 11.388 1.408 1.00 . A A . 9 LYS HB3 1 1 7 2851 1 1 9 LYS HD2 H 18.014 12.161 0.407 1.00 . A A . 9 LYS HD2 1 1 7 2852 1 1 9 LYS HD3 H 18.776 11.350 1.777 1.00 . A A . 9 LYS HD3 1 1 7 2853 1 1 9 LYS HE2 H 20.024 10.058 -0.178 1.00 . A A . 9 LYS HE2 1 1 7 2854 1 1 9 LYS HE3 H 19.651 11.542 -1.055 1.00 . A A . 9 LYS HE3 1 1 7 2855 1 1 9 LYS HG2 H 18.006 9.227 1.071 1.00 . A A . 9 LYS HG2 1 1 7 2856 1 1 9 LYS HG3 H 17.533 9.844 -0.514 1.00 . A A . 9 LYS HG3 1 1 7 2857 1 1 9 LYS HZ1 H 21.435 12.413 -0.101 1.00 . A A . 9 LYS HZ1 1 1 7 2858 1 1 9 LYS HZ2 H 21.638 11.080 0.920 1.00 . A A . 9 LYS HZ2 1 1 7 2859 1 1 9 LYS HZ3 H 20.627 12.354 1.384 1.00 . A A . 9 LYS HZ3 1 1 7 2860 1 1 9 LYS N N 15.986 8.051 1.858 1.00 . A A . 9 LYS N 1 1 7 2861 1 1 9 LYS NZ N 20.957 11.787 0.578 1.00 . A A . 9 LYS NZ 1 1 7 2862 1 1 9 LYS O O 13.412 9.153 1.974 1.00 . A A . 9 LYS O 1 1 7 2863 1 1 10 CYS C C 12.522 12.401 3.937 1.00 . A A . 10 CYS C 1 1 7 2864 1 1 10 CYS CA C 12.765 10.897 4.029 1.00 . A A . 10 CYS CA 1 1 7 2865 1 1 10 CYS CB C 12.547 10.421 5.466 1.00 . A A . 10 CYS CB 1 1 7 2866 1 1 10 CYS H H 14.881 10.973 4.032 1.00 . A A . 10 CYS H 1 1 7 2867 1 1 10 CYS HA H 12.066 10.392 3.381 1.00 . A A . 10 CYS HA 1 1 7 2868 1 1 10 CYS HB2 H 11.487 10.306 5.642 1.00 . A A . 10 CYS HB2 1 1 7 2869 1 1 10 CYS HB3 H 13.034 9.466 5.598 1.00 . A A . 10 CYS HB3 1 1 7 2870 1 1 10 CYS N N 14.112 10.561 3.583 1.00 . A A . 10 CYS N 1 1 7 2871 1 1 10 CYS O O 11.566 12.921 4.510 1.00 . A A . 10 CYS O 1 1 7 2872 1 1 10 CYS SG S 13.197 11.556 6.733 1.00 . A A . 10 CYS SG 1 1 7 2873 1 1 11 ASN C C 11.956 14.899 2.369 1.00 . A A . 11 ASN C 1 1 7 2874 1 1 11 ASN CA C 13.275 14.537 3.045 1.00 . A A . 11 ASN CA 1 1 7 2875 1 1 11 ASN CB C 14.447 15.075 2.223 1.00 . A A . 11 ASN CB 1 1 7 2876 1 1 11 ASN CG C 14.217 16.497 1.749 1.00 . A A . 11 ASN CG 1 1 7 2877 1 1 11 ASN H H 14.137 12.622 2.779 1.00 . A A . 11 ASN H 1 1 7 2878 1 1 11 ASN HA H 13.299 14.987 4.027 1.00 . A A . 11 ASN HA 1 1 7 2879 1 1 11 ASN HB2 H 15.342 15.059 2.829 1.00 . A A . 11 ASN HB2 1 1 7 2880 1 1 11 ASN HB3 H 14.592 14.446 1.358 1.00 . A A . 11 ASN HB3 1 1 7 2881 1 1 11 ASN HD21 H 14.242 15.896 -0.146 1.00 . A A . 11 ASN HD21 1 1 7 2882 1 1 11 ASN HD22 H 13.996 17.588 0.102 1.00 . A A . 11 ASN HD22 1 1 7 2883 1 1 11 ASN N N 13.395 13.093 3.212 1.00 . A A . 11 ASN N 1 1 7 2884 1 1 11 ASN ND2 N 14.144 16.679 0.436 1.00 . A A . 11 ASN ND2 1 1 7 2885 1 1 11 ASN O O 11.496 16.038 2.454 1.00 . A A . 11 ASN O 1 1 7 2886 1 1 11 ASN OD1 O 14.105 17.421 2.555 1.00 . A A . 11 ASN OD1 1 1 7 2887 1 1 12 ASP C C 9.149 12.952 1.213 1.00 . A A . 12 ASP C 1 1 7 2888 1 1 12 ASP CA C 10.087 14.138 1.010 1.00 . A A . 12 ASP CA 1 1 7 2889 1 1 12 ASP CB C 10.326 14.364 -0.484 1.00 . A A . 12 ASP CB 1 1 7 2890 1 1 12 ASP CG C 9.135 15.002 -1.171 1.00 . A A . 12 ASP CG 1 1 7 2891 1 1 12 ASP H H 11.771 13.036 1.669 1.00 . A A . 12 ASP H 1 1 7 2892 1 1 12 ASP HA H 9.626 15.020 1.429 1.00 . A A . 12 ASP HA 1 1 7 2893 1 1 12 ASP HB2 H 11.181 15.013 -0.610 1.00 . A A . 12 ASP HB2 1 1 7 2894 1 1 12 ASP HB3 H 10.527 13.414 -0.957 1.00 . A A . 12 ASP HB3 1 1 7 2895 1 1 12 ASP N N 11.354 13.923 1.699 1.00 . A A . 12 ASP N 1 1 7 2896 1 1 12 ASP O O 8.015 13.115 1.663 1.00 . A A . 12 ASP O 1 1 7 2897 1 1 12 ASP OD1 O 8.170 15.368 -0.468 1.00 . A A . 12 ASP OD1 1 1 7 2898 1 1 12 ASP OD2 O 9.168 15.136 -2.412 1.00 . A A . 12 ASP OD2 1 1 7 2899 1 1 13 ILE C C 8.737 10.127 2.487 1.00 . A A . 13 ILE C 1 1 7 2900 1 1 13 ILE CA C 8.836 10.546 1.024 1.00 . A A . 13 ILE CA 1 1 7 2901 1 1 13 ILE CB C 9.429 9.383 0.207 1.00 . A A . 13 ILE CB 1 1 7 2902 1 1 13 ILE CD1 C 7.124 8.499 -0.413 1.00 . A A . 13 ILE CD1 1 1 7 2903 1 1 13 ILE CG1 C 8.469 8.191 0.206 1.00 . A A . 13 ILE CG1 1 1 7 2904 1 1 13 ILE CG2 C 10.784 8.979 0.768 1.00 . A A . 13 ILE CG2 1 1 7 2905 1 1 13 ILE H H 10.543 11.694 0.525 1.00 . A A . 13 ILE H 1 1 7 2906 1 1 13 ILE HA H 7.843 10.752 0.652 1.00 . A A . 13 ILE HA 1 1 7 2907 1 1 13 ILE HB H 9.572 9.722 -0.807 1.00 . A A . 13 ILE HB 1 1 7 2908 1 1 13 ILE HD11 H 7.151 9.479 -0.866 1.00 . A A . 13 ILE HD11 1 1 7 2909 1 1 13 ILE HD12 H 6.896 7.760 -1.166 1.00 . A A . 13 ILE HD12 1 1 7 2910 1 1 13 ILE HD13 H 6.362 8.478 0.353 1.00 . A A . 13 ILE HD13 1 1 7 2911 1 1 13 ILE HG12 H 8.913 7.381 -0.350 1.00 . A A . 13 ILE HG12 1 1 7 2912 1 1 13 ILE HG13 H 8.302 7.873 1.225 1.00 . A A . 13 ILE HG13 1 1 7 2913 1 1 13 ILE HG21 H 11.258 8.280 0.094 1.00 . A A . 13 ILE HG21 1 1 7 2914 1 1 13 ILE HG22 H 11.406 9.855 0.872 1.00 . A A . 13 ILE HG22 1 1 7 2915 1 1 13 ILE HG23 H 10.651 8.515 1.733 1.00 . A A . 13 ILE HG23 1 1 7 2916 1 1 13 ILE N N 9.631 11.759 0.878 1.00 . A A . 13 ILE N 1 1 7 2917 1 1 13 ILE O O 9.674 10.317 3.264 1.00 . A A . 13 ILE O 1 1 7 2918 1 1 14 HIS C C 7.707 7.621 4.372 1.00 . A A . 14 HIS C 1 1 7 2919 1 1 14 HIS CA C 7.375 9.104 4.226 1.00 . A A . 14 HIS CA 1 1 7 2920 1 1 14 HIS CB C 5.925 9.357 4.641 1.00 . A A . 14 HIS CB 1 1 7 2921 1 1 14 HIS CD2 C 4.183 9.105 2.737 1.00 . A A . 14 HIS CD2 1 1 7 2922 1 1 14 HIS CE1 C 3.683 6.991 3.037 1.00 . A A . 14 HIS CE1 1 1 7 2923 1 1 14 HIS CG C 4.924 8.655 3.776 1.00 . A A . 14 HIS CG 1 1 7 2924 1 1 14 HIS H H 6.887 9.429 2.192 1.00 . A A . 14 HIS H 1 1 7 2925 1 1 14 HIS HA H 8.029 9.671 4.871 1.00 . A A . 14 HIS HA 1 1 7 2926 1 1 14 HIS HB2 H 5.783 9.016 5.656 1.00 . A A . 14 HIS HB2 1 1 7 2927 1 1 14 HIS HB3 H 5.723 10.417 4.591 1.00 . A A . 14 HIS HB3 1 1 7 2928 1 1 14 HIS HD1 H 4.956 6.723 4.616 1.00 . A A . 14 HIS HD1 1 1 7 2929 1 1 14 HIS HD2 H 4.189 10.106 2.329 1.00 . A A . 14 HIS HD2 1 1 7 2930 1 1 14 HIS HE1 H 3.235 6.016 2.924 1.00 . A A . 14 HIS HE1 1 1 7 2931 1 1 14 HIS N N 7.596 9.553 2.857 1.00 . A A . 14 HIS N 1 1 7 2932 1 1 14 HIS ND1 N 4.587 7.328 3.940 1.00 . A A . 14 HIS ND1 1 1 7 2933 1 1 14 HIS NE2 N 3.421 8.052 2.294 1.00 . A A . 14 HIS NE2 1 1 7 2934 1 1 14 HIS O O 7.616 6.857 3.411 1.00 . A A . 14 HIS O 1 1 7 2935 1 1 15 CYS C C 7.211 5.044 6.304 1.00 . A A . 15 CYS C 1 1 7 2936 1 1 15 CYS CA C 8.438 5.832 5.851 1.00 . A A . 15 CYS CA 1 1 7 2937 1 1 15 CYS CB C 9.529 5.756 6.921 1.00 . A A . 15 CYS CB 1 1 7 2938 1 1 15 CYS H H 8.144 7.878 6.306 1.00 . A A . 15 CYS H 1 1 7 2939 1 1 15 CYS HA H 8.811 5.398 4.936 1.00 . A A . 15 CYS HA 1 1 7 2940 1 1 15 CYS HB2 H 9.066 5.759 7.897 1.00 . A A . 15 CYS HB2 1 1 7 2941 1 1 15 CYS HB3 H 10.084 4.839 6.794 1.00 . A A . 15 CYS HB3 1 1 7 2942 1 1 15 CYS N N 8.091 7.222 5.579 1.00 . A A . 15 CYS N 1 1 7 2943 1 1 15 CYS O O 6.265 5.609 6.853 1.00 . A A . 15 CYS O 1 1 7 2944 1 1 15 CYS SG S 10.718 7.136 6.869 1.00 . A A . 15 CYS SG 1 1 7 2945 1 1 16 CYS C C 5.971 2.823 7.968 1.00 . A A . 16 CYS C 1 1 7 2946 1 1 16 CYS CA C 6.127 2.870 6.451 1.00 . A A . 16 CYS CA 1 1 7 2947 1 1 16 CYS CB C 6.346 1.457 5.906 1.00 . A A . 16 CYS CB 1 1 7 2948 1 1 16 CYS H H 8.019 3.344 5.627 1.00 . A A . 16 CYS H 1 1 7 2949 1 1 16 CYS HA H 5.225 3.276 6.021 1.00 . A A . 16 CYS HA 1 1 7 2950 1 1 16 CYS HB2 H 7.407 1.282 5.796 1.00 . A A . 16 CYS HB2 1 1 7 2951 1 1 16 CYS HB3 H 5.940 0.742 6.607 1.00 . A A . 16 CYS HB3 1 1 7 2952 1 1 16 CYS N N 7.236 3.737 6.069 1.00 . A A . 16 CYS N 1 1 7 2953 1 1 16 CYS O O 6.916 3.098 8.709 1.00 . A A . 16 CYS O 1 1 7 2954 1 1 16 CYS SG S 5.565 1.155 4.289 1.00 . A A . 16 CYS SG 1 1 7 2955 1 1 17 SER C C 5.538 1.543 10.566 1.00 . A A . 17 SER C 1 1 7 2956 1 1 17 SER CA C 4.491 2.394 9.853 1.00 . A A . 17 SER CA 1 1 7 2957 1 1 17 SER CB C 3.097 1.810 10.088 1.00 . A A . 17 SER CB 1 1 7 2958 1 1 17 SER H H 4.060 2.266 7.784 1.00 . A A . 17 SER H 1 1 7 2959 1 1 17 SER HA H 4.525 3.396 10.253 1.00 . A A . 17 SER HA 1 1 7 2960 1 1 17 SER HB2 H 2.457 2.067 9.257 1.00 . A A . 17 SER HB2 1 1 7 2961 1 1 17 SER HB3 H 3.169 0.735 10.168 1.00 . A A . 17 SER HB3 1 1 7 2962 1 1 17 SER HG H 2.345 1.597 11.884 1.00 . A A . 17 SER HG 1 1 7 2963 1 1 17 SER N N 4.773 2.473 8.424 1.00 . A A . 17 SER N 1 1 7 2964 1 1 17 SER O O 5.724 0.370 10.246 1.00 . A A . 17 SER O 1 1 7 2965 1 1 17 SER OG O 2.525 2.320 11.279 1.00 . A A . 17 SER OG 1 1 7 2966 1 1 18 GLY C C 8.606 2.073 12.157 1.00 . A A . 18 GLY C 1 1 7 2967 1 1 18 GLY CA C 7.239 1.429 12.281 1.00 . A A . 18 GLY CA 1 1 7 2968 1 1 18 GLY H H 6.028 3.083 11.748 1.00 . A A . 18 GLY H 1 1 7 2969 1 1 18 GLY HA2 H 6.958 1.404 13.323 1.00 . A A . 18 GLY HA2 1 1 7 2970 1 1 18 GLY HA3 H 7.296 0.417 11.908 1.00 . A A . 18 GLY HA3 1 1 7 2971 1 1 18 GLY N N 6.219 2.145 11.536 1.00 . A A . 18 GLY N 1 1 7 2972 1 1 18 GLY O O 9.502 1.804 12.959 1.00 . A A . 18 GLY O 1 1 7 2973 1 1 19 LEU C C 9.901 5.106 11.171 1.00 . A A . 19 LEU C 1 1 7 2974 1 1 19 LEU CA C 10.038 3.607 10.923 1.00 . A A . 19 LEU CA 1 1 7 2975 1 1 19 LEU CB C 10.525 3.357 9.495 1.00 . A A . 19 LEU CB 1 1 7 2976 1 1 19 LEU CD1 C 11.127 1.766 7.653 1.00 . A A . 19 LEU CD1 1 1 7 2977 1 1 19 LEU CD2 C 12.055 1.423 9.951 1.00 . A A . 19 LEU CD2 1 1 7 2978 1 1 19 LEU CG C 10.858 1.906 9.143 1.00 . A A . 19 LEU CG 1 1 7 2979 1 1 19 LEU H H 8.019 3.098 10.544 1.00 . A A . 19 LEU H 1 1 7 2980 1 1 19 LEU HA H 10.760 3.203 11.617 1.00 . A A . 19 LEU HA 1 1 7 2981 1 1 19 LEU HB2 H 9.754 3.692 8.818 1.00 . A A . 19 LEU HB2 1 1 7 2982 1 1 19 LEU HB3 H 11.417 3.948 9.342 1.00 . A A . 19 LEU HB3 1 1 7 2983 1 1 19 LEU HD11 H 11.999 2.345 7.388 1.00 . A A . 19 LEU HD11 1 1 7 2984 1 1 19 LEU HD12 H 10.274 2.126 7.098 1.00 . A A . 19 LEU HD12 1 1 7 2985 1 1 19 LEU HD13 H 11.298 0.726 7.415 1.00 . A A . 19 LEU HD13 1 1 7 2986 1 1 19 LEU HD21 H 11.950 1.746 10.976 1.00 . A A . 19 LEU HD21 1 1 7 2987 1 1 19 LEU HD22 H 12.961 1.838 9.533 1.00 . A A . 19 LEU HD22 1 1 7 2988 1 1 19 LEU HD23 H 12.101 0.345 9.915 1.00 . A A . 19 LEU HD23 1 1 7 2989 1 1 19 LEU HG H 10.013 1.279 9.390 1.00 . A A . 19 LEU HG 1 1 7 2990 1 1 19 LEU N N 8.769 2.924 11.150 1.00 . A A . 19 LEU N 1 1 7 2991 1 1 19 LEU O O 8.828 5.681 10.989 1.00 . A A . 19 LEU O 1 1 7 2992 1 1 20 LYS C C 11.730 7.925 10.750 1.00 . A A . 20 LYS C 1 1 7 2993 1 1 20 LYS CA C 11.002 7.166 11.855 1.00 . A A . 20 LYS CA 1 1 7 2994 1 1 20 LYS CB C 11.665 7.450 13.204 1.00 . A A . 20 LYS CB 1 1 7 2995 1 1 20 LYS CD C 13.934 8.021 14.118 1.00 . A A . 20 LYS CD 1 1 7 2996 1 1 20 LYS CE C 14.599 7.301 15.281 1.00 . A A . 20 LYS CE 1 1 7 2997 1 1 20 LYS CG C 13.133 7.061 13.255 1.00 . A A . 20 LYS CG 1 1 7 2998 1 1 20 LYS H H 11.823 5.220 11.712 1.00 . A A . 20 LYS H 1 1 7 2999 1 1 20 LYS HA H 9.976 7.501 11.890 1.00 . A A . 20 LYS HA 1 1 7 3000 1 1 20 LYS HB2 H 11.586 8.506 13.416 1.00 . A A . 20 LYS HB2 1 1 7 3001 1 1 20 LYS HB3 H 11.142 6.897 13.972 1.00 . A A . 20 LYS HB3 1 1 7 3002 1 1 20 LYS HD2 H 14.699 8.484 13.512 1.00 . A A . 20 LYS HD2 1 1 7 3003 1 1 20 LYS HD3 H 13.272 8.781 14.507 1.00 . A A . 20 LYS HD3 1 1 7 3004 1 1 20 LYS HE2 H 14.003 6.440 15.543 1.00 . A A . 20 LYS HE2 1 1 7 3005 1 1 20 LYS HE3 H 15.583 6.978 14.973 1.00 . A A . 20 LYS HE3 1 1 7 3006 1 1 20 LYS HG2 H 13.219 6.066 13.666 1.00 . A A . 20 LYS HG2 1 1 7 3007 1 1 20 LYS HG3 H 13.533 7.073 12.251 1.00 . A A . 20 LYS HG3 1 1 7 3008 1 1 20 LYS HZ1 H 14.390 7.683 17.324 1.00 . A A . 20 LYS HZ1 1 1 7 3009 1 1 20 LYS HZ2 H 14.166 9.045 16.347 1.00 . A A . 20 LYS HZ2 1 1 7 3010 1 1 20 LYS HZ3 H 15.724 8.446 16.618 1.00 . A A . 20 LYS HZ3 1 1 7 3011 1 1 20 LYS N N 10.997 5.733 11.585 1.00 . A A . 20 LYS N 1 1 7 3012 1 1 20 LYS NZ N 14.729 8.181 16.476 1.00 . A A . 20 LYS NZ 1 1 7 3013 1 1 20 LYS O O 12.642 7.395 10.115 1.00 . A A . 20 LYS O 1 1 7 3014 1 1 21 CYS C C 13.026 10.887 10.095 1.00 . A A . 21 CYS C 1 1 7 3015 1 1 21 CYS CA C 11.935 10.003 9.498 1.00 . A A . 21 CYS CA 1 1 7 3016 1 1 21 CYS CB C 10.876 10.871 8.817 1.00 . A A . 21 CYS CB 1 1 7 3017 1 1 21 CYS H H 10.589 9.538 11.064 1.00 . A A . 21 CYS H 1 1 7 3018 1 1 21 CYS HA H 12.380 9.350 8.763 1.00 . A A . 21 CYS HA 1 1 7 3019 1 1 21 CYS HB2 H 10.233 10.240 8.220 1.00 . A A . 21 CYS HB2 1 1 7 3020 1 1 21 CYS HB3 H 10.284 11.365 9.573 1.00 . A A . 21 CYS HB3 1 1 7 3021 1 1 21 CYS N N 11.322 9.170 10.525 1.00 . A A . 21 CYS N 1 1 7 3022 1 1 21 CYS O O 12.756 11.992 10.567 1.00 . A A . 21 CYS O 1 1 7 3023 1 1 21 CYS SG S 11.560 12.156 7.720 1.00 . A A . 21 CYS SG 1 1 7 3024 1 1 22 ASP C C 15.543 12.482 9.900 1.00 . A A . 22 ASP C 1 1 7 3025 1 1 22 ASP CA C 15.392 11.138 10.606 1.00 . A A . 22 ASP CA 1 1 7 3026 1 1 22 ASP CB C 16.680 10.325 10.461 1.00 . A A . 22 ASP CB 1 1 7 3027 1 1 22 ASP CG C 17.723 10.704 11.493 1.00 . A A . 22 ASP CG 1 1 7 3028 1 1 22 ASP H H 14.411 9.507 9.679 1.00 . A A . 22 ASP H 1 1 7 3029 1 1 22 ASP HA H 15.206 11.316 11.654 1.00 . A A . 22 ASP HA 1 1 7 3030 1 1 22 ASP HB2 H 16.450 9.276 10.578 1.00 . A A . 22 ASP HB2 1 1 7 3031 1 1 22 ASP HB3 H 17.094 10.492 9.478 1.00 . A A . 22 ASP HB3 1 1 7 3032 1 1 22 ASP N N 14.259 10.393 10.069 1.00 . A A . 22 ASP N 1 1 7 3033 1 1 22 ASP O O 16.055 12.554 8.783 1.00 . A A . 22 ASP O 1 1 7 3034 1 1 22 ASP OD1 O 17.790 11.896 11.860 1.00 . A A . 22 ASP OD1 1 1 7 3035 1 1 22 ASP OD2 O 18.473 9.808 11.935 1.00 . A A . 22 ASP OD2 1 1 7 3036 1 1 23 SER C C 16.606 15.407 10.029 1.00 . A A . 23 SER C 1 1 7 3037 1 1 23 SER CA C 15.172 14.886 9.992 1.00 . A A . 23 SER CA 1 1 7 3038 1 1 23 SER CB C 14.251 15.841 10.754 1.00 . A A . 23 SER CB 1 1 7 3039 1 1 23 SER H H 14.694 13.423 11.446 1.00 . A A . 23 SER H 1 1 7 3040 1 1 23 SER HA H 14.848 14.831 8.963 1.00 . A A . 23 SER HA 1 1 7 3041 1 1 23 SER HB2 H 14.240 16.799 10.258 1.00 . A A . 23 SER HB2 1 1 7 3042 1 1 23 SER HB3 H 13.251 15.433 10.773 1.00 . A A . 23 SER HB3 1 1 7 3043 1 1 23 SER HG H 13.970 16.348 12.625 1.00 . A A . 23 SER HG 1 1 7 3044 1 1 23 SER N N 15.092 13.545 10.559 1.00 . A A . 23 SER N 1 1 7 3045 1 1 23 SER O O 16.932 16.409 9.392 1.00 . A A . 23 SER O 1 1 7 3046 1 1 23 SER OG O 14.696 16.022 12.087 1.00 . A A . 23 SER OG 1 1 7 3047 1 1 24 LYS C C 19.685 14.534 9.756 1.00 . A A . 24 LYS C 1 1 7 3048 1 1 24 LYS CA C 18.859 15.109 10.902 1.00 . A A . 24 LYS CA 1 1 7 3049 1 1 24 LYS CB C 19.427 14.637 12.242 1.00 . A A . 24 LYS CB 1 1 7 3050 1 1 24 LYS CD C 19.702 16.032 14.312 1.00 . A A . 24 LYS CD 1 1 7 3051 1 1 24 LYS CE C 19.962 17.418 13.743 1.00 . A A . 24 LYS CE 1 1 7 3052 1 1 24 LYS CG C 18.731 15.247 13.446 1.00 . A A . 24 LYS CG 1 1 7 3053 1 1 24 LYS H H 17.139 13.929 11.265 1.00 . A A . 24 LYS H 1 1 7 3054 1 1 24 LYS HA H 18.908 16.187 10.859 1.00 . A A . 24 LYS HA 1 1 7 3055 1 1 24 LYS HB2 H 19.330 13.563 12.302 1.00 . A A . 24 LYS HB2 1 1 7 3056 1 1 24 LYS HB3 H 20.474 14.898 12.287 1.00 . A A . 24 LYS HB3 1 1 7 3057 1 1 24 LYS HD2 H 19.285 16.134 15.303 1.00 . A A . 24 LYS HD2 1 1 7 3058 1 1 24 LYS HD3 H 20.638 15.494 14.367 1.00 . A A . 24 LYS HD3 1 1 7 3059 1 1 24 LYS HE2 H 19.180 17.656 13.039 1.00 . A A . 24 LYS HE2 1 1 7 3060 1 1 24 LYS HE3 H 19.947 18.134 14.552 1.00 . A A . 24 LYS HE3 1 1 7 3061 1 1 24 LYS HG2 H 17.954 15.913 13.103 1.00 . A A . 24 LYS HG2 1 1 7 3062 1 1 24 LYS HG3 H 18.294 14.455 14.038 1.00 . A A . 24 LYS HG3 1 1 7 3063 1 1 24 LYS HZ1 H 21.780 16.589 13.137 1.00 . A A . 24 LYS HZ1 1 1 7 3064 1 1 24 LYS HZ2 H 21.862 18.244 13.476 1.00 . A A . 24 LYS HZ2 1 1 7 3065 1 1 24 LYS HZ3 H 21.140 17.710 12.043 1.00 . A A . 24 LYS HZ3 1 1 7 3066 1 1 24 LYS N N 17.459 14.719 10.780 1.00 . A A . 24 LYS N 1 1 7 3067 1 1 24 LYS NZ N 21.278 17.496 13.051 1.00 . A A . 24 LYS NZ 1 1 7 3068 1 1 24 LYS O O 20.523 15.224 9.175 1.00 . A A . 24 LYS O 1 1 7 3069 1 1 25 ARG C C 19.315 12.535 7.093 1.00 . A A . 25 ARG C 1 1 7 3070 1 1 25 ARG CA C 20.165 12.600 8.359 1.00 . A A . 25 ARG CA 1 1 7 3071 1 1 25 ARG CB C 20.570 11.188 8.786 1.00 . A A . 25 ARG CB 1 1 7 3072 1 1 25 ARG CD C 22.964 10.902 9.494 1.00 . A A . 25 ARG CD 1 1 7 3073 1 1 25 ARG CG C 21.539 11.160 9.957 1.00 . A A . 25 ARG CG 1 1 7 3074 1 1 25 ARG CZ C 25.257 11.430 10.208 1.00 . A A . 25 ARG CZ 1 1 7 3075 1 1 25 ARG H H 18.763 12.769 9.935 1.00 . A A . 25 ARG H 1 1 7 3076 1 1 25 ARG HA H 21.056 13.173 8.152 1.00 . A A . 25 ARG HA 1 1 7 3077 1 1 25 ARG HB2 H 19.682 10.641 9.070 1.00 . A A . 25 ARG HB2 1 1 7 3078 1 1 25 ARG HB3 H 21.036 10.691 7.949 1.00 . A A . 25 ARG HB3 1 1 7 3079 1 1 25 ARG HD2 H 23.106 9.837 9.387 1.00 . A A . 25 ARG HD2 1 1 7 3080 1 1 25 ARG HD3 H 23.111 11.383 8.539 1.00 . A A . 25 ARG HD3 1 1 7 3081 1 1 25 ARG HE H 23.618 11.772 11.292 1.00 . A A . 25 ARG HE 1 1 7 3082 1 1 25 ARG HG2 H 21.504 12.114 10.464 1.00 . A A . 25 ARG HG2 1 1 7 3083 1 1 25 ARG HG3 H 21.243 10.377 10.639 1.00 . A A . 25 ARG HG3 1 1 7 3084 1 1 25 ARG HH11 H 25.108 10.591 8.376 1.00 . A A . 25 ARG HH11 1 1 7 3085 1 1 25 ARG HH12 H 26.719 10.969 8.891 1.00 . A A . 25 ARG HH12 1 1 7 3086 1 1 25 ARG HH21 H 25.734 12.274 11.982 1.00 . A A . 25 ARG HH21 1 1 7 3087 1 1 25 ARG HH22 H 27.074 11.925 10.942 1.00 . A A . 25 ARG HH22 1 1 7 3088 1 1 25 ARG N N 19.443 13.267 9.435 1.00 . A A . 25 ARG N 1 1 7 3089 1 1 25 ARG NE N 23.949 11.418 10.441 1.00 . A A . 25 ARG NE 1 1 7 3090 1 1 25 ARG NH1 N 25.734 10.957 9.065 1.00 . A A . 25 ARG NH1 1 1 7 3091 1 1 25 ARG NH2 N 26.090 11.916 11.119 1.00 . A A . 25 ARG NH2 1 1 7 3092 1 1 25 ARG O O 19.729 11.966 6.082 1.00 . A A . 25 ARG O 1 1 7 3093 1 1 26 LYS C C 17.007 11.722 5.472 1.00 . A A . 26 LYS C 1 1 7 3094 1 1 26 LYS CA C 17.216 13.132 6.015 1.00 . A A . 26 LYS CA 1 1 7 3095 1 1 26 LYS CB C 17.762 14.040 4.910 1.00 . A A . 26 LYS CB 1 1 7 3096 1 1 26 LYS CD C 17.676 16.520 4.520 1.00 . A A . 26 LYS CD 1 1 7 3097 1 1 26 LYS CE C 18.713 17.616 4.326 1.00 . A A . 26 LYS CE 1 1 7 3098 1 1 26 LYS CG C 18.204 15.405 5.408 1.00 . A A . 26 LYS CG 1 1 7 3099 1 1 26 LYS H H 17.850 13.559 7.989 1.00 . A A . 26 LYS H 1 1 7 3100 1 1 26 LYS HA H 16.266 13.520 6.351 1.00 . A A . 26 LYS HA 1 1 7 3101 1 1 26 LYS HB2 H 18.610 13.556 4.449 1.00 . A A . 26 LYS HB2 1 1 7 3102 1 1 26 LYS HB3 H 16.992 14.184 4.166 1.00 . A A . 26 LYS HB3 1 1 7 3103 1 1 26 LYS HD2 H 17.418 16.109 3.556 1.00 . A A . 26 LYS HD2 1 1 7 3104 1 1 26 LYS HD3 H 16.795 16.947 4.979 1.00 . A A . 26 LYS HD3 1 1 7 3105 1 1 26 LYS HE2 H 19.575 17.390 4.935 1.00 . A A . 26 LYS HE2 1 1 7 3106 1 1 26 LYS HE3 H 19.003 17.638 3.286 1.00 . A A . 26 LYS HE3 1 1 7 3107 1 1 26 LYS HG2 H 17.831 15.551 6.411 1.00 . A A . 26 LYS HG2 1 1 7 3108 1 1 26 LYS HG3 H 19.284 15.443 5.415 1.00 . A A . 26 LYS HG3 1 1 7 3109 1 1 26 LYS HZ1 H 18.292 19.099 5.735 1.00 . A A . 26 LYS HZ1 1 1 7 3110 1 1 26 LYS HZ2 H 17.176 19.024 4.466 1.00 . A A . 26 LYS HZ2 1 1 7 3111 1 1 26 LYS HZ3 H 18.705 19.701 4.209 1.00 . A A . 26 LYS HZ3 1 1 7 3112 1 1 26 LYS N N 18.124 13.121 7.155 1.00 . A A . 26 LYS N 1 1 7 3113 1 1 26 LYS NZ N 18.185 18.954 4.710 1.00 . A A . 26 LYS NZ 1 1 7 3114 1 1 26 LYS O O 17.019 11.505 4.260 1.00 . A A . 26 LYS O 1 1 7 3115 1 1 27 VAL C C 15.737 8.648 7.010 1.00 . A A . 27 VAL C 1 1 7 3116 1 1 27 VAL CA C 16.601 9.378 5.988 1.00 . A A . 27 VAL CA 1 1 7 3117 1 1 27 VAL CB C 17.937 8.627 5.831 1.00 . A A . 27 VAL CB 1 1 7 3118 1 1 27 VAL CG1 C 18.695 9.133 4.614 1.00 . A A . 27 VAL CG1 1 1 7 3119 1 1 27 VAL CG2 C 18.778 8.769 7.091 1.00 . A A . 27 VAL CG2 1 1 7 3120 1 1 27 VAL H H 16.817 11.002 7.328 1.00 . A A . 27 VAL H 1 1 7 3121 1 1 27 VAL HA H 16.095 9.373 5.033 1.00 . A A . 27 VAL HA 1 1 7 3122 1 1 27 VAL HB H 17.722 7.579 5.683 1.00 . A A . 27 VAL HB 1 1 7 3123 1 1 27 VAL HG11 H 18.846 10.199 4.702 1.00 . A A . 27 VAL HG11 1 1 7 3124 1 1 27 VAL HG12 H 19.653 8.637 4.553 1.00 . A A . 27 VAL HG12 1 1 7 3125 1 1 27 VAL HG13 H 18.124 8.925 3.722 1.00 . A A . 27 VAL HG13 1 1 7 3126 1 1 27 VAL HG21 H 19.324 7.853 7.263 1.00 . A A . 27 VAL HG21 1 1 7 3127 1 1 27 VAL HG22 H 19.475 9.586 6.969 1.00 . A A . 27 VAL HG22 1 1 7 3128 1 1 27 VAL HG23 H 18.134 8.968 7.934 1.00 . A A . 27 VAL HG23 1 1 7 3129 1 1 27 VAL N N 16.815 10.767 6.376 1.00 . A A . 27 VAL N 1 1 7 3130 1 1 27 VAL O O 15.501 9.149 8.110 1.00 . A A . 27 VAL O 1 1 7 3131 1 1 28 CYS C C 15.280 5.753 8.406 1.00 . A A . 28 CYS C 1 1 7 3132 1 1 28 CYS CA C 14.428 6.661 7.523 1.00 . A A . 28 CYS CA 1 1 7 3133 1 1 28 CYS CB C 13.447 5.820 6.705 1.00 . A A . 28 CYS CB 1 1 7 3134 1 1 28 CYS H H 15.490 7.116 5.749 1.00 . A A . 28 CYS H 1 1 7 3135 1 1 28 CYS HA H 13.871 7.337 8.154 1.00 . A A . 28 CYS HA 1 1 7 3136 1 1 28 CYS HB2 H 14.003 5.179 6.037 1.00 . A A . 28 CYS HB2 1 1 7 3137 1 1 28 CYS HB3 H 12.861 5.209 7.376 1.00 . A A . 28 CYS HB3 1 1 7 3138 1 1 28 CYS N N 15.267 7.462 6.639 1.00 . A A . 28 CYS N 1 1 7 3139 1 1 28 CYS O O 16.251 5.154 7.945 1.00 . A A . 28 CYS O 1 1 7 3140 1 1 28 CYS SG S 12.290 6.800 5.695 1.00 . A A . 28 CYS SG 1 1 7 3141 1 1 29 VAL C C 14.694 4.217 11.662 1.00 . A A . 29 VAL C 1 1 7 3142 1 1 29 VAL CA C 15.636 4.822 10.627 1.00 . A A . 29 VAL CA 1 1 7 3143 1 1 29 VAL CB C 16.733 5.623 11.353 1.00 . A A . 29 VAL CB 1 1 7 3144 1 1 29 VAL CG1 C 17.766 6.134 10.361 1.00 . A A . 29 VAL CG1 1 1 7 3145 1 1 29 VAL CG2 C 16.121 6.773 12.139 1.00 . A A . 29 VAL CG2 1 1 7 3146 1 1 29 VAL H H 14.125 6.159 9.987 1.00 . A A . 29 VAL H 1 1 7 3147 1 1 29 VAL HA H 16.109 4.023 10.074 1.00 . A A . 29 VAL HA 1 1 7 3148 1 1 29 VAL HB H 17.230 4.963 12.049 1.00 . A A . 29 VAL HB 1 1 7 3149 1 1 29 VAL HG11 H 17.334 6.927 9.769 1.00 . A A . 29 VAL HG11 1 1 7 3150 1 1 29 VAL HG12 H 18.625 6.510 10.898 1.00 . A A . 29 VAL HG12 1 1 7 3151 1 1 29 VAL HG13 H 18.072 5.327 9.712 1.00 . A A . 29 VAL HG13 1 1 7 3152 1 1 29 VAL HG21 H 15.388 7.277 11.526 1.00 . A A . 29 VAL HG21 1 1 7 3153 1 1 29 VAL HG22 H 15.642 6.388 13.028 1.00 . A A . 29 VAL HG22 1 1 7 3154 1 1 29 VAL HG23 H 16.896 7.469 12.421 1.00 . A A . 29 VAL HG23 1 1 7 3155 1 1 29 VAL N N 14.908 5.657 9.679 1.00 . A A . 29 VAL N 1 1 7 3156 1 1 29 VAL O O 13.530 4.605 11.761 1.00 . A A . 29 VAL O 1 1 7 3157 1 1 30 LYS C C 14.075 3.571 14.593 1.00 . A A . 30 LYS C 1 1 7 3158 1 1 30 LYS CA C 14.412 2.604 13.463 1.00 . A A . 30 LYS CA 1 1 7 3159 1 1 30 LYS CB C 15.165 1.394 14.020 1.00 . A A . 30 LYS CB 1 1 7 3160 1 1 30 LYS CD C 14.482 -0.954 14.597 1.00 . A A . 30 LYS CD 1 1 7 3161 1 1 30 LYS CE C 13.584 -1.823 15.463 1.00 . A A . 30 LYS CE 1 1 7 3162 1 1 30 LYS CG C 14.323 0.520 14.932 1.00 . A A . 30 LYS CG 1 1 7 3163 1 1 30 LYS H H 16.141 2.997 12.306 1.00 . A A . 30 LYS H 1 1 7 3164 1 1 30 LYS HA H 13.492 2.266 13.008 1.00 . A A . 30 LYS HA 1 1 7 3165 1 1 30 LYS HB2 H 15.511 0.789 13.195 1.00 . A A . 30 LYS HB2 1 1 7 3166 1 1 30 LYS HB3 H 16.020 1.744 14.581 1.00 . A A . 30 LYS HB3 1 1 7 3167 1 1 30 LYS HD2 H 14.222 -1.108 13.560 1.00 . A A . 30 LYS HD2 1 1 7 3168 1 1 30 LYS HD3 H 15.511 -1.241 14.758 1.00 . A A . 30 LYS HD3 1 1 7 3169 1 1 30 LYS HE2 H 14.144 -2.687 15.785 1.00 . A A . 30 LYS HE2 1 1 7 3170 1 1 30 LYS HE3 H 13.275 -1.252 16.326 1.00 . A A . 30 LYS HE3 1 1 7 3171 1 1 30 LYS HG2 H 14.631 0.680 15.955 1.00 . A A . 30 LYS HG2 1 1 7 3172 1 1 30 LYS HG3 H 13.283 0.795 14.820 1.00 . A A . 30 LYS HG3 1 1 7 3173 1 1 30 LYS HZ1 H 12.519 -2.172 13.700 1.00 . A A . 30 LYS HZ1 1 1 7 3174 1 1 30 LYS HZ2 H 11.549 -1.710 15.006 1.00 . A A . 30 LYS HZ2 1 1 7 3175 1 1 30 LYS HZ3 H 12.180 -3.278 14.935 1.00 . A A . 30 LYS HZ3 1 1 7 3176 1 1 30 LYS N N 15.205 3.263 12.433 1.00 . A A . 30 LYS N 1 1 7 3177 1 1 30 LYS NZ N 12.373 -2.278 14.725 1.00 . A A . 30 LYS NZ 1 1 7 3178 1 1 30 LYS O O 14.946 4.281 15.095 1.00 . A A . 30 LYS O 1 1 7 3179 1 1 31 GLY C C 11.185 3.931 16.818 1.00 . A A . 31 GLY C 1 1 7 3180 1 1 31 GLY CA C 12.378 4.476 16.059 1.00 . A A . 31 GLY CA 1 1 7 3181 1 1 31 GLY H H 12.155 3.005 14.552 1.00 . A A . 31 GLY H 1 1 7 3182 1 1 31 GLY HA2 H 13.198 4.612 16.748 1.00 . A A . 31 GLY HA2 1 1 7 3183 1 1 31 GLY HA3 H 12.114 5.434 15.635 1.00 . A A . 31 GLY HA3 1 1 7 3184 1 1 31 GLY N N 12.806 3.593 14.990 1.00 . A A . 31 GLY N 1 1 7 3185 1 1 31 GLY O O 11.145 2.749 17.161 1.00 . A A . 31 GLY O 1 1 8 3186 1 1 1 GLY C C 3.569 1.584 -0.610 1.00 . A A . 1 GLY C 1 1 8 3187 1 1 1 GLY CA C 2.131 1.222 -0.295 1.00 . A A . 1 GLY CA 1 1 8 3188 1 1 1 GLY H1 H 0.759 -0.266 -0.919 1.00 . A A . 1 GLY H1 1 1 8 3189 1 1 1 GLY HA2 H 1.500 2.069 -0.519 1.00 . A A . 1 GLY HA2 1 1 8 3190 1 1 1 GLY HA3 H 2.051 0.995 0.758 1.00 . A A . 1 GLY HA3 1 1 8 3191 1 1 1 GLY N N 1.667 0.077 -1.057 1.00 . A A . 1 GLY N 1 1 8 3192 1 1 1 GLY O O 3.840 2.642 -1.177 1.00 . A A . 1 GLY O 1 1 8 3193 1 1 2 TYR C C 6.340 2.298 0.064 1.00 . A A . 2 TYR C 1 1 8 3194 1 1 2 TYR CA C 5.912 0.939 -0.481 1.00 . A A . 2 TYR CA 1 1 8 3195 1 1 2 TYR CB C 6.215 0.858 -1.978 1.00 . A A . 2 TYR CB 1 1 8 3196 1 1 2 TYR CD1 C 7.970 2.308 -3.071 1.00 . A A . 2 TYR CD1 1 1 8 3197 1 1 2 TYR CD2 C 8.689 0.359 -1.903 1.00 . A A . 2 TYR CD2 1 1 8 3198 1 1 2 TYR CE1 C 9.281 2.607 -3.389 1.00 . A A . 2 TYR CE1 1 1 8 3199 1 1 2 TYR CE2 C 10.003 0.650 -2.215 1.00 . A A . 2 TYR CE2 1 1 8 3200 1 1 2 TYR CG C 7.651 1.181 -2.323 1.00 . A A . 2 TYR CG 1 1 8 3201 1 1 2 TYR CZ C 10.294 1.775 -2.959 1.00 . A A . 2 TYR CZ 1 1 8 3202 1 1 2 TYR H H 4.215 -0.121 0.210 1.00 . A A . 2 TYR H 1 1 8 3203 1 1 2 TYR HA H 6.467 0.167 0.031 1.00 . A A . 2 TYR HA 1 1 8 3204 1 1 2 TYR HB2 H 6.007 -0.141 -2.328 1.00 . A A . 2 TYR HB2 1 1 8 3205 1 1 2 TYR HB3 H 5.582 1.558 -2.505 1.00 . A A . 2 TYR HB3 1 1 8 3206 1 1 2 TYR HD1 H 7.175 2.958 -3.406 1.00 . A A . 2 TYR HD1 1 1 8 3207 1 1 2 TYR HD2 H 8.458 -0.522 -1.321 1.00 . A A . 2 TYR HD2 1 1 8 3208 1 1 2 TYR HE1 H 9.509 3.488 -3.971 1.00 . A A . 2 TYR HE1 1 1 8 3209 1 1 2 TYR HE2 H 10.796 -0.001 -1.879 1.00 . A A . 2 TYR HE2 1 1 8 3210 1 1 2 TYR HH H 11.687 3.010 -3.437 1.00 . A A . 2 TYR HH 1 1 8 3211 1 1 2 TYR N N 4.493 0.704 -0.239 1.00 . A A . 2 TYR N 1 1 8 3212 1 1 2 TYR O O 6.312 3.302 -0.647 1.00 . A A . 2 TYR O 1 1 8 3213 1 1 2 TYR OH O 11.601 2.068 -3.273 1.00 . A A . 2 TYR OH 1 1 8 3214 1 1 3 CYS C C 8.698 3.636 2.019 1.00 . A A . 3 CYS C 1 1 8 3215 1 1 3 CYS CA C 7.174 3.554 1.975 1.00 . A A . 3 CYS CA 1 1 8 3216 1 1 3 CYS CB C 6.607 3.643 3.393 1.00 . A A . 3 CYS CB 1 1 8 3217 1 1 3 CYS H H 6.740 1.486 1.848 1.00 . A A . 3 CYS H 1 1 8 3218 1 1 3 CYS HA H 6.799 4.382 1.393 1.00 . A A . 3 CYS HA 1 1 8 3219 1 1 3 CYS HB2 H 7.336 3.255 4.089 1.00 . A A . 3 CYS HB2 1 1 8 3220 1 1 3 CYS HB3 H 6.406 4.677 3.628 1.00 . A A . 3 CYS HB3 1 1 8 3221 1 1 3 CYS N N 6.739 2.320 1.331 1.00 . A A . 3 CYS N 1 1 8 3222 1 1 3 CYS O O 9.392 2.778 1.474 1.00 . A A . 3 CYS O 1 1 8 3223 1 1 3 CYS SG S 5.061 2.708 3.634 1.00 . A A . 3 CYS SG 1 1 8 3224 1 1 4 ALA C C 11.218 4.062 3.953 1.00 . A A . 4 ALA C 1 1 8 3225 1 1 4 ALA CA C 10.650 4.867 2.790 1.00 . A A . 4 ALA CA 1 1 8 3226 1 1 4 ALA CB C 10.972 6.344 2.960 1.00 . A A . 4 ALA CB 1 1 8 3227 1 1 4 ALA H H 8.605 5.324 3.085 1.00 . A A . 4 ALA H 1 1 8 3228 1 1 4 ALA HA H 11.108 4.527 1.872 1.00 . A A . 4 ALA HA 1 1 8 3229 1 1 4 ALA HB1 H 11.997 6.453 3.283 1.00 . A A . 4 ALA HB1 1 1 8 3230 1 1 4 ALA HB2 H 10.835 6.853 2.018 1.00 . A A . 4 ALA HB2 1 1 8 3231 1 1 4 ALA HB3 H 10.314 6.773 3.701 1.00 . A A . 4 ALA HB3 1 1 8 3232 1 1 4 ALA N N 9.210 4.674 2.672 1.00 . A A . 4 ALA N 1 1 8 3233 1 1 4 ALA O O 11.018 4.407 5.118 1.00 . A A . 4 ALA O 1 1 8 3234 1 1 5 THR C C 13.861 2.689 5.124 1.00 . A A . 5 THR C 1 1 8 3235 1 1 5 THR CA C 12.525 2.130 4.649 1.00 . A A . 5 THR CA 1 1 8 3236 1 1 5 THR CB C 12.739 0.697 4.125 1.00 . A A . 5 THR CB 1 1 8 3237 1 1 5 THR CG2 C 11.459 -0.118 4.240 1.00 . A A . 5 THR CG2 1 1 8 3238 1 1 5 THR H H 12.054 2.762 2.685 1.00 . A A . 5 THR H 1 1 8 3239 1 1 5 THR HA H 11.845 2.086 5.488 1.00 . A A . 5 THR HA 1 1 8 3240 1 1 5 THR HB H 13.505 0.222 4.721 1.00 . A A . 5 THR HB 1 1 8 3241 1 1 5 THR HG1 H 13.762 0.001 2.589 1.00 . A A . 5 THR HG1 1 1 8 3242 1 1 5 THR HG21 H 11.195 -0.512 3.269 1.00 . A A . 5 THR HG21 1 1 8 3243 1 1 5 THR HG22 H 10.661 0.514 4.601 1.00 . A A . 5 THR HG22 1 1 8 3244 1 1 5 THR HG23 H 11.613 -0.934 4.929 1.00 . A A . 5 THR HG23 1 1 8 3245 1 1 5 THR N N 11.929 2.985 3.631 1.00 . A A . 5 THR N 1 1 8 3246 1 1 5 THR O O 14.388 3.641 4.548 1.00 . A A . 5 THR O 1 1 8 3247 1 1 5 THR OG1 O 13.165 0.734 2.758 1.00 . A A . 5 THR OG1 1 1 8 3248 1 1 6 LYS C C 16.721 2.703 5.629 1.00 . A A . 6 LYS C 1 1 8 3249 1 1 6 LYS CA C 15.682 2.529 6.732 1.00 . A A . 6 LYS CA 1 1 8 3250 1 1 6 LYS CB C 16.185 1.521 7.767 1.00 . A A . 6 LYS CB 1 1 8 3251 1 1 6 LYS CD C 17.774 1.186 9.683 1.00 . A A . 6 LYS CD 1 1 8 3252 1 1 6 LYS CE C 18.799 0.068 9.569 1.00 . A A . 6 LYS CE 1 1 8 3253 1 1 6 LYS CG C 17.545 1.870 8.346 1.00 . A A . 6 LYS CG 1 1 8 3254 1 1 6 LYS H H 13.937 1.338 6.596 1.00 . A A . 6 LYS H 1 1 8 3255 1 1 6 LYS HA H 15.526 3.481 7.215 1.00 . A A . 6 LYS HA 1 1 8 3256 1 1 6 LYS HB2 H 15.473 1.471 8.578 1.00 . A A . 6 LYS HB2 1 1 8 3257 1 1 6 LYS HB3 H 16.255 0.549 7.301 1.00 . A A . 6 LYS HB3 1 1 8 3258 1 1 6 LYS HD2 H 18.133 1.916 10.394 1.00 . A A . 6 LYS HD2 1 1 8 3259 1 1 6 LYS HD3 H 16.838 0.772 10.031 1.00 . A A . 6 LYS HD3 1 1 8 3260 1 1 6 LYS HE2 H 18.323 -0.795 9.127 1.00 . A A . 6 LYS HE2 1 1 8 3261 1 1 6 LYS HE3 H 19.605 0.400 8.931 1.00 . A A . 6 LYS HE3 1 1 8 3262 1 1 6 LYS HG2 H 18.312 1.553 7.656 1.00 . A A . 6 LYS HG2 1 1 8 3263 1 1 6 LYS HG3 H 17.602 2.941 8.485 1.00 . A A . 6 LYS HG3 1 1 8 3264 1 1 6 LYS HZ1 H 19.369 0.514 11.528 1.00 . A A . 6 LYS HZ1 1 1 8 3265 1 1 6 LYS HZ2 H 20.327 -0.668 10.788 1.00 . A A . 6 LYS HZ2 1 1 8 3266 1 1 6 LYS HZ3 H 18.772 -1.056 11.329 1.00 . A A . 6 LYS HZ3 1 1 8 3267 1 1 6 LYS N N 14.405 2.092 6.179 1.00 . A A . 6 LYS N 1 1 8 3268 1 1 6 LYS NZ N 19.355 -0.313 10.897 1.00 . A A . 6 LYS NZ 1 1 8 3269 1 1 6 LYS O O 16.847 1.858 4.743 1.00 . A A . 6 LYS O 1 1 8 3270 1 1 7 GLY C C 17.950 4.849 3.509 1.00 . A A . 7 GLY C 1 1 8 3271 1 1 7 GLY CA C 18.485 4.066 4.692 1.00 . A A . 7 GLY CA 1 1 8 3272 1 1 7 GLY H H 17.321 4.441 6.420 1.00 . A A . 7 GLY H 1 1 8 3273 1 1 7 GLY HA2 H 19.286 4.627 5.150 1.00 . A A . 7 GLY HA2 1 1 8 3274 1 1 7 GLY HA3 H 18.876 3.123 4.337 1.00 . A A . 7 GLY HA3 1 1 8 3275 1 1 7 GLY N N 17.465 3.803 5.690 1.00 . A A . 7 GLY N 1 1 8 3276 1 1 7 GLY O O 18.720 5.401 2.723 1.00 . A A . 7 GLY O 1 1 8 3277 1 1 8 ILE C C 15.725 7.070 2.666 1.00 . A A . 8 ILE C 1 1 8 3278 1 1 8 ILE CA C 15.992 5.617 2.287 1.00 . A A . 8 ILE CA 1 1 8 3279 1 1 8 ILE CB C 14.665 4.954 1.872 1.00 . A A . 8 ILE CB 1 1 8 3280 1 1 8 ILE CD1 C 15.777 3.134 0.482 1.00 . A A . 8 ILE CD1 1 1 8 3281 1 1 8 ILE CG1 C 14.868 3.454 1.648 1.00 . A A . 8 ILE CG1 1 1 8 3282 1 1 8 ILE CG2 C 14.114 5.613 0.616 1.00 . A A . 8 ILE CG2 1 1 8 3283 1 1 8 ILE H H 16.068 4.437 4.041 1.00 . A A . 8 ILE H 1 1 8 3284 1 1 8 ILE HA H 16.663 5.595 1.440 1.00 . A A . 8 ILE HA 1 1 8 3285 1 1 8 ILE HB H 13.952 5.099 2.668 1.00 . A A . 8 ILE HB 1 1 8 3286 1 1 8 ILE HD11 H 15.227 2.577 -0.261 1.00 . A A . 8 ILE HD11 1 1 8 3287 1 1 8 ILE HD12 H 16.143 4.052 0.048 1.00 . A A . 8 ILE HD12 1 1 8 3288 1 1 8 ILE HD13 H 16.612 2.542 0.829 1.00 . A A . 8 ILE HD13 1 1 8 3289 1 1 8 ILE HG12 H 15.302 3.020 2.535 1.00 . A A . 8 ILE HG12 1 1 8 3290 1 1 8 ILE HG13 H 13.909 2.994 1.459 1.00 . A A . 8 ILE HG13 1 1 8 3291 1 1 8 ILE HG21 H 13.568 6.504 0.887 1.00 . A A . 8 ILE HG21 1 1 8 3292 1 1 8 ILE HG22 H 14.931 5.877 -0.039 1.00 . A A . 8 ILE HG22 1 1 8 3293 1 1 8 ILE HG23 H 13.453 4.926 0.110 1.00 . A A . 8 ILE HG23 1 1 8 3294 1 1 8 ILE N N 16.628 4.896 3.382 1.00 . A A . 8 ILE N 1 1 8 3295 1 1 8 ILE O O 14.994 7.350 3.617 1.00 . A A . 8 ILE O 1 1 8 3296 1 1 9 LYS C C 14.663 9.778 2.240 1.00 . A A . 9 LYS C 1 1 8 3297 1 1 9 LYS CA C 16.144 9.416 2.170 1.00 . A A . 9 LYS CA 1 1 8 3298 1 1 9 LYS CB C 16.830 10.238 1.077 1.00 . A A . 9 LYS CB 1 1 8 3299 1 1 9 LYS CD C 19.211 11.000 1.321 1.00 . A A . 9 LYS CD 1 1 8 3300 1 1 9 LYS CE C 19.583 11.913 0.163 1.00 . A A . 9 LYS CE 1 1 8 3301 1 1 9 LYS CG C 18.291 9.878 0.871 1.00 . A A . 9 LYS CG 1 1 8 3302 1 1 9 LYS H H 16.890 7.705 1.171 1.00 . A A . 9 LYS H 1 1 8 3303 1 1 9 LYS HA H 16.602 9.642 3.121 1.00 . A A . 9 LYS HA 1 1 8 3304 1 1 9 LYS HB2 H 16.307 10.083 0.145 1.00 . A A . 9 LYS HB2 1 1 8 3305 1 1 9 LYS HB3 H 16.773 11.285 1.342 1.00 . A A . 9 LYS HB3 1 1 8 3306 1 1 9 LYS HD2 H 18.709 11.585 2.078 1.00 . A A . 9 LYS HD2 1 1 8 3307 1 1 9 LYS HD3 H 20.113 10.571 1.735 1.00 . A A . 9 LYS HD3 1 1 8 3308 1 1 9 LYS HE2 H 19.208 11.483 -0.753 1.00 . A A . 9 LYS HE2 1 1 8 3309 1 1 9 LYS HE3 H 19.126 12.878 0.321 1.00 . A A . 9 LYS HE3 1 1 8 3310 1 1 9 LYS HG2 H 18.517 8.990 1.444 1.00 . A A . 9 LYS HG2 1 1 8 3311 1 1 9 LYS HG3 H 18.460 9.685 -0.178 1.00 . A A . 9 LYS HG3 1 1 8 3312 1 1 9 LYS HZ1 H 21.301 13.100 0.086 1.00 . A A . 9 LYS HZ1 1 1 8 3313 1 1 9 LYS HZ2 H 21.395 11.697 -0.855 1.00 . A A . 9 LYS HZ2 1 1 8 3314 1 1 9 LYS HZ3 H 21.539 11.598 0.828 1.00 . A A . 9 LYS HZ3 1 1 8 3315 1 1 9 LYS N N 16.319 7.991 1.916 1.00 . A A . 9 LYS N 1 1 8 3316 1 1 9 LYS NZ N 21.058 12.089 0.048 1.00 . A A . 9 LYS NZ 1 1 8 3317 1 1 9 LYS O O 13.857 9.292 1.447 1.00 . A A . 9 LYS O 1 1 8 3318 1 1 10 CYS C C 12.808 12.578 3.224 1.00 . A A . 10 CYS C 1 1 8 3319 1 1 10 CYS CA C 12.930 11.063 3.366 1.00 . A A . 10 CYS CA 1 1 8 3320 1 1 10 CYS CB C 12.406 10.625 4.735 1.00 . A A . 10 CYS CB 1 1 8 3321 1 1 10 CYS H H 15.002 10.989 3.795 1.00 . A A . 10 CYS H 1 1 8 3322 1 1 10 CYS HA H 12.338 10.593 2.596 1.00 . A A . 10 CYS HA 1 1 8 3323 1 1 10 CYS HB2 H 11.411 11.023 4.875 1.00 . A A . 10 CYS HB2 1 1 8 3324 1 1 10 CYS HB3 H 12.364 9.546 4.767 1.00 . A A . 10 CYS HB3 1 1 8 3325 1 1 10 CYS N N 14.313 10.635 3.193 1.00 . A A . 10 CYS N 1 1 8 3326 1 1 10 CYS O O 12.350 13.262 4.138 1.00 . A A . 10 CYS O 1 1 8 3327 1 1 10 CYS SG S 13.427 11.182 6.136 1.00 . A A . 10 CYS SG 1 1 8 3328 1 1 11 ASN C C 11.748 14.945 1.403 1.00 . A A . 11 ASN C 1 1 8 3329 1 1 11 ASN CA C 13.158 14.527 1.808 1.00 . A A . 11 ASN CA 1 1 8 3330 1 1 11 ASN CB C 14.151 14.909 0.709 1.00 . A A . 11 ASN CB 1 1 8 3331 1 1 11 ASN CG C 15.576 14.992 1.220 1.00 . A A . 11 ASN CG 1 1 8 3332 1 1 11 ASN H H 13.577 12.497 1.380 1.00 . A A . 11 ASN H 1 1 8 3333 1 1 11 ASN HA H 13.427 15.042 2.718 1.00 . A A . 11 ASN HA 1 1 8 3334 1 1 11 ASN HB2 H 14.113 14.167 -0.076 1.00 . A A . 11 ASN HB2 1 1 8 3335 1 1 11 ASN HB3 H 13.877 15.871 0.302 1.00 . A A . 11 ASN HB3 1 1 8 3336 1 1 11 ASN HD21 H 15.344 16.925 1.625 1.00 . A A . 11 ASN HD21 1 1 8 3337 1 1 11 ASN HD22 H 16.897 16.262 1.992 1.00 . A A . 11 ASN HD22 1 1 8 3338 1 1 11 ASN N N 13.221 13.094 2.071 1.00 . A A . 11 ASN N 1 1 8 3339 1 1 11 ASN ND2 N 15.980 16.179 1.656 1.00 . A A . 11 ASN ND2 1 1 8 3340 1 1 11 ASN O O 11.353 16.096 1.589 1.00 . A A . 11 ASN O 1 1 8 3341 1 1 11 ASN OD1 O 16.305 14.000 1.222 1.00 . A A . 11 ASN OD1 1 1 8 3342 1 1 12 ASP C C 8.768 13.013 0.521 1.00 . A A . 12 ASP C 1 1 8 3343 1 1 12 ASP CA C 9.626 14.270 0.421 1.00 . A A . 12 ASP CA 1 1 8 3344 1 1 12 ASP CB C 9.614 14.798 -1.015 1.00 . A A . 12 ASP CB 1 1 8 3345 1 1 12 ASP CG C 8.386 15.634 -1.314 1.00 . A A . 12 ASP CG 1 1 8 3346 1 1 12 ASP H H 11.365 13.102 0.729 1.00 . A A . 12 ASP H 1 1 8 3347 1 1 12 ASP HA H 9.215 15.024 1.075 1.00 . A A . 12 ASP HA 1 1 8 3348 1 1 12 ASP HB2 H 10.490 15.410 -1.174 1.00 . A A . 12 ASP HB2 1 1 8 3349 1 1 12 ASP HB3 H 9.635 13.962 -1.699 1.00 . A A . 12 ASP HB3 1 1 8 3350 1 1 12 ASP N N 10.993 14.001 0.851 1.00 . A A . 12 ASP N 1 1 8 3351 1 1 12 ASP O O 7.712 12.919 -0.105 1.00 . A A . 12 ASP O 1 1 8 3352 1 1 12 ASP OD1 O 8.282 16.152 -2.446 1.00 . A A . 12 ASP OD1 1 1 8 3353 1 1 12 ASP OD2 O 7.527 15.769 -0.418 1.00 . A A . 12 ASP OD2 1 1 8 3354 1 1 13 ILE C C 8.548 10.342 2.946 1.00 . A A . 13 ILE C 1 1 8 3355 1 1 13 ILE CA C 8.504 10.798 1.492 1.00 . A A . 13 ILE CA 1 1 8 3356 1 1 13 ILE CB C 9.075 9.681 0.598 1.00 . A A . 13 ILE CB 1 1 8 3357 1 1 13 ILE CD1 C 7.968 7.819 -0.738 1.00 . A A . 13 ILE CD1 1 1 8 3358 1 1 13 ILE CG1 C 8.155 8.459 0.620 1.00 . A A . 13 ILE CG1 1 1 8 3359 1 1 13 ILE CG2 C 10.477 9.303 1.054 1.00 . A A . 13 ILE CG2 1 1 8 3360 1 1 13 ILE H H 10.077 12.183 1.783 1.00 . A A . 13 ILE H 1 1 8 3361 1 1 13 ILE HA H 7.474 10.966 1.209 1.00 . A A . 13 ILE HA 1 1 8 3362 1 1 13 ILE HB H 9.140 10.056 -0.412 1.00 . A A . 13 ILE HB 1 1 8 3363 1 1 13 ILE HD11 H 8.136 8.556 -1.510 1.00 . A A . 13 ILE HD11 1 1 8 3364 1 1 13 ILE HD12 H 8.671 7.008 -0.854 1.00 . A A . 13 ILE HD12 1 1 8 3365 1 1 13 ILE HD13 H 6.961 7.437 -0.820 1.00 . A A . 13 ILE HD13 1 1 8 3366 1 1 13 ILE HG12 H 8.569 7.716 1.282 1.00 . A A . 13 ILE HG12 1 1 8 3367 1 1 13 ILE HG13 H 7.182 8.758 0.983 1.00 . A A . 13 ILE HG13 1 1 8 3368 1 1 13 ILE HG21 H 10.428 8.864 2.039 1.00 . A A . 13 ILE HG21 1 1 8 3369 1 1 13 ILE HG22 H 10.899 8.589 0.363 1.00 . A A . 13 ILE HG22 1 1 8 3370 1 1 13 ILE HG23 H 11.096 10.187 1.084 1.00 . A A . 13 ILE HG23 1 1 8 3371 1 1 13 ILE N N 9.229 12.049 1.310 1.00 . A A . 13 ILE N 1 1 8 3372 1 1 13 ILE O O 9.562 10.499 3.627 1.00 . A A . 13 ILE O 1 1 8 3373 1 1 14 HIS C C 7.672 7.804 4.866 1.00 . A A . 14 HIS C 1 1 8 3374 1 1 14 HIS CA C 7.355 9.294 4.791 1.00 . A A . 14 HIS CA 1 1 8 3375 1 1 14 HIS CB C 5.960 9.560 5.360 1.00 . A A . 14 HIS CB 1 1 8 3376 1 1 14 HIS CD2 C 4.507 7.576 4.535 1.00 . A A . 14 HIS CD2 1 1 8 3377 1 1 14 HIS CE1 C 3.135 8.699 3.245 1.00 . A A . 14 HIS CE1 1 1 8 3378 1 1 14 HIS CG C 4.864 8.881 4.598 1.00 . A A . 14 HIS CG 1 1 8 3379 1 1 14 HIS H H 6.666 9.679 2.827 1.00 . A A . 14 HIS H 1 1 8 3380 1 1 14 HIS HA H 8.082 9.834 5.378 1.00 . A A . 14 HIS HA 1 1 8 3381 1 1 14 HIS HB2 H 5.922 9.208 6.380 1.00 . A A . 14 HIS HB2 1 1 8 3382 1 1 14 HIS HB3 H 5.768 10.623 5.343 1.00 . A A . 14 HIS HB3 1 1 8 3383 1 1 14 HIS HD1 H 3.985 10.523 3.614 1.00 . A A . 14 HIS HD1 1 1 8 3384 1 1 14 HIS HD2 H 4.981 6.755 5.054 1.00 . A A . 14 HIS HD2 1 1 8 3385 1 1 14 HIS HE1 H 2.334 8.944 2.563 1.00 . A A . 14 HIS HE1 1 1 8 3386 1 1 14 HIS N N 7.442 9.776 3.417 1.00 . A A . 14 HIS N 1 1 8 3387 1 1 14 HIS ND1 N 3.986 9.557 3.779 1.00 . A A . 14 HIS ND1 1 1 8 3388 1 1 14 HIS NE2 N 3.430 7.490 3.687 1.00 . A A . 14 HIS NE2 1 1 8 3389 1 1 14 HIS O O 7.568 7.086 3.871 1.00 . A A . 14 HIS O 1 1 8 3390 1 1 15 CYS C C 7.164 5.146 6.683 1.00 . A A . 15 CYS C 1 1 8 3391 1 1 15 CYS CA C 8.394 5.941 6.256 1.00 . A A . 15 CYS CA 1 1 8 3392 1 1 15 CYS CB C 9.494 5.806 7.311 1.00 . A A . 15 CYS CB 1 1 8 3393 1 1 15 CYS H H 8.124 7.967 6.807 1.00 . A A . 15 CYS H 1 1 8 3394 1 1 15 CYS HA H 8.756 5.546 5.319 1.00 . A A . 15 CYS HA 1 1 8 3395 1 1 15 CYS HB2 H 9.039 5.750 8.289 1.00 . A A . 15 CYS HB2 1 1 8 3396 1 1 15 CYS HB3 H 10.050 4.898 7.126 1.00 . A A . 15 CYS HB3 1 1 8 3397 1 1 15 CYS N N 8.060 7.345 6.051 1.00 . A A . 15 CYS N 1 1 8 3398 1 1 15 CYS O O 6.211 5.702 7.231 1.00 . A A . 15 CYS O 1 1 8 3399 1 1 15 CYS SG S 10.679 7.189 7.332 1.00 . A A . 15 CYS SG 1 1 8 3400 1 1 16 CYS C C 5.868 2.949 8.297 1.00 . A A . 16 CYS C 1 1 8 3401 1 1 16 CYS CA C 6.080 2.969 6.786 1.00 . A A . 16 CYS CA 1 1 8 3402 1 1 16 CYS CB C 6.335 1.549 6.277 1.00 . A A . 16 CYS CB 1 1 8 3403 1 1 16 CYS H H 7.979 3.457 5.990 1.00 . A A . 16 CYS H 1 1 8 3404 1 1 16 CYS HA H 5.189 3.356 6.315 1.00 . A A . 16 CYS HA 1 1 8 3405 1 1 16 CYS HB2 H 7.401 1.385 6.211 1.00 . A A . 16 CYS HB2 1 1 8 3406 1 1 16 CYS HB3 H 5.909 0.843 6.975 1.00 . A A . 16 CYS HB3 1 1 8 3407 1 1 16 CYS N N 7.191 3.842 6.429 1.00 . A A . 16 CYS N 1 1 8 3408 1 1 16 CYS O O 6.800 3.173 9.068 1.00 . A A . 16 CYS O 1 1 8 3409 1 1 16 CYS SG S 5.621 1.208 4.636 1.00 . A A . 16 CYS SG 1 1 8 3410 1 1 17 SER C C 5.266 1.729 10.889 1.00 . A A . 17 SER C 1 1 8 3411 1 1 17 SER CA C 4.298 2.632 10.131 1.00 . A A . 17 SER CA 1 1 8 3412 1 1 17 SER CB C 2.864 2.135 10.321 1.00 . A A . 17 SER CB 1 1 8 3413 1 1 17 SER H H 3.933 2.508 8.049 1.00 . A A . 17 SER H 1 1 8 3414 1 1 17 SER HA H 4.378 3.635 10.523 1.00 . A A . 17 SER HA 1 1 8 3415 1 1 17 SER HB2 H 2.860 1.056 10.347 1.00 . A A . 17 SER HB2 1 1 8 3416 1 1 17 SER HB3 H 2.473 2.520 11.252 1.00 . A A . 17 SER HB3 1 1 8 3417 1 1 17 SER HG H 1.276 1.979 9.184 1.00 . A A . 17 SER HG 1 1 8 3418 1 1 17 SER N N 4.634 2.678 8.713 1.00 . A A . 17 SER N 1 1 8 3419 1 1 17 SER O O 5.174 0.504 10.819 1.00 . A A . 17 SER O 1 1 8 3420 1 1 17 SER OG O 2.029 2.570 9.261 1.00 . A A . 17 SER OG 1 1 8 3421 1 1 18 GLY C C 8.564 2.161 12.278 1.00 . A A . 18 GLY C 1 1 8 3422 1 1 18 GLY CA C 7.166 1.582 12.377 1.00 . A A . 18 GLY CA 1 1 8 3423 1 1 18 GLY H H 6.219 3.324 11.635 1.00 . A A . 18 GLY H 1 1 8 3424 1 1 18 GLY HA2 H 6.865 1.569 13.414 1.00 . A A . 18 GLY HA2 1 1 8 3425 1 1 18 GLY HA3 H 7.182 0.568 12.005 1.00 . A A . 18 GLY HA3 1 1 8 3426 1 1 18 GLY N N 6.194 2.344 11.616 1.00 . A A . 18 GLY N 1 1 8 3427 1 1 18 GLY O O 9.461 1.769 13.026 1.00 . A A . 18 GLY O 1 1 8 3428 1 1 19 LEU C C 9.968 5.230 11.414 1.00 . A A . 19 LEU C 1 1 8 3429 1 1 19 LEU CA C 10.050 3.728 11.157 1.00 . A A . 19 LEU CA 1 1 8 3430 1 1 19 LEU CB C 10.557 3.470 9.737 1.00 . A A . 19 LEU CB 1 1 8 3431 1 1 19 LEU CD1 C 11.214 1.862 7.929 1.00 . A A . 19 LEU CD1 1 1 8 3432 1 1 19 LEU CD2 C 12.184 1.626 10.223 1.00 . A A . 19 LEU CD2 1 1 8 3433 1 1 19 LEU CG C 10.957 2.029 9.419 1.00 . A A . 19 LEU CG 1 1 8 3434 1 1 19 LEU H H 7.998 3.366 10.787 1.00 . A A . 19 LEU H 1 1 8 3435 1 1 19 LEU HA H 10.741 3.292 11.862 1.00 . A A . 19 LEU HA 1 1 8 3436 1 1 19 LEU HB2 H 9.775 3.755 9.050 1.00 . A A . 19 LEU HB2 1 1 8 3437 1 1 19 LEU HB3 H 11.422 4.098 9.576 1.00 . A A . 19 LEU HB3 1 1 8 3438 1 1 19 LEU HD11 H 12.050 2.480 7.638 1.00 . A A . 19 LEU HD11 1 1 8 3439 1 1 19 LEU HD12 H 10.336 2.161 7.377 1.00 . A A . 19 LEU HD12 1 1 8 3440 1 1 19 LEU HD13 H 11.439 0.827 7.716 1.00 . A A . 19 LEU HD13 1 1 8 3441 1 1 19 LEU HD21 H 13.060 2.100 9.804 1.00 . A A . 19 LEU HD21 1 1 8 3442 1 1 19 LEU HD22 H 12.304 0.553 10.184 1.00 . A A . 19 LEU HD22 1 1 8 3443 1 1 19 LEU HD23 H 12.061 1.939 11.249 1.00 . A A . 19 LEU HD23 1 1 8 3444 1 1 19 LEU HG H 10.145 1.368 9.692 1.00 . A A . 19 LEU HG 1 1 8 3445 1 1 19 LEU N N 8.751 3.095 11.353 1.00 . A A . 19 LEU N 1 1 8 3446 1 1 19 LEU O O 8.886 5.816 11.393 1.00 . A A . 19 LEU O 1 1 8 3447 1 1 20 LYS C C 12.050 7.984 10.876 1.00 . A A . 20 LYS C 1 1 8 3448 1 1 20 LYS CA C 11.181 7.281 11.914 1.00 . A A . 20 LYS CA 1 1 8 3449 1 1 20 LYS CB C 11.730 7.544 13.318 1.00 . A A . 20 LYS CB 1 1 8 3450 1 1 20 LYS CD C 11.174 7.995 15.725 1.00 . A A . 20 LYS CD 1 1 8 3451 1 1 20 LYS CE C 10.418 9.270 16.069 1.00 . A A . 20 LYS CE 1 1 8 3452 1 1 20 LYS CG C 10.690 7.397 14.415 1.00 . A A . 20 LYS CG 1 1 8 3453 1 1 20 LYS H H 11.950 5.325 11.659 1.00 . A A . 20 LYS H 1 1 8 3454 1 1 20 LYS HA H 10.177 7.672 11.850 1.00 . A A . 20 LYS HA 1 1 8 3455 1 1 20 LYS HB2 H 12.532 6.847 13.514 1.00 . A A . 20 LYS HB2 1 1 8 3456 1 1 20 LYS HB3 H 12.122 8.550 13.355 1.00 . A A . 20 LYS HB3 1 1 8 3457 1 1 20 LYS HD2 H 11.024 7.277 16.517 1.00 . A A . 20 LYS HD2 1 1 8 3458 1 1 20 LYS HD3 H 12.227 8.224 15.640 1.00 . A A . 20 LYS HD3 1 1 8 3459 1 1 20 LYS HE2 H 9.383 9.144 15.791 1.00 . A A . 20 LYS HE2 1 1 8 3460 1 1 20 LYS HE3 H 10.487 9.437 17.134 1.00 . A A . 20 LYS HE3 1 1 8 3461 1 1 20 LYS HG2 H 9.786 7.904 14.113 1.00 . A A . 20 LYS HG2 1 1 8 3462 1 1 20 LYS HG3 H 10.483 6.347 14.564 1.00 . A A . 20 LYS HG3 1 1 8 3463 1 1 20 LYS HZ1 H 10.242 10.879 14.750 1.00 . A A . 20 LYS HZ1 1 1 8 3464 1 1 20 LYS HZ2 H 11.776 10.168 14.760 1.00 . A A . 20 LYS HZ2 1 1 8 3465 1 1 20 LYS HZ3 H 11.298 11.164 16.041 1.00 . A A . 20 LYS HZ3 1 1 8 3466 1 1 20 LYS N N 11.120 5.847 11.656 1.00 . A A . 20 LYS N 1 1 8 3467 1 1 20 LYS NZ N 10.972 10.453 15.356 1.00 . A A . 20 LYS NZ 1 1 8 3468 1 1 20 LYS O O 13.160 7.542 10.579 1.00 . A A . 20 LYS O 1 1 8 3469 1 1 21 CYS C C 13.251 10.810 9.984 1.00 . A A . 21 CYS C 1 1 8 3470 1 1 21 CYS CA C 12.268 9.847 9.325 1.00 . A A . 21 CYS CA 1 1 8 3471 1 1 21 CYS CB C 11.293 10.624 8.439 1.00 . A A . 21 CYS CB 1 1 8 3472 1 1 21 CYS H H 10.648 9.384 10.607 1.00 . A A . 21 CYS H 1 1 8 3473 1 1 21 CYS HA H 12.821 9.151 8.713 1.00 . A A . 21 CYS HA 1 1 8 3474 1 1 21 CYS HB2 H 10.797 9.935 7.771 1.00 . A A . 21 CYS HB2 1 1 8 3475 1 1 21 CYS HB3 H 10.555 11.105 9.064 1.00 . A A . 21 CYS HB3 1 1 8 3476 1 1 21 CYS N N 11.539 9.081 10.329 1.00 . A A . 21 CYS N 1 1 8 3477 1 1 21 CYS O O 12.876 11.903 10.410 1.00 . A A . 21 CYS O 1 1 8 3478 1 1 21 CYS SG S 12.081 11.911 7.418 1.00 . A A . 21 CYS SG 1 1 8 3479 1 1 22 ASP C C 15.678 12.556 9.942 1.00 . A A . 22 ASP C 1 1 8 3480 1 1 22 ASP CA C 15.550 11.222 10.671 1.00 . A A . 22 ASP CA 1 1 8 3481 1 1 22 ASP CB C 16.890 10.486 10.654 1.00 . A A . 22 ASP CB 1 1 8 3482 1 1 22 ASP CG C 17.798 10.911 11.792 1.00 . A A . 22 ASP CG 1 1 8 3483 1 1 22 ASP H H 14.749 9.515 9.708 1.00 . A A . 22 ASP H 1 1 8 3484 1 1 22 ASP HA H 15.267 11.412 11.695 1.00 . A A . 22 ASP HA 1 1 8 3485 1 1 22 ASP HB2 H 16.712 9.424 10.738 1.00 . A A . 22 ASP HB2 1 1 8 3486 1 1 22 ASP HB3 H 17.394 10.689 9.720 1.00 . A A . 22 ASP HB3 1 1 8 3487 1 1 22 ASP N N 14.511 10.396 10.065 1.00 . A A . 22 ASP N 1 1 8 3488 1 1 22 ASP O O 16.217 12.621 8.837 1.00 . A A . 22 ASP O 1 1 8 3489 1 1 22 ASP OD1 O 19.032 10.779 11.648 1.00 . A A . 22 ASP OD1 1 1 8 3490 1 1 22 ASP OD2 O 17.275 11.376 12.826 1.00 . A A . 22 ASP OD2 1 1 8 3491 1 1 23 SER C C 16.656 15.500 10.008 1.00 . A A . 23 SER C 1 1 8 3492 1 1 23 SER CA C 15.233 14.949 9.976 1.00 . A A . 23 SER CA 1 1 8 3493 1 1 23 SER CB C 14.289 15.898 10.716 1.00 . A A . 23 SER CB 1 1 8 3494 1 1 23 SER H H 14.762 13.501 11.447 1.00 . A A . 23 SER H 1 1 8 3495 1 1 23 SER HA H 14.915 14.868 8.947 1.00 . A A . 23 SER HA 1 1 8 3496 1 1 23 SER HB2 H 14.498 15.856 11.775 1.00 . A A . 23 SER HB2 1 1 8 3497 1 1 23 SER HB3 H 14.443 16.906 10.359 1.00 . A A . 23 SER HB3 1 1 8 3498 1 1 23 SER HG H 12.398 15.869 11.227 1.00 . A A . 23 SER HG 1 1 8 3499 1 1 23 SER N N 15.179 13.617 10.567 1.00 . A A . 23 SER N 1 1 8 3500 1 1 23 SER O O 16.961 16.501 9.360 1.00 . A A . 23 SER O 1 1 8 3501 1 1 23 SER OG O 12.935 15.539 10.503 1.00 . A A . 23 SER OG 1 1 8 3502 1 1 24 LYS C C 19.750 14.702 9.740 1.00 . A A . 24 LYS C 1 1 8 3503 1 1 24 LYS CA C 18.913 15.259 10.887 1.00 . A A . 24 LYS CA 1 1 8 3504 1 1 24 LYS CB C 19.494 14.800 12.226 1.00 . A A . 24 LYS CB 1 1 8 3505 1 1 24 LYS CD C 19.729 16.707 13.844 1.00 . A A . 24 LYS CD 1 1 8 3506 1 1 24 LYS CE C 18.936 18.002 13.754 1.00 . A A . 24 LYS CE 1 1 8 3507 1 1 24 LYS CG C 18.892 15.510 13.426 1.00 . A A . 24 LYS CG 1 1 8 3508 1 1 24 LYS H H 17.219 14.047 11.261 1.00 . A A . 24 LYS H 1 1 8 3509 1 1 24 LYS HA H 18.939 16.338 10.844 1.00 . A A . 24 LYS HA 1 1 8 3510 1 1 24 LYS HB2 H 19.319 13.740 12.336 1.00 . A A . 24 LYS HB2 1 1 8 3511 1 1 24 LYS HB3 H 20.559 14.982 12.224 1.00 . A A . 24 LYS HB3 1 1 8 3512 1 1 24 LYS HD2 H 20.056 16.568 14.864 1.00 . A A . 24 LYS HD2 1 1 8 3513 1 1 24 LYS HD3 H 20.591 16.777 13.195 1.00 . A A . 24 LYS HD3 1 1 8 3514 1 1 24 LYS HE2 H 19.597 18.792 13.434 1.00 . A A . 24 LYS HE2 1 1 8 3515 1 1 24 LYS HE3 H 18.147 17.875 13.027 1.00 . A A . 24 LYS HE3 1 1 8 3516 1 1 24 LYS HG2 H 17.899 15.851 13.170 1.00 . A A . 24 LYS HG2 1 1 8 3517 1 1 24 LYS HG3 H 18.834 14.816 14.252 1.00 . A A . 24 LYS HG3 1 1 8 3518 1 1 24 LYS HZ1 H 17.297 18.309 15.011 1.00 . A A . 24 LYS HZ1 1 1 8 3519 1 1 24 LYS HZ2 H 18.595 19.350 15.313 1.00 . A A . 24 LYS HZ2 1 1 8 3520 1 1 24 LYS HZ3 H 18.673 17.735 15.810 1.00 . A A . 24 LYS HZ3 1 1 8 3521 1 1 24 LYS N N 17.522 14.839 10.768 1.00 . A A . 24 LYS N 1 1 8 3522 1 1 24 LYS NZ N 18.333 18.375 15.064 1.00 . A A . 24 LYS NZ 1 1 8 3523 1 1 24 LYS O O 20.557 15.415 9.144 1.00 . A A . 24 LYS O 1 1 8 3524 1 1 25 ARG C C 19.426 12.657 7.103 1.00 . A A . 25 ARG C 1 1 8 3525 1 1 25 ARG CA C 20.286 12.771 8.358 1.00 . A A . 25 ARG CA 1 1 8 3526 1 1 25 ARG CB C 20.750 11.382 8.799 1.00 . A A . 25 ARG CB 1 1 8 3527 1 1 25 ARG CD C 23.144 11.681 9.503 1.00 . A A . 25 ARG CD 1 1 8 3528 1 1 25 ARG CG C 21.723 11.406 9.967 1.00 . A A . 25 ARG CG 1 1 8 3529 1 1 25 ARG CZ C 25.223 10.415 9.157 1.00 . A A . 25 ARG CZ 1 1 8 3530 1 1 25 ARG H H 18.893 12.907 9.946 1.00 . A A . 25 ARG H 1 1 8 3531 1 1 25 ARG HA H 21.152 13.376 8.134 1.00 . A A . 25 ARG HA 1 1 8 3532 1 1 25 ARG HB2 H 19.887 10.802 9.090 1.00 . A A . 25 ARG HB2 1 1 8 3533 1 1 25 ARG HB3 H 21.235 10.896 7.966 1.00 . A A . 25 ARG HB3 1 1 8 3534 1 1 25 ARG HD2 H 23.106 12.221 8.569 1.00 . A A . 25 ARG HD2 1 1 8 3535 1 1 25 ARG HD3 H 23.641 12.285 10.247 1.00 . A A . 25 ARG HD3 1 1 8 3536 1 1 25 ARG HE H 23.405 9.606 9.288 1.00 . A A . 25 ARG HE 1 1 8 3537 1 1 25 ARG HG2 H 21.424 12.183 10.656 1.00 . A A . 25 ARG HG2 1 1 8 3538 1 1 25 ARG HG3 H 21.694 10.450 10.467 1.00 . A A . 25 ARG HG3 1 1 8 3539 1 1 25 ARG HH11 H 25.461 12.415 9.311 1.00 . A A . 25 ARG HH11 1 1 8 3540 1 1 25 ARG HH12 H 26.919 11.511 9.067 1.00 . A A . 25 ARG HH12 1 1 8 3541 1 1 25 ARG HH21 H 25.317 8.405 8.967 1.00 . A A . 25 ARG HH21 1 1 8 3542 1 1 25 ARG HH22 H 26.836 9.230 8.870 1.00 . A A . 25 ARG HH22 1 1 8 3543 1 1 25 ARG N N 19.550 13.424 9.435 1.00 . A A . 25 ARG N 1 1 8 3544 1 1 25 ARG NE N 23.904 10.449 9.308 1.00 . A A . 25 ARG NE 1 1 8 3545 1 1 25 ARG NH1 N 25.926 11.540 9.180 1.00 . A A . 25 ARG NH1 1 1 8 3546 1 1 25 ARG NH2 N 25.843 9.255 8.984 1.00 . A A . 25 ARG NH2 1 1 8 3547 1 1 25 ARG O O 19.841 12.067 6.105 1.00 . A A . 25 ARG O 1 1 8 3548 1 1 26 LYS C C 17.123 11.763 5.523 1.00 . A A . 26 LYS C 1 1 8 3549 1 1 26 LYS CA C 17.308 13.190 6.028 1.00 . A A . 26 LYS CA 1 1 8 3550 1 1 26 LYS CB C 17.825 14.080 4.897 1.00 . A A . 26 LYS CB 1 1 8 3551 1 1 26 LYS CD C 19.456 15.974 5.146 1.00 . A A . 26 LYS CD 1 1 8 3552 1 1 26 LYS CE C 19.698 17.329 5.794 1.00 . A A . 26 LYS CE 1 1 8 3553 1 1 26 LYS CG C 18.011 15.532 5.301 1.00 . A A . 26 LYS CG 1 1 8 3554 1 1 26 LYS H H 17.953 13.682 7.984 1.00 . A A . 26 LYS H 1 1 8 3555 1 1 26 LYS HA H 16.354 13.567 6.364 1.00 . A A . 26 LYS HA 1 1 8 3556 1 1 26 LYS HB2 H 18.778 13.698 4.560 1.00 . A A . 26 LYS HB2 1 1 8 3557 1 1 26 LYS HB3 H 17.123 14.044 4.076 1.00 . A A . 26 LYS HB3 1 1 8 3558 1 1 26 LYS HD2 H 20.100 15.244 5.613 1.00 . A A . 26 LYS HD2 1 1 8 3559 1 1 26 LYS HD3 H 19.691 16.042 4.093 1.00 . A A . 26 LYS HD3 1 1 8 3560 1 1 26 LYS HE2 H 19.009 17.448 6.616 1.00 . A A . 26 LYS HE2 1 1 8 3561 1 1 26 LYS HE3 H 20.711 17.358 6.167 1.00 . A A . 26 LYS HE3 1 1 8 3562 1 1 26 LYS HG2 H 17.387 16.154 4.677 1.00 . A A . 26 LYS HG2 1 1 8 3563 1 1 26 LYS HG3 H 17.718 15.649 6.335 1.00 . A A . 26 LYS HG3 1 1 8 3564 1 1 26 LYS HZ1 H 19.323 18.072 3.879 1.00 . A A . 26 LYS HZ1 1 1 8 3565 1 1 26 LYS HZ2 H 20.353 19.045 4.801 1.00 . A A . 26 LYS HZ2 1 1 8 3566 1 1 26 LYS HZ3 H 18.692 19.031 5.121 1.00 . A A . 26 LYS HZ3 1 1 8 3567 1 1 26 LYS N N 18.227 13.226 7.160 1.00 . A A . 26 LYS N 1 1 8 3568 1 1 26 LYS NZ N 19.503 18.448 4.832 1.00 . A A . 26 LYS NZ 1 1 8 3569 1 1 26 LYS O O 17.088 11.521 4.316 1.00 . A A . 26 LYS O 1 1 8 3570 1 1 27 VAL C C 16.013 8.685 7.167 1.00 . A A . 27 VAL C 1 1 8 3571 1 1 27 VAL CA C 16.820 9.418 6.101 1.00 . A A . 27 VAL CA 1 1 8 3572 1 1 27 VAL CB C 18.172 8.704 5.915 1.00 . A A . 27 VAL CB 1 1 8 3573 1 1 27 VAL CG1 C 18.880 9.216 4.671 1.00 . A A . 27 VAL CG1 1 1 8 3574 1 1 27 VAL CG2 C 19.044 8.886 7.148 1.00 . A A . 27 VAL CG2 1 1 8 3575 1 1 27 VAL H H 17.040 11.076 7.398 1.00 . A A . 27 VAL H 1 1 8 3576 1 1 27 VAL HA H 16.283 9.376 5.165 1.00 . A A . 27 VAL HA 1 1 8 3577 1 1 27 VAL HB H 17.983 7.648 5.786 1.00 . A A . 27 VAL HB 1 1 8 3578 1 1 27 VAL HG11 H 19.866 8.779 4.612 1.00 . A A . 27 VAL HG11 1 1 8 3579 1 1 27 VAL HG12 H 18.311 8.943 3.794 1.00 . A A . 27 VAL HG12 1 1 8 3580 1 1 27 VAL HG13 H 18.967 10.292 4.723 1.00 . A A . 27 VAL HG13 1 1 8 3581 1 1 27 VAL HG21 H 19.577 9.822 7.076 1.00 . A A . 27 VAL HG21 1 1 8 3582 1 1 27 VAL HG22 H 18.422 8.894 8.032 1.00 . A A . 27 VAL HG22 1 1 8 3583 1 1 27 VAL HG23 H 19.751 8.072 7.213 1.00 . A A . 27 VAL HG23 1 1 8 3584 1 1 27 VAL N N 17.004 10.821 6.453 1.00 . A A . 27 VAL N 1 1 8 3585 1 1 27 VAL O O 16.050 9.043 8.345 1.00 . A A . 27 VAL O 1 1 8 3586 1 1 28 CYS C C 15.333 5.936 8.500 1.00 . A A . 28 CYS C 1 1 8 3587 1 1 28 CYS CA C 14.465 6.873 7.664 1.00 . A A . 28 CYS CA 1 1 8 3588 1 1 28 CYS CB C 13.423 6.065 6.889 1.00 . A A . 28 CYS CB 1 1 8 3589 1 1 28 CYS H H 15.293 7.421 5.795 1.00 . A A . 28 CYS H 1 1 8 3590 1 1 28 CYS HA H 13.957 7.559 8.325 1.00 . A A . 28 CYS HA 1 1 8 3591 1 1 28 CYS HB2 H 13.926 5.466 6.143 1.00 . A A . 28 CYS HB2 1 1 8 3592 1 1 28 CYS HB3 H 12.901 5.414 7.574 1.00 . A A . 28 CYS HB3 1 1 8 3593 1 1 28 CYS N N 15.283 7.658 6.747 1.00 . A A . 28 CYS N 1 1 8 3594 1 1 28 CYS O O 16.431 5.559 8.091 1.00 . A A . 28 CYS O 1 1 8 3595 1 1 28 CYS SG S 12.179 7.084 6.033 1.00 . A A . 28 CYS SG 1 1 8 3596 1 1 29 VAL C C 14.600 3.832 11.406 1.00 . A A . 29 VAL C 1 1 8 3597 1 1 29 VAL CA C 15.559 4.670 10.566 1.00 . A A . 29 VAL CA 1 1 8 3598 1 1 29 VAL CB C 16.495 5.454 11.505 1.00 . A A . 29 VAL CB 1 1 8 3599 1 1 29 VAL CG1 C 17.692 5.993 10.738 1.00 . A A . 29 VAL CG1 1 1 8 3600 1 1 29 VAL CG2 C 15.738 6.582 12.190 1.00 . A A . 29 VAL CG2 1 1 8 3601 1 1 29 VAL H H 13.951 5.898 9.944 1.00 . A A . 29 VAL H 1 1 8 3602 1 1 29 VAL HA H 16.162 4.010 9.960 1.00 . A A . 29 VAL HA 1 1 8 3603 1 1 29 VAL HB H 16.857 4.778 12.266 1.00 . A A . 29 VAL HB 1 1 8 3604 1 1 29 VAL HG11 H 17.478 6.994 10.393 1.00 . A A . 29 VAL HG11 1 1 8 3605 1 1 29 VAL HG12 H 18.557 6.011 11.385 1.00 . A A . 29 VAL HG12 1 1 8 3606 1 1 29 VAL HG13 H 17.891 5.356 9.888 1.00 . A A . 29 VAL HG13 1 1 8 3607 1 1 29 VAL HG21 H 16.269 6.881 13.081 1.00 . A A . 29 VAL HG21 1 1 8 3608 1 1 29 VAL HG22 H 15.661 7.425 11.518 1.00 . A A . 29 VAL HG22 1 1 8 3609 1 1 29 VAL HG23 H 14.749 6.243 12.457 1.00 . A A . 29 VAL HG23 1 1 8 3610 1 1 29 VAL N N 14.831 5.564 9.673 1.00 . A A . 29 VAL N 1 1 8 3611 1 1 29 VAL O O 13.384 4.011 11.344 1.00 . A A . 29 VAL O 1 1 8 3612 1 1 30 LYS C C 13.392 2.870 13.901 1.00 . A A . 30 LYS C 1 1 8 3613 1 1 30 LYS CA C 14.353 2.050 13.046 1.00 . A A . 30 LYS CA 1 1 8 3614 1 1 30 LYS CB C 15.257 1.205 13.945 1.00 . A A . 30 LYS CB 1 1 8 3615 1 1 30 LYS CD C 15.388 -0.588 15.699 1.00 . A A . 30 LYS CD 1 1 8 3616 1 1 30 LYS CE C 16.465 -1.492 15.120 1.00 . A A . 30 LYS CE 1 1 8 3617 1 1 30 LYS CG C 14.540 0.040 14.605 1.00 . A A . 30 LYS CG 1 1 8 3618 1 1 30 LYS H H 16.133 2.821 12.197 1.00 . A A . 30 LYS H 1 1 8 3619 1 1 30 LYS HA H 13.779 1.395 12.408 1.00 . A A . 30 LYS HA 1 1 8 3620 1 1 30 LYS HB2 H 16.069 0.811 13.351 1.00 . A A . 30 LYS HB2 1 1 8 3621 1 1 30 LYS HB3 H 15.665 1.836 14.721 1.00 . A A . 30 LYS HB3 1 1 8 3622 1 1 30 LYS HD2 H 15.861 0.196 16.271 1.00 . A A . 30 LYS HD2 1 1 8 3623 1 1 30 LYS HD3 H 14.749 -1.173 16.346 1.00 . A A . 30 LYS HD3 1 1 8 3624 1 1 30 LYS HE2 H 16.847 -1.042 14.216 1.00 . A A . 30 LYS HE2 1 1 8 3625 1 1 30 LYS HE3 H 17.264 -1.586 15.841 1.00 . A A . 30 LYS HE3 1 1 8 3626 1 1 30 LYS HG2 H 13.618 0.396 15.039 1.00 . A A . 30 LYS HG2 1 1 8 3627 1 1 30 LYS HG3 H 14.323 -0.709 13.856 1.00 . A A . 30 LYS HG3 1 1 8 3628 1 1 30 LYS HZ1 H 16.475 -3.571 15.323 1.00 . A A . 30 LYS HZ1 1 1 8 3629 1 1 30 LYS HZ2 H 16.028 -3.036 13.782 1.00 . A A . 30 LYS HZ2 1 1 8 3630 1 1 30 LYS HZ3 H 14.937 -2.915 15.068 1.00 . A A . 30 LYS HZ3 1 1 8 3631 1 1 30 LYS N N 15.157 2.916 12.191 1.00 . A A . 30 LYS N 1 1 8 3632 1 1 30 LYS NZ N 15.939 -2.848 14.801 1.00 . A A . 30 LYS NZ 1 1 8 3633 1 1 30 LYS O O 13.674 4.018 14.242 1.00 . A A . 30 LYS O 1 1 8 3634 1 1 31 GLY C C 10.632 2.053 16.089 1.00 . A A . 31 GLY C 1 1 8 3635 1 1 31 GLY CA C 11.271 2.962 15.058 1.00 . A A . 31 GLY CA 1 1 8 3636 1 1 31 GLY H H 12.083 1.355 13.943 1.00 . A A . 31 GLY H 1 1 8 3637 1 1 31 GLY HA2 H 11.752 3.784 15.567 1.00 . A A . 31 GLY HA2 1 1 8 3638 1 1 31 GLY HA3 H 10.498 3.354 14.413 1.00 . A A . 31 GLY HA3 1 1 8 3639 1 1 31 GLY N N 12.255 2.272 14.245 1.00 . A A . 31 GLY N 1 1 8 3640 1 1 31 GLY O O 11.327 1.377 16.847 1.00 . A A . 31 GLY O 1 1 9 3641 1 1 1 GLY C C 4.895 -0.120 1.117 1.00 . A A . 1 GLY C 1 1 9 3642 1 1 1 GLY CA C 3.719 -0.636 1.923 1.00 . A A . 1 GLY CA 1 1 9 3643 1 1 1 GLY H1 H 2.129 0.274 2.985 1.00 . A A . 1 GLY H1 1 1 9 3644 1 1 1 GLY HA2 H 4.089 -1.080 2.836 1.00 . A A . 1 GLY HA2 1 1 9 3645 1 1 1 GLY HA3 H 3.208 -1.394 1.348 1.00 . A A . 1 GLY HA3 1 1 9 3646 1 1 1 GLY N N 2.775 0.413 2.261 1.00 . A A . 1 GLY N 1 1 9 3647 1 1 1 GLY O O 6.050 -0.368 1.462 1.00 . A A . 1 GLY O 1 1 9 3648 1 1 2 TYR C C 6.139 2.486 -0.291 1.00 . A A . 2 TYR C 1 1 9 3649 1 1 2 TYR CA C 5.642 1.145 -0.823 1.00 . A A . 2 TYR CA 1 1 9 3650 1 1 2 TYR CB C 5.118 1.313 -2.250 1.00 . A A . 2 TYR CB 1 1 9 3651 1 1 2 TYR CD1 C 6.809 -0.054 -3.532 1.00 . A A . 2 TYR CD1 1 1 9 3652 1 1 2 TYR CD2 C 6.576 2.253 -4.085 1.00 . A A . 2 TYR CD2 1 1 9 3653 1 1 2 TYR CE1 C 7.788 -0.191 -4.498 1.00 . A A . 2 TYR CE1 1 1 9 3654 1 1 2 TYR CE2 C 7.552 2.124 -5.054 1.00 . A A . 2 TYR CE2 1 1 9 3655 1 1 2 TYR CG C 6.187 1.168 -3.309 1.00 . A A . 2 TYR CG 1 1 9 3656 1 1 2 TYR CZ C 8.155 0.901 -5.257 1.00 . A A . 2 TYR CZ 1 1 9 3657 1 1 2 TYR H H 3.661 0.761 -0.186 1.00 . A A . 2 TYR H 1 1 9 3658 1 1 2 TYR HA H 6.466 0.447 -0.832 1.00 . A A . 2 TYR HA 1 1 9 3659 1 1 2 TYR HB2 H 4.362 0.566 -2.438 1.00 . A A . 2 TYR HB2 1 1 9 3660 1 1 2 TYR HB3 H 4.680 2.295 -2.352 1.00 . A A . 2 TYR HB3 1 1 9 3661 1 1 2 TYR HD1 H 6.519 -0.908 -2.937 1.00 . A A . 2 TYR HD1 1 1 9 3662 1 1 2 TYR HD2 H 6.102 3.210 -3.923 1.00 . A A . 2 TYR HD2 1 1 9 3663 1 1 2 TYR HE1 H 8.260 -1.150 -4.658 1.00 . A A . 2 TYR HE1 1 1 9 3664 1 1 2 TYR HE2 H 7.840 2.979 -5.647 1.00 . A A . 2 TYR HE2 1 1 9 3665 1 1 2 TYR HH H 9.173 1.574 -6.742 1.00 . A A . 2 TYR HH 1 1 9 3666 1 1 2 TYR N N 4.601 0.597 0.038 1.00 . A A . 2 TYR N 1 1 9 3667 1 1 2 TYR O O 6.153 3.486 -1.009 1.00 . A A . 2 TYR O 1 1 9 3668 1 1 2 TYR OH O 9.129 0.769 -6.220 1.00 . A A . 2 TYR OH 1 1 9 3669 1 1 3 CYS C C 8.570 3.725 1.639 1.00 . A A . 3 CYS C 1 1 9 3670 1 1 3 CYS CA C 7.045 3.715 1.605 1.00 . A A . 3 CYS CA 1 1 9 3671 1 1 3 CYS CB C 6.491 3.841 3.026 1.00 . A A . 3 CYS CB 1 1 9 3672 1 1 3 CYS H H 6.511 1.670 1.497 1.00 . A A . 3 CYS H 1 1 9 3673 1 1 3 CYS HA H 6.705 4.556 1.020 1.00 . A A . 3 CYS HA 1 1 9 3674 1 1 3 CYS HB2 H 7.206 3.424 3.721 1.00 . A A . 3 CYS HB2 1 1 9 3675 1 1 3 CYS HB3 H 6.342 4.886 3.255 1.00 . A A . 3 CYS HB3 1 1 9 3676 1 1 3 CYS N N 6.547 2.499 0.974 1.00 . A A . 3 CYS N 1 1 9 3677 1 1 3 CYS O O 9.220 2.866 1.043 1.00 . A A . 3 CYS O 1 1 9 3678 1 1 3 CYS SG S 4.905 2.983 3.285 1.00 . A A . 3 CYS SG 1 1 9 3679 1 1 4 ALA C C 11.110 4.017 3.637 1.00 . A A . 4 ALA C 1 1 9 3680 1 1 4 ALA CA C 10.583 4.823 2.454 1.00 . A A . 4 ALA CA 1 1 9 3681 1 1 4 ALA CB C 10.982 6.285 2.589 1.00 . A A . 4 ALA CB 1 1 9 3682 1 1 4 ALA H H 8.564 5.357 2.793 1.00 . A A . 4 ALA H 1 1 9 3683 1 1 4 ALA HA H 11.023 4.437 1.545 1.00 . A A . 4 ALA HA 1 1 9 3684 1 1 4 ALA HB1 H 10.932 6.761 1.621 1.00 . A A . 4 ALA HB1 1 1 9 3685 1 1 4 ALA HB2 H 10.307 6.780 3.270 1.00 . A A . 4 ALA HB2 1 1 9 3686 1 1 4 ALA HB3 H 11.990 6.348 2.971 1.00 . A A . 4 ALA HB3 1 1 9 3687 1 1 4 ALA N N 9.135 4.702 2.340 1.00 . A A . 4 ALA N 1 1 9 3688 1 1 4 ALA O O 10.888 4.375 4.794 1.00 . A A . 4 ALA O 1 1 9 3689 1 1 5 THR C C 13.707 2.599 4.870 1.00 . A A . 5 THR C 1 1 9 3690 1 1 5 THR CA C 12.365 2.068 4.379 1.00 . A A . 5 THR CA 1 1 9 3691 1 1 5 THR CB C 12.550 0.624 3.876 1.00 . A A . 5 THR CB 1 1 9 3692 1 1 5 THR CG2 C 11.247 -0.155 3.975 1.00 . A A . 5 THR CG2 1 1 9 3693 1 1 5 THR H H 11.952 2.693 2.399 1.00 . A A . 5 THR H 1 1 9 3694 1 1 5 THR HA H 11.670 2.053 5.206 1.00 . A A . 5 THR HA 1 1 9 3695 1 1 5 THR HB H 13.292 0.137 4.493 1.00 . A A . 5 THR HB 1 1 9 3696 1 1 5 THR HG1 H 12.255 0.758 1.930 1.00 . A A . 5 THR HG1 1 1 9 3697 1 1 5 THR HG21 H 11.364 -0.963 4.682 1.00 . A A . 5 THR HG21 1 1 9 3698 1 1 5 THR HG22 H 10.994 -0.557 3.006 1.00 . A A . 5 THR HG22 1 1 9 3699 1 1 5 THR HG23 H 10.459 0.504 4.309 1.00 . A A . 5 THR HG23 1 1 9 3700 1 1 5 THR N N 11.808 2.926 3.340 1.00 . A A . 5 THR N 1 1 9 3701 1 1 5 THR O O 14.237 3.571 4.331 1.00 . A A . 5 THR O 1 1 9 3702 1 1 5 THR OG1 O 13.004 0.633 2.518 1.00 . A A . 5 THR OG1 1 1 9 3703 1 1 6 LYS C C 16.566 2.589 5.358 1.00 . A A . 6 LYS C 1 1 9 3704 1 1 6 LYS CA C 15.535 2.361 6.459 1.00 . A A . 6 LYS CA 1 1 9 3705 1 1 6 LYS CB C 16.045 1.300 7.437 1.00 . A A . 6 LYS CB 1 1 9 3706 1 1 6 LYS CD C 16.534 0.904 9.868 1.00 . A A . 6 LYS CD 1 1 9 3707 1 1 6 LYS CE C 17.756 1.789 10.068 1.00 . A A . 6 LYS CE 1 1 9 3708 1 1 6 LYS CG C 15.568 1.508 8.863 1.00 . A A . 6 LYS CG 1 1 9 3709 1 1 6 LYS H H 13.783 1.187 6.283 1.00 . A A . 6 LYS H 1 1 9 3710 1 1 6 LYS HA H 15.385 3.287 6.992 1.00 . A A . 6 LYS HA 1 1 9 3711 1 1 6 LYS HB2 H 15.707 0.329 7.104 1.00 . A A . 6 LYS HB2 1 1 9 3712 1 1 6 LYS HB3 H 17.125 1.315 7.435 1.00 . A A . 6 LYS HB3 1 1 9 3713 1 1 6 LYS HD2 H 16.030 0.789 10.816 1.00 . A A . 6 LYS HD2 1 1 9 3714 1 1 6 LYS HD3 H 16.856 -0.063 9.509 1.00 . A A . 6 LYS HD3 1 1 9 3715 1 1 6 LYS HE2 H 17.537 2.774 9.687 1.00 . A A . 6 LYS HE2 1 1 9 3716 1 1 6 LYS HE3 H 17.971 1.851 11.124 1.00 . A A . 6 LYS HE3 1 1 9 3717 1 1 6 LYS HG2 H 15.483 2.568 9.054 1.00 . A A . 6 LYS HG2 1 1 9 3718 1 1 6 LYS HG3 H 14.601 1.040 8.982 1.00 . A A . 6 LYS HG3 1 1 9 3719 1 1 6 LYS HZ1 H 19.669 0.950 10.051 1.00 . A A . 6 LYS HZ1 1 1 9 3720 1 1 6 LYS HZ2 H 19.362 1.982 8.746 1.00 . A A . 6 LYS HZ2 1 1 9 3721 1 1 6 LYS HZ3 H 18.683 0.433 8.777 1.00 . A A . 6 LYS HZ3 1 1 9 3722 1 1 6 LYS N N 14.253 1.955 5.895 1.00 . A A . 6 LYS N 1 1 9 3723 1 1 6 LYS NZ N 18.951 1.251 9.361 1.00 . A A . 6 LYS NZ 1 1 9 3724 1 1 6 LYS O O 16.708 1.773 4.448 1.00 . A A . 6 LYS O 1 1 9 3725 1 1 7 GLY C C 17.762 4.914 3.351 1.00 . A A . 7 GLY C 1 1 9 3726 1 1 7 GLY CA C 18.293 4.019 4.452 1.00 . A A . 7 GLY CA 1 1 9 3727 1 1 7 GLY H H 17.127 4.319 6.194 1.00 . A A . 7 GLY H 1 1 9 3728 1 1 7 GLY HA2 H 19.120 4.515 4.938 1.00 . A A . 7 GLY HA2 1 1 9 3729 1 1 7 GLY HA3 H 18.647 3.098 4.012 1.00 . A A . 7 GLY HA3 1 1 9 3730 1 1 7 GLY N N 17.284 3.705 5.447 1.00 . A A . 7 GLY N 1 1 9 3731 1 1 7 GLY O O 18.530 5.597 2.672 1.00 . A A . 7 GLY O 1 1 9 3732 1 1 8 ILE C C 15.559 7.146 2.647 1.00 . A A . 8 ILE C 1 1 9 3733 1 1 8 ILE CA C 15.813 5.729 2.143 1.00 . A A . 8 ILE CA 1 1 9 3734 1 1 8 ILE CB C 14.481 5.116 1.676 1.00 . A A . 8 ILE CB 1 1 9 3735 1 1 8 ILE CD1 C 15.600 3.370 0.200 1.00 . A A . 8 ILE CD1 1 1 9 3736 1 1 8 ILE CG1 C 14.662 3.630 1.358 1.00 . A A . 8 ILE CG1 1 1 9 3737 1 1 8 ILE CG2 C 13.951 5.862 0.461 1.00 . A A . 8 ILE CG2 1 1 9 3738 1 1 8 ILE H H 15.886 4.347 3.744 1.00 . A A . 8 ILE H 1 1 9 3739 1 1 8 ILE HA H 16.482 5.775 1.296 1.00 . A A . 8 ILE HA 1 1 9 3740 1 1 8 ILE HB H 13.762 5.220 2.474 1.00 . A A . 8 ILE HB 1 1 9 3741 1 1 8 ILE HD11 H 15.251 3.901 -0.673 1.00 . A A . 8 ILE HD11 1 1 9 3742 1 1 8 ILE HD12 H 16.592 3.710 0.457 1.00 . A A . 8 ILE HD12 1 1 9 3743 1 1 8 ILE HD13 H 15.626 2.310 -0.010 1.00 . A A . 8 ILE HD13 1 1 9 3744 1 1 8 ILE HG12 H 15.060 3.128 2.226 1.00 . A A . 8 ILE HG12 1 1 9 3745 1 1 8 ILE HG13 H 13.701 3.203 1.110 1.00 . A A . 8 ILE HG13 1 1 9 3746 1 1 8 ILE HG21 H 13.767 6.893 0.724 1.00 . A A . 8 ILE HG21 1 1 9 3747 1 1 8 ILE HG22 H 14.680 5.819 -0.334 1.00 . A A . 8 ILE HG22 1 1 9 3748 1 1 8 ILE HG23 H 13.030 5.405 0.130 1.00 . A A . 8 ILE HG23 1 1 9 3749 1 1 8 ILE N N 16.445 4.912 3.171 1.00 . A A . 8 ILE N 1 1 9 3750 1 1 8 ILE O O 15.024 7.342 3.739 1.00 . A A . 8 ILE O 1 1 9 3751 1 1 9 LYS C C 14.311 9.796 2.622 1.00 . A A . 9 LYS C 1 1 9 3752 1 1 9 LYS CA C 15.755 9.532 2.206 1.00 . A A . 9 LYS CA 1 1 9 3753 1 1 9 LYS CB C 16.133 10.439 1.033 1.00 . A A . 9 LYS CB 1 1 9 3754 1 1 9 LYS CD C 18.397 11.492 1.307 1.00 . A A . 9 LYS CD 1 1 9 3755 1 1 9 LYS CE C 18.992 12.426 0.264 1.00 . A A . 9 LYS CE 1 1 9 3756 1 1 9 LYS CG C 17.604 10.369 0.660 1.00 . A A . 9 LYS CG 1 1 9 3757 1 1 9 LYS H H 16.364 7.913 0.986 1.00 . A A . 9 LYS H 1 1 9 3758 1 1 9 LYS HA H 16.403 9.749 3.041 1.00 . A A . 9 LYS HA 1 1 9 3759 1 1 9 LYS HB2 H 15.550 10.152 0.170 1.00 . A A . 9 LYS HB2 1 1 9 3760 1 1 9 LYS HB3 H 15.897 11.461 1.293 1.00 . A A . 9 LYS HB3 1 1 9 3761 1 1 9 LYS HD2 H 17.741 12.061 1.949 1.00 . A A . 9 LYS HD2 1 1 9 3762 1 1 9 LYS HD3 H 19.197 11.065 1.894 1.00 . A A . 9 LYS HD3 1 1 9 3763 1 1 9 LYS HE2 H 19.966 12.055 -0.018 1.00 . A A . 9 LYS HE2 1 1 9 3764 1 1 9 LYS HE3 H 18.347 12.436 -0.602 1.00 . A A . 9 LYS HE3 1 1 9 3765 1 1 9 LYS HG2 H 18.005 9.423 0.991 1.00 . A A . 9 LYS HG2 1 1 9 3766 1 1 9 LYS HG3 H 17.698 10.446 -0.414 1.00 . A A . 9 LYS HG3 1 1 9 3767 1 1 9 LYS HZ1 H 19.107 13.815 1.819 1.00 . A A . 9 LYS HZ1 1 1 9 3768 1 1 9 LYS HZ2 H 18.356 14.409 0.425 1.00 . A A . 9 LYS HZ2 1 1 9 3769 1 1 9 LYS HZ3 H 20.037 14.223 0.467 1.00 . A A . 9 LYS HZ3 1 1 9 3770 1 1 9 LYS N N 15.943 8.132 1.844 1.00 . A A . 9 LYS N 1 1 9 3771 1 1 9 LYS NZ N 19.133 13.816 0.780 1.00 . A A . 9 LYS NZ 1 1 9 3772 1 1 9 LYS O O 13.375 9.268 2.021 1.00 . A A . 9 LYS O 1 1 9 3773 1 1 10 CYS C C 12.554 12.455 4.046 1.00 . A A . 10 CYS C 1 1 9 3774 1 1 10 CYS CA C 12.809 10.954 4.147 1.00 . A A . 10 CYS CA 1 1 9 3775 1 1 10 CYS CB C 12.652 10.496 5.599 1.00 . A A . 10 CYS CB 1 1 9 3776 1 1 10 CYS H H 14.924 11.008 4.090 1.00 . A A . 10 CYS H 1 1 9 3777 1 1 10 CYS HA H 12.086 10.437 3.536 1.00 . A A . 10 CYS HA 1 1 9 3778 1 1 10 CYS HB2 H 11.603 10.348 5.810 1.00 . A A . 10 CYS HB2 1 1 9 3779 1 1 10 CYS HB3 H 13.176 9.561 5.732 1.00 . A A . 10 CYS HB3 1 1 9 3780 1 1 10 CYS N N 14.138 10.618 3.652 1.00 . A A . 10 CYS N 1 1 9 3781 1 1 10 CYS O O 11.594 12.972 4.616 1.00 . A A . 10 CYS O 1 1 9 3782 1 1 10 CYS SG S 13.302 11.676 6.825 1.00 . A A . 10 CYS SG 1 1 9 3783 1 1 11 ASN C C 11.975 14.937 2.447 1.00 . A A . 11 ASN C 1 1 9 3784 1 1 11 ASN CA C 13.290 14.591 3.139 1.00 . A A . 11 ASN CA 1 1 9 3785 1 1 11 ASN CB C 14.466 15.135 2.326 1.00 . A A . 11 ASN CB 1 1 9 3786 1 1 11 ASN CG C 14.256 14.980 0.832 1.00 . A A . 11 ASN CG 1 1 9 3787 1 1 11 ASN H H 14.166 12.681 2.885 1.00 . A A . 11 ASN H 1 1 9 3788 1 1 11 ASN HA H 13.299 15.046 4.118 1.00 . A A . 11 ASN HA 1 1 9 3789 1 1 11 ASN HB2 H 14.592 16.185 2.545 1.00 . A A . 11 ASN HB2 1 1 9 3790 1 1 11 ASN HB3 H 15.364 14.603 2.602 1.00 . A A . 11 ASN HB3 1 1 9 3791 1 1 11 ASN HD21 H 13.921 16.932 0.652 1.00 . A A . 11 ASN HD21 1 1 9 3792 1 1 11 ASN HD22 H 13.835 16.018 -0.811 1.00 . A A . 11 ASN HD22 1 1 9 3793 1 1 11 ASN N N 13.420 13.149 3.315 1.00 . A A . 11 ASN N 1 1 9 3794 1 1 11 ASN ND2 N 13.976 16.089 0.156 1.00 . A A . 11 ASN ND2 1 1 9 3795 1 1 11 ASN O O 11.381 15.984 2.707 1.00 . A A . 11 ASN O 1 1 9 3796 1 1 11 ASN OD1 O 14.346 13.878 0.292 1.00 . A A . 11 ASN OD1 1 1 9 3797 1 1 12 ASP C C 9.293 13.131 1.110 1.00 . A A . 12 ASP C 1 1 9 3798 1 1 12 ASP CA C 10.280 14.261 0.836 1.00 . A A . 12 ASP CA 1 1 9 3799 1 1 12 ASP CB C 10.554 14.363 -0.665 1.00 . A A . 12 ASP CB 1 1 9 3800 1 1 12 ASP CG C 9.332 14.802 -1.448 1.00 . A A . 12 ASP CG 1 1 9 3801 1 1 12 ASP H H 12.044 13.235 1.401 1.00 . A A . 12 ASP H 1 1 9 3802 1 1 12 ASP HA H 9.849 15.190 1.178 1.00 . A A . 12 ASP HA 1 1 9 3803 1 1 12 ASP HB2 H 11.343 15.083 -0.832 1.00 . A A . 12 ASP HB2 1 1 9 3804 1 1 12 ASP HB3 H 10.868 13.398 -1.034 1.00 . A A . 12 ASP HB3 1 1 9 3805 1 1 12 ASP N N 11.526 14.051 1.565 1.00 . A A . 12 ASP N 1 1 9 3806 1 1 12 ASP O O 8.202 13.360 1.632 1.00 . A A . 12 ASP O 1 1 9 3807 1 1 12 ASP OD1 O 8.252 14.936 -0.836 1.00 . A A . 12 ASP OD1 1 1 9 3808 1 1 12 ASP OD2 O 9.457 15.014 -2.672 1.00 . A A . 12 ASP OD2 1 1 9 3809 1 1 13 ILE C C 8.806 10.339 2.429 1.00 . A A . 13 ILE C 1 1 9 3810 1 1 13 ILE CA C 8.832 10.747 0.959 1.00 . A A . 13 ILE CA 1 1 9 3811 1 1 13 ILE CB C 9.303 9.548 0.114 1.00 . A A . 13 ILE CB 1 1 9 3812 1 1 13 ILE CD1 C 8.513 7.313 -0.811 1.00 . A A . 13 ILE CD1 1 1 9 3813 1 1 13 ILE CG1 C 8.306 8.393 0.227 1.00 . A A . 13 ILE CG1 1 1 9 3814 1 1 13 ILE CG2 C 10.690 9.103 0.553 1.00 . A A . 13 ILE CG2 1 1 9 3815 1 1 13 ILE H H 10.564 11.793 0.340 1.00 . A A . 13 ILE H 1 1 9 3816 1 1 13 ILE HA H 7.830 11.007 0.651 1.00 . A A . 13 ILE HA 1 1 9 3817 1 1 13 ILE HB H 9.362 9.864 -0.916 1.00 . A A . 13 ILE HB 1 1 9 3818 1 1 13 ILE HD11 H 9.203 7.664 -1.564 1.00 . A A . 13 ILE HD11 1 1 9 3819 1 1 13 ILE HD12 H 8.913 6.430 -0.338 1.00 . A A . 13 ILE HD12 1 1 9 3820 1 1 13 ILE HD13 H 7.566 7.074 -1.275 1.00 . A A . 13 ILE HD13 1 1 9 3821 1 1 13 ILE HG12 H 8.399 7.939 1.201 1.00 . A A . 13 ILE HG12 1 1 9 3822 1 1 13 ILE HG13 H 7.304 8.780 0.110 1.00 . A A . 13 ILE HG13 1 1 9 3823 1 1 13 ILE HG21 H 10.645 8.735 1.568 1.00 . A A . 13 ILE HG21 1 1 9 3824 1 1 13 ILE HG22 H 11.038 8.316 -0.098 1.00 . A A . 13 ILE HG22 1 1 9 3825 1 1 13 ILE HG23 H 11.370 9.940 0.503 1.00 . A A . 13 ILE HG23 1 1 9 3826 1 1 13 ILE N N 9.683 11.912 0.752 1.00 . A A . 13 ILE N 1 1 9 3827 1 1 13 ILE O O 9.799 10.486 3.143 1.00 . A A . 13 ILE O 1 1 9 3828 1 1 14 HIS C C 7.773 7.896 4.394 1.00 . A A . 14 HIS C 1 1 9 3829 1 1 14 HIS CA C 7.509 9.393 4.259 1.00 . A A . 14 HIS CA 1 1 9 3830 1 1 14 HIS CB C 6.104 9.722 4.764 1.00 . A A . 14 HIS CB 1 1 9 3831 1 1 14 HIS CD2 C 5.633 9.215 7.263 1.00 . A A . 14 HIS CD2 1 1 9 3832 1 1 14 HIS CE1 C 6.274 11.135 8.106 1.00 . A A . 14 HIS CE1 1 1 9 3833 1 1 14 HIS CG C 6.045 9.993 6.235 1.00 . A A . 14 HIS CG 1 1 9 3834 1 1 14 HIS H H 6.909 9.733 2.257 1.00 . A A . 14 HIS H 1 1 9 3835 1 1 14 HIS HA H 8.232 9.928 4.856 1.00 . A A . 14 HIS HA 1 1 9 3836 1 1 14 HIS HB2 H 5.741 10.600 4.250 1.00 . A A . 14 HIS HB2 1 1 9 3837 1 1 14 HIS HB3 H 5.448 8.890 4.552 1.00 . A A . 14 HIS HB3 1 1 9 3838 1 1 14 HIS HD1 H 6.790 11.963 6.308 1.00 . A A . 14 HIS HD1 1 1 9 3839 1 1 14 HIS HD2 H 5.255 8.205 7.192 1.00 . A A . 14 HIS HD2 1 1 9 3840 1 1 14 HIS HE1 H 6.499 11.926 8.806 1.00 . A A . 14 HIS HE1 1 1 9 3841 1 1 14 HIS N N 7.664 9.824 2.874 1.00 . A A . 14 HIS N 1 1 9 3842 1 1 14 HIS ND1 N 6.439 11.190 6.797 1.00 . A A . 14 HIS ND1 1 1 9 3843 1 1 14 HIS NE2 N 5.785 9.947 8.415 1.00 . A A . 14 HIS NE2 1 1 9 3844 1 1 14 HIS O O 7.665 7.146 3.423 1.00 . A A . 14 HIS O 1 1 9 3845 1 1 15 CYS C C 7.136 5.325 6.295 1.00 . A A . 15 CYS C 1 1 9 3846 1 1 15 CYS CA C 8.402 6.062 5.865 1.00 . A A . 15 CYS CA 1 1 9 3847 1 1 15 CYS CB C 9.475 5.928 6.947 1.00 . A A . 15 CYS CB 1 1 9 3848 1 1 15 CYS H H 8.191 8.114 6.337 1.00 . A A . 15 CYS H 1 1 9 3849 1 1 15 CYS HA H 8.767 5.620 4.951 1.00 . A A . 15 CYS HA 1 1 9 3850 1 1 15 CYS HB2 H 9.000 5.928 7.917 1.00 . A A . 15 CYS HB2 1 1 9 3851 1 1 15 CYS HB3 H 9.999 4.993 6.809 1.00 . A A . 15 CYS HB3 1 1 9 3852 1 1 15 CYS N N 8.121 7.468 5.603 1.00 . A A . 15 CYS N 1 1 9 3853 1 1 15 CYS O O 6.203 5.929 6.825 1.00 . A A . 15 CYS O 1 1 9 3854 1 1 15 CYS SG S 10.712 7.265 6.937 1.00 . A A . 15 CYS SG 1 1 9 3855 1 1 16 CYS C C 5.757 3.186 7.938 1.00 . A A . 16 CYS C 1 1 9 3856 1 1 16 CYS CA C 5.962 3.197 6.426 1.00 . A A . 16 CYS CA 1 1 9 3857 1 1 16 CYS CB C 6.148 1.767 5.916 1.00 . A A . 16 CYS CB 1 1 9 3858 1 1 16 CYS H H 7.887 3.592 5.638 1.00 . A A . 16 CYS H 1 1 9 3859 1 1 16 CYS HA H 5.089 3.626 5.960 1.00 . A A . 16 CYS HA 1 1 9 3860 1 1 16 CYS HB2 H 7.205 1.554 5.840 1.00 . A A . 16 CYS HB2 1 1 9 3861 1 1 16 CYS HB3 H 5.698 1.081 6.617 1.00 . A A . 16 CYS HB3 1 1 9 3862 1 1 16 CYS N N 7.112 4.017 6.064 1.00 . A A . 16 CYS N 1 1 9 3863 1 1 16 CYS O O 6.700 3.382 8.705 1.00 . A A . 16 CYS O 1 1 9 3864 1 1 16 CYS SG S 5.405 1.458 4.281 1.00 . A A . 16 CYS SG 1 1 9 3865 1 1 17 SER C C 5.131 1.993 10.536 1.00 . A A . 17 SER C 1 1 9 3866 1 1 17 SER CA C 4.187 2.923 9.780 1.00 . A A . 17 SER CA 1 1 9 3867 1 1 17 SER CB C 2.739 2.470 9.978 1.00 . A A . 17 SER CB 1 1 9 3868 1 1 17 SER H H 3.808 2.807 7.700 1.00 . A A . 17 SER H 1 1 9 3869 1 1 17 SER HA H 4.299 3.924 10.169 1.00 . A A . 17 SER HA 1 1 9 3870 1 1 17 SER HB2 H 2.551 1.598 9.371 1.00 . A A . 17 SER HB2 1 1 9 3871 1 1 17 SER HB3 H 2.580 2.226 11.018 1.00 . A A . 17 SER HB3 1 1 9 3872 1 1 17 SER HG H 1.395 3.248 8.783 1.00 . A A . 17 SER HG 1 1 9 3873 1 1 17 SER N N 4.518 2.956 8.360 1.00 . A A . 17 SER N 1 1 9 3874 1 1 17 SER O O 5.098 0.776 10.355 1.00 . A A . 17 SER O 1 1 9 3875 1 1 17 SER OG O 1.830 3.491 9.604 1.00 . A A . 17 SER OG 1 1 9 3876 1 1 18 GLY C C 8.321 2.344 12.102 1.00 . A A . 18 GLY C 1 1 9 3877 1 1 18 GLY CA C 6.913 1.785 12.157 1.00 . A A . 18 GLY CA 1 1 9 3878 1 1 18 GLY H H 5.953 3.550 11.489 1.00 . A A . 18 GLY H 1 1 9 3879 1 1 18 GLY HA2 H 6.587 1.759 13.186 1.00 . A A . 18 GLY HA2 1 1 9 3880 1 1 18 GLY HA3 H 6.923 0.777 11.767 1.00 . A A . 18 GLY HA3 1 1 9 3881 1 1 18 GLY N N 5.972 2.575 11.385 1.00 . A A . 18 GLY N 1 1 9 3882 1 1 18 GLY O O 9.159 2.022 12.945 1.00 . A A . 18 GLY O 1 1 9 3883 1 1 19 LEU C C 9.856 5.282 11.244 1.00 . A A . 19 LEU C 1 1 9 3884 1 1 19 LEU CA C 9.902 3.787 10.943 1.00 . A A . 19 LEU CA 1 1 9 3885 1 1 19 LEU CB C 10.418 3.557 9.521 1.00 . A A . 19 LEU CB 1 1 9 3886 1 1 19 LEU CD1 C 10.974 1.987 7.648 1.00 . A A . 19 LEU CD1 1 1 9 3887 1 1 19 LEU CD2 C 11.905 1.582 9.934 1.00 . A A . 19 LEU CD2 1 1 9 3888 1 1 19 LEU CG C 10.716 2.106 9.142 1.00 . A A . 19 LEU CG 1 1 9 3889 1 1 19 LEU H H 7.877 3.402 10.465 1.00 . A A . 19 LEU H 1 1 9 3890 1 1 19 LEU HA H 10.573 3.312 11.642 1.00 . A A . 19 LEU HA 1 1 9 3891 1 1 19 LEU HB2 H 9.674 3.932 8.835 1.00 . A A . 19 LEU HB2 1 1 9 3892 1 1 19 LEU HB3 H 11.330 4.125 9.405 1.00 . A A . 19 LEU HB3 1 1 9 3893 1 1 19 LEU HD11 H 11.835 2.581 7.383 1.00 . A A . 19 LEU HD11 1 1 9 3894 1 1 19 LEU HD12 H 10.111 2.342 7.104 1.00 . A A . 19 LEU HD12 1 1 9 3895 1 1 19 LEU HD13 H 11.158 0.953 7.396 1.00 . A A . 19 LEU HD13 1 1 9 3896 1 1 19 LEU HD21 H 11.866 0.503 9.969 1.00 . A A . 19 LEU HD21 1 1 9 3897 1 1 19 LEU HD22 H 11.871 1.977 10.939 1.00 . A A . 19 LEU HD22 1 1 9 3898 1 1 19 LEU HD23 H 12.822 1.894 9.455 1.00 . A A . 19 LEU HD23 1 1 9 3899 1 1 19 LEU HG H 9.858 1.494 9.382 1.00 . A A . 19 LEU HG 1 1 9 3900 1 1 19 LEU N N 8.584 3.183 11.106 1.00 . A A . 19 LEU N 1 1 9 3901 1 1 19 LEU O O 8.805 5.915 11.145 1.00 . A A . 19 LEU O 1 1 9 3902 1 1 20 LYS C C 11.821 8.018 10.811 1.00 . A A . 20 LYS C 1 1 9 3903 1 1 20 LYS CA C 11.098 7.263 11.922 1.00 . A A . 20 LYS CA 1 1 9 3904 1 1 20 LYS CB C 11.829 7.467 13.251 1.00 . A A . 20 LYS CB 1 1 9 3905 1 1 20 LYS CD C 11.808 7.116 15.738 1.00 . A A . 20 LYS CD 1 1 9 3906 1 1 20 LYS CE C 10.725 7.280 16.793 1.00 . A A . 20 LYS CE 1 1 9 3907 1 1 20 LYS CG C 11.226 6.683 14.403 1.00 . A A . 20 LYS CG 1 1 9 3908 1 1 20 LYS H H 11.810 5.285 11.670 1.00 . A A . 20 LYS H 1 1 9 3909 1 1 20 LYS HA H 10.095 7.650 12.009 1.00 . A A . 20 LYS HA 1 1 9 3910 1 1 20 LYS HB2 H 12.858 7.160 13.133 1.00 . A A . 20 LYS HB2 1 1 9 3911 1 1 20 LYS HB3 H 11.803 8.517 13.505 1.00 . A A . 20 LYS HB3 1 1 9 3912 1 1 20 LYS HD2 H 12.511 6.368 16.074 1.00 . A A . 20 LYS HD2 1 1 9 3913 1 1 20 LYS HD3 H 12.319 8.060 15.609 1.00 . A A . 20 LYS HD3 1 1 9 3914 1 1 20 LYS HE2 H 11.187 7.573 17.723 1.00 . A A . 20 LYS HE2 1 1 9 3915 1 1 20 LYS HE3 H 10.042 8.053 16.471 1.00 . A A . 20 LYS HE3 1 1 9 3916 1 1 20 LYS HG2 H 10.158 6.847 14.419 1.00 . A A . 20 LYS HG2 1 1 9 3917 1 1 20 LYS HG3 H 11.428 5.632 14.256 1.00 . A A . 20 LYS HG3 1 1 9 3918 1 1 20 LYS HZ1 H 9.810 5.862 18.023 1.00 . A A . 20 LYS HZ1 1 1 9 3919 1 1 20 LYS HZ2 H 10.492 5.212 16.619 1.00 . A A . 20 LYS HZ2 1 1 9 3920 1 1 20 LYS HZ3 H 9.039 6.074 16.531 1.00 . A A . 20 LYS HZ3 1 1 9 3921 1 1 20 LYS N N 11.005 5.842 11.609 1.00 . A A . 20 LYS N 1 1 9 3922 1 1 20 LYS NZ N 9.963 6.019 17.006 1.00 . A A . 20 LYS NZ 1 1 9 3923 1 1 20 LYS O O 12.721 7.480 10.164 1.00 . A A . 20 LYS O 1 1 9 3924 1 1 21 CYS C C 13.139 10.970 10.151 1.00 . A A . 21 CYS C 1 1 9 3925 1 1 21 CYS CA C 12.035 10.097 9.563 1.00 . A A . 21 CYS CA 1 1 9 3926 1 1 21 CYS CB C 10.976 10.976 8.894 1.00 . A A . 21 CYS CB 1 1 9 3927 1 1 21 CYS H H 10.702 9.641 11.143 1.00 . A A . 21 CYS H 1 1 9 3928 1 1 21 CYS HA H 12.467 9.441 8.823 1.00 . A A . 21 CYS HA 1 1 9 3929 1 1 21 CYS HB2 H 10.333 10.354 8.289 1.00 . A A . 21 CYS HB2 1 1 9 3930 1 1 21 CYS HB3 H 10.385 11.460 9.657 1.00 . A A . 21 CYS HB3 1 1 9 3931 1 1 21 CYS N N 11.424 9.267 10.595 1.00 . A A . 21 CYS N 1 1 9 3932 1 1 21 CYS O O 12.880 12.065 10.651 1.00 . A A . 21 CYS O 1 1 9 3933 1 1 21 CYS SG S 11.662 12.274 7.816 1.00 . A A . 21 CYS SG 1 1 9 3934 1 1 22 ASP C C 15.673 12.555 9.899 1.00 . A A . 22 ASP C 1 1 9 3935 1 1 22 ASP CA C 15.517 11.214 10.610 1.00 . A A . 22 ASP CA 1 1 9 3936 1 1 22 ASP CB C 16.795 10.388 10.455 1.00 . A A . 22 ASP CB 1 1 9 3937 1 1 22 ASP CG C 17.826 10.713 11.517 1.00 . A A . 22 ASP CG 1 1 9 3938 1 1 22 ASP H H 14.515 9.600 9.675 1.00 . A A . 22 ASP H 1 1 9 3939 1 1 22 ASP HA H 15.342 11.396 11.659 1.00 . A A . 22 ASP HA 1 1 9 3940 1 1 22 ASP HB2 H 16.549 9.339 10.527 1.00 . A A . 22 ASP HB2 1 1 9 3941 1 1 22 ASP HB3 H 17.228 10.586 9.485 1.00 . A A . 22 ASP HB3 1 1 9 3942 1 1 22 ASP N N 14.372 10.479 10.086 1.00 . A A . 22 ASP N 1 1 9 3943 1 1 22 ASP O O 16.177 12.619 8.777 1.00 . A A . 22 ASP O 1 1 9 3944 1 1 22 ASP OD1 O 18.442 9.768 12.055 1.00 . A A . 22 ASP OD1 1 1 9 3945 1 1 22 ASP OD2 O 18.018 11.911 11.811 1.00 . A A . 22 ASP OD2 1 1 9 3946 1 1 23 SER C C 16.764 15.468 10.006 1.00 . A A . 23 SER C 1 1 9 3947 1 1 23 SER CA C 15.324 14.962 9.987 1.00 . A A . 23 SER CA 1 1 9 3948 1 1 23 SER CB C 14.422 15.928 10.758 1.00 . A A . 23 SER CB 1 1 9 3949 1 1 23 SER H H 14.846 13.508 11.449 1.00 . A A . 23 SER H 1 1 9 3950 1 1 23 SER HA H 14.988 14.908 8.963 1.00 . A A . 23 SER HA 1 1 9 3951 1 1 23 SER HB2 H 14.504 15.727 11.815 1.00 . A A . 23 SER HB2 1 1 9 3952 1 1 23 SER HB3 H 14.733 16.943 10.559 1.00 . A A . 23 SER HB3 1 1 9 3953 1 1 23 SER HG H 12.530 15.598 11.143 1.00 . A A . 23 SER HG 1 1 9 3954 1 1 23 SER N N 15.238 13.623 10.558 1.00 . A A . 23 SER N 1 1 9 3955 1 1 23 SER O O 17.093 16.465 9.362 1.00 . A A . 23 SER O 1 1 9 3956 1 1 23 SER OG O 13.067 15.780 10.369 1.00 . A A . 23 SER OG 1 1 9 3957 1 1 24 LYS C C 19.831 14.560 9.702 1.00 . A A . 24 LYS C 1 1 9 3958 1 1 24 LYS CA C 19.023 15.150 10.853 1.00 . A A . 24 LYS CA 1 1 9 3959 1 1 24 LYS CB C 19.601 14.679 12.190 1.00 . A A . 24 LYS CB 1 1 9 3960 1 1 24 LYS CD C 19.688 16.150 14.224 1.00 . A A . 24 LYS CD 1 1 9 3961 1 1 24 LYS CE C 18.860 17.304 14.768 1.00 . A A . 24 LYS CE 1 1 9 3962 1 1 24 LYS CG C 18.841 15.197 13.398 1.00 . A A . 24 LYS CG 1 1 9 3963 1 1 24 LYS H H 17.296 13.989 11.240 1.00 . A A . 24 LYS H 1 1 9 3964 1 1 24 LYS HA H 19.083 16.227 10.805 1.00 . A A . 24 LYS HA 1 1 9 3965 1 1 24 LYS HB2 H 19.584 13.600 12.215 1.00 . A A . 24 LYS HB2 1 1 9 3966 1 1 24 LYS HB3 H 20.625 15.016 12.264 1.00 . A A . 24 LYS HB3 1 1 9 3967 1 1 24 LYS HD2 H 20.119 15.609 15.053 1.00 . A A . 24 LYS HD2 1 1 9 3968 1 1 24 LYS HD3 H 20.478 16.547 13.602 1.00 . A A . 24 LYS HD3 1 1 9 3969 1 1 24 LYS HE2 H 17.835 17.171 14.459 1.00 . A A . 24 LYS HE2 1 1 9 3970 1 1 24 LYS HE3 H 18.915 17.292 15.847 1.00 . A A . 24 LYS HE3 1 1 9 3971 1 1 24 LYS HG2 H 17.958 15.719 13.060 1.00 . A A . 24 LYS HG2 1 1 9 3972 1 1 24 LYS HG3 H 18.551 14.359 14.016 1.00 . A A . 24 LYS HG3 1 1 9 3973 1 1 24 LYS HZ1 H 20.264 18.849 14.711 1.00 . A A . 24 LYS HZ1 1 1 9 3974 1 1 24 LYS HZ2 H 18.667 19.368 14.510 1.00 . A A . 24 LYS HZ2 1 1 9 3975 1 1 24 LYS HZ3 H 19.469 18.591 13.240 1.00 . A A . 24 LYS HZ3 1 1 9 3976 1 1 24 LYS N N 17.619 14.774 10.749 1.00 . A A . 24 LYS N 1 1 9 3977 1 1 24 LYS NZ N 19.349 18.620 14.272 1.00 . A A . 24 LYS NZ 1 1 9 3978 1 1 24 LYS O O 20.676 15.236 9.114 1.00 . A A . 24 LYS O 1 1 9 3979 1 1 25 ARG C C 19.407 12.569 7.042 1.00 . A A . 25 ARG C 1 1 9 3980 1 1 25 ARG CA C 20.266 12.618 8.302 1.00 . A A . 25 ARG CA 1 1 9 3981 1 1 25 ARG CB C 20.649 11.199 8.727 1.00 . A A . 25 ARG CB 1 1 9 3982 1 1 25 ARG CD C 22.005 9.803 10.317 1.00 . A A . 25 ARG CD 1 1 9 3983 1 1 25 ARG CG C 21.287 11.126 10.105 1.00 . A A . 25 ARG CG 1 1 9 3984 1 1 25 ARG CZ C 22.968 8.522 12.182 1.00 . A A . 25 ARG CZ 1 1 9 3985 1 1 25 ARG H H 18.880 12.812 9.889 1.00 . A A . 25 ARG H 1 1 9 3986 1 1 25 ARG HA H 21.166 13.175 8.088 1.00 . A A . 25 ARG HA 1 1 9 3987 1 1 25 ARG HB2 H 19.760 10.585 8.733 1.00 . A A . 25 ARG HB2 1 1 9 3988 1 1 25 ARG HB3 H 21.348 10.798 8.009 1.00 . A A . 25 ARG HB3 1 1 9 3989 1 1 25 ARG HD2 H 21.318 8.998 10.106 1.00 . A A . 25 ARG HD2 1 1 9 3990 1 1 25 ARG HD3 H 22.842 9.750 9.636 1.00 . A A . 25 ARG HD3 1 1 9 3991 1 1 25 ARG HE H 22.473 10.453 12.261 1.00 . A A . 25 ARG HE 1 1 9 3992 1 1 25 ARG HG2 H 22.001 11.931 10.203 1.00 . A A . 25 ARG HG2 1 1 9 3993 1 1 25 ARG HG3 H 20.516 11.232 10.853 1.00 . A A . 25 ARG HG3 1 1 9 3994 1 1 25 ARG HH11 H 22.690 7.469 10.480 1.00 . A A . 25 ARG HH11 1 1 9 3995 1 1 25 ARG HH12 H 23.368 6.578 11.802 1.00 . A A . 25 ARG HH12 1 1 9 3996 1 1 25 ARG HH21 H 23.365 9.290 14.009 1.00 . A A . 25 ARG HH21 1 1 9 3997 1 1 25 ARG HH22 H 23.751 7.615 13.809 1.00 . A A . 25 ARG HH22 1 1 9 3998 1 1 25 ARG N N 19.564 13.298 9.384 1.00 . A A . 25 ARG N 1 1 9 3999 1 1 25 ARG NE N 22.496 9.661 11.685 1.00 . A A . 25 ARG NE 1 1 9 4000 1 1 25 ARG NH1 N 23.012 7.433 11.426 1.00 . A A . 25 ARG NH1 1 1 9 4001 1 1 25 ARG NH2 N 23.397 8.472 13.436 1.00 . A A . 25 ARG NH2 1 1 9 4002 1 1 25 ARG O O 19.805 11.996 6.028 1.00 . A A . 25 ARG O 1 1 9 4003 1 1 26 LYS C C 17.070 11.793 5.440 1.00 . A A . 26 LYS C 1 1 9 4004 1 1 26 LYS CA C 17.309 13.200 5.981 1.00 . A A . 26 LYS CA 1 1 9 4005 1 1 26 LYS CB C 17.863 14.097 4.872 1.00 . A A . 26 LYS CB 1 1 9 4006 1 1 26 LYS CD C 18.355 16.428 4.075 1.00 . A A . 26 LYS CD 1 1 9 4007 1 1 26 LYS CE C 18.775 17.817 4.528 1.00 . A A . 26 LYS CE 1 1 9 4008 1 1 26 LYS CG C 17.919 15.567 5.249 1.00 . A A . 26 LYS CG 1 1 9 4009 1 1 26 LYS H H 17.964 13.612 7.951 1.00 . A A . 26 LYS H 1 1 9 4010 1 1 26 LYS HA H 16.369 13.605 6.324 1.00 . A A . 26 LYS HA 1 1 9 4011 1 1 26 LYS HB2 H 18.864 13.771 4.628 1.00 . A A . 26 LYS HB2 1 1 9 4012 1 1 26 LYS HB3 H 17.238 13.995 3.996 1.00 . A A . 26 LYS HB3 1 1 9 4013 1 1 26 LYS HD2 H 19.191 15.954 3.583 1.00 . A A . 26 LYS HD2 1 1 9 4014 1 1 26 LYS HD3 H 17.530 16.518 3.381 1.00 . A A . 26 LYS HD3 1 1 9 4015 1 1 26 LYS HE2 H 18.955 17.796 5.592 1.00 . A A . 26 LYS HE2 1 1 9 4016 1 1 26 LYS HE3 H 19.685 18.089 4.015 1.00 . A A . 26 LYS HE3 1 1 9 4017 1 1 26 LYS HG2 H 16.939 15.884 5.570 1.00 . A A . 26 LYS HG2 1 1 9 4018 1 1 26 LYS HG3 H 18.624 15.695 6.058 1.00 . A A . 26 LYS HG3 1 1 9 4019 1 1 26 LYS HZ1 H 17.099 18.494 3.482 1.00 . A A . 26 LYS HZ1 1 1 9 4020 1 1 26 LYS HZ2 H 18.173 19.723 3.921 1.00 . A A . 26 LYS HZ2 1 1 9 4021 1 1 26 LYS HZ3 H 17.165 19.026 5.086 1.00 . A A . 26 LYS HZ3 1 1 9 4022 1 1 26 LYS N N 18.226 13.173 7.114 1.00 . A A . 26 LYS N 1 1 9 4023 1 1 26 LYS NZ N 17.730 18.836 4.234 1.00 . A A . 26 LYS NZ 1 1 9 4024 1 1 26 LYS O O 17.060 11.577 4.229 1.00 . A A . 26 LYS O 1 1 9 4025 1 1 27 VAL C C 15.773 8.740 6.993 1.00 . A A . 27 VAL C 1 1 9 4026 1 1 27 VAL CA C 16.637 9.455 5.961 1.00 . A A . 27 VAL CA 1 1 9 4027 1 1 27 VAL CB C 17.958 8.682 5.789 1.00 . A A . 27 VAL CB 1 1 9 4028 1 1 27 VAL CG1 C 18.689 9.146 4.539 1.00 . A A . 27 VAL CG1 1 1 9 4029 1 1 27 VAL CG2 C 18.835 8.846 7.022 1.00 . A A . 27 VAL CG2 1 1 9 4030 1 1 27 VAL H H 16.898 11.075 7.298 1.00 . A A . 27 VAL H 1 1 9 4031 1 1 27 VAL HA H 16.120 9.458 5.013 1.00 . A A . 27 VAL HA 1 1 9 4032 1 1 27 VAL HB H 17.726 7.634 5.675 1.00 . A A . 27 VAL HB 1 1 9 4033 1 1 27 VAL HG11 H 18.857 10.212 4.595 1.00 . A A . 27 VAL HG11 1 1 9 4034 1 1 27 VAL HG12 H 19.638 8.635 4.466 1.00 . A A . 27 VAL HG12 1 1 9 4035 1 1 27 VAL HG13 H 18.091 8.922 3.668 1.00 . A A . 27 VAL HG13 1 1 9 4036 1 1 27 VAL HG21 H 19.536 9.651 6.859 1.00 . A A . 27 VAL HG21 1 1 9 4037 1 1 27 VAL HG22 H 18.215 9.076 7.877 1.00 . A A . 27 VAL HG22 1 1 9 4038 1 1 27 VAL HG23 H 19.375 7.929 7.204 1.00 . A A . 27 VAL HG23 1 1 9 4039 1 1 27 VAL N N 16.878 10.841 6.347 1.00 . A A . 27 VAL N 1 1 9 4040 1 1 27 VAL O O 15.599 9.220 8.114 1.00 . A A . 27 VAL O 1 1 9 4041 1 1 28 CYS C C 15.227 5.894 8.388 1.00 . A A . 28 CYS C 1 1 9 4042 1 1 28 CYS CA C 14.385 6.805 7.499 1.00 . A A . 28 CYS CA 1 1 9 4043 1 1 28 CYS CB C 13.391 5.970 6.689 1.00 . A A . 28 CYS CB 1 1 9 4044 1 1 28 CYS H H 15.406 7.258 5.702 1.00 . A A . 28 CYS H 1 1 9 4045 1 1 28 CYS HA H 13.837 7.492 8.126 1.00 . A A . 28 CYS HA 1 1 9 4046 1 1 28 CYS HB2 H 13.939 5.327 6.016 1.00 . A A . 28 CYS HB2 1 1 9 4047 1 1 28 CYS HB3 H 12.809 5.362 7.365 1.00 . A A . 28 CYS HB3 1 1 9 4048 1 1 28 CYS N N 15.232 7.589 6.608 1.00 . A A . 28 CYS N 1 1 9 4049 1 1 28 CYS O O 16.210 5.305 7.938 1.00 . A A . 28 CYS O 1 1 9 4050 1 1 28 CYS SG S 12.231 6.957 5.690 1.00 . A A . 28 CYS SG 1 1 9 4051 1 1 29 VAL C C 14.599 3.992 11.324 1.00 . A A . 29 VAL C 1 1 9 4052 1 1 29 VAL CA C 15.550 4.942 10.605 1.00 . A A . 29 VAL CA 1 1 9 4053 1 1 29 VAL CB C 16.298 5.791 11.651 1.00 . A A . 29 VAL CB 1 1 9 4054 1 1 29 VAL CG1 C 17.523 6.445 11.031 1.00 . A A . 29 VAL CG1 1 1 9 4055 1 1 29 VAL CG2 C 15.370 6.838 12.249 1.00 . A A . 29 VAL CG2 1 1 9 4056 1 1 29 VAL H H 14.042 6.277 9.953 1.00 . A A . 29 VAL H 1 1 9 4057 1 1 29 VAL HA H 16.278 4.362 10.056 1.00 . A A . 29 VAL HA 1 1 9 4058 1 1 29 VAL HB H 16.629 5.138 12.445 1.00 . A A . 29 VAL HB 1 1 9 4059 1 1 29 VAL HG11 H 17.892 5.826 10.225 1.00 . A A . 29 VAL HG11 1 1 9 4060 1 1 29 VAL HG12 H 17.257 7.418 10.646 1.00 . A A . 29 VAL HG12 1 1 9 4061 1 1 29 VAL HG13 H 18.293 6.552 11.781 1.00 . A A . 29 VAL HG13 1 1 9 4062 1 1 29 VAL HG21 H 15.384 6.757 13.326 1.00 . A A . 29 VAL HG21 1 1 9 4063 1 1 29 VAL HG22 H 15.704 7.823 11.958 1.00 . A A . 29 VAL HG22 1 1 9 4064 1 1 29 VAL HG23 H 14.365 6.677 11.888 1.00 . A A . 29 VAL HG23 1 1 9 4065 1 1 29 VAL N N 14.834 5.783 9.653 1.00 . A A . 29 VAL N 1 1 9 4066 1 1 29 VAL O O 13.379 4.121 11.220 1.00 . A A . 29 VAL O 1 1 9 4067 1 1 30 LYS C C 13.484 2.757 13.824 1.00 . A A . 30 LYS C 1 1 9 4068 1 1 30 LYS CA C 14.369 2.065 12.793 1.00 . A A . 30 LYS CA 1 1 9 4069 1 1 30 LYS CB C 15.281 1.050 13.486 1.00 . A A . 30 LYS CB 1 1 9 4070 1 1 30 LYS CD C 14.340 -0.505 15.220 1.00 . A A . 30 LYS CD 1 1 9 4071 1 1 30 LYS CE C 13.960 -1.949 15.513 1.00 . A A . 30 LYS CE 1 1 9 4072 1 1 30 LYS CG C 14.615 -0.291 13.741 1.00 . A A . 30 LYS CG 1 1 9 4073 1 1 30 LYS H H 16.144 2.986 12.097 1.00 . A A . 30 LYS H 1 1 9 4074 1 1 30 LYS HA H 13.739 1.546 12.086 1.00 . A A . 30 LYS HA 1 1 9 4075 1 1 30 LYS HB2 H 16.151 0.885 12.868 1.00 . A A . 30 LYS HB2 1 1 9 4076 1 1 30 LYS HB3 H 15.596 1.457 14.436 1.00 . A A . 30 LYS HB3 1 1 9 4077 1 1 30 LYS HD2 H 15.228 -0.258 15.782 1.00 . A A . 30 LYS HD2 1 1 9 4078 1 1 30 LYS HD3 H 13.528 0.140 15.523 1.00 . A A . 30 LYS HD3 1 1 9 4079 1 1 30 LYS HE2 H 13.144 -1.956 16.219 1.00 . A A . 30 LYS HE2 1 1 9 4080 1 1 30 LYS HE3 H 13.644 -2.418 14.593 1.00 . A A . 30 LYS HE3 1 1 9 4081 1 1 30 LYS HG2 H 13.679 -0.327 13.203 1.00 . A A . 30 LYS HG2 1 1 9 4082 1 1 30 LYS HG3 H 15.266 -1.079 13.388 1.00 . A A . 30 LYS HG3 1 1 9 4083 1 1 30 LYS HZ1 H 14.885 -3.735 16.074 1.00 . A A . 30 LYS HZ1 1 1 9 4084 1 1 30 LYS HZ2 H 15.278 -2.421 17.063 1.00 . A A . 30 LYS HZ2 1 1 9 4085 1 1 30 LYS HZ3 H 15.960 -2.552 15.521 1.00 . A A . 30 LYS HZ3 1 1 9 4086 1 1 30 LYS N N 15.165 3.037 12.054 1.00 . A A . 30 LYS N 1 1 9 4087 1 1 30 LYS NZ N 15.101 -2.718 16.083 1.00 . A A . 30 LYS NZ 1 1 9 4088 1 1 30 LYS O O 13.867 3.774 14.401 1.00 . A A . 30 LYS O 1 1 9 4089 1 1 31 GLY C C 10.418 1.750 15.584 1.00 . A A . 31 GLY C 1 1 9 4090 1 1 31 GLY CA C 11.380 2.775 15.016 1.00 . A A . 31 GLY CA 1 1 9 4091 1 1 31 GLY H H 12.048 1.387 13.563 1.00 . A A . 31 GLY H 1 1 9 4092 1 1 31 GLY HA2 H 11.949 3.207 15.826 1.00 . A A . 31 GLY HA2 1 1 9 4093 1 1 31 GLY HA3 H 10.812 3.555 14.531 1.00 . A A . 31 GLY HA3 1 1 9 4094 1 1 31 GLY N N 12.300 2.198 14.052 1.00 . A A . 31 GLY N 1 1 9 4095 1 1 31 GLY O O 9.339 2.101 16.062 1.00 . A A . 31 GLY O 1 1 10 4096 1 1 1 GLY C C 3.803 1.180 0.631 1.00 . A A . 1 GLY C 1 1 10 4097 1 1 1 GLY CA C 3.087 0.309 1.644 1.00 . A A . 1 GLY CA 1 1 10 4098 1 1 1 GLY H1 H 3.549 -1.671 2.236 1.00 . A A . 1 GLY H1 1 1 10 4099 1 1 1 GLY HA2 H 2.208 -0.114 1.182 1.00 . A A . 1 GLY HA2 1 1 10 4100 1 1 1 GLY HA3 H 2.784 0.923 2.479 1.00 . A A . 1 GLY HA3 1 1 10 4101 1 1 1 GLY N N 3.923 -0.771 2.137 1.00 . A A . 1 GLY N 1 1 10 4102 1 1 1 GLY O O 3.464 2.351 0.459 1.00 . A A . 1 GLY O 1 1 10 4103 1 1 2 TYR C C 6.087 2.658 -0.466 1.00 . A A . 2 TYR C 1 1 10 4104 1 1 2 TYR CA C 5.566 1.343 -1.038 1.00 . A A . 2 TYR CA 1 1 10 4105 1 1 2 TYR CB C 4.707 1.617 -2.274 1.00 . A A . 2 TYR CB 1 1 10 4106 1 1 2 TYR CD1 C 5.353 3.353 -3.990 1.00 . A A . 2 TYR CD1 1 1 10 4107 1 1 2 TYR CD2 C 6.404 1.217 -4.101 1.00 . A A . 2 TYR CD2 1 1 10 4108 1 1 2 TYR CE1 C 6.078 3.772 -5.089 1.00 . A A . 2 TYR CE1 1 1 10 4109 1 1 2 TYR CE2 C 7.134 1.627 -5.199 1.00 . A A . 2 TYR CE2 1 1 10 4110 1 1 2 TYR CG C 5.503 2.071 -3.477 1.00 . A A . 2 TYR CG 1 1 10 4111 1 1 2 TYR CZ C 6.967 2.906 -5.690 1.00 . A A . 2 TYR CZ 1 1 10 4112 1 1 2 TYR H H 5.021 -0.327 0.141 1.00 . A A . 2 TYR H 1 1 10 4113 1 1 2 TYR HA H 6.407 0.730 -1.326 1.00 . A A . 2 TYR HA 1 1 10 4114 1 1 2 TYR HB2 H 4.181 0.715 -2.546 1.00 . A A . 2 TYR HB2 1 1 10 4115 1 1 2 TYR HB3 H 3.989 2.390 -2.041 1.00 . A A . 2 TYR HB3 1 1 10 4116 1 1 2 TYR HD1 H 4.656 4.030 -3.517 1.00 . A A . 2 TYR HD1 1 1 10 4117 1 1 2 TYR HD2 H 6.531 0.216 -3.714 1.00 . A A . 2 TYR HD2 1 1 10 4118 1 1 2 TYR HE1 H 5.948 4.773 -5.473 1.00 . A A . 2 TYR HE1 1 1 10 4119 1 1 2 TYR HE2 H 7.830 0.949 -5.670 1.00 . A A . 2 TYR HE2 1 1 10 4120 1 1 2 TYR HH H 7.821 2.576 -7.380 1.00 . A A . 2 TYR HH 1 1 10 4121 1 1 2 TYR N N 4.797 0.609 -0.040 1.00 . A A . 2 TYR N 1 1 10 4122 1 1 2 TYR O O 6.120 3.679 -1.154 1.00 . A A . 2 TYR O 1 1 10 4123 1 1 2 TYR OH O 7.692 3.318 -6.785 1.00 . A A . 2 TYR OH 1 1 10 4124 1 1 3 CYS C C 8.541 3.794 1.496 1.00 . A A . 3 CYS C 1 1 10 4125 1 1 3 CYS CA C 7.015 3.812 1.466 1.00 . A A . 3 CYS CA 1 1 10 4126 1 1 3 CYS CB C 6.467 3.903 2.891 1.00 . A A . 3 CYS CB 1 1 10 4127 1 1 3 CYS H H 6.444 1.781 1.295 1.00 . A A . 3 CYS H 1 1 10 4128 1 1 3 CYS HA H 6.689 4.676 0.908 1.00 . A A . 3 CYS HA 1 1 10 4129 1 1 3 CYS HB2 H 7.175 3.451 3.571 1.00 . A A . 3 CYS HB2 1 1 10 4130 1 1 3 CYS HB3 H 6.337 4.943 3.153 1.00 . A A . 3 CYS HB3 1 1 10 4131 1 1 3 CYS N N 6.495 2.625 0.798 1.00 . A A . 3 CYS N 1 1 10 4132 1 1 3 CYS O O 9.175 2.958 0.853 1.00 . A A . 3 CYS O 1 1 10 4133 1 1 3 CYS SG S 4.865 3.067 3.126 1.00 . A A . 3 CYS SG 1 1 10 4134 1 1 4 ALA C C 11.081 3.990 3.545 1.00 . A A . 4 ALA C 1 1 10 4135 1 1 4 ALA CA C 10.573 4.812 2.365 1.00 . A A . 4 ALA CA 1 1 10 4136 1 1 4 ALA CB C 11.002 6.264 2.507 1.00 . A A . 4 ALA CB 1 1 10 4137 1 1 4 ALA H H 8.564 5.361 2.737 1.00 . A A . 4 ALA H 1 1 10 4138 1 1 4 ALA HA H 11.006 4.422 1.455 1.00 . A A . 4 ALA HA 1 1 10 4139 1 1 4 ALA HB1 H 12.011 6.305 2.893 1.00 . A A . 4 ALA HB1 1 1 10 4140 1 1 4 ALA HB2 H 10.967 6.746 1.542 1.00 . A A . 4 ALA HB2 1 1 10 4141 1 1 4 ALA HB3 H 10.336 6.771 3.189 1.00 . A A . 4 ALA HB3 1 1 10 4142 1 1 4 ALA N N 9.123 4.722 2.248 1.00 . A A . 4 ALA N 1 1 10 4143 1 1 4 ALA O O 10.842 4.333 4.703 1.00 . A A . 4 ALA O 1 1 10 4144 1 1 5 THR C C 13.657 2.552 4.798 1.00 . A A . 5 THR C 1 1 10 4145 1 1 5 THR CA C 12.322 2.029 4.280 1.00 . A A . 5 THR CA 1 1 10 4146 1 1 5 THR CB C 12.512 0.592 3.761 1.00 . A A . 5 THR CB 1 1 10 4147 1 1 5 THR CG2 C 11.205 -0.183 3.820 1.00 . A A . 5 THR CG2 1 1 10 4148 1 1 5 THR H H 11.939 2.680 2.303 1.00 . A A . 5 THR H 1 1 10 4149 1 1 5 THR HA H 11.615 2.004 5.096 1.00 . A A . 5 THR HA 1 1 10 4150 1 1 5 THR HB H 13.238 0.092 4.387 1.00 . A A . 5 THR HB 1 1 10 4151 1 1 5 THR HG1 H 13.590 1.365 2.301 1.00 . A A . 5 THR HG1 1 1 10 4152 1 1 5 THR HG21 H 10.413 0.472 4.154 1.00 . A A . 5 THR HG21 1 1 10 4153 1 1 5 THR HG22 H 11.306 -1.008 4.509 1.00 . A A . 5 THR HG22 1 1 10 4154 1 1 5 THR HG23 H 10.966 -0.561 2.837 1.00 . A A . 5 THR HG23 1 1 10 4155 1 1 5 THR N N 11.782 2.901 3.244 1.00 . A A . 5 THR N 1 1 10 4156 1 1 5 THR O O 14.199 3.526 4.275 1.00 . A A . 5 THR O 1 1 10 4157 1 1 5 THR OG1 O 12.997 0.618 2.414 1.00 . A A . 5 THR OG1 1 1 10 4158 1 1 6 LYS C C 16.505 2.535 5.334 1.00 . A A . 6 LYS C 1 1 10 4159 1 1 6 LYS CA C 15.457 2.295 6.416 1.00 . A A . 6 LYS CA 1 1 10 4160 1 1 6 LYS CB C 15.949 1.221 7.389 1.00 . A A . 6 LYS CB 1 1 10 4161 1 1 6 LYS CD C 18.162 0.652 8.434 1.00 . A A . 6 LYS CD 1 1 10 4162 1 1 6 LYS CE C 19.189 1.049 9.483 1.00 . A A . 6 LYS CE 1 1 10 4163 1 1 6 LYS CG C 17.065 1.695 8.305 1.00 . A A . 6 LYS CG 1 1 10 4164 1 1 6 LYS H H 13.703 1.129 6.201 1.00 . A A . 6 LYS H 1 1 10 4165 1 1 6 LYS HA H 15.300 3.215 6.958 1.00 . A A . 6 LYS HA 1 1 10 4166 1 1 6 LYS HB2 H 15.120 0.901 8.002 1.00 . A A . 6 LYS HB2 1 1 10 4167 1 1 6 LYS HB3 H 16.313 0.377 6.821 1.00 . A A . 6 LYS HB3 1 1 10 4168 1 1 6 LYS HD2 H 17.718 -0.291 8.720 1.00 . A A . 6 LYS HD2 1 1 10 4169 1 1 6 LYS HD3 H 18.658 0.544 7.480 1.00 . A A . 6 LYS HD3 1 1 10 4170 1 1 6 LYS HE2 H 20.055 1.454 8.984 1.00 . A A . 6 LYS HE2 1 1 10 4171 1 1 6 LYS HE3 H 18.756 1.804 10.123 1.00 . A A . 6 LYS HE3 1 1 10 4172 1 1 6 LYS HG2 H 17.491 2.601 7.899 1.00 . A A . 6 LYS HG2 1 1 10 4173 1 1 6 LYS HG3 H 16.654 1.895 9.284 1.00 . A A . 6 LYS HG3 1 1 10 4174 1 1 6 LYS HZ1 H 20.631 -0.267 10.224 1.00 . A A . 6 LYS HZ1 1 1 10 4175 1 1 6 LYS HZ2 H 19.108 -0.970 10.010 1.00 . A A . 6 LYS HZ2 1 1 10 4176 1 1 6 LYS HZ3 H 19.384 0.068 11.317 1.00 . A A . 6 LYS HZ3 1 1 10 4177 1 1 6 LYS N N 14.183 1.898 5.828 1.00 . A A . 6 LYS N 1 1 10 4178 1 1 6 LYS NZ N 19.607 -0.111 10.317 1.00 . A A . 6 LYS NZ 1 1 10 4179 1 1 6 LYS O O 16.648 1.738 4.407 1.00 . A A . 6 LYS O 1 1 10 4180 1 1 7 GLY C C 17.753 4.867 3.384 1.00 . A A . 7 GLY C 1 1 10 4181 1 1 7 GLY CA C 18.264 3.961 4.486 1.00 . A A . 7 GLY CA 1 1 10 4182 1 1 7 GLY H H 17.080 4.236 6.220 1.00 . A A . 7 GLY H 1 1 10 4183 1 1 7 GLY HA2 H 19.082 4.451 4.992 1.00 . A A . 7 GLY HA2 1 1 10 4184 1 1 7 GLY HA3 H 18.626 3.044 4.043 1.00 . A A . 7 GLY HA3 1 1 10 4185 1 1 7 GLY N N 17.238 3.637 5.460 1.00 . A A . 7 GLY N 1 1 10 4186 1 1 7 GLY O O 18.533 5.558 2.728 1.00 . A A . 7 GLY O 1 1 10 4187 1 1 8 ILE C C 15.560 7.103 2.664 1.00 . A A . 8 ILE C 1 1 10 4188 1 1 8 ILE CA C 15.827 5.693 2.149 1.00 . A A . 8 ILE CA 1 1 10 4189 1 1 8 ILE CB C 14.504 5.082 1.649 1.00 . A A . 8 ILE CB 1 1 10 4190 1 1 8 ILE CD1 C 15.654 3.350 0.181 1.00 . A A . 8 ILE CD1 1 1 10 4191 1 1 8 ILE CG1 C 14.693 3.600 1.322 1.00 . A A . 8 ILE CG1 1 1 10 4192 1 1 8 ILE CG2 C 13.998 5.839 0.430 1.00 . A A . 8 ILE CG2 1 1 10 4193 1 1 8 ILE H H 15.871 4.293 3.735 1.00 . A A . 8 ILE H 1 1 10 4194 1 1 8 ILE HA H 16.512 5.749 1.315 1.00 . A A . 8 ILE HA 1 1 10 4195 1 1 8 ILE HB H 13.769 5.180 2.434 1.00 . A A . 8 ILE HB 1 1 10 4196 1 1 8 ILE HD11 H 16.478 2.746 0.530 1.00 . A A . 8 ILE HD11 1 1 10 4197 1 1 8 ILE HD12 H 15.141 2.835 -0.617 1.00 . A A . 8 ILE HD12 1 1 10 4198 1 1 8 ILE HD13 H 16.031 4.295 -0.184 1.00 . A A . 8 ILE HD13 1 1 10 4199 1 1 8 ILE HG12 H 15.074 3.091 2.194 1.00 . A A . 8 ILE HG12 1 1 10 4200 1 1 8 ILE HG13 H 13.737 3.174 1.051 1.00 . A A . 8 ILE HG13 1 1 10 4201 1 1 8 ILE HG21 H 13.687 6.830 0.726 1.00 . A A . 8 ILE HG21 1 1 10 4202 1 1 8 ILE HG22 H 14.789 5.914 -0.300 1.00 . A A . 8 ILE HG22 1 1 10 4203 1 1 8 ILE HG23 H 13.160 5.312 0.001 1.00 . A A . 8 ILE HG23 1 1 10 4204 1 1 8 ILE N N 16.440 4.865 3.179 1.00 . A A . 8 ILE N 1 1 10 4205 1 1 8 ILE O O 15.014 7.287 3.752 1.00 . A A . 8 ILE O 1 1 10 4206 1 1 9 LYS C C 14.300 9.748 2.650 1.00 . A A . 9 LYS C 1 1 10 4207 1 1 9 LYS CA C 15.748 9.494 2.246 1.00 . A A . 9 LYS CA 1 1 10 4208 1 1 9 LYS CB C 16.134 10.414 1.085 1.00 . A A . 9 LYS CB 1 1 10 4209 1 1 9 LYS CD C 18.427 11.438 1.020 1.00 . A A . 9 LYS CD 1 1 10 4210 1 1 9 LYS CE C 19.882 11.234 0.629 1.00 . A A . 9 LYS CE 1 1 10 4211 1 1 9 LYS CG C 17.572 10.244 0.627 1.00 . A A . 9 LYS CG 1 1 10 4212 1 1 9 LYS H H 16.378 7.889 1.017 1.00 . A A . 9 LYS H 1 1 10 4213 1 1 9 LYS HA H 16.387 9.707 3.090 1.00 . A A . 9 LYS HA 1 1 10 4214 1 1 9 LYS HB2 H 15.484 10.207 0.247 1.00 . A A . 9 LYS HB2 1 1 10 4215 1 1 9 LYS HB3 H 15.995 11.440 1.393 1.00 . A A . 9 LYS HB3 1 1 10 4216 1 1 9 LYS HD2 H 18.052 12.319 0.520 1.00 . A A . 9 LYS HD2 1 1 10 4217 1 1 9 LYS HD3 H 18.366 11.576 2.090 1.00 . A A . 9 LYS HD3 1 1 10 4218 1 1 9 LYS HE2 H 20.093 10.175 0.615 1.00 . A A . 9 LYS HE2 1 1 10 4219 1 1 9 LYS HE3 H 20.037 11.645 -0.357 1.00 . A A . 9 LYS HE3 1 1 10 4220 1 1 9 LYS HG2 H 17.983 9.356 1.082 1.00 . A A . 9 LYS HG2 1 1 10 4221 1 1 9 LYS HG3 H 17.588 10.141 -0.449 1.00 . A A . 9 LYS HG3 1 1 10 4222 1 1 9 LYS HZ1 H 21.794 11.635 1.369 1.00 . A A . 9 LYS HZ1 1 1 10 4223 1 1 9 LYS HZ2 H 20.591 11.610 2.558 1.00 . A A . 9 LYS HZ2 1 1 10 4224 1 1 9 LYS HZ3 H 20.718 12.933 1.511 1.00 . A A . 9 LYS HZ3 1 1 10 4225 1 1 9 LYS N N 15.948 8.099 1.873 1.00 . A A . 9 LYS N 1 1 10 4226 1 1 9 LYS NZ N 20.811 11.900 1.584 1.00 . A A . 9 LYS NZ 1 1 10 4227 1 1 9 LYS O O 13.372 9.213 2.042 1.00 . A A . 9 LYS O 1 1 10 4228 1 1 10 CYS C C 12.514 12.394 4.066 1.00 . A A . 10 CYS C 1 1 10 4229 1 1 10 CYS CA C 12.776 10.894 4.163 1.00 . A A . 10 CYS CA 1 1 10 4230 1 1 10 CYS CB C 12.608 10.428 5.611 1.00 . A A . 10 CYS CB 1 1 10 4231 1 1 10 CYS H H 14.891 10.964 4.123 1.00 . A A . 10 CYS H 1 1 10 4232 1 1 10 CYS HA H 12.062 10.376 3.542 1.00 . A A . 10 CYS HA 1 1 10 4233 1 1 10 CYS HB2 H 11.559 10.268 5.810 1.00 . A A . 10 CYS HB2 1 1 10 4234 1 1 10 CYS HB3 H 13.141 9.499 5.746 1.00 . A A . 10 CYS HB3 1 1 10 4235 1 1 10 CYS N N 14.112 10.568 3.678 1.00 . A A . 10 CYS N 1 1 10 4236 1 1 10 CYS O O 11.540 12.901 4.622 1.00 . A A . 10 CYS O 1 1 10 4237 1 1 10 CYS SG S 13.231 11.610 6.849 1.00 . A A . 10 CYS SG 1 1 10 4238 1 1 11 ASN C C 11.974 14.880 2.428 1.00 . A A . 11 ASN C 1 1 10 4239 1 1 11 ASN CA C 13.253 14.540 3.187 1.00 . A A . 11 ASN CA 1 1 10 4240 1 1 11 ASN CB C 14.466 15.104 2.443 1.00 . A A . 11 ASN CB 1 1 10 4241 1 1 11 ASN CG C 14.615 14.518 1.053 1.00 . A A . 11 ASN CG 1 1 10 4242 1 1 11 ASN H H 14.146 12.637 2.937 1.00 . A A . 11 ASN H 1 1 10 4243 1 1 11 ASN HA H 13.205 14.986 4.169 1.00 . A A . 11 ASN HA 1 1 10 4244 1 1 11 ASN HB2 H 14.358 16.175 2.352 1.00 . A A . 11 ASN HB2 1 1 10 4245 1 1 11 ASN HB3 H 15.361 14.883 3.006 1.00 . A A . 11 ASN HB3 1 1 10 4246 1 1 11 ASN HD21 H 14.929 16.331 0.296 1.00 . A A . 11 ASN HD21 1 1 10 4247 1 1 11 ASN HD22 H 14.960 15.028 -0.838 1.00 . A A . 11 ASN HD22 1 1 10 4248 1 1 11 ASN N N 13.390 13.098 3.357 1.00 . A A . 11 ASN N 1 1 10 4249 1 1 11 ASN ND2 N 14.860 15.379 0.071 1.00 . A A . 11 ASN ND2 1 1 10 4250 1 1 11 ASN O O 11.348 15.910 2.677 1.00 . A A . 11 ASN O 1 1 10 4251 1 1 11 ASN OD1 O 14.512 13.306 0.863 1.00 . A A . 11 ASN OD1 1 1 10 4252 1 1 12 ASP C C 9.368 13.108 0.970 1.00 . A A . 12 ASP C 1 1 10 4253 1 1 12 ASP CA C 10.387 14.213 0.708 1.00 . A A . 12 ASP CA 1 1 10 4254 1 1 12 ASP CB C 10.734 14.262 -0.781 1.00 . A A . 12 ASP CB 1 1 10 4255 1 1 12 ASP CG C 11.869 13.324 -1.142 1.00 . A A . 12 ASP CG 1 1 10 4256 1 1 12 ASP H H 12.134 13.204 1.350 1.00 . A A . 12 ASP H 1 1 10 4257 1 1 12 ASP HA H 9.955 15.159 0.999 1.00 . A A . 12 ASP HA 1 1 10 4258 1 1 12 ASP HB2 H 9.863 13.981 -1.356 1.00 . A A . 12 ASP HB2 1 1 10 4259 1 1 12 ASP HB3 H 11.024 15.269 -1.043 1.00 . A A . 12 ASP HB3 1 1 10 4260 1 1 12 ASP N N 11.592 14.007 1.502 1.00 . A A . 12 ASP N 1 1 10 4261 1 1 12 ASP O O 8.270 13.367 1.462 1.00 . A A . 12 ASP O 1 1 10 4262 1 1 12 ASP OD1 O 11.601 12.124 -1.358 1.00 . A A . 12 ASP OD1 1 1 10 4263 1 1 12 ASP OD2 O 13.025 13.792 -1.210 1.00 . A A . 12 ASP OD2 1 1 10 4264 1 1 13 ILE C C 8.809 10.326 2.304 1.00 . A A . 13 ILE C 1 1 10 4265 1 1 13 ILE CA C 8.859 10.733 0.835 1.00 . A A . 13 ILE CA 1 1 10 4266 1 1 13 ILE CB C 9.307 9.523 -0.006 1.00 . A A . 13 ILE CB 1 1 10 4267 1 1 13 ILE CD1 C 8.323 7.419 -1.047 1.00 . A A . 13 ILE CD1 1 1 10 4268 1 1 13 ILE CG1 C 8.294 8.384 0.118 1.00 . A A . 13 ILE CG1 1 1 10 4269 1 1 13 ILE CG2 C 10.690 9.060 0.428 1.00 . A A . 13 ILE CG2 1 1 10 4270 1 1 13 ILE H H 10.628 11.734 0.248 1.00 . A A . 13 ILE H 1 1 10 4271 1 1 13 ILE HA H 7.866 11.018 0.518 1.00 . A A . 13 ILE HA 1 1 10 4272 1 1 13 ILE HB H 9.366 9.833 -1.038 1.00 . A A . 13 ILE HB 1 1 10 4273 1 1 13 ILE HD11 H 7.320 7.084 -1.262 1.00 . A A . 13 ILE HD11 1 1 10 4274 1 1 13 ILE HD12 H 8.732 7.914 -1.915 1.00 . A A . 13 ILE HD12 1 1 10 4275 1 1 13 ILE HD13 H 8.940 6.568 -0.794 1.00 . A A . 13 ILE HD13 1 1 10 4276 1 1 13 ILE HG12 H 8.499 7.824 1.017 1.00 . A A . 13 ILE HG12 1 1 10 4277 1 1 13 ILE HG13 H 7.299 8.802 0.179 1.00 . A A . 13 ILE HG13 1 1 10 4278 1 1 13 ILE HG21 H 10.650 8.718 1.452 1.00 . A A . 13 ILE HG21 1 1 10 4279 1 1 13 ILE HG22 H 11.014 8.250 -0.208 1.00 . A A . 13 ILE HG22 1 1 10 4280 1 1 13 ILE HG23 H 11.386 9.881 0.350 1.00 . A A . 13 ILE HG23 1 1 10 4281 1 1 13 ILE N N 9.740 11.877 0.636 1.00 . A A . 13 ILE N 1 1 10 4282 1 1 13 ILE O O 9.790 10.474 3.034 1.00 . A A . 13 ILE O 1 1 10 4283 1 1 14 HIS C C 7.751 7.883 4.254 1.00 . A A . 14 HIS C 1 1 10 4284 1 1 14 HIS CA C 7.484 9.378 4.113 1.00 . A A . 14 HIS CA 1 1 10 4285 1 1 14 HIS CB C 6.070 9.704 4.594 1.00 . A A . 14 HIS CB 1 1 10 4286 1 1 14 HIS CD2 C 6.827 10.640 6.891 1.00 . A A . 14 HIS CD2 1 1 10 4287 1 1 14 HIS CE1 C 5.137 9.937 8.097 1.00 . A A . 14 HIS CE1 1 1 10 4288 1 1 14 HIS CG C 5.985 9.978 6.064 1.00 . A A . 14 HIS CG 1 1 10 4289 1 1 14 HIS H H 6.916 9.717 2.102 1.00 . A A . 14 HIS H 1 1 10 4290 1 1 14 HIS HA H 8.195 9.917 4.722 1.00 . A A . 14 HIS HA 1 1 10 4291 1 1 14 HIS HB2 H 5.712 10.579 4.073 1.00 . A A . 14 HIS HB2 1 1 10 4292 1 1 14 HIS HB3 H 5.420 8.869 4.373 1.00 . A A . 14 HIS HB3 1 1 10 4293 1 1 14 HIS HD1 H 4.161 9.037 6.541 1.00 . A A . 14 HIS HD1 1 1 10 4294 1 1 14 HIS HD2 H 7.759 11.113 6.614 1.00 . A A . 14 HIS HD2 1 1 10 4295 1 1 14 HIS HE1 H 4.481 9.744 8.933 1.00 . A A . 14 HIS HE1 1 1 10 4296 1 1 14 HIS N N 7.661 9.810 2.731 1.00 . A A . 14 HIS N 1 1 10 4297 1 1 14 HIS ND1 N 4.937 9.549 6.851 1.00 . A A . 14 HIS ND1 1 1 10 4298 1 1 14 HIS NE2 N 6.278 10.601 8.149 1.00 . A A . 14 HIS NE2 1 1 10 4299 1 1 14 HIS O O 7.652 7.130 3.284 1.00 . A A . 14 HIS O 1 1 10 4300 1 1 15 CYS C C 7.104 5.315 6.156 1.00 . A A . 15 CYS C 1 1 10 4301 1 1 15 CYS CA C 8.371 6.053 5.735 1.00 . A A . 15 CYS CA 1 1 10 4302 1 1 15 CYS CB C 9.436 5.925 6.826 1.00 . A A . 15 CYS CB 1 1 10 4303 1 1 15 CYS H H 8.151 8.107 6.200 1.00 . A A . 15 CYS H 1 1 10 4304 1 1 15 CYS HA H 8.746 5.610 4.825 1.00 . A A . 15 CYS HA 1 1 10 4305 1 1 15 CYS HB2 H 8.954 5.936 7.792 1.00 . A A . 15 CYS HB2 1 1 10 4306 1 1 15 CYS HB3 H 9.957 4.987 6.701 1.00 . A A . 15 CYS HB3 1 1 10 4307 1 1 15 CYS N N 8.089 7.458 5.467 1.00 . A A . 15 CYS N 1 1 10 4308 1 1 15 CYS O O 6.169 5.916 6.686 1.00 . A A . 15 CYS O 1 1 10 4309 1 1 15 CYS SG S 10.679 7.257 6.813 1.00 . A A . 15 CYS SG 1 1 10 4310 1 1 16 CYS C C 5.740 3.137 7.784 1.00 . A A . 16 CYS C 1 1 10 4311 1 1 16 CYS CA C 5.930 3.186 6.270 1.00 . A A . 16 CYS CA 1 1 10 4312 1 1 16 CYS CB C 6.101 1.768 5.721 1.00 . A A . 16 CYS CB 1 1 10 4313 1 1 16 CYS H H 7.857 3.585 5.492 1.00 . A A . 16 CYS H 1 1 10 4314 1 1 16 CYS HA H 5.054 3.632 5.825 1.00 . A A . 16 CYS HA 1 1 10 4315 1 1 16 CYS HB2 H 7.155 1.551 5.629 1.00 . A A . 16 CYS HB2 1 1 10 4316 1 1 16 CYS HB3 H 5.653 1.067 6.410 1.00 . A A . 16 CYS HB3 1 1 10 4317 1 1 16 CYS N N 7.081 4.008 5.917 1.00 . A A . 16 CYS N 1 1 10 4318 1 1 16 CYS O O 6.685 3.344 8.545 1.00 . A A . 16 CYS O 1 1 10 4319 1 1 16 CYS SG S 5.338 1.507 4.087 1.00 . A A . 16 CYS SG 1 1 10 4320 1 1 17 SER C C 5.175 1.872 10.361 1.00 . A A . 17 SER C 1 1 10 4321 1 1 17 SER CA C 4.197 2.790 9.634 1.00 . A A . 17 SER CA 1 1 10 4322 1 1 17 SER CB C 2.765 2.292 9.836 1.00 . A A . 17 SER CB 1 1 10 4323 1 1 17 SER H H 3.801 2.707 7.556 1.00 . A A . 17 SER H 1 1 10 4324 1 1 17 SER HA H 4.284 3.785 10.044 1.00 . A A . 17 SER HA 1 1 10 4325 1 1 17 SER HB2 H 2.160 2.593 8.995 1.00 . A A . 17 SER HB2 1 1 10 4326 1 1 17 SER HB3 H 2.769 1.214 9.909 1.00 . A A . 17 SER HB3 1 1 10 4327 1 1 17 SER HG H 1.856 3.705 10.842 1.00 . A A . 17 SER HG 1 1 10 4328 1 1 17 SER N N 4.512 2.863 8.212 1.00 . A A . 17 SER N 1 1 10 4329 1 1 17 SER O O 5.293 0.691 10.037 1.00 . A A . 17 SER O 1 1 10 4330 1 1 17 SER OG O 2.201 2.827 11.020 1.00 . A A . 17 SER OG 1 1 10 4331 1 1 18 GLY C C 8.234 2.216 12.036 1.00 . A A . 18 GLY C 1 1 10 4332 1 1 18 GLY CA C 6.833 1.642 12.106 1.00 . A A . 18 GLY CA 1 1 10 4333 1 1 18 GLY H H 5.738 3.371 11.563 1.00 . A A . 18 GLY H 1 1 10 4334 1 1 18 GLY HA2 H 6.519 1.611 13.139 1.00 . A A . 18 GLY HA2 1 1 10 4335 1 1 18 GLY HA3 H 6.849 0.635 11.714 1.00 . A A . 18 GLY HA3 1 1 10 4336 1 1 18 GLY N N 5.874 2.424 11.348 1.00 . A A . 18 GLY N 1 1 10 4337 1 1 18 GLY O O 9.081 1.911 12.877 1.00 . A A . 18 GLY O 1 1 10 4338 1 1 19 LEU C C 9.741 5.153 11.177 1.00 . A A . 19 LEU C 1 1 10 4339 1 1 19 LEU CA C 9.792 3.663 10.851 1.00 . A A . 19 LEU CA 1 1 10 4340 1 1 19 LEU CB C 10.281 3.461 9.416 1.00 . A A . 19 LEU CB 1 1 10 4341 1 1 19 LEU CD1 C 10.868 1.933 7.517 1.00 . A A . 19 LEU CD1 1 1 10 4342 1 1 19 LEU CD2 C 11.774 1.484 9.805 1.00 . A A . 19 LEU CD2 1 1 10 4343 1 1 19 LEU CG C 10.591 2.019 9.010 1.00 . A A . 19 LEU CG 1 1 10 4344 1 1 19 LEU H H 7.768 3.251 10.391 1.00 . A A . 19 LEU H 1 1 10 4345 1 1 19 LEU HA H 10.480 3.182 11.529 1.00 . A A . 19 LEU HA 1 1 10 4346 1 1 19 LEU HB2 H 9.519 3.835 8.750 1.00 . A A . 19 LEU HB2 1 1 10 4347 1 1 19 LEU HB3 H 11.184 4.042 9.290 1.00 . A A . 19 LEU HB3 1 1 10 4348 1 1 19 LEU HD11 H 11.023 0.902 7.239 1.00 . A A . 19 LEU HD11 1 1 10 4349 1 1 19 LEU HD12 H 11.752 2.506 7.281 1.00 . A A . 19 LEU HD12 1 1 10 4350 1 1 19 LEU HD13 H 10.024 2.331 6.971 1.00 . A A . 19 LEU HD13 1 1 10 4351 1 1 19 LEU HD21 H 11.837 0.413 9.677 1.00 . A A . 19 LEU HD21 1 1 10 4352 1 1 19 LEU HD22 H 11.637 1.714 10.852 1.00 . A A . 19 LEU HD22 1 1 10 4353 1 1 19 LEU HD23 H 12.684 1.944 9.450 1.00 . A A . 19 LEU HD23 1 1 10 4354 1 1 19 LEU HG H 9.733 1.398 9.227 1.00 . A A . 19 LEU HG 1 1 10 4355 1 1 19 LEU N N 8.482 3.047 11.029 1.00 . A A . 19 LEU N 1 1 10 4356 1 1 19 LEU O O 8.683 5.778 11.113 1.00 . A A . 19 LEU O 1 1 10 4357 1 1 20 LYS C C 11.716 7.903 10.766 1.00 . A A . 20 LYS C 1 1 10 4358 1 1 20 LYS CA C 10.983 7.132 11.859 1.00 . A A . 20 LYS CA 1 1 10 4359 1 1 20 LYS CB C 11.701 7.318 13.198 1.00 . A A . 20 LYS CB 1 1 10 4360 1 1 20 LYS CD C 11.428 7.721 15.662 1.00 . A A . 20 LYS CD 1 1 10 4361 1 1 20 LYS CE C 10.492 8.682 16.378 1.00 . A A . 20 LYS CE 1 1 10 4362 1 1 20 LYS CG C 10.791 7.157 14.403 1.00 . A A . 20 LYS CG 1 1 10 4363 1 1 20 LYS H H 11.704 5.165 11.559 1.00 . A A . 20 LYS H 1 1 10 4364 1 1 20 LYS HA H 9.978 7.518 11.943 1.00 . A A . 20 LYS HA 1 1 10 4365 1 1 20 LYS HB2 H 12.494 6.589 13.272 1.00 . A A . 20 LYS HB2 1 1 10 4366 1 1 20 LYS HB3 H 12.131 8.309 13.228 1.00 . A A . 20 LYS HB3 1 1 10 4367 1 1 20 LYS HD2 H 11.668 6.907 16.329 1.00 . A A . 20 LYS HD2 1 1 10 4368 1 1 20 LYS HD3 H 12.333 8.247 15.392 1.00 . A A . 20 LYS HD3 1 1 10 4369 1 1 20 LYS HE2 H 10.569 9.653 15.913 1.00 . A A . 20 LYS HE2 1 1 10 4370 1 1 20 LYS HE3 H 9.480 8.317 16.283 1.00 . A A . 20 LYS HE3 1 1 10 4371 1 1 20 LYS HG2 H 9.864 7.680 14.216 1.00 . A A . 20 LYS HG2 1 1 10 4372 1 1 20 LYS HG3 H 10.589 6.106 14.553 1.00 . A A . 20 LYS HG3 1 1 10 4373 1 1 20 LYS HZ1 H 11.829 8.578 17.980 1.00 . A A . 20 LYS HZ1 1 1 10 4374 1 1 20 LYS HZ2 H 10.241 8.159 18.385 1.00 . A A . 20 LYS HZ2 1 1 10 4375 1 1 20 LYS HZ3 H 10.652 9.782 18.147 1.00 . A A . 20 LYS HZ3 1 1 10 4376 1 1 20 LYS N N 10.893 5.716 11.526 1.00 . A A . 20 LYS N 1 1 10 4377 1 1 20 LYS NZ N 10.827 8.810 17.824 1.00 . A A . 20 LYS NZ 1 1 10 4378 1 1 20 LYS O O 12.624 7.376 10.123 1.00 . A A . 20 LYS O 1 1 10 4379 1 1 21 CYS C C 13.033 10.868 10.158 1.00 . A A . 21 CYS C 1 1 10 4380 1 1 21 CYS CA C 11.937 9.999 9.548 1.00 . A A . 21 CYS CA 1 1 10 4381 1 1 21 CYS CB C 10.884 10.883 8.878 1.00 . A A . 21 CYS CB 1 1 10 4382 1 1 21 CYS H H 10.588 9.519 11.107 1.00 . A A . 21 CYS H 1 1 10 4383 1 1 21 CYS HA H 12.379 9.354 8.803 1.00 . A A . 21 CYS HA 1 1 10 4384 1 1 21 CYS HB2 H 10.245 10.266 8.262 1.00 . A A . 21 CYS HB2 1 1 10 4385 1 1 21 CYS HB3 H 10.287 11.361 9.641 1.00 . A A . 21 CYS HB3 1 1 10 4386 1 1 21 CYS N N 11.317 9.154 10.562 1.00 . A A . 21 CYS N 1 1 10 4387 1 1 21 CYS O O 12.766 11.959 10.661 1.00 . A A . 21 CYS O 1 1 10 4388 1 1 21 CYS SG S 11.577 12.192 7.816 1.00 . A A . 21 CYS SG 1 1 10 4389 1 1 22 ASP C C 15.569 12.453 9.960 1.00 . A A . 22 ASP C 1 1 10 4390 1 1 22 ASP CA C 15.403 11.106 10.657 1.00 . A A . 22 ASP CA 1 1 10 4391 1 1 22 ASP CB C 16.683 10.282 10.514 1.00 . A A . 22 ASP CB 1 1 10 4392 1 1 22 ASP CG C 17.689 10.580 11.608 1.00 . A A . 22 ASP CG 1 1 10 4393 1 1 22 ASP H H 14.415 9.499 9.696 1.00 . A A . 22 ASP H 1 1 10 4394 1 1 22 ASP HA H 15.213 11.280 11.705 1.00 . A A . 22 ASP HA 1 1 10 4395 1 1 22 ASP HB2 H 16.434 9.232 10.556 1.00 . A A . 22 ASP HB2 1 1 10 4396 1 1 22 ASP HB3 H 17.140 10.501 9.560 1.00 . A A . 22 ASP HB3 1 1 10 4397 1 1 22 ASP N N 14.266 10.375 10.110 1.00 . A A . 22 ASP N 1 1 10 4398 1 1 22 ASP O O 16.088 12.526 8.845 1.00 . A A . 22 ASP O 1 1 10 4399 1 1 22 ASP OD1 O 18.663 9.810 11.744 1.00 . A A . 22 ASP OD1 1 1 10 4400 1 1 22 ASP OD2 O 17.502 11.583 12.328 1.00 . A A . 22 ASP OD2 1 1 10 4401 1 1 23 SER C C 16.660 15.365 10.107 1.00 . A A . 23 SER C 1 1 10 4402 1 1 23 SER CA C 15.221 14.860 10.064 1.00 . A A . 23 SER CA 1 1 10 4403 1 1 23 SER CB C 14.309 15.819 10.831 1.00 . A A . 23 SER CB 1 1 10 4404 1 1 23 SER H H 14.722 13.393 11.508 1.00 . A A . 23 SER H 1 1 10 4405 1 1 23 SER HA H 14.898 14.815 9.035 1.00 . A A . 23 SER HA 1 1 10 4406 1 1 23 SER HB2 H 14.508 16.832 10.514 1.00 . A A . 23 SER HB2 1 1 10 4407 1 1 23 SER HB3 H 13.277 15.573 10.625 1.00 . A A . 23 SER HB3 1 1 10 4408 1 1 23 SER HG H 14.651 16.607 12.592 1.00 . A A . 23 SER HG 1 1 10 4409 1 1 23 SER N N 15.126 13.516 10.623 1.00 . A A . 23 SER N 1 1 10 4410 1 1 23 SER O O 16.998 16.366 9.476 1.00 . A A . 23 SER O 1 1 10 4411 1 1 23 SER OG O 14.530 15.727 12.228 1.00 . A A . 23 SER OG 1 1 10 4412 1 1 24 LYS C C 19.731 14.459 9.835 1.00 . A A . 24 LYS C 1 1 10 4413 1 1 24 LYS CA C 18.908 15.038 10.981 1.00 . A A . 24 LYS CA 1 1 10 4414 1 1 24 LYS CB C 19.468 14.554 12.321 1.00 . A A . 24 LYS CB 1 1 10 4415 1 1 24 LYS CD C 19.859 15.302 14.686 1.00 . A A . 24 LYS CD 1 1 10 4416 1 1 24 LYS CE C 20.113 16.722 15.169 1.00 . A A . 24 LYS CE 1 1 10 4417 1 1 24 LYS CG C 18.883 15.276 13.522 1.00 . A A . 24 LYS CG 1 1 10 4418 1 1 24 LYS H H 17.175 13.874 11.335 1.00 . A A . 24 LYS H 1 1 10 4419 1 1 24 LYS HA H 18.969 16.115 10.944 1.00 . A A . 24 LYS HA 1 1 10 4420 1 1 24 LYS HB2 H 19.260 13.499 12.424 1.00 . A A . 24 LYS HB2 1 1 10 4421 1 1 24 LYS HB3 H 20.539 14.702 12.324 1.00 . A A . 24 LYS HB3 1 1 10 4422 1 1 24 LYS HD2 H 19.449 14.725 15.502 1.00 . A A . 24 LYS HD2 1 1 10 4423 1 1 24 LYS HD3 H 20.796 14.866 14.370 1.00 . A A . 24 LYS HD3 1 1 10 4424 1 1 24 LYS HE2 H 21.001 17.099 14.686 1.00 . A A . 24 LYS HE2 1 1 10 4425 1 1 24 LYS HE3 H 19.267 17.337 14.897 1.00 . A A . 24 LYS HE3 1 1 10 4426 1 1 24 LYS HG2 H 18.648 16.292 13.240 1.00 . A A . 24 LYS HG2 1 1 10 4427 1 1 24 LYS HG3 H 17.981 14.768 13.831 1.00 . A A . 24 LYS HG3 1 1 10 4428 1 1 24 LYS HZ1 H 21.247 17.149 16.870 1.00 . A A . 24 LYS HZ1 1 1 10 4429 1 1 24 LYS HZ2 H 20.205 15.830 17.056 1.00 . A A . 24 LYS HZ2 1 1 10 4430 1 1 24 LYS HZ3 H 19.587 17.405 17.072 1.00 . A A . 24 LYS HZ3 1 1 10 4431 1 1 24 LYS N N 17.505 14.664 10.856 1.00 . A A . 24 LYS N 1 1 10 4432 1 1 24 LYS NZ N 20.301 16.781 16.645 1.00 . A A . 24 LYS NZ 1 1 10 4433 1 1 24 LYS O O 20.583 15.139 9.264 1.00 . A A . 24 LYS O 1 1 10 4434 1 1 25 ARG C C 19.340 12.491 7.152 1.00 . A A . 25 ARG C 1 1 10 4435 1 1 25 ARG CA C 20.184 12.529 8.423 1.00 . A A . 25 ARG CA 1 1 10 4436 1 1 25 ARG CB C 20.562 11.106 8.840 1.00 . A A . 25 ARG CB 1 1 10 4437 1 1 25 ARG CD C 22.162 9.714 10.187 1.00 . A A . 25 ARG CD 1 1 10 4438 1 1 25 ARG CG C 21.441 11.048 10.079 1.00 . A A . 25 ARG CG 1 1 10 4439 1 1 25 ARG CZ C 24.112 10.316 11.559 1.00 . A A . 25 ARG CZ 1 1 10 4440 1 1 25 ARG H H 18.776 12.708 9.994 1.00 . A A . 25 ARG H 1 1 10 4441 1 1 25 ARG HA H 21.086 13.088 8.225 1.00 . A A . 25 ARG HA 1 1 10 4442 1 1 25 ARG HB2 H 19.658 10.550 9.040 1.00 . A A . 25 ARG HB2 1 1 10 4443 1 1 25 ARG HB3 H 21.092 10.635 8.026 1.00 . A A . 25 ARG HB3 1 1 10 4444 1 1 25 ARG HD2 H 21.741 9.158 11.011 1.00 . A A . 25 ARG HD2 1 1 10 4445 1 1 25 ARG HD3 H 22.015 9.165 9.270 1.00 . A A . 25 ARG HD3 1 1 10 4446 1 1 25 ARG HE H 24.201 9.665 9.676 1.00 . A A . 25 ARG HE 1 1 10 4447 1 1 25 ARG HG2 H 22.175 11.839 10.025 1.00 . A A . 25 ARG HG2 1 1 10 4448 1 1 25 ARG HG3 H 20.823 11.186 10.953 1.00 . A A . 25 ARG HG3 1 1 10 4449 1 1 25 ARG HH11 H 22.326 10.524 12.481 1.00 . A A . 25 ARG HH11 1 1 10 4450 1 1 25 ARG HH12 H 23.709 10.945 13.437 1.00 . A A . 25 ARG HH12 1 1 10 4451 1 1 25 ARG HH21 H 26.028 10.216 10.924 1.00 . A A . 25 ARG HH21 1 1 10 4452 1 1 25 ARG HH22 H 25.814 10.770 12.550 1.00 . A A . 25 ARG HH22 1 1 10 4453 1 1 25 ARG N N 19.468 13.199 9.502 1.00 . A A . 25 ARG N 1 1 10 4454 1 1 25 ARG NE N 23.595 9.884 10.414 1.00 . A A . 25 ARG NE 1 1 10 4455 1 1 25 ARG NH1 N 23.317 10.620 12.576 1.00 . A A . 25 ARG NH1 1 1 10 4456 1 1 25 ARG NH2 N 25.426 10.444 11.689 1.00 . A A . 25 ARG NH2 1 1 10 4457 1 1 25 ARG O O 19.751 11.927 6.138 1.00 . A A . 25 ARG O 1 1 10 4458 1 1 26 LYS C C 17.024 11.729 5.515 1.00 . A A . 26 LYS C 1 1 10 4459 1 1 26 LYS CA C 17.255 13.130 6.070 1.00 . A A . 26 LYS CA 1 1 10 4460 1 1 26 LYS CB C 17.823 14.037 4.975 1.00 . A A . 26 LYS CB 1 1 10 4461 1 1 26 LYS CD C 16.866 16.164 5.907 1.00 . A A . 26 LYS CD 1 1 10 4462 1 1 26 LYS CE C 17.133 17.634 6.192 1.00 . A A . 26 LYS CE 1 1 10 4463 1 1 26 LYS CG C 18.126 15.447 5.450 1.00 . A A . 26 LYS CG 1 1 10 4464 1 1 26 LYS H H 17.885 13.526 8.052 1.00 . A A . 26 LYS H 1 1 10 4465 1 1 26 LYS HA H 16.311 13.532 6.405 1.00 . A A . 26 LYS HA 1 1 10 4466 1 1 26 LYS HB2 H 18.738 13.601 4.603 1.00 . A A . 26 LYS HB2 1 1 10 4467 1 1 26 LYS HB3 H 17.108 14.097 4.168 1.00 . A A . 26 LYS HB3 1 1 10 4468 1 1 26 LYS HD2 H 16.118 16.090 5.131 1.00 . A A . 26 LYS HD2 1 1 10 4469 1 1 26 LYS HD3 H 16.501 15.692 6.808 1.00 . A A . 26 LYS HD3 1 1 10 4470 1 1 26 LYS HE2 H 16.239 18.076 6.603 1.00 . A A . 26 LYS HE2 1 1 10 4471 1 1 26 LYS HE3 H 17.935 17.707 6.912 1.00 . A A . 26 LYS HE3 1 1 10 4472 1 1 26 LYS HG2 H 18.819 15.399 6.277 1.00 . A A . 26 LYS HG2 1 1 10 4473 1 1 26 LYS HG3 H 18.571 16.003 4.637 1.00 . A A . 26 LYS HG3 1 1 10 4474 1 1 26 LYS HZ1 H 16.883 19.188 4.819 1.00 . A A . 26 LYS HZ1 1 1 10 4475 1 1 26 LYS HZ2 H 17.453 17.752 4.131 1.00 . A A . 26 LYS HZ2 1 1 10 4476 1 1 26 LYS HZ3 H 18.495 18.725 5.043 1.00 . A A . 26 LYS HZ3 1 1 10 4477 1 1 26 LYS N N 18.158 13.094 7.215 1.00 . A A . 26 LYS N 1 1 10 4478 1 1 26 LYS NZ N 17.518 18.377 4.960 1.00 . A A . 26 LYS NZ 1 1 10 4479 1 1 26 LYS O O 17.027 11.523 4.301 1.00 . A A . 26 LYS O 1 1 10 4480 1 1 27 VAL C C 15.708 8.662 7.025 1.00 . A A . 27 VAL C 1 1 10 4481 1 1 27 VAL CA C 16.585 9.386 6.010 1.00 . A A . 27 VAL CA 1 1 10 4482 1 1 27 VAL CB C 17.908 8.615 5.848 1.00 . A A . 27 VAL CB 1 1 10 4483 1 1 27 VAL CG1 C 18.652 9.083 4.606 1.00 . A A . 27 VAL CG1 1 1 10 4484 1 1 27 VAL CG2 C 18.773 8.775 7.089 1.00 . A A . 27 VAL CG2 1 1 10 4485 1 1 27 VAL H H 16.830 10.994 7.364 1.00 . A A . 27 VAL H 1 1 10 4486 1 1 27 VAL HA H 16.080 9.397 5.055 1.00 . A A . 27 VAL HA 1 1 10 4487 1 1 27 VAL HB H 17.678 7.566 5.729 1.00 . A A . 27 VAL HB 1 1 10 4488 1 1 27 VAL HG11 H 18.818 10.149 4.668 1.00 . A A . 27 VAL HG11 1 1 10 4489 1 1 27 VAL HG12 H 19.601 8.572 4.540 1.00 . A A . 27 VAL HG12 1 1 10 4490 1 1 27 VAL HG13 H 18.061 8.862 3.729 1.00 . A A . 27 VAL HG13 1 1 10 4491 1 1 27 VAL HG21 H 19.314 7.858 7.271 1.00 . A A . 27 VAL HG21 1 1 10 4492 1 1 27 VAL HG22 H 19.475 9.582 6.938 1.00 . A A . 27 VAL HG22 1 1 10 4493 1 1 27 VAL HG23 H 18.146 8.999 7.939 1.00 . A A . 27 VAL HG23 1 1 10 4494 1 1 27 VAL N N 16.821 10.768 6.411 1.00 . A A . 27 VAL N 1 1 10 4495 1 1 27 VAL O O 15.520 9.132 8.147 1.00 . A A . 27 VAL O 1 1 10 4496 1 1 28 CYS C C 15.146 5.803 8.388 1.00 . A A . 28 CYS C 1 1 10 4497 1 1 28 CYS CA C 14.316 6.722 7.497 1.00 . A A . 28 CYS CA 1 1 10 4498 1 1 28 CYS CB C 13.332 5.894 6.667 1.00 . A A . 28 CYS CB 1 1 10 4499 1 1 28 CYS H H 15.361 7.189 5.717 1.00 . A A . 28 CYS H 1 1 10 4500 1 1 28 CYS HA H 13.760 7.403 8.123 1.00 . A A . 28 CYS HA 1 1 10 4501 1 1 28 CYS HB2 H 13.888 5.230 6.022 1.00 . A A . 28 CYS HB2 1 1 10 4502 1 1 28 CYS HB3 H 12.716 5.308 7.333 1.00 . A A . 28 CYS HB3 1 1 10 4503 1 1 28 CYS N N 15.174 7.513 6.623 1.00 . A A . 28 CYS N 1 1 10 4504 1 1 28 CYS O O 16.141 5.226 7.947 1.00 . A A . 28 CYS O 1 1 10 4505 1 1 28 CYS SG S 12.226 6.888 5.616 1.00 . A A . 28 CYS SG 1 1 10 4506 1 1 29 VAL C C 14.459 4.127 11.540 1.00 . A A . 29 VAL C 1 1 10 4507 1 1 29 VAL CA C 15.435 4.821 10.597 1.00 . A A . 29 VAL CA 1 1 10 4508 1 1 29 VAL CB C 16.448 5.630 11.428 1.00 . A A . 29 VAL CB 1 1 10 4509 1 1 29 VAL CG1 C 17.543 6.193 10.535 1.00 . A A . 29 VAL CG1 1 1 10 4510 1 1 29 VAL CG2 C 15.744 6.743 12.189 1.00 . A A . 29 VAL CG2 1 1 10 4511 1 1 29 VAL H H 13.931 6.156 9.936 1.00 . A A . 29 VAL H 1 1 10 4512 1 1 29 VAL HA H 15.976 4.071 10.039 1.00 . A A . 29 VAL HA 1 1 10 4513 1 1 29 VAL HB H 16.906 4.965 12.146 1.00 . A A . 29 VAL HB 1 1 10 4514 1 1 29 VAL HG11 H 18.345 6.577 11.148 1.00 . A A . 29 VAL HG11 1 1 10 4515 1 1 29 VAL HG12 H 17.921 5.412 9.892 1.00 . A A . 29 VAL HG12 1 1 10 4516 1 1 29 VAL HG13 H 17.139 6.993 9.932 1.00 . A A . 29 VAL HG13 1 1 10 4517 1 1 29 VAL HG21 H 16.029 6.701 13.230 1.00 . A A . 29 VAL HG21 1 1 10 4518 1 1 29 VAL HG22 H 16.030 7.699 11.776 1.00 . A A . 29 VAL HG22 1 1 10 4519 1 1 29 VAL HG23 H 14.675 6.619 12.102 1.00 . A A . 29 VAL HG23 1 1 10 4520 1 1 29 VAL N N 14.731 5.671 9.644 1.00 . A A . 29 VAL N 1 1 10 4521 1 1 29 VAL O O 13.432 4.693 11.915 1.00 . A A . 29 VAL O 1 1 10 4522 1 1 30 LYS C C 14.095 2.607 14.262 1.00 . A A . 30 LYS C 1 1 10 4523 1 1 30 LYS CA C 13.940 2.125 12.823 1.00 . A A . 30 LYS CA 1 1 10 4524 1 1 30 LYS CB C 14.287 0.637 12.732 1.00 . A A . 30 LYS CB 1 1 10 4525 1 1 30 LYS CD C 14.008 -1.242 14.376 1.00 . A A . 30 LYS CD 1 1 10 4526 1 1 30 LYS CE C 13.044 -1.866 15.373 1.00 . A A . 30 LYS CE 1 1 10 4527 1 1 30 LYS CG C 13.300 -0.263 13.454 1.00 . A A . 30 LYS CG 1 1 10 4528 1 1 30 LYS H H 15.618 2.499 11.589 1.00 . A A . 30 LYS H 1 1 10 4529 1 1 30 LYS HA H 12.914 2.265 12.518 1.00 . A A . 30 LYS HA 1 1 10 4530 1 1 30 LYS HB2 H 14.311 0.348 11.692 1.00 . A A . 30 LYS HB2 1 1 10 4531 1 1 30 LYS HB3 H 15.266 0.481 13.163 1.00 . A A . 30 LYS HB3 1 1 10 4532 1 1 30 LYS HD2 H 14.452 -2.026 13.782 1.00 . A A . 30 LYS HD2 1 1 10 4533 1 1 30 LYS HD3 H 14.782 -0.716 14.918 1.00 . A A . 30 LYS HD3 1 1 10 4534 1 1 30 LYS HE2 H 12.076 -1.404 15.256 1.00 . A A . 30 LYS HE2 1 1 10 4535 1 1 30 LYS HE3 H 12.966 -2.923 15.165 1.00 . A A . 30 LYS HE3 1 1 10 4536 1 1 30 LYS HG2 H 12.631 0.348 14.042 1.00 . A A . 30 LYS HG2 1 1 10 4537 1 1 30 LYS HG3 H 12.732 -0.820 12.722 1.00 . A A . 30 LYS HG3 1 1 10 4538 1 1 30 LYS HZ1 H 13.932 -2.559 17.132 1.00 . A A . 30 LYS HZ1 1 1 10 4539 1 1 30 LYS HZ2 H 12.696 -1.434 17.387 1.00 . A A . 30 LYS HZ2 1 1 10 4540 1 1 30 LYS HZ3 H 14.206 -0.918 16.827 1.00 . A A . 30 LYS HZ3 1 1 10 4541 1 1 30 LYS N N 14.786 2.897 11.921 1.00 . A A . 30 LYS N 1 1 10 4542 1 1 30 LYS NZ N 13.502 -1.681 16.778 1.00 . A A . 30 LYS NZ 1 1 10 4543 1 1 30 LYS O O 15.053 2.250 14.946 1.00 . A A . 30 LYS O 1 1 10 4544 1 1 31 GLY C C 12.414 3.078 17.046 1.00 . A A . 31 GLY C 1 1 10 4545 1 1 31 GLY CA C 13.195 3.935 16.070 1.00 . A A . 31 GLY CA 1 1 10 4546 1 1 31 GLY H H 12.404 3.670 14.124 1.00 . A A . 31 GLY H 1 1 10 4547 1 1 31 GLY HA2 H 14.225 3.979 16.390 1.00 . A A . 31 GLY HA2 1 1 10 4548 1 1 31 GLY HA3 H 12.783 4.934 16.078 1.00 . A A . 31 GLY HA3 1 1 10 4549 1 1 31 GLY N N 13.145 3.419 14.715 1.00 . A A . 31 GLY N 1 1 10 4550 1 1 31 GLY O O 11.934 2.001 16.691 1.00 . A A . 31 GLY O 1 1 11 4551 1 1 1 GLY C C 3.510 1.783 -0.909 1.00 . A A . 1 GLY C 1 1 11 4552 1 1 1 GLY CA C 2.056 1.461 -0.627 1.00 . A A . 1 GLY CA 1 1 11 4553 1 1 1 GLY H1 H 1.580 2.052 -2.604 1.00 . A A . 1 GLY H1 1 1 11 4554 1 1 1 GLY HA2 H 1.734 2.026 0.235 1.00 . A A . 1 GLY HA2 1 1 11 4555 1 1 1 GLY HA3 H 1.968 0.407 -0.408 1.00 . A A . 1 GLY HA3 1 1 11 4556 1 1 1 GLY N N 1.190 1.780 -1.748 1.00 . A A . 1 GLY N 1 1 11 4557 1 1 1 GLY O O 3.821 2.814 -1.507 1.00 . A A . 1 GLY O 1 1 11 4558 1 1 2 TYR C C 6.291 2.427 -0.091 1.00 . A A . 2 TYR C 1 1 11 4559 1 1 2 TYR CA C 5.834 1.097 -0.682 1.00 . A A . 2 TYR CA 1 1 11 4560 1 1 2 TYR CB C 6.168 1.048 -2.174 1.00 . A A . 2 TYR CB 1 1 11 4561 1 1 2 TYR CD1 C 8.033 2.429 -3.169 1.00 . A A . 2 TYR CD1 1 1 11 4562 1 1 2 TYR CD2 C 8.604 0.393 -2.070 1.00 . A A . 2 TYR CD2 1 1 11 4563 1 1 2 TYR CE1 C 9.366 2.659 -3.448 1.00 . A A . 2 TYR CE1 1 1 11 4564 1 1 2 TYR CE2 C 9.940 0.615 -2.343 1.00 . A A . 2 TYR CE2 1 1 11 4565 1 1 2 TYR CG C 7.629 1.295 -2.476 1.00 . A A . 2 TYR CG 1 1 11 4566 1 1 2 TYR CZ C 10.316 1.749 -3.032 1.00 . A A . 2 TYR CZ 1 1 11 4567 1 1 2 TYR H H 4.095 0.097 -0.008 1.00 . A A . 2 TYR H 1 1 11 4568 1 1 2 TYR HA H 6.355 0.295 -0.180 1.00 . A A . 2 TYR HA 1 1 11 4569 1 1 2 TYR HB2 H 5.909 0.075 -2.562 1.00 . A A . 2 TYR HB2 1 1 11 4570 1 1 2 TYR HB3 H 5.590 1.801 -2.691 1.00 . A A . 2 TYR HB3 1 1 11 4571 1 1 2 TYR HD1 H 7.287 3.140 -3.493 1.00 . A A . 2 TYR HD1 1 1 11 4572 1 1 2 TYR HD2 H 8.306 -0.494 -1.531 1.00 . A A . 2 TYR HD2 1 1 11 4573 1 1 2 TYR HE1 H 9.661 3.547 -3.987 1.00 . A A . 2 TYR HE1 1 1 11 4574 1 1 2 TYR HE2 H 10.684 -0.097 -2.018 1.00 . A A . 2 TYR HE2 1 1 11 4575 1 1 2 TYR HH H 11.916 1.424 -4.047 1.00 . A A . 2 TYR HH 1 1 11 4576 1 1 2 TYR N N 4.404 0.900 -0.477 1.00 . A A . 2 TYR N 1 1 11 4577 1 1 2 TYR O O 6.273 3.459 -0.764 1.00 . A A . 2 TYR O 1 1 11 4578 1 1 2 TYR OH O 11.646 1.973 -3.308 1.00 . A A . 2 TYR OH 1 1 11 4579 1 1 3 CYS C C 8.688 3.652 1.889 1.00 . A A . 3 CYS C 1 1 11 4580 1 1 3 CYS CA C 7.164 3.597 1.857 1.00 . A A . 3 CYS CA 1 1 11 4581 1 1 3 CYS CB C 6.611 3.641 3.283 1.00 . A A . 3 CYS CB 1 1 11 4582 1 1 3 CYS H H 6.692 1.543 1.657 1.00 . A A . 3 CYS H 1 1 11 4583 1 1 3 CYS HA H 6.796 4.452 1.311 1.00 . A A . 3 CYS HA 1 1 11 4584 1 1 3 CYS HB2 H 7.340 3.213 3.956 1.00 . A A . 3 CYS HB2 1 1 11 4585 1 1 3 CYS HB3 H 6.433 4.670 3.560 1.00 . A A . 3 CYS HB3 1 1 11 4586 1 1 3 CYS N N 6.701 2.396 1.172 1.00 . A A . 3 CYS N 1 1 11 4587 1 1 3 CYS O O 9.362 2.819 1.284 1.00 . A A . 3 CYS O 1 1 11 4588 1 1 3 CYS SG S 5.051 2.728 3.504 1.00 . A A . 3 CYS SG 1 1 11 4589 1 1 4 ALA C C 11.224 3.987 3.874 1.00 . A A . 4 ALA C 1 1 11 4590 1 1 4 ALA CA C 10.669 4.802 2.711 1.00 . A A . 4 ALA CA 1 1 11 4591 1 1 4 ALA CB C 11.023 6.272 2.878 1.00 . A A . 4 ALA CB 1 1 11 4592 1 1 4 ALA H H 8.635 5.272 3.058 1.00 . A A . 4 ALA H 1 1 11 4593 1 1 4 ALA HA H 11.117 4.451 1.792 1.00 . A A . 4 ALA HA 1 1 11 4594 1 1 4 ALA HB1 H 10.387 6.711 3.633 1.00 . A A . 4 ALA HB1 1 1 11 4595 1 1 4 ALA HB2 H 12.056 6.362 3.180 1.00 . A A . 4 ALA HB2 1 1 11 4596 1 1 4 ALA HB3 H 10.876 6.786 1.940 1.00 . A A . 4 ALA HB3 1 1 11 4597 1 1 4 ALA N N 9.225 4.639 2.598 1.00 . A A . 4 ALA N 1 1 11 4598 1 1 4 ALA O O 11.015 4.326 5.040 1.00 . A A . 4 ALA O 1 1 11 4599 1 1 5 THR C C 13.849 2.596 5.060 1.00 . A A . 5 THR C 1 1 11 4600 1 1 5 THR CA C 12.515 2.044 4.568 1.00 . A A . 5 THR CA 1 1 11 4601 1 1 5 THR CB C 12.729 0.615 4.036 1.00 . A A . 5 THR CB 1 1 11 4602 1 1 5 THR CG2 C 11.440 -0.190 4.111 1.00 . A A . 5 THR CG2 1 1 11 4603 1 1 5 THR H H 12.063 2.691 2.604 1.00 . A A . 5 THR H 1 1 11 4604 1 1 5 THR HA H 11.827 1.997 5.400 1.00 . A A . 5 THR HA 1 1 11 4605 1 1 5 THR HB H 13.476 0.127 4.646 1.00 . A A . 5 THR HB 1 1 11 4606 1 1 5 THR HG1 H 14.125 0.881 2.668 1.00 . A A . 5 THR HG1 1 1 11 4607 1 1 5 THR HG21 H 11.569 -1.012 4.799 1.00 . A A . 5 THR HG21 1 1 11 4608 1 1 5 THR HG22 H 11.197 -0.573 3.132 1.00 . A A . 5 THR HG22 1 1 11 4609 1 1 5 THR HG23 H 10.639 0.446 4.458 1.00 . A A . 5 THR HG23 1 1 11 4610 1 1 5 THR N N 11.932 2.909 3.551 1.00 . A A . 5 THR N 1 1 11 4611 1 1 5 THR O O 14.384 3.550 4.496 1.00 . A A . 5 THR O 1 1 11 4612 1 1 5 THR OG1 O 13.190 0.661 2.681 1.00 . A A . 5 THR OG1 1 1 11 4613 1 1 6 LYS C C 16.700 2.611 5.590 1.00 . A A . 6 LYS C 1 1 11 4614 1 1 6 LYS CA C 15.654 2.418 6.683 1.00 . A A . 6 LYS CA 1 1 11 4615 1 1 6 LYS CB C 16.152 1.392 7.704 1.00 . A A . 6 LYS CB 1 1 11 4616 1 1 6 LYS CD C 17.764 0.974 9.585 1.00 . A A . 6 LYS CD 1 1 11 4617 1 1 6 LYS CE C 19.243 0.953 9.939 1.00 . A A . 6 LYS CE 1 1 11 4618 1 1 6 LYS CG C 17.513 1.727 8.289 1.00 . A A . 6 LYS CG 1 1 11 4619 1 1 6 LYS H H 13.907 1.233 6.522 1.00 . A A . 6 LYS H 1 1 11 4620 1 1 6 LYS HA H 15.494 3.361 7.182 1.00 . A A . 6 LYS HA 1 1 11 4621 1 1 6 LYS HB2 H 15.440 1.334 8.514 1.00 . A A . 6 LYS HB2 1 1 11 4622 1 1 6 LYS HB3 H 16.218 0.427 7.224 1.00 . A A . 6 LYS HB3 1 1 11 4623 1 1 6 LYS HD2 H 17.221 1.458 10.383 1.00 . A A . 6 LYS HD2 1 1 11 4624 1 1 6 LYS HD3 H 17.415 -0.043 9.473 1.00 . A A . 6 LYS HD3 1 1 11 4625 1 1 6 LYS HE2 H 19.796 0.561 9.099 1.00 . A A . 6 LYS HE2 1 1 11 4626 1 1 6 LYS HE3 H 19.565 1.963 10.143 1.00 . A A . 6 LYS HE3 1 1 11 4627 1 1 6 LYS HG2 H 18.278 1.459 7.575 1.00 . A A . 6 LYS HG2 1 1 11 4628 1 1 6 LYS HG3 H 17.558 2.789 8.486 1.00 . A A . 6 LYS HG3 1 1 11 4629 1 1 6 LYS HZ1 H 18.721 -0.545 11.298 1.00 . A A . 6 LYS HZ1 1 1 11 4630 1 1 6 LYS HZ2 H 19.635 0.706 11.976 1.00 . A A . 6 LYS HZ2 1 1 11 4631 1 1 6 LYS HZ3 H 20.382 -0.448 10.990 1.00 . A A . 6 LYS HZ3 1 1 11 4632 1 1 6 LYS N N 14.381 1.989 6.115 1.00 . A A . 6 LYS N 1 1 11 4633 1 1 6 LYS NZ N 19.515 0.107 11.134 1.00 . A A . 6 LYS NZ 1 1 11 4634 1 1 6 LYS O O 16.834 1.780 4.692 1.00 . A A . 6 LYS O 1 1 11 4635 1 1 7 GLY C C 17.937 4.794 3.512 1.00 . A A . 7 GLY C 1 1 11 4636 1 1 7 GLY CA C 18.466 3.992 4.685 1.00 . A A . 7 GLY CA 1 1 11 4637 1 1 7 GLY H H 17.290 4.339 6.411 1.00 . A A . 7 GLY H 1 1 11 4638 1 1 7 GLY HA2 H 19.263 4.547 5.157 1.00 . A A . 7 GLY HA2 1 1 11 4639 1 1 7 GLY HA3 H 18.861 3.057 4.317 1.00 . A A . 7 GLY HA3 1 1 11 4640 1 1 7 GLY N N 17.441 3.712 5.673 1.00 . A A . 7 GLY N 1 1 11 4641 1 1 7 GLY O O 18.711 5.363 2.741 1.00 . A A . 7 GLY O 1 1 11 4642 1 1 8 ILE C C 15.717 7.022 2.688 1.00 . A A . 8 ILE C 1 1 11 4643 1 1 8 ILE CA C 15.986 5.576 2.288 1.00 . A A . 8 ILE CA 1 1 11 4644 1 1 8 ILE CB C 14.661 4.920 1.857 1.00 . A A . 8 ILE CB 1 1 11 4645 1 1 8 ILE CD1 C 15.782 3.140 0.423 1.00 . A A . 8 ILE CD1 1 1 11 4646 1 1 8 ILE CG1 C 14.867 3.427 1.594 1.00 . A A . 8 ILE CG1 1 1 11 4647 1 1 8 ILE CG2 C 14.106 5.609 0.619 1.00 . A A . 8 ILE CG2 1 1 11 4648 1 1 8 ILE H H 16.053 4.365 4.022 1.00 . A A . 8 ILE H 1 1 11 4649 1 1 8 ILE HA H 16.660 5.566 1.444 1.00 . A A . 8 ILE HA 1 1 11 4650 1 1 8 ILE HB H 13.947 5.041 2.657 1.00 . A A . 8 ILE HB 1 1 11 4651 1 1 8 ILE HD11 H 16.540 2.432 0.722 1.00 . A A . 8 ILE HD11 1 1 11 4652 1 1 8 ILE HD12 H 15.206 2.730 -0.393 1.00 . A A . 8 ILE HD12 1 1 11 4653 1 1 8 ILE HD13 H 16.255 4.058 0.103 1.00 . A A . 8 ILE HD13 1 1 11 4654 1 1 8 ILE HG12 H 15.299 2.969 2.470 1.00 . A A . 8 ILE HG12 1 1 11 4655 1 1 8 ILE HG13 H 13.910 2.969 1.388 1.00 . A A . 8 ILE HG13 1 1 11 4656 1 1 8 ILE HG21 H 13.886 6.641 0.851 1.00 . A A . 8 ILE HG21 1 1 11 4657 1 1 8 ILE HG22 H 14.837 5.567 -0.174 1.00 . A A . 8 ILE HG22 1 1 11 4658 1 1 8 ILE HG23 H 13.202 5.110 0.303 1.00 . A A . 8 ILE HG23 1 1 11 4659 1 1 8 ILE N N 16.616 4.838 3.375 1.00 . A A . 8 ILE N 1 1 11 4660 1 1 8 ILE O O 15.031 7.289 3.675 1.00 . A A . 8 ILE O 1 1 11 4661 1 1 9 LYS C C 14.597 9.733 2.242 1.00 . A A . 9 LYS C 1 1 11 4662 1 1 9 LYS CA C 16.079 9.376 2.183 1.00 . A A . 9 LYS CA 1 1 11 4663 1 1 9 LYS CB C 16.773 10.214 1.107 1.00 . A A . 9 LYS CB 1 1 11 4664 1 1 9 LYS CD C 19.119 10.968 1.595 1.00 . A A . 9 LYS CD 1 1 11 4665 1 1 9 LYS CE C 19.810 11.830 0.549 1.00 . A A . 9 LYS CE 1 1 11 4666 1 1 9 LYS CG C 18.251 9.900 0.952 1.00 . A A . 9 LYS CG 1 1 11 4667 1 1 9 LYS H H 16.798 7.681 1.140 1.00 . A A . 9 LYS H 1 1 11 4668 1 1 9 LYS HA H 16.527 9.592 3.141 1.00 . A A . 9 LYS HA 1 1 11 4669 1 1 9 LYS HB2 H 16.287 10.036 0.160 1.00 . A A . 9 LYS HB2 1 1 11 4670 1 1 9 LYS HB3 H 16.674 11.260 1.362 1.00 . A A . 9 LYS HB3 1 1 11 4671 1 1 9 LYS HD2 H 18.499 11.601 2.213 1.00 . A A . 9 LYS HD2 1 1 11 4672 1 1 9 LYS HD3 H 19.870 10.489 2.207 1.00 . A A . 9 LYS HD3 1 1 11 4673 1 1 9 LYS HE2 H 20.846 11.534 0.484 1.00 . A A . 9 LYS HE2 1 1 11 4674 1 1 9 LYS HE3 H 19.330 11.668 -0.405 1.00 . A A . 9 LYS HE3 1 1 11 4675 1 1 9 LYS HG2 H 18.460 8.951 1.422 1.00 . A A . 9 LYS HG2 1 1 11 4676 1 1 9 LYS HG3 H 18.488 9.842 -0.101 1.00 . A A . 9 LYS HG3 1 1 11 4677 1 1 9 LYS HZ1 H 20.103 13.438 1.849 1.00 . A A . 9 LYS HZ1 1 1 11 4678 1 1 9 LYS HZ2 H 18.754 13.608 0.844 1.00 . A A . 9 LYS HZ2 1 1 11 4679 1 1 9 LYS HZ3 H 20.309 13.831 0.217 1.00 . A A . 9 LYS HZ3 1 1 11 4680 1 1 9 LYS N N 16.261 7.955 1.913 1.00 . A A . 9 LYS N 1 1 11 4681 1 1 9 LYS NZ N 19.739 13.278 0.888 1.00 . A A . 9 LYS NZ 1 1 11 4682 1 1 9 LYS O O 13.799 9.251 1.438 1.00 . A A . 9 LYS O 1 1 11 4683 1 1 10 CYS C C 12.722 12.518 3.220 1.00 . A A . 10 CYS C 1 1 11 4684 1 1 10 CYS CA C 12.849 11.004 3.362 1.00 . A A . 10 CYS CA 1 1 11 4685 1 1 10 CYS CB C 12.317 10.563 4.727 1.00 . A A . 10 CYS CB 1 1 11 4686 1 1 10 CYS H H 14.917 10.933 3.810 1.00 . A A . 10 CYS H 1 1 11 4687 1 1 10 CYS HA H 12.264 10.532 2.588 1.00 . A A . 10 CYS HA 1 1 11 4688 1 1 10 CYS HB2 H 11.310 10.934 4.849 1.00 . A A . 10 CYS HB2 1 1 11 4689 1 1 10 CYS HB3 H 12.305 9.484 4.769 1.00 . A A . 10 CYS HB3 1 1 11 4690 1 1 10 CYS N N 14.235 10.582 3.198 1.00 . A A . 10 CYS N 1 1 11 4691 1 1 10 CYS O O 12.196 13.193 4.104 1.00 . A A . 10 CYS O 1 1 11 4692 1 1 10 CYS SG S 13.302 11.162 6.138 1.00 . A A . 10 CYS SG 1 1 11 4693 1 1 11 ASN C C 11.760 14.886 1.353 1.00 . A A . 11 ASN C 1 1 11 4694 1 1 11 ASN CA C 13.147 14.479 1.841 1.00 . A A . 11 ASN CA 1 1 11 4695 1 1 11 ASN CB C 14.201 14.875 0.805 1.00 . A A . 11 ASN CB 1 1 11 4696 1 1 11 ASN CG C 15.534 15.223 1.439 1.00 . A A . 11 ASN CG 1 1 11 4697 1 1 11 ASN H H 13.614 12.455 1.431 1.00 . A A . 11 ASN H 1 1 11 4698 1 1 11 ASN HA H 13.356 14.991 2.767 1.00 . A A . 11 ASN HA 1 1 11 4699 1 1 11 ASN HB2 H 14.354 14.051 0.122 1.00 . A A . 11 ASN HB2 1 1 11 4700 1 1 11 ASN HB3 H 13.850 15.734 0.253 1.00 . A A . 11 ASN HB3 1 1 11 4701 1 1 11 ASN HD21 H 16.384 15.343 -0.354 1.00 . A A . 11 ASN HD21 1 1 11 4702 1 1 11 ASN HD22 H 17.422 15.653 0.992 1.00 . A A . 11 ASN HD22 1 1 11 4703 1 1 11 ASN N N 13.207 13.044 2.100 1.00 . A A . 11 ASN N 1 1 11 4704 1 1 11 ASN ND2 N 16.549 15.427 0.608 1.00 . A A . 11 ASN ND2 1 1 11 4705 1 1 11 ASN O O 11.355 16.040 1.499 1.00 . A A . 11 ASN O 1 1 11 4706 1 1 11 ASN OD1 O 15.648 15.307 2.662 1.00 . A A . 11 ASN OD1 1 1 11 4707 1 1 12 ASP C C 8.835 12.935 0.344 1.00 . A A . 12 ASP C 1 1 11 4708 1 1 12 ASP CA C 9.696 14.192 0.268 1.00 . A A . 12 ASP CA 1 1 11 4709 1 1 12 ASP CB C 9.761 14.693 -1.175 1.00 . A A . 12 ASP CB 1 1 11 4710 1 1 12 ASP CG C 10.473 13.721 -2.095 1.00 . A A . 12 ASP CG 1 1 11 4711 1 1 12 ASP H H 11.417 13.033 0.689 1.00 . A A . 12 ASP H 1 1 11 4712 1 1 12 ASP HA H 9.250 14.957 0.885 1.00 . A A . 12 ASP HA 1 1 11 4713 1 1 12 ASP HB2 H 8.757 14.840 -1.545 1.00 . A A . 12 ASP HB2 1 1 11 4714 1 1 12 ASP HB3 H 10.290 15.635 -1.199 1.00 . A A . 12 ASP HB3 1 1 11 4715 1 1 12 ASP N N 11.038 13.933 0.776 1.00 . A A . 12 ASP N 1 1 11 4716 1 1 12 ASP O O 7.811 12.831 -0.332 1.00 . A A . 12 ASP O 1 1 11 4717 1 1 12 ASP OD1 O 11.710 13.824 -2.226 1.00 . A A . 12 ASP OD1 1 1 11 4718 1 1 12 ASP OD2 O 9.792 12.855 -2.683 1.00 . A A . 12 ASP OD2 1 1 11 4719 1 1 13 ILE C C 8.518 10.288 2.793 1.00 . A A . 13 ILE C 1 1 11 4720 1 1 13 ILE CA C 8.524 10.735 1.335 1.00 . A A . 13 ILE CA 1 1 11 4721 1 1 13 ILE CB C 9.123 9.612 0.467 1.00 . A A . 13 ILE CB 1 1 11 4722 1 1 13 ILE CD1 C 7.902 7.867 -0.925 1.00 . A A . 13 ILE CD1 1 1 11 4723 1 1 13 ILE CG1 C 8.198 8.393 0.461 1.00 . A A . 13 ILE CG1 1 1 11 4724 1 1 13 ILE CG2 C 10.506 9.232 0.975 1.00 . A A . 13 ILE CG2 1 1 11 4725 1 1 13 ILE H H 10.080 12.126 1.682 1.00 . A A . 13 ILE H 1 1 11 4726 1 1 13 ILE HA H 7.505 10.902 1.017 1.00 . A A . 13 ILE HA 1 1 11 4727 1 1 13 ILE HB H 9.226 9.982 -0.541 1.00 . A A . 13 ILE HB 1 1 11 4728 1 1 13 ILE HD11 H 7.015 7.250 -0.895 1.00 . A A . 13 ILE HD11 1 1 11 4729 1 1 13 ILE HD12 H 7.742 8.695 -1.599 1.00 . A A . 13 ILE HD12 1 1 11 4730 1 1 13 ILE HD13 H 8.738 7.277 -1.273 1.00 . A A . 13 ILE HD13 1 1 11 4731 1 1 13 ILE HG12 H 8.658 7.597 1.026 1.00 . A A . 13 ILE HG12 1 1 11 4732 1 1 13 ILE HG13 H 7.259 8.661 0.923 1.00 . A A . 13 ILE HG13 1 1 11 4733 1 1 13 ILE HG21 H 10.939 8.491 0.319 1.00 . A A . 13 ILE HG21 1 1 11 4734 1 1 13 ILE HG22 H 11.136 10.108 0.993 1.00 . A A . 13 ILE HG22 1 1 11 4735 1 1 13 ILE HG23 H 10.425 8.826 1.972 1.00 . A A . 13 ILE HG23 1 1 11 4736 1 1 13 ILE N N 9.257 11.984 1.171 1.00 . A A . 13 ILE N 1 1 11 4737 1 1 13 ILE O O 9.502 10.467 3.512 1.00 . A A . 13 ILE O 1 1 11 4738 1 1 14 HIS C C 7.614 7.743 4.691 1.00 . A A . 14 HIS C 1 1 11 4739 1 1 14 HIS CA C 7.272 9.227 4.595 1.00 . A A . 14 HIS CA 1 1 11 4740 1 1 14 HIS CB C 5.851 9.469 5.106 1.00 . A A . 14 HIS CB 1 1 11 4741 1 1 14 HIS CD2 C 5.019 9.110 7.536 1.00 . A A . 14 HIS CD2 1 1 11 4742 1 1 14 HIS CE1 C 6.265 10.617 8.527 1.00 . A A . 14 HIS CE1 1 1 11 4743 1 1 14 HIS CG C 5.778 9.701 6.584 1.00 . A A . 14 HIS CG 1 1 11 4744 1 1 14 HIS H H 6.655 9.588 2.602 1.00 . A A . 14 HIS H 1 1 11 4745 1 1 14 HIS HA H 7.965 9.783 5.207 1.00 . A A . 14 HIS HA 1 1 11 4746 1 1 14 HIS HB2 H 5.442 10.339 4.613 1.00 . A A . 14 HIS HB2 1 1 11 4747 1 1 14 HIS HB3 H 5.240 8.609 4.873 1.00 . A A . 14 HIS HB3 1 1 11 4748 1 1 14 HIS HD1 H 7.202 11.236 6.817 1.00 . A A . 14 HIS HD1 1 1 11 4749 1 1 14 HIS HD2 H 4.295 8.322 7.382 1.00 . A A . 14 HIS HD2 1 1 11 4750 1 1 14 HIS HE1 H 6.714 11.243 9.284 1.00 . A A . 14 HIS HE1 1 1 11 4751 1 1 14 HIS N N 7.405 9.703 3.222 1.00 . A A . 14 HIS N 1 1 11 4752 1 1 14 HIS ND1 N 6.547 10.641 7.237 1.00 . A A . 14 HIS ND1 1 1 11 4753 1 1 14 HIS NE2 N 5.341 9.696 8.735 1.00 . A A . 14 HIS NE2 1 1 11 4754 1 1 14 HIS O O 7.524 7.009 3.706 1.00 . A A . 14 HIS O 1 1 11 4755 1 1 15 CYS C C 7.146 5.103 6.546 1.00 . A A . 15 CYS C 1 1 11 4756 1 1 15 CYS CA C 8.364 5.912 6.108 1.00 . A A . 15 CYS CA 1 1 11 4757 1 1 15 CYS CB C 9.465 5.809 7.165 1.00 . A A . 15 CYS CB 1 1 11 4758 1 1 15 CYS H H 8.059 7.940 6.630 1.00 . A A . 15 CYS H 1 1 11 4759 1 1 15 CYS HA H 8.732 5.509 5.177 1.00 . A A . 15 CYS HA 1 1 11 4760 1 1 15 CYS HB2 H 9.011 5.777 8.145 1.00 . A A . 15 CYS HB2 1 1 11 4761 1 1 15 CYS HB3 H 10.025 4.900 7.004 1.00 . A A . 15 CYS HB3 1 1 11 4762 1 1 15 CYS N N 8.007 7.307 5.883 1.00 . A A . 15 CYS N 1 1 11 4763 1 1 15 CYS O O 6.194 5.647 7.105 1.00 . A A . 15 CYS O 1 1 11 4764 1 1 15 CYS SG S 10.644 7.198 7.149 1.00 . A A . 15 CYS SG 1 1 11 4765 1 1 16 CYS C C 5.911 2.864 8.170 1.00 . A A . 16 CYS C 1 1 11 4766 1 1 16 CYS CA C 6.086 2.915 6.655 1.00 . A A . 16 CYS CA 1 1 11 4767 1 1 16 CYS CB C 6.335 1.506 6.111 1.00 . A A . 16 CYS CB 1 1 11 4768 1 1 16 CYS H H 7.972 3.424 5.840 1.00 . A A . 16 CYS H 1 1 11 4769 1 1 16 CYS HA H 5.182 3.307 6.213 1.00 . A A . 16 CYS HA 1 1 11 4770 1 1 16 CYS HB2 H 7.400 1.348 6.017 1.00 . A A . 16 CYS HB2 1 1 11 4771 1 1 16 CYS HB3 H 5.930 0.784 6.805 1.00 . A A . 16 CYS HB3 1 1 11 4772 1 1 16 CYS N N 7.185 3.800 6.288 1.00 . A A . 16 CYS N 1 1 11 4773 1 1 16 CYS O O 6.852 3.112 8.923 1.00 . A A . 16 CYS O 1 1 11 4774 1 1 16 CYS SG S 5.584 1.194 4.481 1.00 . A A . 16 CYS SG 1 1 11 4775 1 1 17 SER C C 5.426 1.596 10.758 1.00 . A A . 17 SER C 1 1 11 4776 1 1 17 SER CA C 4.398 2.459 10.034 1.00 . A A . 17 SER CA 1 1 11 4777 1 1 17 SER CB C 2.995 1.890 10.249 1.00 . A A . 17 SER CB 1 1 11 4778 1 1 17 SER H H 3.989 2.353 7.959 1.00 . A A . 17 SER H 1 1 11 4779 1 1 17 SER HA H 4.437 3.460 10.437 1.00 . A A . 17 SER HA 1 1 11 4780 1 1 17 SER HB2 H 2.369 2.155 9.410 1.00 . A A . 17 SER HB2 1 1 11 4781 1 1 17 SER HB3 H 3.054 0.814 10.329 1.00 . A A . 17 SER HB3 1 1 11 4782 1 1 17 SER HG H 2.941 2.143 12.191 1.00 . A A . 17 SER HG 1 1 11 4783 1 1 17 SER N N 4.699 2.540 8.609 1.00 . A A . 17 SER N 1 1 11 4784 1 1 17 SER O O 5.560 0.405 10.479 1.00 . A A . 17 SER O 1 1 11 4785 1 1 17 SER OG O 2.412 2.405 11.434 1.00 . A A . 17 SER OG 1 1 11 4786 1 1 18 GLY C C 8.538 2.092 12.304 1.00 . A A . 18 GLY C 1 1 11 4787 1 1 18 GLY CA C 7.158 1.479 12.441 1.00 . A A . 18 GLY CA 1 1 11 4788 1 1 18 GLY H H 6.001 3.158 11.870 1.00 . A A . 18 GLY H 1 1 11 4789 1 1 18 GLY HA2 H 6.880 1.473 13.484 1.00 . A A . 18 GLY HA2 1 1 11 4790 1 1 18 GLY HA3 H 7.193 0.461 12.082 1.00 . A A . 18 GLY HA3 1 1 11 4791 1 1 18 GLY N N 6.151 2.206 11.690 1.00 . A A . 18 GLY N 1 1 11 4792 1 1 18 GLY O O 9.450 1.762 13.063 1.00 . A A . 18 GLY O 1 1 11 4793 1 1 19 LEU C C 9.872 5.142 11.368 1.00 . A A . 19 LEU C 1 1 11 4794 1 1 19 LEU CA C 9.973 3.644 11.097 1.00 . A A . 19 LEU CA 1 1 11 4795 1 1 19 LEU CB C 10.435 3.405 9.658 1.00 . A A . 19 LEU CB 1 1 11 4796 1 1 19 LEU CD1 C 11.136 1.840 7.830 1.00 . A A . 19 LEU CD1 1 1 11 4797 1 1 19 LEU CD2 C 12.088 1.579 10.128 1.00 . A A . 19 LEU CD2 1 1 11 4798 1 1 19 LEU CG C 10.861 1.976 9.319 1.00 . A A . 19 LEU CG 1 1 11 4799 1 1 19 LEU H H 7.930 3.206 10.760 1.00 . A A . 19 LEU H 1 1 11 4800 1 1 19 LEU HA H 10.696 3.216 11.775 1.00 . A A . 19 LEU HA 1 1 11 4801 1 1 19 LEU HB2 H 9.622 3.671 9.001 1.00 . A A . 19 LEU HB2 1 1 11 4802 1 1 19 LEU HB3 H 11.277 4.056 9.470 1.00 . A A . 19 LEU HB3 1 1 11 4803 1 1 19 LEU HD11 H 12.002 2.429 7.568 1.00 . A A . 19 LEU HD11 1 1 11 4804 1 1 19 LEU HD12 H 10.280 2.190 7.273 1.00 . A A . 19 LEU HD12 1 1 11 4805 1 1 19 LEU HD13 H 11.321 0.803 7.591 1.00 . A A . 19 LEU HD13 1 1 11 4806 1 1 19 LEU HD21 H 11.897 1.750 11.178 1.00 . A A . 19 LEU HD21 1 1 11 4807 1 1 19 LEU HD22 H 12.934 2.174 9.815 1.00 . A A . 19 LEU HD22 1 1 11 4808 1 1 19 LEU HD23 H 12.303 0.533 9.967 1.00 . A A . 19 LEU HD23 1 1 11 4809 1 1 19 LEU HG H 10.058 1.297 9.573 1.00 . A A . 19 LEU HG 1 1 11 4810 1 1 19 LEU N N 8.693 2.985 11.333 1.00 . A A . 19 LEU N 1 1 11 4811 1 1 19 LEU O O 8.780 5.711 11.369 1.00 . A A . 19 LEU O 1 1 11 4812 1 1 20 LYS C C 11.923 7.929 10.834 1.00 . A A . 20 LYS C 1 1 11 4813 1 1 20 LYS CA C 11.060 7.208 11.864 1.00 . A A . 20 LYS CA 1 1 11 4814 1 1 20 LYS CB C 11.602 7.468 13.271 1.00 . A A . 20 LYS CB 1 1 11 4815 1 1 20 LYS CD C 13.713 7.430 14.631 1.00 . A A . 20 LYS CD 1 1 11 4816 1 1 20 LYS CE C 14.524 6.449 15.464 1.00 . A A . 20 LYS CE 1 1 11 4817 1 1 20 LYS CG C 12.885 6.715 13.578 1.00 . A A . 20 LYS CG 1 1 11 4818 1 1 20 LYS H H 11.856 5.267 11.580 1.00 . A A . 20 LYS H 1 1 11 4819 1 1 20 LYS HA H 10.051 7.587 11.800 1.00 . A A . 20 LYS HA 1 1 11 4820 1 1 20 LYS HB2 H 11.794 8.525 13.380 1.00 . A A . 20 LYS HB2 1 1 11 4821 1 1 20 LYS HB3 H 10.854 7.170 13.992 1.00 . A A . 20 LYS HB3 1 1 11 4822 1 1 20 LYS HD2 H 14.391 8.114 14.141 1.00 . A A . 20 LYS HD2 1 1 11 4823 1 1 20 LYS HD3 H 13.051 7.982 15.283 1.00 . A A . 20 LYS HD3 1 1 11 4824 1 1 20 LYS HE2 H 14.314 5.447 15.122 1.00 . A A . 20 LYS HE2 1 1 11 4825 1 1 20 LYS HE3 H 15.573 6.664 15.329 1.00 . A A . 20 LYS HE3 1 1 11 4826 1 1 20 LYS HG2 H 12.635 5.729 13.940 1.00 . A A . 20 LYS HG2 1 1 11 4827 1 1 20 LYS HG3 H 13.467 6.630 12.671 1.00 . A A . 20 LYS HG3 1 1 11 4828 1 1 20 LYS HZ1 H 13.161 6.495 17.047 1.00 . A A . 20 LYS HZ1 1 1 11 4829 1 1 20 LYS HZ2 H 14.536 7.447 17.299 1.00 . A A . 20 LYS HZ2 1 1 11 4830 1 1 20 LYS HZ3 H 14.637 5.764 17.434 1.00 . A A . 20 LYS HZ3 1 1 11 4831 1 1 20 LYS N N 11.017 5.775 11.595 1.00 . A A . 20 LYS N 1 1 11 4832 1 1 20 LYS NZ N 14.192 6.545 16.913 1.00 . A A . 20 LYS NZ 1 1 11 4833 1 1 20 LYS O O 13.037 7.499 10.531 1.00 . A A . 20 LYS O 1 1 11 4834 1 1 21 CYS C C 13.106 10.772 9.974 1.00 . A A . 21 CYS C 1 1 11 4835 1 1 21 CYS CA C 12.127 9.812 9.304 1.00 . A A . 21 CYS CA 1 1 11 4836 1 1 21 CYS CB C 11.146 10.594 8.429 1.00 . A A . 21 CYS CB 1 1 11 4837 1 1 21 CYS H H 10.511 9.322 10.581 1.00 . A A . 21 CYS H 1 1 11 4838 1 1 21 CYS HA H 12.683 9.126 8.683 1.00 . A A . 21 CYS HA 1 1 11 4839 1 1 21 CYS HB2 H 10.635 9.906 7.771 1.00 . A A . 21 CYS HB2 1 1 11 4840 1 1 21 CYS HB3 H 10.422 11.084 9.062 1.00 . A A . 21 CYS HB3 1 1 11 4841 1 1 21 CYS N N 11.404 9.029 10.299 1.00 . A A . 21 CYS N 1 1 11 4842 1 1 21 CYS O O 12.733 11.874 10.377 1.00 . A A . 21 CYS O 1 1 11 4843 1 1 21 CYS SG S 11.930 11.870 7.392 1.00 . A A . 21 CYS SG 1 1 11 4844 1 1 22 ASP C C 15.540 12.498 9.976 1.00 . A A . 22 ASP C 1 1 11 4845 1 1 22 ASP CA C 15.393 11.168 10.707 1.00 . A A . 22 ASP CA 1 1 11 4846 1 1 22 ASP CB C 16.729 10.424 10.714 1.00 . A A . 22 ASP CB 1 1 11 4847 1 1 22 ASP CG C 17.606 10.821 11.886 1.00 . A A . 22 ASP CG 1 1 11 4848 1 1 22 ASP H H 14.595 9.458 9.747 1.00 . A A . 22 ASP H 1 1 11 4849 1 1 22 ASP HA H 15.095 11.363 11.726 1.00 . A A . 22 ASP HA 1 1 11 4850 1 1 22 ASP HB2 H 16.543 9.362 10.772 1.00 . A A . 22 ASP HB2 1 1 11 4851 1 1 22 ASP HB3 H 17.260 10.643 9.800 1.00 . A A . 22 ASP HB3 1 1 11 4852 1 1 22 ASP N N 14.359 10.346 10.088 1.00 . A A . 22 ASP N 1 1 11 4853 1 1 22 ASP O O 16.098 12.557 8.880 1.00 . A A . 22 ASP O 1 1 11 4854 1 1 22 ASP OD1 O 18.830 10.973 11.687 1.00 . A A . 22 ASP OD1 1 1 11 4855 1 1 22 ASP OD2 O 17.069 10.979 13.002 1.00 . A A . 22 ASP OD2 1 1 11 4856 1 1 23 SER C C 16.531 15.436 10.045 1.00 . A A . 23 SER C 1 1 11 4857 1 1 23 SER CA C 15.106 14.893 9.993 1.00 . A A . 23 SER CA 1 1 11 4858 1 1 23 SER CB C 14.157 15.851 10.717 1.00 . A A . 23 SER CB 1 1 11 4859 1 1 23 SER H H 14.602 13.453 11.461 1.00 . A A . 23 SER H 1 1 11 4860 1 1 23 SER HA H 14.802 14.810 8.960 1.00 . A A . 23 SER HA 1 1 11 4861 1 1 23 SER HB2 H 14.244 16.835 10.283 1.00 . A A . 23 SER HB2 1 1 11 4862 1 1 23 SER HB3 H 13.142 15.497 10.608 1.00 . A A . 23 SER HB3 1 1 11 4863 1 1 23 SER HG H 14.448 16.849 12.377 1.00 . A A . 23 SER HG 1 1 11 4864 1 1 23 SER N N 15.035 13.564 10.589 1.00 . A A . 23 SER N 1 1 11 4865 1 1 23 SER O O 16.852 16.434 9.399 1.00 . A A . 23 SER O 1 1 11 4866 1 1 23 SER OG O 14.468 15.931 12.097 1.00 . A A . 23 SER OG 1 1 11 4867 1 1 24 LYS C C 19.622 14.626 9.817 1.00 . A A . 24 LYS C 1 1 11 4868 1 1 24 LYS CA C 18.775 15.184 10.955 1.00 . A A . 24 LYS CA 1 1 11 4869 1 1 24 LYS CB C 19.337 14.717 12.300 1.00 . A A . 24 LYS CB 1 1 11 4870 1 1 24 LYS CD C 19.580 15.952 14.473 1.00 . A A . 24 LYS CD 1 1 11 4871 1 1 24 LYS CE C 18.854 16.530 15.679 1.00 . A A . 24 LYS CE 1 1 11 4872 1 1 24 LYS CG C 18.612 15.303 13.499 1.00 . A A . 24 LYS CG 1 1 11 4873 1 1 24 LYS H H 17.068 13.983 11.309 1.00 . A A . 24 LYS H 1 1 11 4874 1 1 24 LYS HA H 18.807 16.262 10.916 1.00 . A A . 24 LYS HA 1 1 11 4875 1 1 24 LYS HB2 H 19.264 13.641 12.353 1.00 . A A . 24 LYS HB2 1 1 11 4876 1 1 24 LYS HB3 H 20.377 15.002 12.360 1.00 . A A . 24 LYS HB3 1 1 11 4877 1 1 24 LYS HD2 H 20.286 15.210 14.815 1.00 . A A . 24 LYS HD2 1 1 11 4878 1 1 24 LYS HD3 H 20.108 16.748 13.967 1.00 . A A . 24 LYS HD3 1 1 11 4879 1 1 24 LYS HE2 H 19.530 17.183 16.210 1.00 . A A . 24 LYS HE2 1 1 11 4880 1 1 24 LYS HE3 H 18.003 17.097 15.332 1.00 . A A . 24 LYS HE3 1 1 11 4881 1 1 24 LYS HG2 H 17.910 16.049 13.155 1.00 . A A . 24 LYS HG2 1 1 11 4882 1 1 24 LYS HG3 H 18.079 14.513 14.008 1.00 . A A . 24 LYS HG3 1 1 11 4883 1 1 24 LYS HZ1 H 19.129 14.754 16.743 1.00 . A A . 24 LYS HZ1 1 1 11 4884 1 1 24 LYS HZ2 H 17.542 14.995 16.211 1.00 . A A . 24 LYS HZ2 1 1 11 4885 1 1 24 LYS HZ3 H 18.135 15.875 17.528 1.00 . A A . 24 LYS HZ3 1 1 11 4886 1 1 24 LYS N N 17.383 14.771 10.818 1.00 . A A . 24 LYS N 1 1 11 4887 1 1 24 LYS NZ N 18.382 15.464 16.605 1.00 . A A . 24 LYS NZ 1 1 11 4888 1 1 24 LYS O O 20.438 15.338 9.231 1.00 . A A . 24 LYS O 1 1 11 4889 1 1 25 ARG C C 19.321 12.583 7.175 1.00 . A A . 25 ARG C 1 1 11 4890 1 1 25 ARG CA C 20.169 12.696 8.439 1.00 . A A . 25 ARG CA 1 1 11 4891 1 1 25 ARG CB C 20.628 11.306 8.883 1.00 . A A . 25 ARG CB 1 1 11 4892 1 1 25 ARG CD C 23.042 11.117 9.556 1.00 . A A . 25 ARG CD 1 1 11 4893 1 1 25 ARG CG C 21.616 11.331 10.038 1.00 . A A . 25 ARG CG 1 1 11 4894 1 1 25 ARG CZ C 23.275 8.671 9.632 1.00 . A A . 25 ARG CZ 1 1 11 4895 1 1 25 ARG H H 18.758 12.833 10.011 1.00 . A A . 25 ARG H 1 1 11 4896 1 1 25 ARG HA H 21.037 13.300 8.223 1.00 . A A . 25 ARG HA 1 1 11 4897 1 1 25 ARG HB2 H 19.764 10.735 9.191 1.00 . A A . 25 ARG HB2 1 1 11 4898 1 1 25 ARG HB3 H 21.097 10.811 8.047 1.00 . A A . 25 ARG HB3 1 1 11 4899 1 1 25 ARG HD2 H 23.281 11.879 8.829 1.00 . A A . 25 ARG HD2 1 1 11 4900 1 1 25 ARG HD3 H 23.710 11.203 10.400 1.00 . A A . 25 ARG HD3 1 1 11 4901 1 1 25 ARG HE H 23.303 9.767 7.966 1.00 . A A . 25 ARG HE 1 1 11 4902 1 1 25 ARG HG2 H 21.555 12.291 10.531 1.00 . A A . 25 ARG HG2 1 1 11 4903 1 1 25 ARG HG3 H 21.359 10.549 10.736 1.00 . A A . 25 ARG HG3 1 1 11 4904 1 1 25 ARG HH11 H 23.041 9.559 11.431 1.00 . A A . 25 ARG HH11 1 1 11 4905 1 1 25 ARG HH12 H 23.207 7.835 11.471 1.00 . A A . 25 ARG HH12 1 1 11 4906 1 1 25 ARG HH21 H 23.522 7.497 8.005 1.00 . A A . 25 ARG HH21 1 1 11 4907 1 1 25 ARG HH22 H 23.481 6.663 9.522 1.00 . A A . 25 ARG HH22 1 1 11 4908 1 1 25 ARG N N 19.423 13.349 9.507 1.00 . A A . 25 ARG N 1 1 11 4909 1 1 25 ARG NE N 23.220 9.804 8.941 1.00 . A A . 25 ARG NE 1 1 11 4910 1 1 25 ARG NH1 N 23.166 8.690 10.953 1.00 . A A . 25 ARG NH1 1 1 11 4911 1 1 25 ARG NH2 N 23.439 7.515 9.001 1.00 . A A . 25 ARG NH2 1 1 11 4912 1 1 25 ARG O O 19.744 11.990 6.181 1.00 . A A . 25 ARG O 1 1 11 4913 1 1 26 LYS C C 17.030 11.693 5.574 1.00 . A A . 26 LYS C 1 1 11 4914 1 1 26 LYS CA C 17.215 13.120 6.078 1.00 . A A . 26 LYS CA 1 1 11 4915 1 1 26 LYS CB C 17.747 14.007 4.950 1.00 . A A . 26 LYS CB 1 1 11 4916 1 1 26 LYS CD C 18.329 16.335 4.208 1.00 . A A . 26 LYS CD 1 1 11 4917 1 1 26 LYS CE C 19.505 17.022 4.885 1.00 . A A . 26 LYS CE 1 1 11 4918 1 1 26 LYS CG C 17.535 15.491 5.191 1.00 . A A . 26 LYS CG 1 1 11 4919 1 1 26 LYS H H 17.842 13.613 8.040 1.00 . A A . 26 LYS H 1 1 11 4920 1 1 26 LYS HA H 16.259 13.501 6.404 1.00 . A A . 26 LYS HA 1 1 11 4921 1 1 26 LYS HB2 H 18.807 13.829 4.838 1.00 . A A . 26 LYS HB2 1 1 11 4922 1 1 26 LYS HB3 H 17.247 13.738 4.031 1.00 . A A . 26 LYS HB3 1 1 11 4923 1 1 26 LYS HD2 H 18.704 15.698 3.421 1.00 . A A . 26 LYS HD2 1 1 11 4924 1 1 26 LYS HD3 H 17.679 17.087 3.785 1.00 . A A . 26 LYS HD3 1 1 11 4925 1 1 26 LYS HE2 H 19.984 17.675 4.171 1.00 . A A . 26 LYS HE2 1 1 11 4926 1 1 26 LYS HE3 H 19.135 17.605 5.715 1.00 . A A . 26 LYS HE3 1 1 11 4927 1 1 26 LYS HG2 H 16.486 15.719 5.078 1.00 . A A . 26 LYS HG2 1 1 11 4928 1 1 26 LYS HG3 H 17.852 15.732 6.196 1.00 . A A . 26 LYS HG3 1 1 11 4929 1 1 26 LYS HZ1 H 20.039 15.340 6.002 1.00 . A A . 26 LYS HZ1 1 1 11 4930 1 1 26 LYS HZ2 H 21.239 16.530 5.940 1.00 . A A . 26 LYS HZ2 1 1 11 4931 1 1 26 LYS HZ3 H 20.954 15.546 4.594 1.00 . A A . 26 LYS HZ3 1 1 11 4932 1 1 26 LYS N N 18.123 13.155 7.219 1.00 . A A . 26 LYS N 1 1 11 4933 1 1 26 LYS NZ N 20.505 16.040 5.390 1.00 . A A . 26 LYS NZ 1 1 11 4934 1 1 26 LYS O O 16.998 11.450 4.367 1.00 . A A . 26 LYS O 1 1 11 4935 1 1 27 VAL C C 15.913 8.618 7.220 1.00 . A A . 27 VAL C 1 1 11 4936 1 1 27 VAL CA C 16.721 9.349 6.154 1.00 . A A . 27 VAL CA 1 1 11 4937 1 1 27 VAL CB C 18.073 8.634 5.969 1.00 . A A . 27 VAL CB 1 1 11 4938 1 1 27 VAL CG1 C 18.784 9.147 4.727 1.00 . A A . 27 VAL CG1 1 1 11 4939 1 1 27 VAL CG2 C 18.943 8.813 7.204 1.00 . A A . 27 VAL CG2 1 1 11 4940 1 1 27 VAL H H 16.940 11.008 7.450 1.00 . A A . 27 VAL H 1 1 11 4941 1 1 27 VAL HA H 16.185 9.307 5.217 1.00 . A A . 27 VAL HA 1 1 11 4942 1 1 27 VAL HB H 17.884 7.578 5.838 1.00 . A A . 27 VAL HB 1 1 11 4943 1 1 27 VAL HG11 H 18.214 8.879 3.849 1.00 . A A . 27 VAL HG11 1 1 11 4944 1 1 27 VAL HG12 H 18.876 10.222 4.782 1.00 . A A . 27 VAL HG12 1 1 11 4945 1 1 27 VAL HG13 H 19.767 8.704 4.666 1.00 . A A . 27 VAL HG13 1 1 11 4946 1 1 27 VAL HG21 H 18.327 9.118 8.037 1.00 . A A . 27 VAL HG21 1 1 11 4947 1 1 27 VAL HG22 H 19.431 7.878 7.441 1.00 . A A . 27 VAL HG22 1 1 11 4948 1 1 27 VAL HG23 H 19.690 9.569 7.012 1.00 . A A . 27 VAL HG23 1 1 11 4949 1 1 27 VAL N N 16.906 10.752 6.505 1.00 . A A . 27 VAL N 1 1 11 4950 1 1 27 VAL O O 15.915 9.003 8.389 1.00 . A A . 27 VAL O 1 1 11 4951 1 1 28 CYS C C 15.280 5.836 8.560 1.00 . A A . 28 CYS C 1 1 11 4952 1 1 28 CYS CA C 14.409 6.773 7.728 1.00 . A A . 28 CYS CA 1 1 11 4953 1 1 28 CYS CB C 13.366 5.965 6.954 1.00 . A A . 28 CYS CB 1 1 11 4954 1 1 28 CYS H H 15.261 7.301 5.863 1.00 . A A . 28 CYS H 1 1 11 4955 1 1 28 CYS HA H 13.902 7.457 8.391 1.00 . A A . 28 CYS HA 1 1 11 4956 1 1 28 CYS HB2 H 13.872 5.290 6.279 1.00 . A A . 28 CYS HB2 1 1 11 4957 1 1 28 CYS HB3 H 12.775 5.391 7.653 1.00 . A A . 28 CYS HB3 1 1 11 4958 1 1 28 CYS N N 15.223 7.560 6.809 1.00 . A A . 28 CYS N 1 1 11 4959 1 1 28 CYS O O 16.311 5.352 8.094 1.00 . A A . 28 CYS O 1 1 11 4960 1 1 28 CYS SG S 12.222 6.980 5.964 1.00 . A A . 28 CYS SG 1 1 11 4961 1 1 29 VAL C C 14.659 4.001 11.667 1.00 . A A . 29 VAL C 1 1 11 4962 1 1 29 VAL CA C 15.596 4.704 10.692 1.00 . A A . 29 VAL CA 1 1 11 4963 1 1 29 VAL CB C 16.660 5.482 11.489 1.00 . A A . 29 VAL CB 1 1 11 4964 1 1 29 VAL CG1 C 17.778 5.951 10.571 1.00 . A A . 29 VAL CG1 1 1 11 4965 1 1 29 VAL CG2 C 16.027 6.658 12.216 1.00 . A A . 29 VAL CG2 1 1 11 4966 1 1 29 VAL H H 14.027 5.999 10.109 1.00 . A A . 29 VAL H 1 1 11 4967 1 1 29 VAL HA H 16.099 3.961 10.090 1.00 . A A . 29 VAL HA 1 1 11 4968 1 1 29 VAL HB H 17.085 4.817 12.226 1.00 . A A . 29 VAL HB 1 1 11 4969 1 1 29 VAL HG11 H 18.620 6.275 11.165 1.00 . A A . 29 VAL HG11 1 1 11 4970 1 1 29 VAL HG12 H 18.081 5.138 9.927 1.00 . A A . 29 VAL HG12 1 1 11 4971 1 1 29 VAL HG13 H 17.427 6.776 9.968 1.00 . A A . 29 VAL HG13 1 1 11 4972 1 1 29 VAL HG21 H 16.803 7.293 12.617 1.00 . A A . 29 VAL HG21 1 1 11 4973 1 1 29 VAL HG22 H 15.420 7.225 11.524 1.00 . A A . 29 VAL HG22 1 1 11 4974 1 1 29 VAL HG23 H 15.407 6.293 13.021 1.00 . A A . 29 VAL HG23 1 1 11 4975 1 1 29 VAL N N 14.856 5.584 9.794 1.00 . A A . 29 VAL N 1 1 11 4976 1 1 29 VAL O O 13.533 4.444 11.892 1.00 . A A . 29 VAL O 1 1 11 4977 1 1 30 LYS C C 14.255 2.857 14.540 1.00 . A A . 30 LYS C 1 1 11 4978 1 1 30 LYS CA C 14.339 2.136 13.198 1.00 . A A . 30 LYS CA 1 1 11 4979 1 1 30 LYS CB C 14.942 0.743 13.393 1.00 . A A . 30 LYS CB 1 1 11 4980 1 1 30 LYS CD C 14.203 -1.657 13.344 1.00 . A A . 30 LYS CD 1 1 11 4981 1 1 30 LYS CE C 12.899 -2.358 12.995 1.00 . A A . 30 LYS CE 1 1 11 4982 1 1 30 LYS CG C 13.954 -0.278 13.931 1.00 . A A . 30 LYS CG 1 1 11 4983 1 1 30 LYS H H 16.038 2.599 12.025 1.00 . A A . 30 LYS H 1 1 11 4984 1 1 30 LYS HA H 13.342 2.034 12.795 1.00 . A A . 30 LYS HA 1 1 11 4985 1 1 30 LYS HB2 H 15.313 0.389 12.443 1.00 . A A . 30 LYS HB2 1 1 11 4986 1 1 30 LYS HB3 H 15.767 0.815 14.088 1.00 . A A . 30 LYS HB3 1 1 11 4987 1 1 30 LYS HD2 H 14.796 -1.556 12.447 1.00 . A A . 30 LYS HD2 1 1 11 4988 1 1 30 LYS HD3 H 14.741 -2.255 14.067 1.00 . A A . 30 LYS HD3 1 1 11 4989 1 1 30 LYS HE2 H 12.315 -2.473 13.895 1.00 . A A . 30 LYS HE2 1 1 11 4990 1 1 30 LYS HE3 H 12.356 -1.747 12.289 1.00 . A A . 30 LYS HE3 1 1 11 4991 1 1 30 LYS HG2 H 14.055 -0.332 15.005 1.00 . A A . 30 LYS HG2 1 1 11 4992 1 1 30 LYS HG3 H 12.952 0.036 13.677 1.00 . A A . 30 LYS HG3 1 1 11 4993 1 1 30 LYS HZ1 H 13.827 -3.629 11.622 1.00 . A A . 30 LYS HZ1 1 1 11 4994 1 1 30 LYS HZ2 H 12.246 -4.083 12.015 1.00 . A A . 30 LYS HZ2 1 1 11 4995 1 1 30 LYS HZ3 H 13.501 -4.355 13.115 1.00 . A A . 30 LYS HZ3 1 1 11 4996 1 1 30 LYS N N 15.132 2.902 12.245 1.00 . A A . 30 LYS N 1 1 11 4997 1 1 30 LYS NZ N 13.135 -3.700 12.395 1.00 . A A . 30 LYS NZ 1 1 11 4998 1 1 30 LYS O O 15.269 3.278 15.094 1.00 . A A . 30 LYS O 1 1 11 4999 1 1 31 GLY C C 11.935 2.889 17.262 1.00 . A A . 31 GLY C 1 1 11 5000 1 1 31 GLY CA C 12.845 3.665 16.331 1.00 . A A . 31 GLY CA 1 1 11 5001 1 1 31 GLY H H 12.265 2.640 14.571 1.00 . A A . 31 GLY H 1 1 11 5002 1 1 31 GLY HA2 H 13.806 3.793 16.807 1.00 . A A . 31 GLY HA2 1 1 11 5003 1 1 31 GLY HA3 H 12.411 4.638 16.151 1.00 . A A . 31 GLY HA3 1 1 11 5004 1 1 31 GLY N N 13.038 2.995 15.058 1.00 . A A . 31 GLY N 1 1 11 5005 1 1 31 GLY O O 11.202 3.477 18.057 1.00 . A A . 31 GLY O 1 1 12 5006 1 1 1 GLY C C 3.563 -0.252 -1.043 1.00 . A A . 1 GLY C 1 1 12 5007 1 1 1 GLY CA C 2.059 -0.118 -1.183 1.00 . A A . 1 GLY CA 1 1 12 5008 1 1 1 GLY H1 H 0.432 -0.998 -0.154 1.00 . A A . 1 GLY H1 1 1 12 5009 1 1 1 GLY HA2 H 1.743 -0.642 -2.073 1.00 . A A . 1 GLY HA2 1 1 12 5010 1 1 1 GLY HA3 H 1.811 0.928 -1.286 1.00 . A A . 1 GLY HA3 1 1 12 5011 1 1 1 GLY N N 1.345 -0.659 -0.042 1.00 . A A . 1 GLY N 1 1 12 5012 1 1 1 GLY O O 4.107 -1.352 -1.142 1.00 . A A . 1 GLY O 1 1 12 5013 1 1 2 TYR C C 6.179 2.233 -0.174 1.00 . A A . 2 TYR C 1 1 12 5014 1 1 2 TYR CA C 5.686 0.874 -0.662 1.00 . A A . 2 TYR CA 1 1 12 5015 1 1 2 TYR CB C 6.358 0.522 -1.990 1.00 . A A . 2 TYR CB 1 1 12 5016 1 1 2 TYR CD1 C 8.117 -1.174 -1.354 1.00 . A A . 2 TYR CD1 1 1 12 5017 1 1 2 TYR CD2 C 8.841 0.936 -2.193 1.00 . A A . 2 TYR CD2 1 1 12 5018 1 1 2 TYR CE1 C 9.431 -1.576 -1.217 1.00 . A A . 2 TYR CE1 1 1 12 5019 1 1 2 TYR CE2 C 10.158 0.542 -2.061 1.00 . A A . 2 TYR CE2 1 1 12 5020 1 1 2 TYR CG C 7.799 0.087 -1.843 1.00 . A A . 2 TYR CG 1 1 12 5021 1 1 2 TYR CZ C 10.448 -0.715 -1.572 1.00 . A A . 2 TYR CZ 1 1 12 5022 1 1 2 TYR H H 3.746 1.716 -0.743 1.00 . A A . 2 TYR H 1 1 12 5023 1 1 2 TYR HA H 5.946 0.125 0.071 1.00 . A A . 2 TYR HA 1 1 12 5024 1 1 2 TYR HB2 H 5.815 -0.284 -2.458 1.00 . A A . 2 TYR HB2 1 1 12 5025 1 1 2 TYR HB3 H 6.337 1.387 -2.637 1.00 . A A . 2 TYR HB3 1 1 12 5026 1 1 2 TYR HD1 H 7.318 -1.847 -1.076 1.00 . A A . 2 TYR HD1 1 1 12 5027 1 1 2 TYR HD2 H 8.610 1.920 -2.575 1.00 . A A . 2 TYR HD2 1 1 12 5028 1 1 2 TYR HE1 H 9.659 -2.561 -0.835 1.00 . A A . 2 TYR HE1 1 1 12 5029 1 1 2 TYR HE2 H 10.955 1.216 -2.338 1.00 . A A . 2 TYR HE2 1 1 12 5030 1 1 2 TYR HH H 12.338 -0.424 -1.777 1.00 . A A . 2 TYR HH 1 1 12 5031 1 1 2 TYR N N 4.236 0.870 -0.812 1.00 . A A . 2 TYR N 1 1 12 5032 1 1 2 TYR O O 6.180 3.211 -0.921 1.00 . A A . 2 TYR O 1 1 12 5033 1 1 2 TYR OH O 11.760 -1.111 -1.438 1.00 . A A . 2 TYR OH 1 1 12 5034 1 1 3 CYS C C 8.621 3.541 1.695 1.00 . A A . 3 CYS C 1 1 12 5035 1 1 3 CYS CA C 7.096 3.521 1.677 1.00 . A A . 3 CYS CA 1 1 12 5036 1 1 3 CYS CB C 6.555 3.685 3.098 1.00 . A A . 3 CYS CB 1 1 12 5037 1 1 3 CYS H H 6.574 1.470 1.632 1.00 . A A . 3 CYS H 1 1 12 5038 1 1 3 CYS HA H 6.745 4.343 1.071 1.00 . A A . 3 CYS HA 1 1 12 5039 1 1 3 CYS HB2 H 7.280 3.294 3.798 1.00 . A A . 3 CYS HB2 1 1 12 5040 1 1 3 CYS HB3 H 6.399 4.735 3.298 1.00 . A A . 3 CYS HB3 1 1 12 5041 1 1 3 CYS N N 6.599 2.284 1.086 1.00 . A A . 3 CYS N 1 1 12 5042 1 1 3 CYS O O 9.271 2.680 1.102 1.00 . A A . 3 CYS O 1 1 12 5043 1 1 3 CYS SG S 4.978 2.823 3.398 1.00 . A A . 3 CYS SG 1 1 12 5044 1 1 4 ALA C C 11.172 3.911 3.694 1.00 . A A . 4 ALA C 1 1 12 5045 1 1 4 ALA CA C 10.635 4.660 2.479 1.00 . A A . 4 ALA CA 1 1 12 5046 1 1 4 ALA CB C 11.029 6.128 2.546 1.00 . A A . 4 ALA CB 1 1 12 5047 1 1 4 ALA H H 8.615 5.185 2.832 1.00 . A A . 4 ALA H 1 1 12 5048 1 1 4 ALA HA H 11.070 4.236 1.586 1.00 . A A . 4 ALA HA 1 1 12 5049 1 1 4 ALA HB1 H 11.008 6.551 1.552 1.00 . A A . 4 ALA HB1 1 1 12 5050 1 1 4 ALA HB2 H 10.333 6.659 3.178 1.00 . A A . 4 ALA HB2 1 1 12 5051 1 1 4 ALA HB3 H 12.025 6.215 2.954 1.00 . A A . 4 ALA HB3 1 1 12 5052 1 1 4 ALA N N 9.186 4.529 2.381 1.00 . A A . 4 ALA N 1 1 12 5053 1 1 4 ALA O O 10.963 4.324 4.835 1.00 . A A . 4 ALA O 1 1 12 5054 1 1 5 THR C C 13.776 2.552 4.971 1.00 . A A . 5 THR C 1 1 12 5055 1 1 5 THR CA C 12.432 1.996 4.514 1.00 . A A . 5 THR CA 1 1 12 5056 1 1 5 THR CB C 12.617 0.531 4.076 1.00 . A A . 5 THR CB 1 1 12 5057 1 1 5 THR CG2 C 11.313 -0.242 4.206 1.00 . A A . 5 THR CG2 1 1 12 5058 1 1 5 THR H H 11.999 2.527 2.511 1.00 . A A . 5 THR H 1 1 12 5059 1 1 5 THR HA H 11.743 2.017 5.346 1.00 . A A . 5 THR HA 1 1 12 5060 1 1 5 THR HB H 13.357 0.071 4.715 1.00 . A A . 5 THR HB 1 1 12 5061 1 1 5 THR HG1 H 12.330 0.601 2.126 1.00 . A A . 5 THR HG1 1 1 12 5062 1 1 5 THR HG21 H 11.058 -0.680 3.252 1.00 . A A . 5 THR HG21 1 1 12 5063 1 1 5 THR HG22 H 10.526 0.430 4.516 1.00 . A A . 5 THR HG22 1 1 12 5064 1 1 5 THR HG23 H 11.431 -1.023 4.941 1.00 . A A . 5 THR HG23 1 1 12 5065 1 1 5 THR N N 11.866 2.805 3.442 1.00 . A A . 5 THR N 1 1 12 5066 1 1 5 THR O O 14.292 3.510 4.395 1.00 . A A . 5 THR O 1 1 12 5067 1 1 5 THR OG1 O 13.075 0.480 2.720 1.00 . A A . 5 THR OG1 1 1 12 5068 1 1 6 LYS C C 16.638 2.586 5.422 1.00 . A A . 6 LYS C 1 1 12 5069 1 1 6 LYS CA C 15.626 2.377 6.544 1.00 . A A . 6 LYS CA 1 1 12 5070 1 1 6 LYS CB C 16.159 1.346 7.541 1.00 . A A . 6 LYS CB 1 1 12 5071 1 1 6 LYS CD C 17.752 1.087 9.466 1.00 . A A . 6 LYS CD 1 1 12 5072 1 1 6 LYS CE C 19.232 0.952 9.791 1.00 . A A . 6 LYS CE 1 1 12 5073 1 1 6 LYS CG C 17.537 1.683 8.085 1.00 . A A . 6 LYS CG 1 1 12 5074 1 1 6 LYS H H 13.879 1.186 6.427 1.00 . A A . 6 LYS H 1 1 12 5075 1 1 6 LYS HA H 15.474 3.315 7.055 1.00 . A A . 6 LYS HA 1 1 12 5076 1 1 6 LYS HB2 H 15.473 1.278 8.372 1.00 . A A . 6 LYS HB2 1 1 12 5077 1 1 6 LYS HB3 H 16.214 0.384 7.051 1.00 . A A . 6 LYS HB3 1 1 12 5078 1 1 6 LYS HD2 H 17.291 1.730 10.202 1.00 . A A . 6 LYS HD2 1 1 12 5079 1 1 6 LYS HD3 H 17.293 0.109 9.502 1.00 . A A . 6 LYS HD3 1 1 12 5080 1 1 6 LYS HE2 H 19.781 0.842 8.868 1.00 . A A . 6 LYS HE2 1 1 12 5081 1 1 6 LYS HE3 H 19.558 1.847 10.299 1.00 . A A . 6 LYS HE3 1 1 12 5082 1 1 6 LYS HG2 H 18.285 1.288 7.414 1.00 . A A . 6 LYS HG2 1 1 12 5083 1 1 6 LYS HG3 H 17.637 2.757 8.147 1.00 . A A . 6 LYS HG3 1 1 12 5084 1 1 6 LYS HZ1 H 20.491 -0.210 10.984 1.00 . A A . 6 LYS HZ1 1 1 12 5085 1 1 6 LYS HZ2 H 19.339 -1.106 10.131 1.00 . A A . 6 LYS HZ2 1 1 12 5086 1 1 6 LYS HZ3 H 18.877 -0.211 11.490 1.00 . A A . 6 LYS HZ3 1 1 12 5087 1 1 6 LYS N N 14.339 1.945 6.010 1.00 . A A . 6 LYS N 1 1 12 5088 1 1 6 LYS NZ N 19.503 -0.227 10.660 1.00 . A A . 6 LYS NZ 1 1 12 5089 1 1 6 LYS O O 16.812 1.724 4.562 1.00 . A A . 6 LYS O 1 1 12 5090 1 1 7 GLY C C 17.737 4.919 3.317 1.00 . A A . 7 GLY C 1 1 12 5091 1 1 7 GLY CA C 18.291 4.038 4.419 1.00 . A A . 7 GLY CA 1 1 12 5092 1 1 7 GLY H H 17.123 4.387 6.150 1.00 . A A . 7 GLY H 1 1 12 5093 1 1 7 GLY HA2 H 19.128 4.539 4.880 1.00 . A A . 7 GLY HA2 1 1 12 5094 1 1 7 GLY HA3 H 18.635 3.111 3.983 1.00 . A A . 7 GLY HA3 1 1 12 5095 1 1 7 GLY N N 17.304 3.737 5.439 1.00 . A A . 7 GLY N 1 1 12 5096 1 1 7 GLY O O 18.494 5.528 2.561 1.00 . A A . 7 GLY O 1 1 12 5097 1 1 8 ILE C C 15.477 7.205 2.724 1.00 . A A . 8 ILE C 1 1 12 5098 1 1 8 ILE CA C 15.759 5.799 2.207 1.00 . A A . 8 ILE CA 1 1 12 5099 1 1 8 ILE CB C 14.437 5.161 1.741 1.00 . A A . 8 ILE CB 1 1 12 5100 1 1 8 ILE CD1 C 15.576 3.460 0.229 1.00 . A A . 8 ILE CD1 1 1 12 5101 1 1 8 ILE CG1 C 14.649 3.684 1.403 1.00 . A A . 8 ILE CG1 1 1 12 5102 1 1 8 ILE CG2 C 13.882 5.910 0.539 1.00 . A A . 8 ILE CG2 1 1 12 5103 1 1 8 ILE H H 15.863 4.477 3.857 1.00 . A A . 8 ILE H 1 1 12 5104 1 1 8 ILE HA H 16.422 5.865 1.357 1.00 . A A . 8 ILE HA 1 1 12 5105 1 1 8 ILE HB H 13.722 5.239 2.546 1.00 . A A . 8 ILE HB 1 1 12 5106 1 1 8 ILE HD11 H 15.883 4.414 -0.175 1.00 . A A . 8 ILE HD11 1 1 12 5107 1 1 8 ILE HD12 H 16.446 2.910 0.555 1.00 . A A . 8 ILE HD12 1 1 12 5108 1 1 8 ILE HD13 H 15.060 2.896 -0.535 1.00 . A A . 8 ILE HD13 1 1 12 5109 1 1 8 ILE HG12 H 15.072 3.182 2.259 1.00 . A A . 8 ILE HG12 1 1 12 5110 1 1 8 ILE HG13 H 13.695 3.236 1.164 1.00 . A A . 8 ILE HG13 1 1 12 5111 1 1 8 ILE HG21 H 13.570 6.898 0.844 1.00 . A A . 8 ILE HG21 1 1 12 5112 1 1 8 ILE HG22 H 14.647 5.993 -0.218 1.00 . A A . 8 ILE HG22 1 1 12 5113 1 1 8 ILE HG23 H 13.035 5.373 0.139 1.00 . A A . 8 ILE HG23 1 1 12 5114 1 1 8 ILE N N 16.413 4.986 3.225 1.00 . A A . 8 ILE N 1 1 12 5115 1 1 8 ILE O O 15.049 7.386 3.864 1.00 . A A . 8 ILE O 1 1 12 5116 1 1 9 LYS C C 14.082 9.781 2.806 1.00 . A A . 9 LYS C 1 1 12 5117 1 1 9 LYS CA C 15.488 9.592 2.246 1.00 . A A . 9 LYS CA 1 1 12 5118 1 1 9 LYS CB C 15.692 10.503 1.033 1.00 . A A . 9 LYS CB 1 1 12 5119 1 1 9 LYS CD C 17.842 11.801 1.056 1.00 . A A . 9 LYS CD 1 1 12 5120 1 1 9 LYS CE C 19.290 11.843 0.592 1.00 . A A . 9 LYS CE 1 1 12 5121 1 1 9 LYS CG C 17.130 10.558 0.549 1.00 . A A . 9 LYS CG 1 1 12 5122 1 1 9 LYS H H 16.058 7.993 0.981 1.00 . A A . 9 LYS H 1 1 12 5123 1 1 9 LYS HA H 16.205 9.856 3.008 1.00 . A A . 9 LYS HA 1 1 12 5124 1 1 9 LYS HB2 H 15.074 10.146 0.222 1.00 . A A . 9 LYS HB2 1 1 12 5125 1 1 9 LYS HB3 H 15.383 11.505 1.295 1.00 . A A . 9 LYS HB3 1 1 12 5126 1 1 9 LYS HD2 H 17.331 12.676 0.682 1.00 . A A . 9 LYS HD2 1 1 12 5127 1 1 9 LYS HD3 H 17.819 11.803 2.137 1.00 . A A . 9 LYS HD3 1 1 12 5128 1 1 9 LYS HE2 H 19.914 11.423 1.366 1.00 . A A . 9 LYS HE2 1 1 12 5129 1 1 9 LYS HE3 H 19.383 11.252 -0.307 1.00 . A A . 9 LYS HE3 1 1 12 5130 1 1 9 LYS HG2 H 17.655 9.685 0.907 1.00 . A A . 9 LYS HG2 1 1 12 5131 1 1 9 LYS HG3 H 17.137 10.566 -0.532 1.00 . A A . 9 LYS HG3 1 1 12 5132 1 1 9 LYS HZ1 H 18.918 13.862 0.209 1.00 . A A . 9 LYS HZ1 1 1 12 5133 1 1 9 LYS HZ2 H 20.288 13.257 -0.577 1.00 . A A . 9 LYS HZ2 1 1 12 5134 1 1 9 LYS HZ3 H 20.340 13.581 1.082 1.00 . A A . 9 LYS HZ3 1 1 12 5135 1 1 9 LYS N N 15.718 8.200 1.877 1.00 . A A . 9 LYS N 1 1 12 5136 1 1 9 LYS NZ N 19.741 13.233 0.307 1.00 . A A . 9 LYS NZ 1 1 12 5137 1 1 9 LYS O O 13.127 9.160 2.338 1.00 . A A . 9 LYS O 1 1 12 5138 1 1 10 CYS C C 12.341 12.404 4.373 1.00 . A A . 10 CYS C 1 1 12 5139 1 1 10 CYS CA C 12.672 10.915 4.434 1.00 . A A . 10 CYS CA 1 1 12 5140 1 1 10 CYS CB C 12.675 10.442 5.889 1.00 . A A . 10 CYS CB 1 1 12 5141 1 1 10 CYS H H 14.759 11.108 4.140 1.00 . A A . 10 CYS H 1 1 12 5142 1 1 10 CYS HA H 11.917 10.369 3.889 1.00 . A A . 10 CYS HA 1 1 12 5143 1 1 10 CYS HB2 H 11.660 10.232 6.194 1.00 . A A . 10 CYS HB2 1 1 12 5144 1 1 10 CYS HB3 H 13.262 9.539 5.964 1.00 . A A . 10 CYS HB3 1 1 12 5145 1 1 10 CYS N N 13.961 10.643 3.810 1.00 . A A . 10 CYS N 1 1 12 5146 1 1 10 CYS O O 11.411 12.871 5.028 1.00 . A A . 10 CYS O 1 1 12 5147 1 1 10 CYS SG S 13.366 11.652 7.063 1.00 . A A . 10 CYS SG 1 1 12 5148 1 1 11 ASN C C 11.753 14.864 2.467 1.00 . A A . 11 ASN C 1 1 12 5149 1 1 11 ASN CA C 12.899 14.578 3.432 1.00 . A A . 11 ASN CA 1 1 12 5150 1 1 11 ASN CB C 14.179 15.255 2.936 1.00 . A A . 11 ASN CB 1 1 12 5151 1 1 11 ASN CG C 14.797 14.528 1.757 1.00 . A A . 11 ASN CG 1 1 12 5152 1 1 11 ASN H H 13.837 12.713 3.082 1.00 . A A . 11 ASN H 1 1 12 5153 1 1 11 ASN HA H 12.645 14.977 4.403 1.00 . A A . 11 ASN HA 1 1 12 5154 1 1 11 ASN HB2 H 13.950 16.265 2.631 1.00 . A A . 11 ASN HB2 1 1 12 5155 1 1 11 ASN HB3 H 14.901 15.280 3.738 1.00 . A A . 11 ASN HB3 1 1 12 5156 1 1 11 ASN HD21 H 13.624 15.525 0.497 1.00 . A A . 11 ASN HD21 1 1 12 5157 1 1 11 ASN HD22 H 14.712 14.393 -0.225 1.00 . A A . 11 ASN HD22 1 1 12 5158 1 1 11 ASN N N 13.110 13.143 3.580 1.00 . A A . 11 ASN N 1 1 12 5159 1 1 11 ASN ND2 N 14.331 14.848 0.555 1.00 . A A . 11 ASN ND2 1 1 12 5160 1 1 11 ASN O O 11.055 15.870 2.595 1.00 . A A . 11 ASN O 1 1 12 5161 1 1 11 ASN OD1 O 15.682 13.690 1.925 1.00 . A A . 11 ASN OD1 1 1 12 5162 1 1 12 ASP C C 9.444 13.037 0.681 1.00 . A A . 12 ASP C 1 1 12 5163 1 1 12 ASP CA C 10.501 14.125 0.515 1.00 . A A . 12 ASP CA 1 1 12 5164 1 1 12 ASP CB C 11.079 14.081 -0.900 1.00 . A A . 12 ASP CB 1 1 12 5165 1 1 12 ASP CG C 12.328 13.227 -0.988 1.00 . A A . 12 ASP CG 1 1 12 5166 1 1 12 ASP H H 12.152 13.189 1.452 1.00 . A A . 12 ASP H 1 1 12 5167 1 1 12 ASP HA H 10.037 15.087 0.675 1.00 . A A . 12 ASP HA 1 1 12 5168 1 1 12 ASP HB2 H 10.338 13.672 -1.572 1.00 . A A . 12 ASP HB2 1 1 12 5169 1 1 12 ASP HB3 H 11.327 15.085 -1.212 1.00 . A A . 12 ASP HB3 1 1 12 5170 1 1 12 ASP N N 11.563 13.971 1.502 1.00 . A A . 12 ASP N 1 1 12 5171 1 1 12 ASP O O 8.250 13.327 0.769 1.00 . A A . 12 ASP O 1 1 12 5172 1 1 12 ASP OD1 O 12.350 12.141 -0.372 1.00 . A A . 12 ASP OD1 1 1 12 5173 1 1 12 ASP OD2 O 13.284 13.645 -1.675 1.00 . A A . 12 ASP OD2 1 1 12 5174 1 1 13 ILE C C 8.832 10.270 2.342 1.00 . A A . 13 ILE C 1 1 12 5175 1 1 13 ILE CA C 8.983 10.657 0.875 1.00 . A A . 13 ILE CA 1 1 12 5176 1 1 13 ILE CB C 9.470 9.431 0.080 1.00 . A A . 13 ILE CB 1 1 12 5177 1 1 13 ILE CD1 C 8.371 7.473 -1.119 1.00 . A A . 13 ILE CD1 1 1 12 5178 1 1 13 ILE CG1 C 8.430 8.311 0.140 1.00 . A A . 13 ILE CG1 1 1 12 5179 1 1 13 ILE CG2 C 10.808 8.947 0.620 1.00 . A A . 13 ILE CG2 1 1 12 5180 1 1 13 ILE H H 10.853 11.620 0.645 1.00 . A A . 13 ILE H 1 1 12 5181 1 1 13 ILE HA H 8.017 10.950 0.490 1.00 . A A . 13 ILE HA 1 1 12 5182 1 1 13 ILE HB H 9.610 9.728 -0.947 1.00 . A A . 13 ILE HB 1 1 12 5183 1 1 13 ILE HD11 H 7.356 7.449 -1.488 1.00 . A A . 13 ILE HD11 1 1 12 5184 1 1 13 ILE HD12 H 9.018 7.903 -1.868 1.00 . A A . 13 ILE HD12 1 1 12 5185 1 1 13 ILE HD13 H 8.696 6.467 -0.897 1.00 . A A . 13 ILE HD13 1 1 12 5186 1 1 13 ILE HG12 H 8.663 7.654 0.963 1.00 . A A . 13 ILE HG12 1 1 12 5187 1 1 13 ILE HG13 H 7.453 8.745 0.296 1.00 . A A . 13 ILE HG13 1 1 12 5188 1 1 13 ILE HG21 H 10.667 8.522 1.603 1.00 . A A . 13 ILE HG21 1 1 12 5189 1 1 13 ILE HG22 H 11.212 8.196 -0.042 1.00 . A A . 13 ILE HG22 1 1 12 5190 1 1 13 ILE HG23 H 11.493 9.779 0.682 1.00 . A A . 13 ILE HG23 1 1 12 5191 1 1 13 ILE N N 9.891 11.787 0.721 1.00 . A A . 13 ILE N 1 1 12 5192 1 1 13 ILE O O 9.754 10.445 3.140 1.00 . A A . 13 ILE O 1 1 12 5193 1 1 14 HIS C C 7.693 7.843 4.253 1.00 . A A . 14 HIS C 1 1 12 5194 1 1 14 HIS CA C 7.392 9.326 4.064 1.00 . A A . 14 HIS CA 1 1 12 5195 1 1 14 HIS CB C 5.934 9.613 4.427 1.00 . A A . 14 HIS CB 1 1 12 5196 1 1 14 HIS CD2 C 4.584 11.827 4.447 1.00 . A A . 14 HIS CD2 1 1 12 5197 1 1 14 HIS CE1 C 6.050 13.087 5.483 1.00 . A A . 14 HIS CE1 1 1 12 5198 1 1 14 HIS CG C 5.663 11.056 4.719 1.00 . A A . 14 HIS CG 1 1 12 5199 1 1 14 HIS H H 6.968 9.627 2.011 1.00 . A A . 14 HIS H 1 1 12 5200 1 1 14 HIS HA H 8.035 9.897 4.716 1.00 . A A . 14 HIS HA 1 1 12 5201 1 1 14 HIS HB2 H 5.301 9.317 3.603 1.00 . A A . 14 HIS HB2 1 1 12 5202 1 1 14 HIS HB3 H 5.669 9.040 5.303 1.00 . A A . 14 HIS HB3 1 1 12 5203 1 1 14 HIS HD1 H 7.446 11.607 5.697 1.00 . A A . 14 HIS HD1 1 1 12 5204 1 1 14 HIS HD2 H 3.682 11.513 3.942 1.00 . A A . 14 HIS HD2 1 1 12 5205 1 1 14 HIS HE1 H 6.529 13.935 5.948 1.00 . A A . 14 HIS HE1 1 1 12 5206 1 1 14 HIS N N 7.663 9.741 2.692 1.00 . A A . 14 HIS N 1 1 12 5207 1 1 14 HIS ND1 N 6.563 11.875 5.368 1.00 . A A . 14 HIS ND1 1 1 12 5208 1 1 14 HIS NE2 N 4.849 13.085 4.932 1.00 . A A . 14 HIS NE2 1 1 12 5209 1 1 14 HIS O O 7.590 7.053 3.313 1.00 . A A . 14 HIS O 1 1 12 5210 1 1 15 CYS C C 7.141 5.333 6.257 1.00 . A A . 15 CYS C 1 1 12 5211 1 1 15 CYS CA C 8.383 6.082 5.785 1.00 . A A . 15 CYS CA 1 1 12 5212 1 1 15 CYS CB C 9.471 6.015 6.858 1.00 . A A . 15 CYS CB 1 1 12 5213 1 1 15 CYS H H 8.129 8.146 6.181 1.00 . A A . 15 CYS H 1 1 12 5214 1 1 15 CYS HA H 8.750 5.614 4.884 1.00 . A A . 15 CYS HA 1 1 12 5215 1 1 15 CYS HB2 H 9.007 6.052 7.833 1.00 . A A . 15 CYS HB2 1 1 12 5216 1 1 15 CYS HB3 H 10.009 5.084 6.757 1.00 . A A . 15 CYS HB3 1 1 12 5217 1 1 15 CYS N N 8.066 7.470 5.472 1.00 . A A . 15 CYS N 1 1 12 5218 1 1 15 CYS O O 6.184 5.938 6.742 1.00 . A A . 15 CYS O 1 1 12 5219 1 1 15 CYS SG S 10.685 7.370 6.772 1.00 . A A . 15 CYS SG 1 1 12 5220 1 1 16 CYS C C 5.852 3.225 8.036 1.00 . A A . 16 CYS C 1 1 12 5221 1 1 16 CYS CA C 6.039 3.179 6.522 1.00 . A A . 16 CYS CA 1 1 12 5222 1 1 16 CYS CB C 6.255 1.734 6.068 1.00 . A A . 16 CYS CB 1 1 12 5223 1 1 16 CYS H H 7.953 3.587 5.718 1.00 . A A . 16 CYS H 1 1 12 5224 1 1 16 CYS HA H 5.148 3.565 6.050 1.00 . A A . 16 CYS HA 1 1 12 5225 1 1 16 CYS HB2 H 7.316 1.544 5.991 1.00 . A A . 16 CYS HB2 1 1 12 5226 1 1 16 CYS HB3 H 5.828 1.066 6.802 1.00 . A A . 16 CYS HB3 1 1 12 5227 1 1 16 CYS N N 7.162 4.012 6.112 1.00 . A A . 16 CYS N 1 1 12 5228 1 1 16 CYS O O 6.804 3.449 8.783 1.00 . A A . 16 CYS O 1 1 12 5229 1 1 16 CYS SG S 5.504 1.341 4.456 1.00 . A A . 16 CYS SG 1 1 12 5230 1 1 17 SER C C 5.247 2.118 10.682 1.00 . A A . 17 SER C 1 1 12 5231 1 1 17 SER CA C 4.304 3.032 9.905 1.00 . A A . 17 SER CA 1 1 12 5232 1 1 17 SER CB C 2.854 2.604 10.137 1.00 . A A . 17 SER CB 1 1 12 5233 1 1 17 SER H H 3.900 2.838 7.836 1.00 . A A . 17 SER H 1 1 12 5234 1 1 17 SER HA H 4.432 4.045 10.258 1.00 . A A . 17 SER HA 1 1 12 5235 1 1 17 SER HB2 H 2.631 2.652 11.191 1.00 . A A . 17 SER HB2 1 1 12 5236 1 1 17 SER HB3 H 2.195 3.269 9.598 1.00 . A A . 17 SER HB3 1 1 12 5237 1 1 17 SER HG H 2.073 0.815 10.309 1.00 . A A . 17 SER HG 1 1 12 5238 1 1 17 SER N N 4.618 3.012 8.481 1.00 . A A . 17 SER N 1 1 12 5239 1 1 17 SER O O 5.266 0.906 10.474 1.00 . A A . 17 SER O 1 1 12 5240 1 1 17 SER OG O 2.636 1.279 9.684 1.00 . A A . 17 SER OG 1 1 12 5241 1 1 18 GLY C C 8.378 2.476 12.297 1.00 . A A . 18 GLY C 1 1 12 5242 1 1 18 GLY CA C 6.964 1.935 12.375 1.00 . A A . 18 GLY CA 1 1 12 5243 1 1 18 GLY H H 5.970 3.681 11.704 1.00 . A A . 18 GLY H 1 1 12 5244 1 1 18 GLY HA2 H 6.641 1.949 13.406 1.00 . A A . 18 GLY HA2 1 1 12 5245 1 1 18 GLY HA3 H 6.961 0.915 12.021 1.00 . A A . 18 GLY HA3 1 1 12 5246 1 1 18 GLY N N 6.029 2.710 11.580 1.00 . A A . 18 GLY N 1 1 12 5247 1 1 18 GLY O O 9.199 2.217 13.179 1.00 . A A . 18 GLY O 1 1 12 5248 1 1 19 LEU C C 9.981 5.300 11.340 1.00 . A A . 19 LEU C 1 1 12 5249 1 1 19 LEU CA C 9.991 3.803 11.048 1.00 . A A . 19 LEU CA 1 1 12 5250 1 1 19 LEU CB C 10.476 3.554 9.619 1.00 . A A . 19 LEU CB 1 1 12 5251 1 1 19 LEU CD1 C 11.072 1.961 7.778 1.00 . A A . 19 LEU CD1 1 1 12 5252 1 1 19 LEU CD2 C 12.040 1.646 10.062 1.00 . A A . 19 LEU CD2 1 1 12 5253 1 1 19 LEU CG C 10.825 2.107 9.271 1.00 . A A . 19 LEU CG 1 1 12 5254 1 1 19 LEU H H 7.970 3.397 10.571 1.00 . A A . 19 LEU H 1 1 12 5255 1 1 19 LEU HA H 10.666 3.319 11.738 1.00 . A A . 19 LEU HA 1 1 12 5256 1 1 19 LEU HB2 H 9.698 3.878 8.945 1.00 . A A . 19 LEU HB2 1 1 12 5257 1 1 19 LEU HB3 H 11.360 4.156 9.461 1.00 . A A . 19 LEU HB3 1 1 12 5258 1 1 19 LEU HD11 H 10.221 2.341 7.233 1.00 . A A . 19 LEU HD11 1 1 12 5259 1 1 19 LEU HD12 H 11.218 0.919 7.537 1.00 . A A . 19 LEU HD12 1 1 12 5260 1 1 19 LEU HD13 H 11.954 2.521 7.503 1.00 . A A . 19 LEU HD13 1 1 12 5261 1 1 19 LEU HD21 H 11.916 1.914 11.101 1.00 . A A . 19 LEU HD21 1 1 12 5262 1 1 19 LEU HD22 H 12.927 2.123 9.671 1.00 . A A . 19 LEU HD22 1 1 12 5263 1 1 19 LEU HD23 H 12.140 0.574 9.977 1.00 . A A . 19 LEU HD23 1 1 12 5264 1 1 19 LEU HG H 9.992 1.469 9.534 1.00 . A A . 19 LEU HG 1 1 12 5265 1 1 19 LEU N N 8.665 3.226 11.240 1.00 . A A . 19 LEU N 1 1 12 5266 1 1 19 LEU O O 8.978 5.980 11.122 1.00 . A A . 19 LEU O 1 1 12 5267 1 1 20 LYS C C 11.919 7.981 11.023 1.00 . A A . 20 LYS C 1 1 12 5268 1 1 20 LYS CA C 11.227 7.227 12.153 1.00 . A A . 20 LYS CA 1 1 12 5269 1 1 20 LYS CB C 12.008 7.411 13.457 1.00 . A A . 20 LYS CB 1 1 12 5270 1 1 20 LYS CD C 11.211 7.808 15.805 1.00 . A A . 20 LYS CD 1 1 12 5271 1 1 20 LYS CE C 10.510 7.205 17.013 1.00 . A A . 20 LYS CE 1 1 12 5272 1 1 20 LYS CG C 11.321 6.806 14.668 1.00 . A A . 20 LYS CG 1 1 12 5273 1 1 20 LYS H H 11.871 5.217 11.987 1.00 . A A . 20 LYS H 1 1 12 5274 1 1 20 LYS HA H 10.232 7.626 12.280 1.00 . A A . 20 LYS HA 1 1 12 5275 1 1 20 LYS HB2 H 12.978 6.948 13.350 1.00 . A A . 20 LYS HB2 1 1 12 5276 1 1 20 LYS HB3 H 12.142 8.468 13.635 1.00 . A A . 20 LYS HB3 1 1 12 5277 1 1 20 LYS HD2 H 12.203 8.118 16.097 1.00 . A A . 20 LYS HD2 1 1 12 5278 1 1 20 LYS HD3 H 10.649 8.665 15.465 1.00 . A A . 20 LYS HD3 1 1 12 5279 1 1 20 LYS HE2 H 9.808 7.926 17.403 1.00 . A A . 20 LYS HE2 1 1 12 5280 1 1 20 LYS HE3 H 9.979 6.319 16.700 1.00 . A A . 20 LYS HE3 1 1 12 5281 1 1 20 LYS HG2 H 10.328 6.487 14.386 1.00 . A A . 20 LYS HG2 1 1 12 5282 1 1 20 LYS HG3 H 11.892 5.953 15.006 1.00 . A A . 20 LYS HG3 1 1 12 5283 1 1 20 LYS HZ1 H 12.340 6.442 17.670 1.00 . A A . 20 LYS HZ1 1 1 12 5284 1 1 20 LYS HZ2 H 11.052 6.127 18.719 1.00 . A A . 20 LYS HZ2 1 1 12 5285 1 1 20 LYS HZ3 H 11.724 7.678 18.646 1.00 . A A . 20 LYS HZ3 1 1 12 5286 1 1 20 LYS N N 11.104 5.809 11.834 1.00 . A A . 20 LYS N 1 1 12 5287 1 1 20 LYS NZ N 11.474 6.837 18.088 1.00 . A A . 20 LYS NZ 1 1 12 5288 1 1 20 LYS O O 12.791 7.438 10.343 1.00 . A A . 20 LYS O 1 1 12 5289 1 1 21 CYS C C 13.242 10.925 10.334 1.00 . A A . 21 CYS C 1 1 12 5290 1 1 21 CYS CA C 12.110 10.065 9.780 1.00 . A A . 21 CYS CA 1 1 12 5291 1 1 21 CYS CB C 11.037 10.957 9.151 1.00 . A A . 21 CYS CB 1 1 12 5292 1 1 21 CYS H H 10.827 9.613 11.401 1.00 . A A . 21 CYS H 1 1 12 5293 1 1 21 CYS HA H 12.510 9.410 9.021 1.00 . A A . 21 CYS HA 1 1 12 5294 1 1 21 CYS HB2 H 10.378 10.347 8.551 1.00 . A A . 21 CYS HB2 1 1 12 5295 1 1 21 CYS HB3 H 10.466 11.429 9.937 1.00 . A A . 21 CYS HB3 1 1 12 5296 1 1 21 CYS N N 11.527 9.235 10.827 1.00 . A A . 21 CYS N 1 1 12 5297 1 1 21 CYS O O 13.007 12.005 10.875 1.00 . A A . 21 CYS O 1 1 12 5298 1 1 21 CYS SG S 11.700 12.274 8.080 1.00 . A A . 21 CYS SG 1 1 12 5299 1 1 22 ASP C C 15.767 12.515 9.988 1.00 . A A . 22 ASP C 1 1 12 5300 1 1 22 ASP CA C 15.639 11.161 10.680 1.00 . A A . 22 ASP CA 1 1 12 5301 1 1 22 ASP CB C 16.907 10.336 10.451 1.00 . A A . 22 ASP CB 1 1 12 5302 1 1 22 ASP CG C 17.999 10.664 11.450 1.00 . A A . 22 ASP CG 1 1 12 5303 1 1 22 ASP H H 14.593 9.570 9.754 1.00 . A A . 22 ASP H 1 1 12 5304 1 1 22 ASP HA H 15.513 11.323 11.739 1.00 . A A . 22 ASP HA 1 1 12 5305 1 1 22 ASP HB2 H 16.667 9.287 10.541 1.00 . A A . 22 ASP HB2 1 1 12 5306 1 1 22 ASP HB3 H 17.282 10.532 9.457 1.00 . A A . 22 ASP HB3 1 1 12 5307 1 1 22 ASP N N 14.470 10.437 10.194 1.00 . A A . 22 ASP N 1 1 12 5308 1 1 22 ASP O O 16.221 12.599 8.847 1.00 . A A . 22 ASP O 1 1 12 5309 1 1 22 ASP OD1 O 18.038 11.817 11.929 1.00 . A A . 22 ASP OD1 1 1 12 5310 1 1 22 ASP OD2 O 18.814 9.768 11.753 1.00 . A A . 22 ASP OD2 1 1 12 5311 1 1 23 SER C C 16.864 15.425 10.102 1.00 . A A . 23 SER C 1 1 12 5312 1 1 23 SER CA C 15.425 14.920 10.136 1.00 . A A . 23 SER CA 1 1 12 5313 1 1 23 SER CB C 14.558 15.872 10.963 1.00 . A A . 23 SER CB 1 1 12 5314 1 1 23 SER H H 15.008 13.439 11.590 1.00 . A A . 23 SER H 1 1 12 5315 1 1 23 SER HA H 15.044 14.885 9.126 1.00 . A A . 23 SER HA 1 1 12 5316 1 1 23 SER HB2 H 14.593 15.576 12.001 1.00 . A A . 23 SER HB2 1 1 12 5317 1 1 23 SER HB3 H 14.937 16.878 10.862 1.00 . A A . 23 SER HB3 1 1 12 5318 1 1 23 SER HG H 12.695 16.474 11.034 1.00 . A A . 23 SER HG 1 1 12 5319 1 1 23 SER N N 15.361 13.571 10.685 1.00 . A A . 23 SER N 1 1 12 5320 1 1 23 SER O O 17.166 16.434 9.464 1.00 . A A . 23 SER O 1 1 12 5321 1 1 23 SER OG O 13.211 15.844 10.525 1.00 . A A . 23 SER OG 1 1 12 5322 1 1 24 LYS C C 19.915 14.521 9.648 1.00 . A A . 24 LYS C 1 1 12 5323 1 1 24 LYS CA C 19.158 15.089 10.845 1.00 . A A . 24 LYS CA 1 1 12 5324 1 1 24 LYS CB C 19.793 14.593 12.146 1.00 . A A . 24 LYS CB 1 1 12 5325 1 1 24 LYS CD C 19.916 14.813 14.645 1.00 . A A . 24 LYS CD 1 1 12 5326 1 1 24 LYS CE C 20.087 16.052 15.510 1.00 . A A . 24 LYS CE 1 1 12 5327 1 1 24 LYS CG C 19.105 15.114 13.396 1.00 . A A . 24 LYS CG 1 1 12 5328 1 1 24 LYS H H 17.448 13.921 11.283 1.00 . A A . 24 LYS H 1 1 12 5329 1 1 24 LYS HA H 19.217 16.167 10.814 1.00 . A A . 24 LYS HA 1 1 12 5330 1 1 24 LYS HB2 H 19.754 13.513 12.162 1.00 . A A . 24 LYS HB2 1 1 12 5331 1 1 24 LYS HB3 H 20.826 14.907 12.171 1.00 . A A . 24 LYS HB3 1 1 12 5332 1 1 24 LYS HD2 H 19.407 14.054 15.220 1.00 . A A . 24 LYS HD2 1 1 12 5333 1 1 24 LYS HD3 H 20.892 14.452 14.352 1.00 . A A . 24 LYS HD3 1 1 12 5334 1 1 24 LYS HE2 H 19.112 16.454 15.737 1.00 . A A . 24 LYS HE2 1 1 12 5335 1 1 24 LYS HE3 H 20.582 15.769 16.427 1.00 . A A . 24 LYS HE3 1 1 12 5336 1 1 24 LYS HG2 H 18.982 16.183 13.308 1.00 . A A . 24 LYS HG2 1 1 12 5337 1 1 24 LYS HG3 H 18.136 14.644 13.485 1.00 . A A . 24 LYS HG3 1 1 12 5338 1 1 24 LYS HZ1 H 21.218 17.809 15.515 1.00 . A A . 24 LYS HZ1 1 1 12 5339 1 1 24 LYS HZ2 H 20.324 17.574 14.099 1.00 . A A . 24 LYS HZ2 1 1 12 5340 1 1 24 LYS HZ3 H 21.727 16.669 14.373 1.00 . A A . 24 LYS HZ3 1 1 12 5341 1 1 24 LYS N N 17.750 14.716 10.795 1.00 . A A . 24 LYS N 1 1 12 5342 1 1 24 LYS NZ N 20.896 17.099 14.826 1.00 . A A . 24 LYS NZ 1 1 12 5343 1 1 24 LYS O O 20.735 15.206 9.038 1.00 . A A . 24 LYS O 1 1 12 5344 1 1 25 ARG C C 19.372 12.580 6.972 1.00 . A A . 25 ARG C 1 1 12 5345 1 1 25 ARG CA C 20.286 12.605 8.194 1.00 . A A . 25 ARG CA 1 1 12 5346 1 1 25 ARG CB C 20.685 11.178 8.575 1.00 . A A . 25 ARG CB 1 1 12 5347 1 1 25 ARG CD C 22.143 9.677 9.967 1.00 . A A . 25 ARG CD 1 1 12 5348 1 1 25 ARG CG C 21.731 11.112 9.676 1.00 . A A . 25 ARG CG 1 1 12 5349 1 1 25 ARG CZ C 22.949 9.787 12.287 1.00 . A A . 25 ARG CZ 1 1 12 5350 1 1 25 ARG H H 18.969 12.770 9.843 1.00 . A A . 25 ARG H 1 1 12 5351 1 1 25 ARG HA H 21.176 13.166 7.952 1.00 . A A . 25 ARG HA 1 1 12 5352 1 1 25 ARG HB2 H 19.806 10.648 8.912 1.00 . A A . 25 ARG HB2 1 1 12 5353 1 1 25 ARG HB3 H 21.081 10.683 7.702 1.00 . A A . 25 ARG HB3 1 1 12 5354 1 1 25 ARG HD2 H 21.277 9.129 10.305 1.00 . A A . 25 ARG HD2 1 1 12 5355 1 1 25 ARG HD3 H 22.517 9.233 9.056 1.00 . A A . 25 ARG HD3 1 1 12 5356 1 1 25 ARG HE H 24.095 9.406 10.699 1.00 . A A . 25 ARG HE 1 1 12 5357 1 1 25 ARG HG2 H 22.603 11.669 9.365 1.00 . A A . 25 ARG HG2 1 1 12 5358 1 1 25 ARG HG3 H 21.323 11.549 10.574 1.00 . A A . 25 ARG HG3 1 1 12 5359 1 1 25 ARG HH11 H 20.969 10.116 12.058 1.00 . A A . 25 ARG HH11 1 1 12 5360 1 1 25 ARG HH12 H 21.550 10.191 13.688 1.00 . A A . 25 ARG HH12 1 1 12 5361 1 1 25 ARG HH21 H 24.872 9.502 12.841 1.00 . A A . 25 ARG HH21 1 1 12 5362 1 1 25 ARG HH22 H 23.770 9.842 14.133 1.00 . A A . 25 ARG HH22 1 1 12 5363 1 1 25 ARG N N 19.632 13.265 9.318 1.00 . A A . 25 ARG N 1 1 12 5364 1 1 25 ARG NE N 23.181 9.603 10.992 1.00 . A A . 25 ARG NE 1 1 12 5365 1 1 25 ARG NH1 N 21.722 10.054 12.713 1.00 . A A . 25 ARG NH1 1 1 12 5366 1 1 25 ARG NH2 N 23.946 9.703 13.159 1.00 . A A . 25 ARG NH2 1 1 12 5367 1 1 25 ARG O O 19.725 12.026 5.931 1.00 . A A . 25 ARG O 1 1 12 5368 1 1 26 LYS C C 16.968 11.836 5.458 1.00 . A A . 26 LYS C 1 1 12 5369 1 1 26 LYS CA C 17.231 13.232 6.014 1.00 . A A . 26 LYS CA 1 1 12 5370 1 1 26 LYS CB C 17.738 14.149 4.899 1.00 . A A . 26 LYS CB 1 1 12 5371 1 1 26 LYS CD C 18.680 16.391 4.269 1.00 . A A . 26 LYS CD 1 1 12 5372 1 1 26 LYS CE C 20.187 16.183 4.270 1.00 . A A . 26 LYS CE 1 1 12 5373 1 1 26 LYS CG C 18.005 15.572 5.357 1.00 . A A . 26 LYS CG 1 1 12 5374 1 1 26 LYS H H 17.972 13.607 7.962 1.00 . A A . 26 LYS H 1 1 12 5375 1 1 26 LYS HA H 16.308 13.630 6.405 1.00 . A A . 26 LYS HA 1 1 12 5376 1 1 26 LYS HB2 H 18.657 13.742 4.504 1.00 . A A . 26 LYS HB2 1 1 12 5377 1 1 26 LYS HB3 H 16.999 14.179 4.111 1.00 . A A . 26 LYS HB3 1 1 12 5378 1 1 26 LYS HD2 H 18.287 16.091 3.309 1.00 . A A . 26 LYS HD2 1 1 12 5379 1 1 26 LYS HD3 H 18.470 17.438 4.436 1.00 . A A . 26 LYS HD3 1 1 12 5380 1 1 26 LYS HE2 H 20.485 15.802 5.234 1.00 . A A . 26 LYS HE2 1 1 12 5381 1 1 26 LYS HE3 H 20.438 15.462 3.505 1.00 . A A . 26 LYS HE3 1 1 12 5382 1 1 26 LYS HG2 H 17.067 16.041 5.614 1.00 . A A . 26 LYS HG2 1 1 12 5383 1 1 26 LYS HG3 H 18.647 15.547 6.226 1.00 . A A . 26 LYS HG3 1 1 12 5384 1 1 26 LYS HZ1 H 20.633 17.842 3.081 1.00 . A A . 26 LYS HZ1 1 1 12 5385 1 1 26 LYS HZ2 H 21.946 17.273 3.983 1.00 . A A . 26 LYS HZ2 1 1 12 5386 1 1 26 LYS HZ3 H 20.714 18.148 4.743 1.00 . A A . 26 LYS HZ3 1 1 12 5387 1 1 26 LYS N N 18.196 13.183 7.107 1.00 . A A . 26 LYS N 1 1 12 5388 1 1 26 LYS NZ N 20.922 17.450 4.001 1.00 . A A . 26 LYS NZ 1 1 12 5389 1 1 26 LYS O O 16.907 11.642 4.244 1.00 . A A . 26 LYS O 1 1 12 5390 1 1 27 VAL C C 15.728 8.756 7.006 1.00 . A A . 27 VAL C 1 1 12 5391 1 1 27 VAL CA C 16.552 9.489 5.953 1.00 . A A . 27 VAL CA 1 1 12 5392 1 1 27 VAL CB C 17.864 8.717 5.715 1.00 . A A . 27 VAL CB 1 1 12 5393 1 1 27 VAL CG1 C 18.509 9.151 4.408 1.00 . A A . 27 VAL CG1 1 1 12 5394 1 1 27 VAL CG2 C 18.819 8.917 6.883 1.00 . A A . 27 VAL CG2 1 1 12 5395 1 1 27 VAL H H 16.871 11.083 7.308 1.00 . A A . 27 VAL H 1 1 12 5396 1 1 27 VAL HA H 15.998 9.510 5.026 1.00 . A A . 27 VAL HA 1 1 12 5397 1 1 27 VAL HB H 17.631 7.665 5.645 1.00 . A A . 27 VAL HB 1 1 12 5398 1 1 27 VAL HG11 H 18.683 10.216 4.429 1.00 . A A . 27 VAL HG11 1 1 12 5399 1 1 27 VAL HG12 H 19.449 8.633 4.281 1.00 . A A . 27 VAL HG12 1 1 12 5400 1 1 27 VAL HG13 H 17.851 8.910 3.585 1.00 . A A . 27 VAL HG13 1 1 12 5401 1 1 27 VAL HG21 H 19.388 8.013 7.040 1.00 . A A . 27 VAL HG21 1 1 12 5402 1 1 27 VAL HG22 H 19.492 9.733 6.661 1.00 . A A . 27 VAL HG22 1 1 12 5403 1 1 27 VAL HG23 H 18.255 9.149 7.774 1.00 . A A . 27 VAL HG23 1 1 12 5404 1 1 27 VAL N N 16.812 10.866 6.355 1.00 . A A . 27 VAL N 1 1 12 5405 1 1 27 VAL O O 15.608 9.211 8.144 1.00 . A A . 27 VAL O 1 1 12 5406 1 1 28 CYS C C 15.222 5.904 8.379 1.00 . A A . 28 CYS C 1 1 12 5407 1 1 28 CYS CA C 14.348 6.820 7.528 1.00 . A A . 28 CYS CA 1 1 12 5408 1 1 28 CYS CB C 13.333 5.988 6.741 1.00 . A A . 28 CYS CB 1 1 12 5409 1 1 28 CYS H H 15.293 7.307 5.698 1.00 . A A . 28 CYS H 1 1 12 5410 1 1 28 CYS HA H 13.816 7.498 8.179 1.00 . A A . 28 CYS HA 1 1 12 5411 1 1 28 CYS HB2 H 13.863 5.268 6.134 1.00 . A A . 28 CYS HB2 1 1 12 5412 1 1 28 CYS HB3 H 12.693 5.464 7.435 1.00 . A A . 28 CYS HB3 1 1 12 5413 1 1 28 CYS N N 15.161 7.618 6.619 1.00 . A A . 28 CYS N 1 1 12 5414 1 1 28 CYS O O 16.216 5.358 7.902 1.00 . A A . 28 CYS O 1 1 12 5415 1 1 28 CYS SG S 12.268 6.967 5.633 1.00 . A A . 28 CYS SG 1 1 12 5416 1 1 29 VAL C C 14.654 4.069 11.437 1.00 . A A . 29 VAL C 1 1 12 5417 1 1 29 VAL CA C 15.592 4.891 10.561 1.00 . A A . 29 VAL CA 1 1 12 5418 1 1 29 VAL CB C 16.522 5.723 11.465 1.00 . A A . 29 VAL CB 1 1 12 5419 1 1 29 VAL CG1 C 17.603 6.402 10.638 1.00 . A A . 29 VAL CG1 1 1 12 5420 1 1 29 VAL CG2 C 15.721 6.746 12.255 1.00 . A A . 29 VAL CG2 1 1 12 5421 1 1 29 VAL H H 14.043 6.204 9.966 1.00 . A A . 29 VAL H 1 1 12 5422 1 1 29 VAL HA H 16.202 4.220 9.973 1.00 . A A . 29 VAL HA 1 1 12 5423 1 1 29 VAL HB H 17.003 5.055 12.164 1.00 . A A . 29 VAL HB 1 1 12 5424 1 1 29 VAL HG11 H 18.000 5.701 9.919 1.00 . A A . 29 VAL HG11 1 1 12 5425 1 1 29 VAL HG12 H 17.180 7.250 10.119 1.00 . A A . 29 VAL HG12 1 1 12 5426 1 1 29 VAL HG13 H 18.397 6.737 11.289 1.00 . A A . 29 VAL HG13 1 1 12 5427 1 1 29 VAL HG21 H 16.354 7.195 13.006 1.00 . A A . 29 VAL HG21 1 1 12 5428 1 1 29 VAL HG22 H 15.357 7.513 11.586 1.00 . A A . 29 VAL HG22 1 1 12 5429 1 1 29 VAL HG23 H 14.885 6.259 12.733 1.00 . A A . 29 VAL HG23 1 1 12 5430 1 1 29 VAL N N 14.844 5.742 9.643 1.00 . A A . 29 VAL N 1 1 12 5431 1 1 29 VAL O O 13.443 4.294 11.452 1.00 . A A . 29 VAL O 1 1 12 5432 1 1 30 LYS C C 13.947 3.031 14.267 1.00 . A A . 30 LYS C 1 1 12 5433 1 1 30 LYS CA C 14.435 2.256 13.047 1.00 . A A . 30 LYS CA 1 1 12 5434 1 1 30 LYS CB C 15.266 1.051 13.494 1.00 . A A . 30 LYS CB 1 1 12 5435 1 1 30 LYS CD C 14.711 -1.348 12.998 1.00 . A A . 30 LYS CD 1 1 12 5436 1 1 30 LYS CE C 13.904 -2.564 13.424 1.00 . A A . 30 LYS CE 1 1 12 5437 1 1 30 LYS CG C 14.429 -0.152 13.891 1.00 . A A . 30 LYS CG 1 1 12 5438 1 1 30 LYS H H 16.190 2.982 12.111 1.00 . A A . 30 LYS H 1 1 12 5439 1 1 30 LYS HA H 13.578 1.906 12.492 1.00 . A A . 30 LYS HA 1 1 12 5440 1 1 30 LYS HB2 H 15.918 0.758 12.683 1.00 . A A . 30 LYS HB2 1 1 12 5441 1 1 30 LYS HB3 H 15.870 1.340 14.342 1.00 . A A . 30 LYS HB3 1 1 12 5442 1 1 30 LYS HD2 H 14.451 -1.096 11.980 1.00 . A A . 30 LYS HD2 1 1 12 5443 1 1 30 LYS HD3 H 15.764 -1.587 13.053 1.00 . A A . 30 LYS HD3 1 1 12 5444 1 1 30 LYS HE2 H 13.519 -2.395 14.418 1.00 . A A . 30 LYS HE2 1 1 12 5445 1 1 30 LYS HE3 H 13.081 -2.693 12.736 1.00 . A A . 30 LYS HE3 1 1 12 5446 1 1 30 LYS HG2 H 14.659 -0.417 14.913 1.00 . A A . 30 LYS HG2 1 1 12 5447 1 1 30 LYS HG3 H 13.383 0.107 13.811 1.00 . A A . 30 LYS HG3 1 1 12 5448 1 1 30 LYS HZ1 H 15.432 -3.768 12.662 1.00 . A A . 30 LYS HZ1 1 1 12 5449 1 1 30 LYS HZ2 H 14.124 -4.637 13.289 1.00 . A A . 30 LYS HZ2 1 1 12 5450 1 1 30 LYS HZ3 H 15.227 -3.898 14.337 1.00 . A A . 30 LYS HZ3 1 1 12 5451 1 1 30 LYS N N 15.220 3.113 12.166 1.00 . A A . 30 LYS N 1 1 12 5452 1 1 30 LYS NZ N 14.729 -3.804 13.429 1.00 . A A . 30 LYS NZ 1 1 12 5453 1 1 30 LYS O O 14.655 3.888 14.794 1.00 . A A . 30 LYS O 1 1 12 5454 1 1 31 GLY C C 12.124 2.508 17.093 1.00 . A A . 31 GLY C 1 1 12 5455 1 1 31 GLY CA C 12.172 3.398 15.867 1.00 . A A . 31 GLY CA 1 1 12 5456 1 1 31 GLY H H 12.213 2.030 14.251 1.00 . A A . 31 GLY H 1 1 12 5457 1 1 31 GLY HA2 H 12.774 4.267 16.090 1.00 . A A . 31 GLY HA2 1 1 12 5458 1 1 31 GLY HA3 H 11.168 3.719 15.630 1.00 . A A . 31 GLY HA3 1 1 12 5459 1 1 31 GLY N N 12.733 2.722 14.712 1.00 . A A . 31 GLY N 1 1 12 5460 1 1 31 GLY O O 11.675 2.930 18.158 1.00 . A A . 31 GLY O 1 1 13 5461 1 1 1 GLY C C 3.568 0.047 -1.168 1.00 . A A . 1 GLY C 1 1 13 5462 1 1 1 GLY CA C 2.117 0.236 -1.563 1.00 . A A . 1 GLY CA 1 1 13 5463 1 1 1 GLY H1 H 1.095 1.194 0.025 1.00 . A A . 1 GLY H1 1 1 13 5464 1 1 1 GLY HA2 H 1.809 -0.599 -2.173 1.00 . A A . 1 GLY HA2 1 1 13 5465 1 1 1 GLY HA3 H 2.030 1.144 -2.143 1.00 . A A . 1 GLY HA3 1 1 13 5466 1 1 1 GLY N N 1.237 0.329 -0.413 1.00 . A A . 1 GLY N 1 1 13 5467 1 1 1 GLY O O 4.038 -1.082 -1.026 1.00 . A A . 1 GLY O 1 1 13 5468 1 1 2 TYR C C 6.156 2.453 -0.077 1.00 . A A . 2 TYR C 1 1 13 5469 1 1 2 TYR CA C 5.689 1.104 -0.616 1.00 . A A . 2 TYR CA 1 1 13 5470 1 1 2 TYR CB C 6.545 0.698 -1.816 1.00 . A A . 2 TYR CB 1 1 13 5471 1 1 2 TYR CD1 C 8.292 -0.563 -0.498 1.00 . A A . 2 TYR CD1 1 1 13 5472 1 1 2 TYR CD2 C 9.031 1.059 -2.081 1.00 . A A . 2 TYR CD2 1 1 13 5473 1 1 2 TYR CE1 C 9.603 -0.845 -0.168 1.00 . A A . 2 TYR CE1 1 1 13 5474 1 1 2 TYR CE2 C 10.345 0.783 -1.758 1.00 . A A . 2 TYR CE2 1 1 13 5475 1 1 2 TYR CG C 7.982 0.392 -1.459 1.00 . A A . 2 TYR CG 1 1 13 5476 1 1 2 TYR CZ C 10.626 -0.170 -0.801 1.00 . A A . 2 TYR CZ 1 1 13 5477 1 1 2 TYR H H 3.851 2.025 -1.120 1.00 . A A . 2 TYR H 1 1 13 5478 1 1 2 TYR HA H 5.799 0.362 0.160 1.00 . A A . 2 TYR HA 1 1 13 5479 1 1 2 TYR HB2 H 6.122 -0.186 -2.269 1.00 . A A . 2 TYR HB2 1 1 13 5480 1 1 2 TYR HB3 H 6.546 1.501 -2.538 1.00 . A A . 2 TYR HB3 1 1 13 5481 1 1 2 TYR HD1 H 7.489 -1.090 -0.004 1.00 . A A . 2 TYR HD1 1 1 13 5482 1 1 2 TYR HD2 H 8.807 1.805 -2.830 1.00 . A A . 2 TYR HD2 1 1 13 5483 1 1 2 TYR HE1 H 9.824 -1.591 0.581 1.00 . A A . 2 TYR HE1 1 1 13 5484 1 1 2 TYR HE2 H 11.146 1.312 -2.253 1.00 . A A . 2 TYR HE2 1 1 13 5485 1 1 2 TYR HH H 11.999 -1.349 -0.153 1.00 . A A . 2 TYR HH 1 1 13 5486 1 1 2 TYR N N 4.281 1.154 -0.992 1.00 . A A . 2 TYR N 1 1 13 5487 1 1 2 TYR O O 6.146 3.457 -0.790 1.00 . A A . 2 TYR O 1 1 13 5488 1 1 2 TYR OH O 11.934 -0.447 -0.475 1.00 . A A . 2 TYR OH 1 1 13 5489 1 1 3 CYS C C 8.565 3.735 1.854 1.00 . A A . 3 CYS C 1 1 13 5490 1 1 3 CYS CA C 7.039 3.691 1.823 1.00 . A A . 3 CYS CA 1 1 13 5491 1 1 3 CYS CB C 6.487 3.797 3.246 1.00 . A A . 3 CYS CB 1 1 13 5492 1 1 3 CYS H H 6.553 1.635 1.704 1.00 . A A . 3 CYS H 1 1 13 5493 1 1 3 CYS HA H 6.679 4.528 1.243 1.00 . A A . 3 CYS HA 1 1 13 5494 1 1 3 CYS HB2 H 7.213 3.394 3.937 1.00 . A A . 3 CYS HB2 1 1 13 5495 1 1 3 CYS HB3 H 6.312 4.836 3.480 1.00 . A A . 3 CYS HB3 1 1 13 5496 1 1 3 CYS N N 6.567 2.468 1.186 1.00 . A A . 3 CYS N 1 1 13 5497 1 1 3 CYS O O 9.232 2.909 1.232 1.00 . A A . 3 CYS O 1 1 13 5498 1 1 3 CYS SG S 4.923 2.899 3.504 1.00 . A A . 3 CYS SG 1 1 13 5499 1 1 4 ALA C C 11.102 4.029 3.854 1.00 . A A . 4 ALA C 1 1 13 5500 1 1 4 ALA CA C 10.554 4.855 2.696 1.00 . A A . 4 ALA CA 1 1 13 5501 1 1 4 ALA CB C 10.920 6.322 2.872 1.00 . A A . 4 ALA CB 1 1 13 5502 1 1 4 ALA H H 8.524 5.333 3.054 1.00 . A A . 4 ALA H 1 1 13 5503 1 1 4 ALA HA H 10.999 4.506 1.775 1.00 . A A . 4 ALA HA 1 1 13 5504 1 1 4 ALA HB1 H 11.887 6.396 3.347 1.00 . A A . 4 ALA HB1 1 1 13 5505 1 1 4 ALA HB2 H 10.955 6.802 1.905 1.00 . A A . 4 ALA HB2 1 1 13 5506 1 1 4 ALA HB3 H 10.177 6.806 3.488 1.00 . A A . 4 ALA HB3 1 1 13 5507 1 1 4 ALA N N 9.109 4.705 2.582 1.00 . A A . 4 ALA N 1 1 13 5508 1 1 4 ALA O O 10.882 4.353 5.021 1.00 . A A . 4 ALA O 1 1 13 5509 1 1 5 THR C C 13.732 2.623 5.031 1.00 . A A . 5 THR C 1 1 13 5510 1 1 5 THR CA C 12.395 2.083 4.537 1.00 . A A . 5 THR CA 1 1 13 5511 1 1 5 THR CB C 12.599 0.655 3.996 1.00 . A A . 5 THR CB 1 1 13 5512 1 1 5 THR CG2 C 11.304 -0.141 4.069 1.00 . A A . 5 THR CG2 1 1 13 5513 1 1 5 THR H H 11.957 2.751 2.577 1.00 . A A . 5 THR H 1 1 13 5514 1 1 5 THR HA H 11.707 2.036 5.369 1.00 . A A . 5 THR HA 1 1 13 5515 1 1 5 THR HB H 13.343 0.159 4.603 1.00 . A A . 5 THR HB 1 1 13 5516 1 1 5 THR HG1 H 14.012 0.819 2.631 1.00 . A A . 5 THR HG1 1 1 13 5517 1 1 5 THR HG21 H 10.509 0.497 4.427 1.00 . A A . 5 THR HG21 1 1 13 5518 1 1 5 THR HG22 H 11.431 -0.973 4.745 1.00 . A A . 5 THR HG22 1 1 13 5519 1 1 5 THR HG23 H 11.054 -0.510 3.086 1.00 . A A . 5 THR HG23 1 1 13 5520 1 1 5 THR N N 11.817 2.957 3.524 1.00 . A A . 5 THR N 1 1 13 5521 1 1 5 THR O O 14.271 3.580 4.474 1.00 . A A . 5 THR O 1 1 13 5522 1 1 5 THR OG1 O 13.058 0.705 2.641 1.00 . A A . 5 THR OG1 1 1 13 5523 1 1 6 LYS C C 16.592 2.593 5.556 1.00 . A A . 6 LYS C 1 1 13 5524 1 1 6 LYS CA C 15.541 2.419 6.647 1.00 . A A . 6 LYS CA 1 1 13 5525 1 1 6 LYS CB C 16.023 1.394 7.676 1.00 . A A . 6 LYS CB 1 1 13 5526 1 1 6 LYS CD C 17.100 -0.833 8.115 1.00 . A A . 6 LYS CD 1 1 13 5527 1 1 6 LYS CE C 17.979 -1.925 7.526 1.00 . A A . 6 LYS CE 1 1 13 5528 1 1 6 LYS CG C 16.664 0.164 7.055 1.00 . A A . 6 LYS CG 1 1 13 5529 1 1 6 LYS H H 13.787 1.246 6.479 1.00 . A A . 6 LYS H 1 1 13 5530 1 1 6 LYS HA H 15.391 3.368 7.140 1.00 . A A . 6 LYS HA 1 1 13 5531 1 1 6 LYS HB2 H 16.749 1.864 8.323 1.00 . A A . 6 LYS HB2 1 1 13 5532 1 1 6 LYS HB3 H 15.179 1.073 8.270 1.00 . A A . 6 LYS HB3 1 1 13 5533 1 1 6 LYS HD2 H 17.657 -0.312 8.880 1.00 . A A . 6 LYS HD2 1 1 13 5534 1 1 6 LYS HD3 H 16.221 -1.287 8.553 1.00 . A A . 6 LYS HD3 1 1 13 5535 1 1 6 LYS HE2 H 18.896 -1.479 7.172 1.00 . A A . 6 LYS HE2 1 1 13 5536 1 1 6 LYS HE3 H 18.203 -2.645 8.299 1.00 . A A . 6 LYS HE3 1 1 13 5537 1 1 6 LYS HG2 H 15.949 -0.312 6.401 1.00 . A A . 6 LYS HG2 1 1 13 5538 1 1 6 LYS HG3 H 17.529 0.470 6.484 1.00 . A A . 6 LYS HG3 1 1 13 5539 1 1 6 LYS HZ1 H 17.479 -3.647 6.455 1.00 . A A . 6 LYS HZ1 1 1 13 5540 1 1 6 LYS HZ2 H 17.688 -2.277 5.487 1.00 . A A . 6 LYS HZ2 1 1 13 5541 1 1 6 LYS HZ3 H 16.286 -2.448 6.418 1.00 . A A . 6 LYS HZ3 1 1 13 5542 1 1 6 LYS N N 14.265 2.003 6.079 1.00 . A A . 6 LYS N 1 1 13 5543 1 1 6 LYS NZ N 17.311 -2.623 6.392 1.00 . A A . 6 LYS NZ 1 1 13 5544 1 1 6 LYS O O 16.678 1.788 4.629 1.00 . A A . 6 LYS O 1 1 13 5545 1 1 7 GLY C C 17.906 4.661 3.482 1.00 . A A . 7 GLY C 1 1 13 5546 1 1 7 GLY CA C 18.428 3.907 4.690 1.00 . A A . 7 GLY CA 1 1 13 5547 1 1 7 GLY H H 17.277 4.257 6.433 1.00 . A A . 7 GLY H 1 1 13 5548 1 1 7 GLY HA2 H 19.211 4.488 5.153 1.00 . A A . 7 GLY HA2 1 1 13 5549 1 1 7 GLY HA3 H 18.839 2.964 4.361 1.00 . A A . 7 GLY HA3 1 1 13 5550 1 1 7 GLY N N 17.392 3.649 5.673 1.00 . A A . 7 GLY N 1 1 13 5551 1 1 7 GLY O O 18.678 5.063 2.612 1.00 . A A . 7 GLY O 1 1 13 5552 1 1 8 ILE C C 15.706 7.020 2.677 1.00 . A A . 8 ILE C 1 1 13 5553 1 1 8 ILE CA C 15.968 5.561 2.318 1.00 . A A . 8 ILE CA 1 1 13 5554 1 1 8 ILE CB C 14.642 4.900 1.902 1.00 . A A . 8 ILE CB 1 1 13 5555 1 1 8 ILE CD1 C 15.743 3.116 0.458 1.00 . A A . 8 ILE CD1 1 1 13 5556 1 1 8 ILE CG1 C 14.850 3.406 1.644 1.00 . A A . 8 ILE CG1 1 1 13 5557 1 1 8 ILE CG2 C 14.075 5.582 0.665 1.00 . A A . 8 ILE CG2 1 1 13 5558 1 1 8 ILE H H 16.029 4.508 4.153 1.00 . A A . 8 ILE H 1 1 13 5559 1 1 8 ILE HA H 16.646 5.525 1.477 1.00 . A A . 8 ILE HA 1 1 13 5560 1 1 8 ILE HB H 13.935 5.024 2.707 1.00 . A A . 8 ILE HB 1 1 13 5561 1 1 8 ILE HD11 H 16.584 2.518 0.777 1.00 . A A . 8 ILE HD11 1 1 13 5562 1 1 8 ILE HD12 H 15.183 2.580 -0.293 1.00 . A A . 8 ILE HD12 1 1 13 5563 1 1 8 ILE HD13 H 16.103 4.047 0.042 1.00 . A A . 8 ILE HD13 1 1 13 5564 1 1 8 ILE HG12 H 15.300 2.956 2.515 1.00 . A A . 8 ILE HG12 1 1 13 5565 1 1 8 ILE HG13 H 13.891 2.943 1.459 1.00 . A A . 8 ILE HG13 1 1 13 5566 1 1 8 ILE HG21 H 14.886 5.897 0.025 1.00 . A A . 8 ILE HG21 1 1 13 5567 1 1 8 ILE HG22 H 13.443 4.889 0.130 1.00 . A A . 8 ILE HG22 1 1 13 5568 1 1 8 ILE HG23 H 13.495 6.443 0.963 1.00 . A A . 8 ILE HG23 1 1 13 5569 1 1 8 ILE N N 16.592 4.852 3.429 1.00 . A A . 8 ILE N 1 1 13 5570 1 1 8 ILE O O 15.132 7.320 3.724 1.00 . A A . 8 ILE O 1 1 13 5571 1 1 9 LYS C C 14.466 9.673 2.265 1.00 . A A . 9 LYS C 1 1 13 5572 1 1 9 LYS CA C 15.937 9.353 2.020 1.00 . A A . 9 LYS CA 1 1 13 5573 1 1 9 LYS CB C 16.450 10.149 0.818 1.00 . A A . 9 LYS CB 1 1 13 5574 1 1 9 LYS CD C 18.718 11.160 1.196 1.00 . A A . 9 LYS CD 1 1 13 5575 1 1 9 LYS CE C 20.068 11.345 0.521 1.00 . A A . 9 LYS CE 1 1 13 5576 1 1 9 LYS CG C 17.944 10.004 0.585 1.00 . A A . 9 LYS CG 1 1 13 5577 1 1 9 LYS H H 16.579 7.623 0.983 1.00 . A A . 9 LYS H 1 1 13 5578 1 1 9 LYS HA H 16.504 9.632 2.895 1.00 . A A . 9 LYS HA 1 1 13 5579 1 1 9 LYS HB2 H 15.934 9.811 -0.069 1.00 . A A . 9 LYS HB2 1 1 13 5580 1 1 9 LYS HB3 H 16.231 11.195 0.974 1.00 . A A . 9 LYS HB3 1 1 13 5581 1 1 9 LYS HD2 H 18.143 12.067 1.081 1.00 . A A . 9 LYS HD2 1 1 13 5582 1 1 9 LYS HD3 H 18.875 10.961 2.247 1.00 . A A . 9 LYS HD3 1 1 13 5583 1 1 9 LYS HE2 H 20.222 10.534 -0.175 1.00 . A A . 9 LYS HE2 1 1 13 5584 1 1 9 LYS HE3 H 20.062 12.283 -0.015 1.00 . A A . 9 LYS HE3 1 1 13 5585 1 1 9 LYS HG2 H 18.281 9.082 1.034 1.00 . A A . 9 LYS HG2 1 1 13 5586 1 1 9 LYS HG3 H 18.132 9.978 -0.479 1.00 . A A . 9 LYS HG3 1 1 13 5587 1 1 9 LYS HZ1 H 21.396 12.334 1.794 1.00 . A A . 9 LYS HZ1 1 1 13 5588 1 1 9 LYS HZ2 H 22.038 10.940 1.085 1.00 . A A . 9 LYS HZ2 1 1 13 5589 1 1 9 LYS HZ3 H 20.923 10.808 2.350 1.00 . A A . 9 LYS HZ3 1 1 13 5590 1 1 9 LYS N N 16.128 7.924 1.799 1.00 . A A . 9 LYS N 1 1 13 5591 1 1 9 LYS NZ N 21.184 11.357 1.506 1.00 . A A . 9 LYS NZ 1 1 13 5592 1 1 9 LYS O O 13.586 9.173 1.563 1.00 . A A . 9 LYS O 1 1 13 5593 1 1 10 CYS C C 12.676 12.415 3.538 1.00 . A A . 10 CYS C 1 1 13 5594 1 1 10 CYS CA C 12.841 10.899 3.600 1.00 . A A . 10 CYS CA 1 1 13 5595 1 1 10 CYS CB C 12.474 10.392 4.996 1.00 . A A . 10 CYS CB 1 1 13 5596 1 1 10 CYS H H 14.949 10.877 3.787 1.00 . A A . 10 CYS H 1 1 13 5597 1 1 10 CYS HA H 12.179 10.448 2.876 1.00 . A A . 10 CYS HA 1 1 13 5598 1 1 10 CYS HB2 H 11.406 10.480 5.133 1.00 . A A . 10 CYS HB2 1 1 13 5599 1 1 10 CYS HB3 H 12.757 9.353 5.079 1.00 . A A . 10 CYS HB3 1 1 13 5600 1 1 10 CYS N N 14.205 10.511 3.263 1.00 . A A . 10 CYS N 1 1 13 5601 1 1 10 CYS O O 11.834 12.987 4.228 1.00 . A A . 10 CYS O 1 1 13 5602 1 1 10 CYS SG S 13.283 11.299 6.353 1.00 . A A . 10 CYS SG 1 1 13 5603 1 1 11 ASN C C 12.036 14.959 2.132 1.00 . A A . 11 ASN C 1 1 13 5604 1 1 11 ASN CA C 13.432 14.509 2.553 1.00 . A A . 11 ASN CA 1 1 13 5605 1 1 11 ASN CB C 14.462 14.974 1.522 1.00 . A A . 11 ASN CB 1 1 13 5606 1 1 11 ASN CG C 15.865 14.505 1.854 1.00 . A A . 11 ASN CG 1 1 13 5607 1 1 11 ASN H H 14.139 12.549 2.181 1.00 . A A . 11 ASN H 1 1 13 5608 1 1 11 ASN HA H 13.667 14.952 3.509 1.00 . A A . 11 ASN HA 1 1 13 5609 1 1 11 ASN HB2 H 14.193 14.582 0.551 1.00 . A A . 11 ASN HB2 1 1 13 5610 1 1 11 ASN HB3 H 14.462 16.053 1.483 1.00 . A A . 11 ASN HB3 1 1 13 5611 1 1 11 ASN HD21 H 16.502 16.387 1.934 1.00 . A A . 11 ASN HD21 1 1 13 5612 1 1 11 ASN HD22 H 17.695 15.176 2.244 1.00 . A A . 11 ASN HD22 1 1 13 5613 1 1 11 ASN N N 13.487 13.059 2.705 1.00 . A A . 11 ASN N 1 1 13 5614 1 1 11 ASN ND2 N 16.780 15.452 2.028 1.00 . A A . 11 ASN ND2 1 1 13 5615 1 1 11 ASN O O 11.650 16.107 2.352 1.00 . A A . 11 ASN O 1 1 13 5616 1 1 11 ASN OD1 O 16.124 13.305 1.953 1.00 . A A . 11 ASN OD1 1 1 13 5617 1 1 12 ASP C C 8.995 13.171 1.340 1.00 . A A . 12 ASP C 1 1 13 5618 1 1 12 ASP CA C 9.930 14.348 1.077 1.00 . A A . 12 ASP CA 1 1 13 5619 1 1 12 ASP CB C 9.930 14.692 -0.413 1.00 . A A . 12 ASP CB 1 1 13 5620 1 1 12 ASP CG C 10.916 13.853 -1.201 1.00 . A A . 12 ASP CG 1 1 13 5621 1 1 12 ASP H H 11.648 13.148 1.380 1.00 . A A . 12 ASP H 1 1 13 5622 1 1 12 ASP HA H 9.578 15.202 1.635 1.00 . A A . 12 ASP HA 1 1 13 5623 1 1 12 ASP HB2 H 8.941 14.523 -0.815 1.00 . A A . 12 ASP HB2 1 1 13 5624 1 1 12 ASP HB3 H 10.191 15.733 -0.535 1.00 . A A . 12 ASP HB3 1 1 13 5625 1 1 12 ASP N N 11.284 14.046 1.527 1.00 . A A . 12 ASP N 1 1 13 5626 1 1 12 ASP O O 7.858 13.354 1.776 1.00 . A A . 12 ASP O 1 1 13 5627 1 1 12 ASP OD1 O 12.131 14.129 -1.116 1.00 . A A . 12 ASP OD1 1 1 13 5628 1 1 12 ASP OD2 O 10.473 12.920 -1.903 1.00 . A A . 12 ASP OD2 1 1 13 5629 1 1 13 ILE C C 8.714 10.329 2.742 1.00 . A A . 13 ILE C 1 1 13 5630 1 1 13 ILE CA C 8.690 10.758 1.279 1.00 . A A . 13 ILE CA 1 1 13 5631 1 1 13 ILE CB C 9.196 9.595 0.406 1.00 . A A . 13 ILE CB 1 1 13 5632 1 1 13 ILE CD1 C 6.860 8.748 -0.143 1.00 . A A . 13 ILE CD1 1 1 13 5633 1 1 13 ILE CG1 C 8.211 8.425 0.455 1.00 . A A . 13 ILE CG1 1 1 13 5634 1 1 13 ILE CG2 C 10.577 9.150 0.865 1.00 . A A . 13 ILE CG2 1 1 13 5635 1 1 13 ILE H H 10.395 11.883 0.727 1.00 . A A . 13 ILE H 1 1 13 5636 1 1 13 ILE HA H 7.670 10.977 0.996 1.00 . A A . 13 ILE HA 1 1 13 5637 1 1 13 ILE HB H 9.277 9.946 -0.611 1.00 . A A . 13 ILE HB 1 1 13 5638 1 1 13 ILE HD11 H 6.820 9.797 -0.400 1.00 . A A . 13 ILE HD11 1 1 13 5639 1 1 13 ILE HD12 H 6.706 8.153 -1.030 1.00 . A A . 13 ILE HD12 1 1 13 5640 1 1 13 ILE HD13 H 6.085 8.526 0.577 1.00 . A A . 13 ILE HD13 1 1 13 5641 1 1 13 ILE HG12 H 8.624 7.592 -0.091 1.00 . A A . 13 ILE HG12 1 1 13 5642 1 1 13 ILE HG13 H 8.058 8.136 1.485 1.00 . A A . 13 ILE HG13 1 1 13 5643 1 1 13 ILE HG21 H 11.247 9.997 0.862 1.00 . A A . 13 ILE HG21 1 1 13 5644 1 1 13 ILE HG22 H 10.511 8.748 1.865 1.00 . A A . 13 ILE HG22 1 1 13 5645 1 1 13 ILE HG23 H 10.953 8.392 0.196 1.00 . A A . 13 ILE HG23 1 1 13 5646 1 1 13 ILE N N 9.482 11.964 1.072 1.00 . A A . 13 ILE N 1 1 13 5647 1 1 13 ILE O O 9.729 10.471 3.425 1.00 . A A . 13 ILE O 1 1 13 5648 1 1 14 HIS C C 7.757 7.852 4.704 1.00 . A A . 14 HIS C 1 1 13 5649 1 1 14 HIS CA C 7.483 9.350 4.600 1.00 . A A . 14 HIS CA 1 1 13 5650 1 1 14 HIS CB C 6.095 9.666 5.157 1.00 . A A . 14 HIS CB 1 1 13 5651 1 1 14 HIS CD2 C 6.589 10.931 7.367 1.00 . A A . 14 HIS CD2 1 1 13 5652 1 1 14 HIS CE1 C 5.648 9.524 8.759 1.00 . A A . 14 HIS CE1 1 1 13 5653 1 1 14 HIS CG C 6.083 9.911 6.634 1.00 . A A . 14 HIS CG 1 1 13 5654 1 1 14 HIS H H 6.815 9.715 2.625 1.00 . A A . 14 HIS H 1 1 13 5655 1 1 14 HIS HA H 8.224 9.879 5.181 1.00 . A A . 14 HIS HA 1 1 13 5656 1 1 14 HIS HB2 H 5.713 10.552 4.671 1.00 . A A . 14 HIS HB2 1 1 13 5657 1 1 14 HIS HB3 H 5.434 8.836 4.952 1.00 . A A . 14 HIS HB3 1 1 13 5658 1 1 14 HIS HD1 H 5.047 8.207 7.313 1.00 . A A . 14 HIS HD1 1 1 13 5659 1 1 14 HIS HD2 H 7.118 11.794 6.986 1.00 . A A . 14 HIS HD2 1 1 13 5660 1 1 14 HIS HE1 H 5.292 9.059 9.666 1.00 . A A . 14 HIS HE1 1 1 13 5661 1 1 14 HIS N N 7.590 9.802 3.218 1.00 . A A . 14 HIS N 1 1 13 5662 1 1 14 HIS ND1 N 5.501 9.046 7.536 1.00 . A A . 14 HIS ND1 1 1 13 5663 1 1 14 HIS NE2 N 6.305 10.667 8.684 1.00 . A A . 14 HIS NE2 1 1 13 5664 1 1 14 HIS O O 7.641 7.119 3.721 1.00 . A A . 14 HIS O 1 1 13 5665 1 1 15 CYS C C 7.154 5.242 6.559 1.00 . A A . 15 CYS C 1 1 13 5666 1 1 15 CYS CA C 8.412 5.994 6.134 1.00 . A A . 15 CYS CA 1 1 13 5667 1 1 15 CYS CB C 9.494 5.846 7.206 1.00 . A A . 15 CYS CB 1 1 13 5668 1 1 15 CYS H H 8.195 8.037 6.647 1.00 . A A . 15 CYS H 1 1 13 5669 1 1 15 CYS HA H 8.774 5.573 5.209 1.00 . A A . 15 CYS HA 1 1 13 5670 1 1 15 CYS HB2 H 9.027 5.838 8.180 1.00 . A A . 15 CYS HB2 1 1 13 5671 1 1 15 CYS HB3 H 10.015 4.912 7.054 1.00 . A A . 15 CYS HB3 1 1 13 5672 1 1 15 CYS N N 8.121 7.404 5.901 1.00 . A A . 15 CYS N 1 1 13 5673 1 1 15 CYS O O 6.226 5.827 7.118 1.00 . A A . 15 CYS O 1 1 13 5674 1 1 15 CYS SG S 10.735 7.181 7.199 1.00 . A A . 15 CYS SG 1 1 13 5675 1 1 16 CYS C C 5.780 3.082 8.155 1.00 . A A . 16 CYS C 1 1 13 5676 1 1 16 CYS CA C 5.989 3.107 6.644 1.00 . A A . 16 CYS CA 1 1 13 5677 1 1 16 CYS CB C 6.190 1.682 6.122 1.00 . A A . 16 CYS CB 1 1 13 5678 1 1 16 CYS H H 7.902 3.531 5.843 1.00 . A A . 16 CYS H 1 1 13 5679 1 1 16 CYS HA H 5.112 3.530 6.178 1.00 . A A . 16 CYS HA 1 1 13 5680 1 1 16 CYS HB2 H 7.249 1.479 6.052 1.00 . A A . 16 CYS HB2 1 1 13 5681 1 1 16 CYS HB3 H 5.741 0.987 6.816 1.00 . A A . 16 CYS HB3 1 1 13 5682 1 1 16 CYS N N 7.131 3.941 6.290 1.00 . A A . 16 CYS N 1 1 13 5683 1 1 16 CYS O O 6.721 3.268 8.925 1.00 . A A . 16 CYS O 1 1 13 5684 1 1 16 CYS SG S 5.459 1.381 4.481 1.00 . A A . 16 CYS SG 1 1 13 5685 1 1 17 SER C C 5.145 1.868 10.740 1.00 . A A . 17 SER C 1 1 13 5686 1 1 17 SER CA C 4.204 2.807 9.990 1.00 . A A . 17 SER CA 1 1 13 5687 1 1 17 SER CB C 2.755 2.354 10.180 1.00 . A A . 17 SER CB 1 1 13 5688 1 1 17 SER H H 3.830 2.711 7.908 1.00 . A A . 17 SER H 1 1 13 5689 1 1 17 SER HA H 4.317 3.804 10.389 1.00 . A A . 17 SER HA 1 1 13 5690 1 1 17 SER HB2 H 2.488 2.439 11.222 1.00 . A A . 17 SER HB2 1 1 13 5691 1 1 17 SER HB3 H 2.105 2.983 9.589 1.00 . A A . 17 SER HB3 1 1 13 5692 1 1 17 SER HG H 1.810 0.940 9.209 1.00 . A A . 17 SER HG 1 1 13 5693 1 1 17 SER N N 4.539 2.852 8.571 1.00 . A A . 17 SER N 1 1 13 5694 1 1 17 SER O O 5.059 0.648 10.605 1.00 . A A . 17 SER O 1 1 13 5695 1 1 17 SER OG O 2.584 1.008 9.773 1.00 . A A . 17 SER OG 1 1 13 5696 1 1 18 GLY C C 8.399 2.193 12.214 1.00 . A A . 18 GLY C 1 1 13 5697 1 1 18 GLY CA C 6.987 1.649 12.291 1.00 . A A . 18 GLY CA 1 1 13 5698 1 1 18 GLY H H 6.064 3.425 11.599 1.00 . A A . 18 GLY H 1 1 13 5699 1 1 18 GLY HA2 H 6.675 1.629 13.325 1.00 . A A . 18 GLY HA2 1 1 13 5700 1 1 18 GLY HA3 H 6.980 0.640 11.904 1.00 . A A . 18 GLY HA3 1 1 13 5701 1 1 18 GLY N N 6.043 2.447 11.531 1.00 . A A . 18 GLY N 1 1 13 5702 1 1 18 GLY O O 9.265 1.807 13.001 1.00 . A A . 18 GLY O 1 1 13 5703 1 1 19 LEU C C 9.918 5.184 11.379 1.00 . A A . 19 LEU C 1 1 13 5704 1 1 19 LEU CA C 9.954 3.688 11.086 1.00 . A A . 19 LEU CA 1 1 13 5705 1 1 19 LEU CB C 10.457 3.447 9.661 1.00 . A A . 19 LEU CB 1 1 13 5706 1 1 19 LEU CD1 C 11.043 1.863 7.810 1.00 . A A . 19 LEU CD1 1 1 13 5707 1 1 19 LEU CD2 C 12.002 1.521 10.095 1.00 . A A . 19 LEU CD2 1 1 13 5708 1 1 19 LEU CG C 10.793 1.999 9.304 1.00 . A A . 19 LEU CG 1 1 13 5709 1 1 19 LEU H H 7.906 3.358 10.667 1.00 . A A . 19 LEU H 1 1 13 5710 1 1 19 LEU HA H 10.630 3.213 11.782 1.00 . A A . 19 LEU HA 1 1 13 5711 1 1 19 LEU HB2 H 9.692 3.787 8.980 1.00 . A A . 19 LEU HB2 1 1 13 5712 1 1 19 LEU HB3 H 11.350 4.040 9.522 1.00 . A A . 19 LEU HB3 1 1 13 5713 1 1 19 LEU HD11 H 11.904 2.453 7.534 1.00 . A A . 19 LEU HD11 1 1 13 5714 1 1 19 LEU HD12 H 10.178 2.212 7.266 1.00 . A A . 19 LEU HD12 1 1 13 5715 1 1 19 LEU HD13 H 11.225 0.826 7.569 1.00 . A A . 19 LEU HD13 1 1 13 5716 1 1 19 LEU HD21 H 12.900 1.944 9.669 1.00 . A A . 19 LEU HD21 1 1 13 5717 1 1 19 LEU HD22 H 12.057 0.443 10.051 1.00 . A A . 19 LEU HD22 1 1 13 5718 1 1 19 LEU HD23 H 11.907 1.837 11.123 1.00 . A A . 19 LEU HD23 1 1 13 5719 1 1 19 LEU HG H 9.953 1.367 9.560 1.00 . A A . 19 LEU HG 1 1 13 5720 1 1 19 LEU N N 8.635 3.090 11.264 1.00 . A A . 19 LEU N 1 1 13 5721 1 1 19 LEU O O 8.860 5.812 11.334 1.00 . A A . 19 LEU O 1 1 13 5722 1 1 20 LYS C C 11.984 7.899 10.895 1.00 . A A . 20 LYS C 1 1 13 5723 1 1 20 LYS CA C 11.186 7.175 11.975 1.00 . A A . 20 LYS CA 1 1 13 5724 1 1 20 LYS CB C 11.847 7.385 13.339 1.00 . A A . 20 LYS CB 1 1 13 5725 1 1 20 LYS CD C 10.363 8.208 15.192 1.00 . A A . 20 LYS CD 1 1 13 5726 1 1 20 LYS CE C 11.057 8.505 16.512 1.00 . A A . 20 LYS CE 1 1 13 5727 1 1 20 LYS CG C 10.963 6.990 14.510 1.00 . A A . 20 LYS CG 1 1 13 5728 1 1 20 LYS H H 11.892 5.198 11.698 1.00 . A A . 20 LYS H 1 1 13 5729 1 1 20 LYS HA H 10.187 7.582 12.001 1.00 . A A . 20 LYS HA 1 1 13 5730 1 1 20 LYS HB2 H 12.751 6.796 13.383 1.00 . A A . 20 LYS HB2 1 1 13 5731 1 1 20 LYS HB3 H 12.102 8.430 13.445 1.00 . A A . 20 LYS HB3 1 1 13 5732 1 1 20 LYS HD2 H 10.470 9.063 14.542 1.00 . A A . 20 LYS HD2 1 1 13 5733 1 1 20 LYS HD3 H 9.315 8.024 15.380 1.00 . A A . 20 LYS HD3 1 1 13 5734 1 1 20 LYS HE2 H 11.936 7.884 16.590 1.00 . A A . 20 LYS HE2 1 1 13 5735 1 1 20 LYS HE3 H 11.350 9.545 16.523 1.00 . A A . 20 LYS HE3 1 1 13 5736 1 1 20 LYS HG2 H 10.162 6.362 14.149 1.00 . A A . 20 LYS HG2 1 1 13 5737 1 1 20 LYS HG3 H 11.557 6.442 15.228 1.00 . A A . 20 LYS HG3 1 1 13 5738 1 1 20 LYS HZ1 H 9.823 9.136 18.074 1.00 . A A . 20 LYS HZ1 1 1 13 5739 1 1 20 LYS HZ2 H 10.694 7.728 18.416 1.00 . A A . 20 LYS HZ2 1 1 13 5740 1 1 20 LYS HZ3 H 9.356 7.664 17.383 1.00 . A A . 20 LYS HZ3 1 1 13 5741 1 1 20 LYS N N 11.082 5.751 11.678 1.00 . A A . 20 LYS N 1 1 13 5742 1 1 20 LYS NZ N 10.170 8.239 17.678 1.00 . A A . 20 LYS NZ 1 1 13 5743 1 1 20 LYS O O 13.053 7.443 10.487 1.00 . A A . 20 LYS O 1 1 13 5744 1 1 21 CYS C C 13.111 10.804 10.026 1.00 . A A . 21 CYS C 1 1 13 5745 1 1 21 CYS CA C 12.123 9.820 9.406 1.00 . A A . 21 CYS CA 1 1 13 5746 1 1 21 CYS CB C 11.090 10.575 8.569 1.00 . A A . 21 CYS CB 1 1 13 5747 1 1 21 CYS H H 10.605 9.344 10.802 1.00 . A A . 21 CYS H 1 1 13 5748 1 1 21 CYS HA H 12.665 9.140 8.766 1.00 . A A . 21 CYS HA 1 1 13 5749 1 1 21 CYS HB2 H 10.576 9.875 7.927 1.00 . A A . 21 CYS HB2 1 1 13 5750 1 1 21 CYS HB3 H 10.374 11.041 9.229 1.00 . A A . 21 CYS HB3 1 1 13 5751 1 1 21 CYS N N 11.460 9.031 10.437 1.00 . A A . 21 CYS N 1 1 13 5752 1 1 21 CYS O O 12.729 11.891 10.461 1.00 . A A . 21 CYS O 1 1 13 5753 1 1 21 CYS SG S 11.799 11.878 7.510 1.00 . A A . 21 CYS SG 1 1 13 5754 1 1 22 ASP C C 15.552 12.566 9.838 1.00 . A A . 22 ASP C 1 1 13 5755 1 1 22 ASP CA C 15.424 11.265 10.625 1.00 . A A . 22 ASP CA 1 1 13 5756 1 1 22 ASP CB C 16.763 10.526 10.634 1.00 . A A . 22 ASP CB 1 1 13 5757 1 1 22 ASP CG C 17.667 10.979 11.764 1.00 . A A . 22 ASP CG 1 1 13 5758 1 1 22 ASP H H 14.623 9.539 9.697 1.00 . A A . 22 ASP H 1 1 13 5759 1 1 22 ASP HA H 15.147 11.500 11.642 1.00 . A A . 22 ASP HA 1 1 13 5760 1 1 22 ASP HB2 H 16.582 9.467 10.746 1.00 . A A . 22 ASP HB2 1 1 13 5761 1 1 22 ASP HB3 H 17.271 10.703 9.697 1.00 . A A . 22 ASP HB3 1 1 13 5762 1 1 22 ASP N N 14.381 10.417 10.061 1.00 . A A . 22 ASP N 1 1 13 5763 1 1 22 ASP O O 16.105 12.586 8.739 1.00 . A A . 22 ASP O 1 1 13 5764 1 1 22 ASP OD1 O 17.377 12.031 12.371 1.00 . A A . 22 ASP OD1 1 1 13 5765 1 1 22 ASP OD2 O 18.664 10.281 12.041 1.00 . A A . 22 ASP OD2 1 1 13 5766 1 1 23 SER C C 16.503 15.522 9.792 1.00 . A A . 23 SER C 1 1 13 5767 1 1 23 SER CA C 15.087 14.954 9.758 1.00 . A A . 23 SER CA 1 1 13 5768 1 1 23 SER CB C 14.120 15.925 10.438 1.00 . A A . 23 SER CB 1 1 13 5769 1 1 23 SER H H 14.607 13.569 11.286 1.00 . A A . 23 SER H 1 1 13 5770 1 1 23 SER HA H 14.789 14.823 8.729 1.00 . A A . 23 SER HA 1 1 13 5771 1 1 23 SER HB2 H 13.105 15.645 10.197 1.00 . A A . 23 SER HB2 1 1 13 5772 1 1 23 SER HB3 H 14.262 15.880 11.508 1.00 . A A . 23 SER HB3 1 1 13 5773 1 1 23 SER HG H 13.600 17.806 10.262 1.00 . A A . 23 SER HG 1 1 13 5774 1 1 23 SER N N 15.035 13.650 10.408 1.00 . A A . 23 SER N 1 1 13 5775 1 1 23 SER O O 16.812 16.492 9.099 1.00 . A A . 23 SER O 1 1 13 5776 1 1 23 SER OG O 14.342 17.255 10.002 1.00 . A A . 23 SER OG 1 1 13 5777 1 1 24 LYS C C 19.611 14.741 9.632 1.00 . A A . 24 LYS C 1 1 13 5778 1 1 24 LYS CA C 18.743 15.352 10.728 1.00 . A A . 24 LYS CA 1 1 13 5779 1 1 24 LYS CB C 19.299 14.974 12.103 1.00 . A A . 24 LYS CB 1 1 13 5780 1 1 24 LYS CD C 19.366 16.010 14.390 1.00 . A A . 24 LYS CD 1 1 13 5781 1 1 24 LYS CE C 19.377 17.529 14.467 1.00 . A A . 24 LYS CE 1 1 13 5782 1 1 24 LYS CG C 18.478 15.516 13.260 1.00 . A A . 24 LYS CG 1 1 13 5783 1 1 24 LYS H H 17.054 14.142 11.129 1.00 . A A . 24 LYS H 1 1 13 5784 1 1 24 LYS HA H 18.759 16.426 10.626 1.00 . A A . 24 LYS HA 1 1 13 5785 1 1 24 LYS HB2 H 19.327 13.897 12.183 1.00 . A A . 24 LYS HB2 1 1 13 5786 1 1 24 LYS HB3 H 20.304 15.359 12.190 1.00 . A A . 24 LYS HB3 1 1 13 5787 1 1 24 LYS HD2 H 18.997 15.616 15.325 1.00 . A A . 24 LYS HD2 1 1 13 5788 1 1 24 LYS HD3 H 20.375 15.660 14.223 1.00 . A A . 24 LYS HD3 1 1 13 5789 1 1 24 LYS HE2 H 20.107 17.834 15.201 1.00 . A A . 24 LYS HE2 1 1 13 5790 1 1 24 LYS HE3 H 19.652 17.923 13.500 1.00 . A A . 24 LYS HE3 1 1 13 5791 1 1 24 LYS HG2 H 17.873 16.338 12.907 1.00 . A A . 24 LYS HG2 1 1 13 5792 1 1 24 LYS HG3 H 17.838 14.730 13.635 1.00 . A A . 24 LYS HG3 1 1 13 5793 1 1 24 LYS HZ1 H 17.592 17.450 15.550 1.00 . A A . 24 LYS HZ1 1 1 13 5794 1 1 24 LYS HZ2 H 17.432 18.141 14.015 1.00 . A A . 24 LYS HZ2 1 1 13 5795 1 1 24 LYS HZ3 H 18.153 19.021 15.267 1.00 . A A . 24 LYS HZ3 1 1 13 5796 1 1 24 LYS N N 17.360 14.910 10.603 1.00 . A A . 24 LYS N 1 1 13 5797 1 1 24 LYS NZ N 18.045 18.074 14.852 1.00 . A A . 24 LYS NZ 1 1 13 5798 1 1 24 LYS O O 20.453 15.419 9.044 1.00 . A A . 24 LYS O 1 1 13 5799 1 1 25 ARG C C 19.347 12.618 7.053 1.00 . A A . 25 ARG C 1 1 13 5800 1 1 25 ARG CA C 20.161 12.756 8.336 1.00 . A A . 25 ARG CA 1 1 13 5801 1 1 25 ARG CB C 20.579 11.372 8.838 1.00 . A A . 25 ARG CB 1 1 13 5802 1 1 25 ARG CD C 22.007 10.019 10.402 1.00 . A A . 25 ARG CD 1 1 13 5803 1 1 25 ARG CG C 21.573 11.416 9.987 1.00 . A A . 25 ARG CG 1 1 13 5804 1 1 25 ARG CZ C 23.257 10.307 12.499 1.00 . A A . 25 ARG CZ 1 1 13 5805 1 1 25 ARG H H 18.712 12.970 9.865 1.00 . A A . 25 ARG H 1 1 13 5806 1 1 25 ARG HA H 21.047 13.336 8.127 1.00 . A A . 25 ARG HA 1 1 13 5807 1 1 25 ARG HB2 H 19.699 10.842 9.173 1.00 . A A . 25 ARG HB2 1 1 13 5808 1 1 25 ARG HB3 H 21.028 10.827 8.022 1.00 . A A . 25 ARG HB3 1 1 13 5809 1 1 25 ARG HD2 H 21.258 9.312 10.077 1.00 . A A . 25 ARG HD2 1 1 13 5810 1 1 25 ARG HD3 H 22.947 9.792 9.923 1.00 . A A . 25 ARG HD3 1 1 13 5811 1 1 25 ARG HE H 21.436 9.506 12.359 1.00 . A A . 25 ARG HE 1 1 13 5812 1 1 25 ARG HG2 H 22.444 11.974 9.676 1.00 . A A . 25 ARG HG2 1 1 13 5813 1 1 25 ARG HG3 H 21.112 11.906 10.832 1.00 . A A . 25 ARG HG3 1 1 13 5814 1 1 25 ARG HH11 H 24.214 10.956 10.843 1.00 . A A . 25 ARG HH11 1 1 13 5815 1 1 25 ARG HH12 H 25.085 11.153 12.328 1.00 . A A . 25 ARG HH12 1 1 13 5816 1 1 25 ARG HH21 H 22.571 9.760 14.320 1.00 . A A . 25 ARG HH21 1 1 13 5817 1 1 25 ARG HH22 H 24.150 10.472 14.305 1.00 . A A . 25 ARG HH22 1 1 13 5818 1 1 25 ARG N N 19.398 13.457 9.362 1.00 . A A . 25 ARG N 1 1 13 5819 1 1 25 ARG NE N 22.171 9.904 11.849 1.00 . A A . 25 ARG NE 1 1 13 5820 1 1 25 ARG NH1 N 24.269 10.849 11.835 1.00 . A A . 25 ARG NH1 1 1 13 5821 1 1 25 ARG NH2 N 23.332 10.168 13.817 1.00 . A A . 25 ARG NH2 1 1 13 5822 1 1 25 ARG O O 19.802 12.019 6.078 1.00 . A A . 25 ARG O 1 1 13 5823 1 1 26 LYS C C 17.075 11.678 5.429 1.00 . A A . 26 LYS C 1 1 13 5824 1 1 26 LYS CA C 17.264 13.118 5.897 1.00 . A A . 26 LYS CA 1 1 13 5825 1 1 26 LYS CB C 17.836 13.964 4.757 1.00 . A A . 26 LYS CB 1 1 13 5826 1 1 26 LYS CD C 19.539 15.803 4.937 1.00 . A A . 26 LYS CD 1 1 13 5827 1 1 26 LYS CE C 19.837 17.172 5.529 1.00 . A A . 26 LYS CE 1 1 13 5828 1 1 26 LYS CG C 18.084 15.413 5.141 1.00 . A A . 26 LYS CG 1 1 13 5829 1 1 26 LYS H H 17.835 13.640 7.867 1.00 . A A . 26 LYS H 1 1 13 5830 1 1 26 LYS HA H 16.304 13.519 6.185 1.00 . A A . 26 LYS HA 1 1 13 5831 1 1 26 LYS HB2 H 18.774 13.532 4.439 1.00 . A A . 26 LYS HB2 1 1 13 5832 1 1 26 LYS HB3 H 17.143 13.947 3.929 1.00 . A A . 26 LYS HB3 1 1 13 5833 1 1 26 LYS HD2 H 20.170 15.070 5.418 1.00 . A A . 26 LYS HD2 1 1 13 5834 1 1 26 LYS HD3 H 19.752 15.823 3.878 1.00 . A A . 26 LYS HD3 1 1 13 5835 1 1 26 LYS HE2 H 19.041 17.438 6.206 1.00 . A A . 26 LYS HE2 1 1 13 5836 1 1 26 LYS HE3 H 20.769 17.119 6.072 1.00 . A A . 26 LYS HE3 1 1 13 5837 1 1 26 LYS HG2 H 17.463 16.050 4.529 1.00 . A A . 26 LYS HG2 1 1 13 5838 1 1 26 LYS HG3 H 17.827 15.549 6.182 1.00 . A A . 26 LYS HG3 1 1 13 5839 1 1 26 LYS HZ1 H 19.008 18.602 4.252 1.00 . A A . 26 LYS HZ1 1 1 13 5840 1 1 26 LYS HZ2 H 20.359 17.813 3.610 1.00 . A A . 26 LYS HZ2 1 1 13 5841 1 1 26 LYS HZ3 H 20.558 18.994 4.805 1.00 . A A . 26 LYS HZ3 1 1 13 5842 1 1 26 LYS N N 18.142 13.177 7.060 1.00 . A A . 26 LYS N 1 1 13 5843 1 1 26 LYS NZ N 19.949 18.219 4.475 1.00 . A A . 26 LYS NZ 1 1 13 5844 1 1 26 LYS O O 17.052 11.402 4.230 1.00 . A A . 26 LYS O 1 1 13 5845 1 1 27 VAL C C 15.964 8.646 7.169 1.00 . A A . 27 VAL C 1 1 13 5846 1 1 27 VAL CA C 16.750 9.353 6.070 1.00 . A A . 27 VAL CA 1 1 13 5847 1 1 27 VAL CB C 18.099 8.635 5.876 1.00 . A A . 27 VAL CB 1 1 13 5848 1 1 27 VAL CG1 C 18.762 9.085 4.583 1.00 . A A . 27 VAL CG1 1 1 13 5849 1 1 27 VAL CG2 C 19.011 8.884 7.068 1.00 . A A . 27 VAL CG2 1 1 13 5850 1 1 27 VAL H H 16.966 11.045 7.323 1.00 . A A . 27 VAL H 1 1 13 5851 1 1 27 VAL HA H 16.195 9.288 5.146 1.00 . A A . 27 VAL HA 1 1 13 5852 1 1 27 VAL HB H 17.912 7.573 5.808 1.00 . A A . 27 VAL HB 1 1 13 5853 1 1 27 VAL HG11 H 18.932 10.151 4.619 1.00 . A A . 27 VAL HG11 1 1 13 5854 1 1 27 VAL HG12 H 19.705 8.573 4.465 1.00 . A A . 27 VAL HG12 1 1 13 5855 1 1 27 VAL HG13 H 18.118 8.852 3.748 1.00 . A A . 27 VAL HG13 1 1 13 5856 1 1 27 VAL HG21 H 19.553 7.980 7.300 1.00 . A A . 27 VAL HG21 1 1 13 5857 1 1 27 VAL HG22 H 19.711 9.671 6.828 1.00 . A A . 27 VAL HG22 1 1 13 5858 1 1 27 VAL HG23 H 18.418 9.178 7.921 1.00 . A A . 27 VAL HG23 1 1 13 5859 1 1 27 VAL N N 16.939 10.764 6.385 1.00 . A A . 27 VAL N 1 1 13 5860 1 1 27 VAL O O 15.909 9.113 8.307 1.00 . A A . 27 VAL O 1 1 13 5861 1 1 28 CYS C C 15.478 5.869 8.641 1.00 . A A . 28 CYS C 1 1 13 5862 1 1 28 CYS CA C 14.573 6.743 7.777 1.00 . A A . 28 CYS CA 1 1 13 5863 1 1 28 CYS CB C 13.552 5.871 7.045 1.00 . A A . 28 CYS CB 1 1 13 5864 1 1 28 CYS H H 15.437 7.195 5.898 1.00 . A A . 28 CYS H 1 1 13 5865 1 1 28 CYS HA H 14.049 7.438 8.416 1.00 . A A . 28 CYS HA 1 1 13 5866 1 1 28 CYS HB2 H 14.073 5.212 6.367 1.00 . A A . 28 CYS HB2 1 1 13 5867 1 1 28 CYS HB3 H 13.010 5.280 7.768 1.00 . A A . 28 CYS HB3 1 1 13 5868 1 1 28 CYS N N 15.357 7.516 6.822 1.00 . A A . 28 CYS N 1 1 13 5869 1 1 28 CYS O O 16.489 5.348 8.171 1.00 . A A . 28 CYS O 1 1 13 5870 1 1 28 CYS SG S 12.333 6.813 6.071 1.00 . A A . 28 CYS SG 1 1 13 5871 1 1 29 VAL C C 14.972 4.049 11.715 1.00 . A A . 29 VAL C 1 1 13 5872 1 1 29 VAL CA C 15.882 4.901 10.838 1.00 . A A . 29 VAL CA 1 1 13 5873 1 1 29 VAL CB C 16.772 5.777 11.739 1.00 . A A . 29 VAL CB 1 1 13 5874 1 1 29 VAL CG1 C 17.854 6.463 10.918 1.00 . A A . 29 VAL CG1 1 1 13 5875 1 1 29 VAL CG2 C 15.930 6.799 12.488 1.00 . A A . 29 VAL CG2 1 1 13 5876 1 1 29 VAL H H 14.290 6.154 10.224 1.00 . A A . 29 VAL H 1 1 13 5877 1 1 29 VAL HA H 16.522 4.250 10.259 1.00 . A A . 29 VAL HA 1 1 13 5878 1 1 29 VAL HB H 17.254 5.138 12.465 1.00 . A A . 29 VAL HB 1 1 13 5879 1 1 29 VAL HG11 H 18.586 6.900 11.581 1.00 . A A . 29 VAL HG11 1 1 13 5880 1 1 29 VAL HG12 H 18.334 5.738 10.277 1.00 . A A . 29 VAL HG12 1 1 13 5881 1 1 29 VAL HG13 H 17.408 7.239 10.314 1.00 . A A . 29 VAL HG13 1 1 13 5882 1 1 29 VAL HG21 H 16.437 7.085 13.397 1.00 . A A . 29 VAL HG21 1 1 13 5883 1 1 29 VAL HG22 H 15.786 7.671 11.866 1.00 . A A . 29 VAL HG22 1 1 13 5884 1 1 29 VAL HG23 H 14.971 6.367 12.730 1.00 . A A . 29 VAL HG23 1 1 13 5885 1 1 29 VAL N N 15.106 5.713 9.908 1.00 . A A . 29 VAL N 1 1 13 5886 1 1 29 VAL O O 13.758 4.251 11.751 1.00 . A A . 29 VAL O 1 1 13 5887 1 1 30 LYS C C 13.931 3.013 14.255 1.00 . A A . 30 LYS C 1 1 13 5888 1 1 30 LYS CA C 14.811 2.210 13.302 1.00 . A A . 30 LYS CA 1 1 13 5889 1 1 30 LYS CB C 15.762 1.316 14.100 1.00 . A A . 30 LYS CB 1 1 13 5890 1 1 30 LYS CD C 15.446 0.153 16.304 1.00 . A A . 30 LYS CD 1 1 13 5891 1 1 30 LYS CE C 14.358 -0.491 17.150 1.00 . A A . 30 LYS CE 1 1 13 5892 1 1 30 LYS CG C 15.062 0.185 14.834 1.00 . A A . 30 LYS CG 1 1 13 5893 1 1 30 LYS H H 16.538 2.981 12.352 1.00 . A A . 30 LYS H 1 1 13 5894 1 1 30 LYS HA H 14.179 1.589 12.685 1.00 . A A . 30 LYS HA 1 1 13 5895 1 1 30 LYS HB2 H 16.485 0.885 13.423 1.00 . A A . 30 LYS HB2 1 1 13 5896 1 1 30 LYS HB3 H 16.281 1.923 14.828 1.00 . A A . 30 LYS HB3 1 1 13 5897 1 1 30 LYS HD2 H 16.357 -0.414 16.418 1.00 . A A . 30 LYS HD2 1 1 13 5898 1 1 30 LYS HD3 H 15.605 1.166 16.648 1.00 . A A . 30 LYS HD3 1 1 13 5899 1 1 30 LYS HE2 H 13.531 0.198 17.235 1.00 . A A . 30 LYS HE2 1 1 13 5900 1 1 30 LYS HE3 H 14.026 -1.393 16.659 1.00 . A A . 30 LYS HE3 1 1 13 5901 1 1 30 LYS HG2 H 13.994 0.323 14.755 1.00 . A A . 30 LYS HG2 1 1 13 5902 1 1 30 LYS HG3 H 15.341 -0.754 14.379 1.00 . A A . 30 LYS HG3 1 1 13 5903 1 1 30 LYS HZ1 H 14.041 -0.966 19.159 1.00 . A A . 30 LYS HZ1 1 1 13 5904 1 1 30 LYS HZ2 H 15.446 -0.068 18.882 1.00 . A A . 30 LYS HZ2 1 1 13 5905 1 1 30 LYS HZ3 H 15.402 -1.712 18.486 1.00 . A A . 30 LYS HZ3 1 1 13 5906 1 1 30 LYS N N 15.566 3.094 12.422 1.00 . A A . 30 LYS N 1 1 13 5907 1 1 30 LYS NZ N 14.846 -0.833 18.515 1.00 . A A . 30 LYS NZ 1 1 13 5908 1 1 30 LYS O O 14.357 4.031 14.799 1.00 . A A . 30 LYS O 1 1 13 5909 1 1 31 GLY C C 11.837 2.697 16.760 1.00 . A A . 31 GLY C 1 1 13 5910 1 1 31 GLY CA C 11.783 3.233 15.343 1.00 . A A . 31 GLY CA 1 1 13 5911 1 1 31 GLY H H 12.417 1.729 13.993 1.00 . A A . 31 GLY H 1 1 13 5912 1 1 31 GLY HA2 H 12.030 4.284 15.357 1.00 . A A . 31 GLY HA2 1 1 13 5913 1 1 31 GLY HA3 H 10.778 3.114 14.964 1.00 . A A . 31 GLY HA3 1 1 13 5914 1 1 31 GLY N N 12.702 2.546 14.454 1.00 . A A . 31 GLY N 1 1 13 5915 1 1 31 GLY O O 11.803 3.463 17.722 1.00 . A A . 31 GLY O 1 1 14 5916 1 1 1 GLY C C 3.466 1.322 -0.803 1.00 . A A . 1 GLY C 1 1 14 5917 1 1 1 GLY CA C 2.030 0.992 -0.444 1.00 . A A . 1 GLY CA 1 1 14 5918 1 1 1 GLY H1 H 1.540 2.816 0.514 1.00 . A A . 1 GLY H1 1 1 14 5919 1 1 1 GLY HA2 H 2.025 0.357 0.429 1.00 . A A . 1 GLY HA2 1 1 14 5920 1 1 1 GLY HA3 H 1.580 0.458 -1.268 1.00 . A A . 1 GLY HA3 1 1 14 5921 1 1 1 GLY N N 1.241 2.178 -0.168 1.00 . A A . 1 GLY N 1 1 14 5922 1 1 1 GLY O O 3.734 2.334 -1.450 1.00 . A A . 1 GLY O 1 1 14 5923 1 1 2 TYR C C 6.265 2.042 -0.155 1.00 . A A . 2 TYR C 1 1 14 5924 1 1 2 TYR CA C 5.807 0.676 -0.656 1.00 . A A . 2 TYR CA 1 1 14 5925 1 1 2 TYR CB C 6.079 0.553 -2.156 1.00 . A A . 2 TYR CB 1 1 14 5926 1 1 2 TYR CD1 C 8.564 0.139 -1.986 1.00 . A A . 2 TYR CD1 1 1 14 5927 1 1 2 TYR CD2 C 7.808 1.860 -3.451 1.00 . A A . 2 TYR CD2 1 1 14 5928 1 1 2 TYR CE1 C 9.873 0.412 -2.332 1.00 . A A . 2 TYR CE1 1 1 14 5929 1 1 2 TYR CE2 C 9.114 2.140 -3.804 1.00 . A A . 2 TYR CE2 1 1 14 5930 1 1 2 TYR CG C 7.510 0.856 -2.539 1.00 . A A . 2 TYR CG 1 1 14 5931 1 1 2 TYR CZ C 10.143 1.413 -3.242 1.00 . A A . 2 TYR CZ 1 1 14 5932 1 1 2 TYR H H 4.115 -0.321 0.132 1.00 . A A . 2 TYR H 1 1 14 5933 1 1 2 TYR HA H 6.363 -0.090 -0.135 1.00 . A A . 2 TYR HA 1 1 14 5934 1 1 2 TYR HB2 H 5.858 -0.454 -2.474 1.00 . A A . 2 TYR HB2 1 1 14 5935 1 1 2 TYR HB3 H 5.440 1.242 -2.688 1.00 . A A . 2 TYR HB3 1 1 14 5936 1 1 2 TYR HD1 H 8.350 -0.645 -1.274 1.00 . A A . 2 TYR HD1 1 1 14 5937 1 1 2 TYR HD2 H 7.000 2.427 -3.890 1.00 . A A . 2 TYR HD2 1 1 14 5938 1 1 2 TYR HE1 H 10.680 -0.156 -1.892 1.00 . A A . 2 TYR HE1 1 1 14 5939 1 1 2 TYR HE2 H 9.326 2.924 -4.516 1.00 . A A . 2 TYR HE2 1 1 14 5940 1 1 2 TYR HH H 11.459 2.376 -4.261 1.00 . A A . 2 TYR HH 1 1 14 5941 1 1 2 TYR N N 4.391 0.468 -0.379 1.00 . A A . 2 TYR N 1 1 14 5942 1 1 2 TYR O O 6.246 3.027 -0.894 1.00 . A A . 2 TYR O 1 1 14 5943 1 1 2 TYR OH O 11.446 1.690 -3.590 1.00 . A A . 2 TYR OH 1 1 14 5944 1 1 3 CYS C C 8.665 3.395 1.738 1.00 . A A . 3 CYS C 1 1 14 5945 1 1 3 CYS CA C 7.140 3.339 1.710 1.00 . A A . 3 CYS CA 1 1 14 5946 1 1 3 CYS CB C 6.588 3.479 3.130 1.00 . A A . 3 CYS CB 1 1 14 5947 1 1 3 CYS H H 6.668 1.276 1.648 1.00 . A A . 3 CYS H 1 1 14 5948 1 1 3 CYS HA H 6.773 4.156 1.108 1.00 . A A . 3 CYS HA 1 1 14 5949 1 1 3 CYS HB2 H 7.318 3.101 3.831 1.00 . A A . 3 CYS HB2 1 1 14 5950 1 1 3 CYS HB3 H 6.406 4.523 3.336 1.00 . A A . 3 CYS HB3 1 1 14 5951 1 1 3 CYS N N 6.676 2.095 1.108 1.00 . A A . 3 CYS N 1 1 14 5952 1 1 3 CYS O O 9.338 2.533 1.175 1.00 . A A . 3 CYS O 1 1 14 5953 1 1 3 CYS SG S 5.031 2.577 3.415 1.00 . A A . 3 CYS SG 1 1 14 5954 1 1 4 ALA C C 11.202 3.823 3.700 1.00 . A A . 4 ALA C 1 1 14 5955 1 1 4 ALA CA C 10.646 4.584 2.501 1.00 . A A . 4 ALA CA 1 1 14 5956 1 1 4 ALA CB C 11.000 6.060 2.600 1.00 . A A . 4 ALA CB 1 1 14 5957 1 1 4 ALA H H 8.612 5.071 2.826 1.00 . A A . 4 ALA H 1 1 14 5958 1 1 4 ALA HA H 11.093 4.191 1.599 1.00 . A A . 4 ALA HA 1 1 14 5959 1 1 4 ALA HB1 H 10.310 6.551 3.272 1.00 . A A . 4 ALA HB1 1 1 14 5960 1 1 4 ALA HB2 H 12.006 6.165 2.977 1.00 . A A . 4 ALA HB2 1 1 14 5961 1 1 4 ALA HB3 H 10.932 6.513 1.622 1.00 . A A . 4 ALA HB3 1 1 14 5962 1 1 4 ALA N N 9.202 4.416 2.398 1.00 . A A . 4 ALA N 1 1 14 5963 1 1 4 ALA O O 10.971 4.199 4.849 1.00 . A A . 4 ALA O 1 1 14 5964 1 1 5 THR C C 13.849 2.523 4.956 1.00 . A A . 5 THR C 1 1 14 5965 1 1 5 THR CA C 12.526 1.935 4.480 1.00 . A A . 5 THR CA 1 1 14 5966 1 1 5 THR CB C 12.760 0.488 4.008 1.00 . A A . 5 THR CB 1 1 14 5967 1 1 5 THR CG2 C 11.485 -0.333 4.126 1.00 . A A . 5 THR CG2 1 1 14 5968 1 1 5 THR H H 12.087 2.502 2.488 1.00 . A A . 5 THR H 1 1 14 5969 1 1 5 THR HA H 11.834 1.914 5.309 1.00 . A A . 5 THR HA 1 1 14 5970 1 1 5 THR HB H 13.518 0.040 4.633 1.00 . A A . 5 THR HB 1 1 14 5971 1 1 5 THR HG1 H 13.485 -0.405 2.406 1.00 . A A . 5 THR HG1 1 1 14 5972 1 1 5 THR HG21 H 11.633 -1.127 4.842 1.00 . A A . 5 THR HG21 1 1 14 5973 1 1 5 THR HG22 H 11.239 -0.757 3.163 1.00 . A A . 5 THR HG22 1 1 14 5974 1 1 5 THR HG23 H 10.677 0.303 4.456 1.00 . A A . 5 THR HG23 1 1 14 5975 1 1 5 THR N N 11.938 2.750 3.424 1.00 . A A . 5 THR N 1 1 14 5976 1 1 5 THR O O 14.348 3.497 4.390 1.00 . A A . 5 THR O 1 1 14 5977 1 1 5 THR OG1 O 13.212 0.483 2.649 1.00 . A A . 5 THR OG1 1 1 14 5978 1 1 6 LYS C C 16.709 2.613 5.443 1.00 . A A . 6 LYS C 1 1 14 5979 1 1 6 LYS CA C 15.684 2.389 6.550 1.00 . A A . 6 LYS CA 1 1 14 5980 1 1 6 LYS CB C 16.223 1.376 7.563 1.00 . A A . 6 LYS CB 1 1 14 5981 1 1 6 LYS CD C 17.403 -0.805 7.966 1.00 . A A . 6 LYS CD 1 1 14 5982 1 1 6 LYS CE C 16.537 -2.056 7.987 1.00 . A A . 6 LYS CE 1 1 14 5983 1 1 6 LYS CG C 16.920 0.188 6.922 1.00 . A A . 6 LYS CG 1 1 14 5984 1 1 6 LYS H H 13.970 1.154 6.407 1.00 . A A . 6 LYS H 1 1 14 5985 1 1 6 LYS HA H 15.504 3.327 7.053 1.00 . A A . 6 LYS HA 1 1 14 5986 1 1 6 LYS HB2 H 16.928 1.874 8.212 1.00 . A A . 6 LYS HB2 1 1 14 5987 1 1 6 LYS HB3 H 15.400 1.005 8.156 1.00 . A A . 6 LYS HB3 1 1 14 5988 1 1 6 LYS HD2 H 18.419 -1.089 7.738 1.00 . A A . 6 LYS HD2 1 1 14 5989 1 1 6 LYS HD3 H 17.367 -0.337 8.939 1.00 . A A . 6 LYS HD3 1 1 14 5990 1 1 6 LYS HE2 H 15.676 -1.871 8.611 1.00 . A A . 6 LYS HE2 1 1 14 5991 1 1 6 LYS HE3 H 16.212 -2.269 6.980 1.00 . A A . 6 LYS HE3 1 1 14 5992 1 1 6 LYS HG2 H 16.228 -0.310 6.259 1.00 . A A . 6 LYS HG2 1 1 14 5993 1 1 6 LYS HG3 H 17.770 0.544 6.357 1.00 . A A . 6 LYS HG3 1 1 14 5994 1 1 6 LYS HZ1 H 18.297 -3.123 8.343 1.00 . A A . 6 LYS HZ1 1 1 14 5995 1 1 6 LYS HZ2 H 16.949 -4.102 8.049 1.00 . A A . 6 LYS HZ2 1 1 14 5996 1 1 6 LYS HZ3 H 17.119 -3.324 9.542 1.00 . A A . 6 LYS HZ3 1 1 14 5997 1 1 6 LYS N N 14.416 1.926 5.999 1.00 . A A . 6 LYS N 1 1 14 5998 1 1 6 LYS NZ N 17.277 -3.234 8.518 1.00 . A A . 6 LYS NZ 1 1 14 5999 1 1 6 LYS O O 16.829 1.806 4.523 1.00 . A A . 6 LYS O 1 1 14 6000 1 1 7 GLY C C 17.906 4.865 3.408 1.00 . A A . 7 GLY C 1 1 14 6001 1 1 7 GLY CA C 18.454 4.023 4.542 1.00 . A A . 7 GLY CA 1 1 14 6002 1 1 7 GLY H H 17.308 4.321 6.298 1.00 . A A . 7 GLY H 1 1 14 6003 1 1 7 GLY HA2 H 19.264 4.558 5.016 1.00 . A A . 7 GLY HA2 1 1 14 6004 1 1 7 GLY HA3 H 18.837 3.098 4.136 1.00 . A A . 7 GLY HA3 1 1 14 6005 1 1 7 GLY N N 17.448 3.714 5.541 1.00 . A A . 7 GLY N 1 1 14 6006 1 1 7 GLY O O 18.666 5.477 2.657 1.00 . A A . 7 GLY O 1 1 14 6007 1 1 8 ILE C C 15.651 7.095 2.692 1.00 . A A . 8 ILE C 1 1 14 6008 1 1 8 ILE CA C 15.935 5.670 2.230 1.00 . A A . 8 ILE CA 1 1 14 6009 1 1 8 ILE CB C 14.615 5.014 1.782 1.00 . A A . 8 ILE CB 1 1 14 6010 1 1 8 ILE CD1 C 15.755 3.294 0.293 1.00 . A A . 8 ILE CD1 1 1 14 6011 1 1 8 ILE CG1 C 14.836 3.533 1.471 1.00 . A A . 8 ILE CG1 1 1 14 6012 1 1 8 ILE CG2 C 14.050 5.738 0.569 1.00 . A A . 8 ILE CG2 1 1 14 6013 1 1 8 ILE H H 16.031 4.388 3.911 1.00 . A A . 8 ILE H 1 1 14 6014 1 1 8 ILE HA H 16.603 5.704 1.382 1.00 . A A . 8 ILE HA 1 1 14 6015 1 1 8 ILE HB H 13.903 5.103 2.588 1.00 . A A . 8 ILE HB 1 1 14 6016 1 1 8 ILE HD11 H 16.084 4.242 -0.106 1.00 . A A . 8 ILE HD11 1 1 14 6017 1 1 8 ILE HD12 H 16.612 2.721 0.615 1.00 . A A . 8 ILE HD12 1 1 14 6018 1 1 8 ILE HD13 H 15.224 2.747 -0.473 1.00 . A A . 8 ILE HD13 1 1 14 6019 1 1 8 ILE HG12 H 15.270 3.051 2.332 1.00 . A A . 8 ILE HG12 1 1 14 6020 1 1 8 ILE HG13 H 13.884 3.074 1.248 1.00 . A A . 8 ILE HG13 1 1 14 6021 1 1 8 ILE HG21 H 14.851 5.969 -0.118 1.00 . A A . 8 ILE HG21 1 1 14 6022 1 1 8 ILE HG22 H 13.327 5.104 0.078 1.00 . A A . 8 ILE HG22 1 1 14 6023 1 1 8 ILE HG23 H 13.572 6.653 0.886 1.00 . A A . 8 ILE HG23 1 1 14 6024 1 1 8 ILE N N 16.584 4.896 3.282 1.00 . A A . 8 ILE N 1 1 14 6025 1 1 8 ILE O O 15.101 7.312 3.772 1.00 . A A . 8 ILE O 1 1 14 6026 1 1 9 LYS C C 14.356 9.723 2.571 1.00 . A A . 9 LYS C 1 1 14 6027 1 1 9 LYS CA C 15.810 9.471 2.185 1.00 . A A . 9 LYS CA 1 1 14 6028 1 1 9 LYS CB C 16.192 10.351 0.993 1.00 . A A . 9 LYS CB 1 1 14 6029 1 1 9 LYS CD C 18.580 11.023 1.394 1.00 . A A . 9 LYS CD 1 1 14 6030 1 1 9 LYS CE C 19.631 11.710 0.536 1.00 . A A . 9 LYS CE 1 1 14 6031 1 1 9 LYS CG C 17.635 10.182 0.551 1.00 . A A . 9 LYS CG 1 1 14 6032 1 1 9 LYS H H 16.460 7.829 1.018 1.00 . A A . 9 LYS H 1 1 14 6033 1 1 9 LYS HA H 16.441 9.721 3.024 1.00 . A A . 9 LYS HA 1 1 14 6034 1 1 9 LYS HB2 H 15.551 10.107 0.160 1.00 . A A . 9 LYS HB2 1 1 14 6035 1 1 9 LYS HB3 H 16.039 11.387 1.262 1.00 . A A . 9 LYS HB3 1 1 14 6036 1 1 9 LYS HD2 H 18.009 11.776 1.916 1.00 . A A . 9 LYS HD2 1 1 14 6037 1 1 9 LYS HD3 H 19.074 10.383 2.111 1.00 . A A . 9 LYS HD3 1 1 14 6038 1 1 9 LYS HE2 H 20.356 12.178 1.185 1.00 . A A . 9 LYS HE2 1 1 14 6039 1 1 9 LYS HE3 H 20.121 10.966 -0.074 1.00 . A A . 9 LYS HE3 1 1 14 6040 1 1 9 LYS HG2 H 17.913 9.143 0.647 1.00 . A A . 9 LYS HG2 1 1 14 6041 1 1 9 LYS HG3 H 17.723 10.486 -0.483 1.00 . A A . 9 LYS HG3 1 1 14 6042 1 1 9 LYS HZ1 H 18.004 12.793 -0.201 1.00 . A A . 9 LYS HZ1 1 1 14 6043 1 1 9 LYS HZ2 H 19.216 12.513 -1.347 1.00 . A A . 9 LYS HZ2 1 1 14 6044 1 1 9 LYS HZ3 H 19.445 13.677 -0.141 1.00 . A A . 9 LYS HZ3 1 1 14 6045 1 1 9 LYS N N 16.026 8.065 1.865 1.00 . A A . 9 LYS N 1 1 14 6046 1 1 9 LYS NZ N 19.033 12.746 -0.350 1.00 . A A . 9 LYS NZ 1 1 14 6047 1 1 9 LYS O O 13.438 9.163 1.972 1.00 . A A . 9 LYS O 1 1 14 6048 1 1 10 CYS C C 12.558 12.400 3.956 1.00 . A A . 10 CYS C 1 1 14 6049 1 1 10 CYS CA C 12.812 10.898 4.041 1.00 . A A . 10 CYS CA 1 1 14 6050 1 1 10 CYS CB C 12.617 10.418 5.481 1.00 . A A . 10 CYS CB 1 1 14 6051 1 1 10 CYS H H 14.926 10.985 4.014 1.00 . A A . 10 CYS H 1 1 14 6052 1 1 10 CYS HA H 12.105 10.389 3.403 1.00 . A A . 10 CYS HA 1 1 14 6053 1 1 10 CYS HB2 H 11.561 10.291 5.670 1.00 . A A . 10 CYS HB2 1 1 14 6054 1 1 10 CYS HB3 H 13.117 9.468 5.606 1.00 . A A . 10 CYS HB3 1 1 14 6055 1 1 10 CYS N N 14.154 10.570 3.575 1.00 . A A . 10 CYS N 1 1 14 6056 1 1 10 CYS O O 11.604 12.913 4.539 1.00 . A A . 10 CYS O 1 1 14 6057 1 1 10 CYS SG S 13.272 11.559 6.740 1.00 . A A . 10 CYS SG 1 1 14 6058 1 1 11 ASN C C 11.954 14.900 2.417 1.00 . A A . 11 ASN C 1 1 14 6059 1 1 11 ASN CA C 13.289 14.543 3.062 1.00 . A A . 11 ASN CA 1 1 14 6060 1 1 11 ASN CB C 14.440 15.088 2.214 1.00 . A A . 11 ASN CB 1 1 14 6061 1 1 11 ASN CG C 14.377 16.594 2.053 1.00 . A A . 11 ASN CG 1 1 14 6062 1 1 11 ASN H H 14.160 12.634 2.783 1.00 . A A . 11 ASN H 1 1 14 6063 1 1 11 ASN HA H 13.333 14.992 4.043 1.00 . A A . 11 ASN HA 1 1 14 6064 1 1 11 ASN HB2 H 15.378 14.835 2.687 1.00 . A A . 11 ASN HB2 1 1 14 6065 1 1 11 ASN HB3 H 14.403 14.637 1.234 1.00 . A A . 11 ASN HB3 1 1 14 6066 1 1 11 ASN HD21 H 15.242 16.464 0.267 1.00 . A A . 11 ASN HD21 1 1 14 6067 1 1 11 ASN HD22 H 14.842 18.060 0.793 1.00 . A A . 11 ASN HD22 1 1 14 6068 1 1 11 ASN N N 13.419 13.099 3.224 1.00 . A A . 11 ASN N 1 1 14 6069 1 1 11 ASN ND2 N 14.870 17.089 0.923 1.00 . A A . 11 ASN ND2 1 1 14 6070 1 1 11 ASN O O 11.481 16.031 2.528 1.00 . A A . 11 ASN O 1 1 14 6071 1 1 11 ASN OD1 O 13.889 17.304 2.933 1.00 . A A . 11 ASN OD1 1 1 14 6072 1 1 12 ASP C C 9.141 12.945 1.300 1.00 . A A . 12 ASP C 1 1 14 6073 1 1 12 ASP CA C 10.068 14.137 1.080 1.00 . A A . 12 ASP CA 1 1 14 6074 1 1 12 ASP CB C 10.275 14.369 -0.417 1.00 . A A . 12 ASP CB 1 1 14 6075 1 1 12 ASP CG C 9.124 15.124 -1.051 1.00 . A A . 12 ASP CG 1 1 14 6076 1 1 12 ASP H H 11.777 13.046 1.690 1.00 . A A . 12 ASP H 1 1 14 6077 1 1 12 ASP HA H 9.612 15.015 1.511 1.00 . A A . 12 ASP HA 1 1 14 6078 1 1 12 ASP HB2 H 11.180 14.941 -0.565 1.00 . A A . 12 ASP HB2 1 1 14 6079 1 1 12 ASP HB3 H 10.373 13.414 -0.913 1.00 . A A . 12 ASP HB3 1 1 14 6080 1 1 12 ASP N N 11.350 13.927 1.743 1.00 . A A . 12 ASP N 1 1 14 6081 1 1 12 ASP O O 8.015 13.101 1.771 1.00 . A A . 12 ASP O 1 1 14 6082 1 1 12 ASP OD1 O 7.966 14.895 -0.641 1.00 . A A . 12 ASP OD1 1 1 14 6083 1 1 12 ASP OD2 O 9.380 15.946 -1.956 1.00 . A A . 12 ASP OD2 1 1 14 6084 1 1 13 ILE C C 8.769 10.117 2.576 1.00 . A A . 13 ILE C 1 1 14 6085 1 1 13 ILE CA C 8.838 10.539 1.113 1.00 . A A . 13 ILE CA 1 1 14 6086 1 1 13 ILE CB C 9.422 9.380 0.283 1.00 . A A . 13 ILE CB 1 1 14 6087 1 1 13 ILE CD1 C 8.437 7.435 -1.031 1.00 . A A . 13 ILE CD1 1 1 14 6088 1 1 13 ILE CG1 C 8.458 8.191 0.279 1.00 . A A . 13 ILE CG1 1 1 14 6089 1 1 13 ILE CG2 C 10.779 8.967 0.832 1.00 . A A . 13 ILE CG2 1 1 14 6090 1 1 13 ILE H H 10.528 11.697 0.583 1.00 . A A . 13 ILE H 1 1 14 6091 1 1 13 ILE HA H 7.837 10.740 0.759 1.00 . A A . 13 ILE HA 1 1 14 6092 1 1 13 ILE HB H 9.560 9.726 -0.730 1.00 . A A . 13 ILE HB 1 1 14 6093 1 1 13 ILE HD11 H 7.587 7.752 -1.617 1.00 . A A . 13 ILE HD11 1 1 14 6094 1 1 13 ILE HD12 H 9.347 7.635 -1.578 1.00 . A A . 13 ILE HD12 1 1 14 6095 1 1 13 ILE HD13 H 8.362 6.375 -0.834 1.00 . A A . 13 ILE HD13 1 1 14 6096 1 1 13 ILE HG12 H 8.746 7.500 1.055 1.00 . A A . 13 ILE HG12 1 1 14 6097 1 1 13 ILE HG13 H 7.457 8.548 0.473 1.00 . A A . 13 ILE HG13 1 1 14 6098 1 1 13 ILE HG21 H 10.650 8.503 1.799 1.00 . A A . 13 ILE HG21 1 1 14 6099 1 1 13 ILE HG22 H 11.241 8.264 0.156 1.00 . A A . 13 ILE HG22 1 1 14 6100 1 1 13 ILE HG23 H 11.408 9.838 0.931 1.00 . A A . 13 ILE HG23 1 1 14 6101 1 1 13 ILE N N 9.623 11.756 0.954 1.00 . A A . 13 ILE N 1 1 14 6102 1 1 13 ILE O O 9.727 10.290 3.330 1.00 . A A . 13 ILE O 1 1 14 6103 1 1 14 HIS C C 7.743 7.622 4.479 1.00 . A A . 14 HIS C 1 1 14 6104 1 1 14 HIS CA C 7.434 9.110 4.347 1.00 . A A . 14 HIS CA 1 1 14 6105 1 1 14 HIS CB C 6.001 9.388 4.799 1.00 . A A . 14 HIS CB 1 1 14 6106 1 1 14 HIS CD2 C 4.677 7.473 3.655 1.00 . A A . 14 HIS CD2 1 1 14 6107 1 1 14 HIS CE1 C 3.283 8.698 2.489 1.00 . A A . 14 HIS CE1 1 1 14 6108 1 1 14 HIS CG C 4.963 8.770 3.913 1.00 . A A . 14 HIS CG 1 1 14 6109 1 1 14 HIS H H 6.901 9.449 2.326 1.00 . A A . 14 HIS H 1 1 14 6110 1 1 14 HIS HA H 8.115 9.663 4.976 1.00 . A A . 14 HIS HA 1 1 14 6111 1 1 14 HIS HB2 H 5.862 8.995 5.795 1.00 . A A . 14 HIS HB2 1 1 14 6112 1 1 14 HIS HB3 H 5.834 10.456 4.812 1.00 . A A . 14 HIS HB3 1 1 14 6113 1 1 14 HIS HD1 H 4.025 10.491 3.138 1.00 . A A . 14 HIS HD1 1 1 14 6114 1 1 14 HIS HD2 H 5.179 6.610 4.071 1.00 . A A . 14 HIS HD2 1 1 14 6115 1 1 14 HIS HE1 H 2.490 8.998 1.820 1.00 . A A . 14 HIS HE1 1 1 14 6116 1 1 14 HIS N N 7.628 9.560 2.973 1.00 . A A . 14 HIS N 1 1 14 6117 1 1 14 HIS ND1 N 4.073 9.513 3.166 1.00 . A A . 14 HIS ND1 1 1 14 6118 1 1 14 HIS NE2 N 3.629 7.455 2.768 1.00 . A A . 14 HIS NE2 1 1 14 6119 1 1 14 HIS O O 7.644 6.867 3.511 1.00 . A A . 14 HIS O 1 1 14 6120 1 1 15 CYS C C 7.204 5.036 6.391 1.00 . A A . 15 CYS C 1 1 14 6121 1 1 15 CYS CA C 8.442 5.808 5.944 1.00 . A A . 15 CYS CA 1 1 14 6122 1 1 15 CYS CB C 9.533 5.706 7.013 1.00 . A A . 15 CYS CB 1 1 14 6123 1 1 15 CYS H H 8.178 7.854 6.417 1.00 . A A . 15 CYS H 1 1 14 6124 1 1 15 CYS HA H 8.809 5.376 5.026 1.00 . A A . 15 CYS HA 1 1 14 6125 1 1 15 CYS HB2 H 9.069 5.695 7.989 1.00 . A A . 15 CYS HB2 1 1 14 6126 1 1 15 CYS HB3 H 10.081 4.787 6.870 1.00 . A A . 15 CYS HB3 1 1 14 6127 1 1 15 CYS N N 8.118 7.205 5.684 1.00 . A A . 15 CYS N 1 1 14 6128 1 1 15 CYS O O 6.257 5.615 6.924 1.00 . A A . 15 CYS O 1 1 14 6129 1 1 15 CYS SG S 10.730 7.079 6.986 1.00 . A A . 15 CYS SG 1 1 14 6130 1 1 16 CYS C C 5.897 2.878 8.060 1.00 . A A . 16 CYS C 1 1 14 6131 1 1 16 CYS CA C 6.098 2.873 6.547 1.00 . A A . 16 CYS CA 1 1 14 6132 1 1 16 CYS CB C 6.331 1.443 6.058 1.00 . A A . 16 CYS CB 1 1 14 6133 1 1 16 CYS H H 8.003 3.322 5.740 1.00 . A A . 16 CYS H 1 1 14 6134 1 1 16 CYS HA H 5.209 3.265 6.077 1.00 . A A . 16 CYS HA 1 1 14 6135 1 1 16 CYS HB2 H 7.394 1.265 5.980 1.00 . A A . 16 CYS HB2 1 1 14 6136 1 1 16 CYS HB3 H 5.907 0.752 6.772 1.00 . A A . 16 CYS HB3 1 1 14 6137 1 1 16 CYS N N 7.219 3.726 6.169 1.00 . A A . 16 CYS N 1 1 14 6138 1 1 16 CYS O O 6.834 3.122 8.820 1.00 . A A . 16 CYS O 1 1 14 6139 1 1 16 CYS SG S 5.591 1.084 4.432 1.00 . A A . 16 CYS SG 1 1 14 6140 1 1 17 SER C C 5.323 1.703 10.678 1.00 . A A . 17 SER C 1 1 14 6141 1 1 17 SER CA C 4.343 2.584 9.910 1.00 . A A . 17 SER CA 1 1 14 6142 1 1 17 SER CB C 2.914 2.080 10.120 1.00 . A A . 17 SER CB 1 1 14 6143 1 1 17 SER H H 3.964 2.422 7.834 1.00 . A A . 17 SER H 1 1 14 6144 1 1 17 SER HA H 4.417 3.595 10.284 1.00 . A A . 17 SER HA 1 1 14 6145 1 1 17 SER HB2 H 2.633 2.220 11.152 1.00 . A A . 17 SER HB2 1 1 14 6146 1 1 17 SER HB3 H 2.241 2.638 9.484 1.00 . A A . 17 SER HB3 1 1 14 6147 1 1 17 SER HG H 3.119 0.177 10.540 1.00 . A A . 17 SER HG 1 1 14 6148 1 1 17 SER N N 4.668 2.608 8.489 1.00 . A A . 17 SER N 1 1 14 6149 1 1 17 SER O O 5.321 0.481 10.533 1.00 . A A . 17 SER O 1 1 14 6150 1 1 17 SER OG O 2.807 0.703 9.800 1.00 . A A . 17 SER OG 1 1 14 6151 1 1 18 GLY C C 8.525 2.193 12.189 1.00 . A A . 18 GLY C 1 1 14 6152 1 1 18 GLY CA C 7.136 1.591 12.274 1.00 . A A . 18 GLY CA 1 1 14 6153 1 1 18 GLY H H 6.118 3.309 11.570 1.00 . A A . 18 GLY H 1 1 14 6154 1 1 18 GLY HA2 H 6.822 1.581 13.307 1.00 . A A . 18 GLY HA2 1 1 14 6155 1 1 18 GLY HA3 H 7.174 0.576 11.909 1.00 . A A . 18 GLY HA3 1 1 14 6156 1 1 18 GLY N N 6.161 2.333 11.495 1.00 . A A . 18 GLY N 1 1 14 6157 1 1 18 GLY O O 9.393 1.890 13.009 1.00 . A A . 18 GLY O 1 1 14 6158 1 1 19 LEU C C 9.937 5.192 11.262 1.00 . A A . 19 LEU C 1 1 14 6159 1 1 19 LEU CA C 10.032 3.692 11.003 1.00 . A A . 19 LEU CA 1 1 14 6160 1 1 19 LEU CB C 10.546 3.440 9.585 1.00 . A A . 19 LEU CB 1 1 14 6161 1 1 19 LEU CD1 C 11.156 1.838 7.756 1.00 . A A . 19 LEU CD1 1 1 14 6162 1 1 19 LEU CD2 C 12.112 1.538 10.047 1.00 . A A . 19 LEU CD2 1 1 14 6163 1 1 19 LEU CG C 10.900 1.991 9.247 1.00 . A A . 19 LEU CG 1 1 14 6164 1 1 19 LEU H H 8.008 3.250 10.573 1.00 . A A . 19 LEU H 1 1 14 6165 1 1 19 LEU HA H 10.725 3.260 11.710 1.00 . A A . 19 LEU HA 1 1 14 6166 1 1 19 LEU HB2 H 9.782 3.763 8.894 1.00 . A A . 19 LEU HB2 1 1 14 6167 1 1 19 LEU HB3 H 11.434 4.040 9.444 1.00 . A A . 19 LEU HB3 1 1 14 6168 1 1 19 LEU HD11 H 12.001 2.447 7.471 1.00 . A A . 19 LEU HD11 1 1 14 6169 1 1 19 LEU HD12 H 10.282 2.155 7.206 1.00 . A A . 19 LEU HD12 1 1 14 6170 1 1 19 LEU HD13 H 11.366 0.802 7.531 1.00 . A A . 19 LEU HD13 1 1 14 6171 1 1 19 LEU HD21 H 12.139 0.458 10.078 1.00 . A A . 19 LEU HD21 1 1 14 6172 1 1 19 LEU HD22 H 12.044 1.925 11.054 1.00 . A A . 19 LEU HD22 1 1 14 6173 1 1 19 LEU HD23 H 13.012 1.907 9.579 1.00 . A A . 19 LEU HD23 1 1 14 6174 1 1 19 LEU HG H 10.067 1.353 9.509 1.00 . A A . 19 LEU HG 1 1 14 6175 1 1 19 LEU N N 8.738 3.047 11.194 1.00 . A A . 19 LEU N 1 1 14 6176 1 1 19 LEU O O 8.869 5.790 11.127 1.00 . A A . 19 LEU O 1 1 14 6177 1 1 20 LYS C C 11.825 7.974 10.789 1.00 . A A . 20 LYS C 1 1 14 6178 1 1 20 LYS CA C 11.106 7.228 11.908 1.00 . A A . 20 LYS CA 1 1 14 6179 1 1 20 LYS CB C 11.807 7.490 13.243 1.00 . A A . 20 LYS CB 1 1 14 6180 1 1 20 LYS CD C 9.814 8.004 14.683 1.00 . A A . 20 LYS CD 1 1 14 6181 1 1 20 LYS CE C 8.488 7.311 14.411 1.00 . A A . 20 LYS CE 1 1 14 6182 1 1 20 LYS CG C 10.990 7.069 14.452 1.00 . A A . 20 LYS CG 1 1 14 6183 1 1 20 LYS H H 11.880 5.266 11.724 1.00 . A A . 20 LYS H 1 1 14 6184 1 1 20 LYS HA H 10.089 7.586 11.968 1.00 . A A . 20 LYS HA 1 1 14 6185 1 1 20 LYS HB2 H 12.740 6.946 13.258 1.00 . A A . 20 LYS HB2 1 1 14 6186 1 1 20 LYS HB3 H 12.015 8.547 13.325 1.00 . A A . 20 LYS HB3 1 1 14 6187 1 1 20 LYS HD2 H 9.828 8.339 15.710 1.00 . A A . 20 LYS HD2 1 1 14 6188 1 1 20 LYS HD3 H 9.908 8.855 14.023 1.00 . A A . 20 LYS HD3 1 1 14 6189 1 1 20 LYS HE2 H 7.782 8.042 14.050 1.00 . A A . 20 LYS HE2 1 1 14 6190 1 1 20 LYS HE3 H 8.641 6.554 13.655 1.00 . A A . 20 LYS HE3 1 1 14 6191 1 1 20 LYS HG2 H 10.614 6.070 14.291 1.00 . A A . 20 LYS HG2 1 1 14 6192 1 1 20 LYS HG3 H 11.625 7.081 15.326 1.00 . A A . 20 LYS HG3 1 1 14 6193 1 1 20 LYS HZ1 H 8.139 5.648 15.626 1.00 . A A . 20 LYS HZ1 1 1 14 6194 1 1 20 LYS HZ2 H 6.907 6.805 15.678 1.00 . A A . 20 LYS HZ2 1 1 14 6195 1 1 20 LYS HZ3 H 8.367 7.088 16.484 1.00 . A A . 20 LYS HZ3 1 1 14 6196 1 1 20 LYS N N 11.060 5.796 11.633 1.00 . A A . 20 LYS N 1 1 14 6197 1 1 20 LYS NZ N 7.937 6.668 15.636 1.00 . A A . 20 LYS NZ 1 1 14 6198 1 1 20 LYS O O 12.735 7.437 10.156 1.00 . A A . 20 LYS O 1 1 14 6199 1 1 21 CYS C C 13.108 10.932 10.087 1.00 . A A . 21 CYS C 1 1 14 6200 1 1 21 CYS CA C 12.017 10.035 9.508 1.00 . A A . 21 CYS CA 1 1 14 6201 1 1 21 CYS CB C 10.951 10.889 8.819 1.00 . A A . 21 CYS CB 1 1 14 6202 1 1 21 CYS H H 10.682 9.587 11.088 1.00 . A A . 21 CYS H 1 1 14 6203 1 1 21 CYS HA H 12.462 9.373 8.781 1.00 . A A . 21 CYS HA 1 1 14 6204 1 1 21 CYS HB2 H 10.316 10.248 8.226 1.00 . A A . 21 CYS HB2 1 1 14 6205 1 1 21 CYS HB3 H 10.354 11.382 9.572 1.00 . A A . 21 CYS HB3 1 1 14 6206 1 1 21 CYS N N 11.412 9.214 10.550 1.00 . A A . 21 CYS N 1 1 14 6207 1 1 21 CYS O O 12.832 12.035 10.561 1.00 . A A . 21 CYS O 1 1 14 6208 1 1 21 CYS SG S 11.625 12.173 7.716 1.00 . A A . 21 CYS SG 1 1 14 6209 1 1 22 ASP C C 15.604 12.553 9.853 1.00 . A A . 22 ASP C 1 1 14 6210 1 1 22 ASP CA C 15.478 11.210 10.564 1.00 . A A . 22 ASP CA 1 1 14 6211 1 1 22 ASP CB C 16.771 10.410 10.403 1.00 . A A . 22 ASP CB 1 1 14 6212 1 1 22 ASP CG C 17.794 10.740 11.473 1.00 . A A . 22 ASP CG 1 1 14 6213 1 1 22 ASP H H 14.501 9.566 9.655 1.00 . A A . 22 ASP H 1 1 14 6214 1 1 22 ASP HA H 15.304 11.388 11.615 1.00 . A A . 22 ASP HA 1 1 14 6215 1 1 22 ASP HB2 H 16.544 9.355 10.462 1.00 . A A . 22 ASP HB2 1 1 14 6216 1 1 22 ASP HB3 H 17.204 10.627 9.438 1.00 . A A . 22 ASP HB3 1 1 14 6217 1 1 22 ASP N N 14.345 10.452 10.045 1.00 . A A . 22 ASP N 1 1 14 6218 1 1 22 ASP O O 16.099 12.627 8.728 1.00 . A A . 22 ASP O 1 1 14 6219 1 1 22 ASP OD1 O 18.834 11.343 11.134 1.00 . A A . 22 ASP OD1 1 1 14 6220 1 1 22 ASP OD2 O 17.553 10.396 12.649 1.00 . A A . 22 ASP OD2 1 1 14 6221 1 1 23 SER C C 16.637 15.491 9.964 1.00 . A A . 23 SER C 1 1 14 6222 1 1 23 SER CA C 15.210 14.953 9.944 1.00 . A A . 23 SER CA 1 1 14 6223 1 1 23 SER CB C 14.286 15.899 10.714 1.00 . A A . 23 SER CB 1 1 14 6224 1 1 23 SER H H 14.768 13.490 11.409 1.00 . A A . 23 SER H 1 1 14 6225 1 1 23 SER HA H 14.875 14.892 8.919 1.00 . A A . 23 SER HA 1 1 14 6226 1 1 23 SER HB2 H 13.265 15.566 10.607 1.00 . A A . 23 SER HB2 1 1 14 6227 1 1 23 SER HB3 H 14.559 15.893 11.759 1.00 . A A . 23 SER HB3 1 1 14 6228 1 1 23 SER HG H 14.183 17.844 10.926 1.00 . A A . 23 SER HG 1 1 14 6229 1 1 23 SER N N 15.152 13.613 10.515 1.00 . A A . 23 SER N 1 1 14 6230 1 1 23 SER O O 16.945 16.494 9.320 1.00 . A A . 23 SER O 1 1 14 6231 1 1 23 SER OG O 14.388 17.224 10.222 1.00 . A A . 23 SER OG 1 1 14 6232 1 1 24 LYS C C 19.725 14.649 9.666 1.00 . A A . 24 LYS C 1 1 14 6233 1 1 24 LYS CA C 18.903 15.224 10.814 1.00 . A A . 24 LYS CA 1 1 14 6234 1 1 24 LYS CB C 19.488 14.770 12.153 1.00 . A A . 24 LYS CB 1 1 14 6235 1 1 24 LYS CD C 19.472 15.009 14.654 1.00 . A A . 24 LYS CD 1 1 14 6236 1 1 24 LYS CE C 20.946 15.252 14.940 1.00 . A A . 24 LYS CE 1 1 14 6237 1 1 24 LYS CG C 19.052 15.626 13.330 1.00 . A A . 24 LYS CG 1 1 14 6238 1 1 24 LYS H H 17.201 14.025 11.200 1.00 . A A . 24 LYS H 1 1 14 6239 1 1 24 LYS HA H 18.939 16.302 10.763 1.00 . A A . 24 LYS HA 1 1 14 6240 1 1 24 LYS HB2 H 19.179 13.752 12.341 1.00 . A A . 24 LYS HB2 1 1 14 6241 1 1 24 LYS HB3 H 20.567 14.803 12.091 1.00 . A A . 24 LYS HB3 1 1 14 6242 1 1 24 LYS HD2 H 18.885 15.447 15.447 1.00 . A A . 24 LYS HD2 1 1 14 6243 1 1 24 LYS HD3 H 19.292 13.943 14.617 1.00 . A A . 24 LYS HD3 1 1 14 6244 1 1 24 LYS HE2 H 21.251 14.613 15.754 1.00 . A A . 24 LYS HE2 1 1 14 6245 1 1 24 LYS HE3 H 21.516 15.007 14.056 1.00 . A A . 24 LYS HE3 1 1 14 6246 1 1 24 LYS HG2 H 19.505 16.602 13.241 1.00 . A A . 24 LYS HG2 1 1 14 6247 1 1 24 LYS HG3 H 17.976 15.723 13.313 1.00 . A A . 24 LYS HG3 1 1 14 6248 1 1 24 LYS HZ1 H 22.062 17.013 14.820 1.00 . A A . 24 LYS HZ1 1 1 14 6249 1 1 24 LYS HZ2 H 21.362 16.749 16.336 1.00 . A A . 24 LYS HZ2 1 1 14 6250 1 1 24 LYS HZ3 H 20.404 17.267 15.042 1.00 . A A . 24 LYS HZ3 1 1 14 6251 1 1 24 LYS N N 17.507 14.817 10.709 1.00 . A A . 24 LYS N 1 1 14 6252 1 1 24 LYS NZ N 21.212 16.670 15.310 1.00 . A A . 24 LYS NZ 1 1 14 6253 1 1 24 LYS O O 20.554 15.342 9.076 1.00 . A A . 24 LYS O 1 1 14 6254 1 1 25 ARG C C 19.351 12.636 7.015 1.00 . A A . 25 ARG C 1 1 14 6255 1 1 25 ARG CA C 20.208 12.711 8.275 1.00 . A A . 25 ARG CA 1 1 14 6256 1 1 25 ARG CB C 20.625 11.303 8.707 1.00 . A A . 25 ARG CB 1 1 14 6257 1 1 25 ARG CD C 22.914 10.693 9.544 1.00 . A A . 25 ARG CD 1 1 14 6258 1 1 25 ARG CG C 21.561 11.285 9.904 1.00 . A A . 25 ARG CG 1 1 14 6259 1 1 25 ARG CZ C 25.011 10.097 10.681 1.00 . A A . 25 ARG CZ 1 1 14 6260 1 1 25 ARG H H 18.816 12.878 9.861 1.00 . A A . 25 ARG H 1 1 14 6261 1 1 25 ARG HA H 21.095 13.289 8.060 1.00 . A A . 25 ARG HA 1 1 14 6262 1 1 25 ARG HB2 H 19.739 10.741 8.962 1.00 . A A . 25 ARG HB2 1 1 14 6263 1 1 25 ARG HB3 H 21.123 10.820 7.880 1.00 . A A . 25 ARG HB3 1 1 14 6264 1 1 25 ARG HD2 H 22.757 9.773 9.001 1.00 . A A . 25 ARG HD2 1 1 14 6265 1 1 25 ARG HD3 H 23.443 11.395 8.916 1.00 . A A . 25 ARG HD3 1 1 14 6266 1 1 25 ARG HE H 23.280 10.463 11.601 1.00 . A A . 25 ARG HE 1 1 14 6267 1 1 25 ARG HG2 H 21.704 12.297 10.253 1.00 . A A . 25 ARG HG2 1 1 14 6268 1 1 25 ARG HG3 H 21.115 10.692 10.688 1.00 . A A . 25 ARG HG3 1 1 14 6269 1 1 25 ARG HH11 H 25.136 10.204 8.667 1.00 . A A . 25 ARG HH11 1 1 14 6270 1 1 25 ARG HH12 H 26.607 9.784 9.481 1.00 . A A . 25 ARG HH12 1 1 14 6271 1 1 25 ARG HH21 H 25.210 9.912 12.684 1.00 . A A . 25 ARG HH21 1 1 14 6272 1 1 25 ARG HH22 H 26.648 9.618 11.765 1.00 . A A . 25 ARG HH22 1 1 14 6273 1 1 25 ARG N N 19.489 13.379 9.354 1.00 . A A . 25 ARG N 1 1 14 6274 1 1 25 ARG NE N 23.722 10.413 10.728 1.00 . A A . 25 ARG NE 1 1 14 6275 1 1 25 ARG NH1 N 25.636 10.022 9.514 1.00 . A A . 25 ARG NH1 1 1 14 6276 1 1 25 ARG NH2 N 25.678 9.856 11.802 1.00 . A A . 25 ARG NH2 1 1 14 6277 1 1 25 ARG O O 19.765 12.070 6.003 1.00 . A A . 25 ARG O 1 1 14 6278 1 1 26 LYS C C 17.039 11.796 5.412 1.00 . A A . 26 LYS C 1 1 14 6279 1 1 26 LYS CA C 17.239 13.209 5.950 1.00 . A A . 26 LYS CA 1 1 14 6280 1 1 26 LYS CB C 17.769 14.119 4.840 1.00 . A A . 26 LYS CB 1 1 14 6281 1 1 26 LYS CD C 16.655 16.363 5.021 1.00 . A A . 26 LYS CD 1 1 14 6282 1 1 26 LYS CE C 16.612 17.621 5.874 1.00 . A A . 26 LYS CE 1 1 14 6283 1 1 26 LYS CG C 17.927 15.568 5.265 1.00 . A A . 26 LYS CG 1 1 14 6284 1 1 26 LYS H H 17.881 13.645 7.920 1.00 . A A . 26 LYS H 1 1 14 6285 1 1 26 LYS HA H 16.288 13.589 6.292 1.00 . A A . 26 LYS HA 1 1 14 6286 1 1 26 LYS HB2 H 18.733 13.752 4.520 1.00 . A A . 26 LYS HB2 1 1 14 6287 1 1 26 LYS HB3 H 17.085 14.083 4.004 1.00 . A A . 26 LYS HB3 1 1 14 6288 1 1 26 LYS HD2 H 16.611 16.646 3.980 1.00 . A A . 26 LYS HD2 1 1 14 6289 1 1 26 LYS HD3 H 15.803 15.744 5.264 1.00 . A A . 26 LYS HD3 1 1 14 6290 1 1 26 LYS HE2 H 16.099 17.398 6.797 1.00 . A A . 26 LYS HE2 1 1 14 6291 1 1 26 LYS HE3 H 17.625 17.928 6.091 1.00 . A A . 26 LYS HE3 1 1 14 6292 1 1 26 LYS HG2 H 18.164 15.602 6.318 1.00 . A A . 26 LYS HG2 1 1 14 6293 1 1 26 LYS HG3 H 18.733 16.014 4.699 1.00 . A A . 26 LYS HG3 1 1 14 6294 1 1 26 LYS HZ1 H 16.188 18.772 4.183 1.00 . A A . 26 LYS HZ1 1 1 14 6295 1 1 26 LYS HZ2 H 16.144 19.643 5.633 1.00 . A A . 26 LYS HZ2 1 1 14 6296 1 1 26 LYS HZ3 H 14.877 18.594 5.237 1.00 . A A . 26 LYS HZ3 1 1 14 6297 1 1 26 LYS N N 18.155 13.209 7.085 1.00 . A A . 26 LYS N 1 1 14 6298 1 1 26 LYS NZ N 15.906 18.736 5.184 1.00 . A A . 26 LYS NZ 1 1 14 6299 1 1 26 LYS O O 17.053 11.574 4.201 1.00 . A A . 26 LYS O 1 1 14 6300 1 1 27 VAL C C 15.781 8.722 6.957 1.00 . A A . 27 VAL C 1 1 14 6301 1 1 27 VAL CA C 16.648 9.451 5.936 1.00 . A A . 27 VAL CA 1 1 14 6302 1 1 27 VAL CB C 17.988 8.706 5.791 1.00 . A A . 27 VAL CB 1 1 14 6303 1 1 27 VAL CG1 C 18.722 9.166 4.541 1.00 . A A . 27 VAL CG1 1 1 14 6304 1 1 27 VAL CG2 C 18.847 8.909 7.029 1.00 . A A . 27 VAL CG2 1 1 14 6305 1 1 27 VAL H H 16.852 11.081 7.270 1.00 . A A . 27 VAL H 1 1 14 6306 1 1 27 VAL HA H 16.147 9.439 4.979 1.00 . A A . 27 VAL HA 1 1 14 6307 1 1 27 VAL HB H 17.780 7.650 5.692 1.00 . A A . 27 VAL HB 1 1 14 6308 1 1 27 VAL HG11 H 19.681 8.673 4.485 1.00 . A A . 27 VAL HG11 1 1 14 6309 1 1 27 VAL HG12 H 18.137 8.916 3.667 1.00 . A A . 27 VAL HG12 1 1 14 6310 1 1 27 VAL HG13 H 18.869 10.235 4.583 1.00 . A A . 27 VAL HG13 1 1 14 6311 1 1 27 VAL HG21 H 19.529 9.730 6.862 1.00 . A A . 27 VAL HG21 1 1 14 6312 1 1 27 VAL HG22 H 18.214 9.135 7.875 1.00 . A A . 27 VAL HG22 1 1 14 6313 1 1 27 VAL HG23 H 19.408 8.009 7.231 1.00 . A A . 27 VAL HG23 1 1 14 6314 1 1 27 VAL N N 16.853 10.843 6.320 1.00 . A A . 27 VAL N 1 1 14 6315 1 1 27 VAL O O 15.589 9.196 8.077 1.00 . A A . 27 VAL O 1 1 14 6316 1 1 28 CYS C C 15.256 5.885 8.356 1.00 . A A . 28 CYS C 1 1 14 6317 1 1 28 CYS CA C 14.412 6.768 7.442 1.00 . A A . 28 CYS CA 1 1 14 6318 1 1 28 CYS CB C 13.457 5.902 6.617 1.00 . A A . 28 CYS CB 1 1 14 6319 1 1 28 CYS H H 15.448 7.239 5.657 1.00 . A A . 28 CYS H 1 1 14 6320 1 1 28 CYS HA H 13.834 7.447 8.050 1.00 . A A . 28 CYS HA 1 1 14 6321 1 1 28 CYS HB2 H 14.030 5.323 5.908 1.00 . A A . 28 CYS HB2 1 1 14 6322 1 1 28 CYS HB3 H 12.930 5.232 7.279 1.00 . A A . 28 CYS HB3 1 1 14 6323 1 1 28 CYS N N 15.259 7.565 6.562 1.00 . A A . 28 CYS N 1 1 14 6324 1 1 28 CYS O O 16.296 5.366 7.949 1.00 . A A . 28 CYS O 1 1 14 6325 1 1 28 CYS SG S 12.215 6.850 5.681 1.00 . A A . 28 CYS SG 1 1 14 6326 1 1 29 VAL C C 14.540 4.101 11.429 1.00 . A A . 29 VAL C 1 1 14 6327 1 1 29 VAL CA C 15.513 4.898 10.566 1.00 . A A . 29 VAL CA 1 1 14 6328 1 1 29 VAL CB C 16.406 5.758 11.480 1.00 . A A . 29 VAL CB 1 1 14 6329 1 1 29 VAL CG1 C 17.618 6.268 10.715 1.00 . A A . 29 VAL CG1 1 1 14 6330 1 1 29 VAL CG2 C 15.611 6.913 12.068 1.00 . A A . 29 VAL CG2 1 1 14 6331 1 1 29 VAL H H 13.967 6.159 9.859 1.00 . A A . 29 VAL H 1 1 14 6332 1 1 29 VAL HA H 16.145 4.210 10.024 1.00 . A A . 29 VAL HA 1 1 14 6333 1 1 29 VAL HB H 16.757 5.139 12.293 1.00 . A A . 29 VAL HB 1 1 14 6334 1 1 29 VAL HG11 H 17.351 7.167 10.178 1.00 . A A . 29 VAL HG11 1 1 14 6335 1 1 29 VAL HG12 H 18.417 6.485 11.408 1.00 . A A . 29 VAL HG12 1 1 14 6336 1 1 29 VAL HG13 H 17.944 5.515 10.013 1.00 . A A . 29 VAL HG13 1 1 14 6337 1 1 29 VAL HG21 H 15.199 7.510 11.268 1.00 . A A . 29 VAL HG21 1 1 14 6338 1 1 29 VAL HG22 H 14.808 6.525 12.677 1.00 . A A . 29 VAL HG22 1 1 14 6339 1 1 29 VAL HG23 H 16.260 7.525 12.677 1.00 . A A . 29 VAL HG23 1 1 14 6340 1 1 29 VAL N N 14.801 5.719 9.594 1.00 . A A . 29 VAL N 1 1 14 6341 1 1 29 VAL O O 13.324 4.252 11.315 1.00 . A A . 29 VAL O 1 1 14 6342 1 1 30 LYS C C 13.736 3.254 14.348 1.00 . A A . 30 LYS C 1 1 14 6343 1 1 30 LYS CA C 14.267 2.431 13.179 1.00 . A A . 30 LYS CA 1 1 14 6344 1 1 30 LYS CB C 15.079 1.245 13.703 1.00 . A A . 30 LYS CB 1 1 14 6345 1 1 30 LYS CD C 15.025 -1.259 13.899 1.00 . A A . 30 LYS CD 1 1 14 6346 1 1 30 LYS CE C 14.277 -2.442 14.494 1.00 . A A . 30 LYS CE 1 1 14 6347 1 1 30 LYS CG C 14.233 0.030 14.041 1.00 . A A . 30 LYS CG 1 1 14 6348 1 1 30 LYS H H 16.061 3.176 12.339 1.00 . A A . 30 LYS H 1 1 14 6349 1 1 30 LYS HA H 13.430 2.059 12.607 1.00 . A A . 30 LYS HA 1 1 14 6350 1 1 30 LYS HB2 H 15.800 0.958 12.952 1.00 . A A . 30 LYS HB2 1 1 14 6351 1 1 30 LYS HB3 H 15.605 1.551 14.596 1.00 . A A . 30 LYS HB3 1 1 14 6352 1 1 30 LYS HD2 H 15.201 -1.450 12.851 1.00 . A A . 30 LYS HD2 1 1 14 6353 1 1 30 LYS HD3 H 15.971 -1.148 14.411 1.00 . A A . 30 LYS HD3 1 1 14 6354 1 1 30 LYS HE2 H 14.521 -2.515 15.543 1.00 . A A . 30 LYS HE2 1 1 14 6355 1 1 30 LYS HE3 H 13.216 -2.272 14.383 1.00 . A A . 30 LYS HE3 1 1 14 6356 1 1 30 LYS HG2 H 13.886 0.116 15.060 1.00 . A A . 30 LYS HG2 1 1 14 6357 1 1 30 LYS HG3 H 13.384 -0.004 13.372 1.00 . A A . 30 LYS HG3 1 1 14 6358 1 1 30 LYS HZ1 H 15.212 -3.530 12.977 1.00 . A A . 30 LYS HZ1 1 1 14 6359 1 1 30 LYS HZ2 H 13.775 -4.228 13.533 1.00 . A A . 30 LYS HZ2 1 1 14 6360 1 1 30 LYS HZ3 H 15.181 -4.325 14.470 1.00 . A A . 30 LYS HZ3 1 1 14 6361 1 1 30 LYS N N 15.085 3.252 12.294 1.00 . A A . 30 LYS N 1 1 14 6362 1 1 30 LYS NZ N 14.636 -3.721 13.822 1.00 . A A . 30 LYS NZ 1 1 14 6363 1 1 30 LYS O O 14.480 3.999 14.984 1.00 . A A . 30 LYS O 1 1 14 6364 1 1 31 GLY C C 11.902 3.096 17.033 1.00 . A A . 31 GLY C 1 1 14 6365 1 1 31 GLY CA C 11.836 3.849 15.720 1.00 . A A . 31 GLY CA 1 1 14 6366 1 1 31 GLY H H 11.898 2.505 14.085 1.00 . A A . 31 GLY H 1 1 14 6367 1 1 31 GLY HA2 H 12.347 4.793 15.832 1.00 . A A . 31 GLY HA2 1 1 14 6368 1 1 31 GLY HA3 H 10.800 4.038 15.479 1.00 . A A . 31 GLY HA3 1 1 14 6369 1 1 31 GLY N N 12.443 3.113 14.626 1.00 . A A . 31 GLY N 1 1 14 6370 1 1 31 GLY O O 11.996 1.868 17.049 1.00 . A A . 31 GLY O 1 1 15 6371 1 1 1 GLY C C 3.464 -0.058 -1.080 1.00 . A A . 1 GLY C 1 1 15 6372 1 1 1 GLY CA C 2.022 0.143 -1.501 1.00 . A A . 1 GLY CA 1 1 15 6373 1 1 1 GLY H1 H 1.757 -1.292 -3.035 1.00 . A A . 1 GLY H1 1 1 15 6374 1 1 1 GLY HA2 H 1.785 1.195 -1.449 1.00 . A A . 1 GLY HA2 1 1 15 6375 1 1 1 GLY HA3 H 1.381 -0.394 -0.816 1.00 . A A . 1 GLY HA3 1 1 15 6376 1 1 1 GLY N N 1.766 -0.330 -2.849 1.00 . A A . 1 GLY N 1 1 15 6377 1 1 1 GLY O O 3.913 -1.190 -0.897 1.00 . A A . 1 GLY O 1 1 15 6378 1 1 2 TYR C C 6.070 2.333 -0.005 1.00 . A A . 2 TYR C 1 1 15 6379 1 1 2 TYR CA C 5.594 0.982 -0.530 1.00 . A A . 2 TYR CA 1 1 15 6380 1 1 2 TYR CB C 6.463 0.547 -1.712 1.00 . A A . 2 TYR CB 1 1 15 6381 1 1 2 TYR CD1 C 7.741 -1.322 -0.595 1.00 . A A . 2 TYR CD1 1 1 15 6382 1 1 2 TYR CD2 C 8.984 0.438 -1.615 1.00 . A A . 2 TYR CD2 1 1 15 6383 1 1 2 TYR CE1 C 8.918 -1.940 -0.216 1.00 . A A . 2 TYR CE1 1 1 15 6384 1 1 2 TYR CE2 C 10.165 -0.173 -1.241 1.00 . A A . 2 TYR CE2 1 1 15 6385 1 1 2 TYR CG C 7.753 -0.125 -1.300 1.00 . A A . 2 TYR CG 1 1 15 6386 1 1 2 TYR CZ C 10.127 -1.362 -0.542 1.00 . A A . 2 TYR CZ 1 1 15 6387 1 1 2 TYR H H 3.779 1.916 -1.088 1.00 . A A . 2 TYR H 1 1 15 6388 1 1 2 TYR HA H 5.684 0.249 0.258 1.00 . A A . 2 TYR HA 1 1 15 6389 1 1 2 TYR HB2 H 5.907 -0.149 -2.322 1.00 . A A . 2 TYR HB2 1 1 15 6390 1 1 2 TYR HB3 H 6.715 1.415 -2.303 1.00 . A A . 2 TYR HB3 1 1 15 6391 1 1 2 TYR HD1 H 6.792 -1.773 -0.341 1.00 . A A . 2 TYR HD1 1 1 15 6392 1 1 2 TYR HD2 H 9.010 1.369 -2.162 1.00 . A A . 2 TYR HD2 1 1 15 6393 1 1 2 TYR HE1 H 8.888 -2.870 0.332 1.00 . A A . 2 TYR HE1 1 1 15 6394 1 1 2 TYR HE2 H 11.112 0.279 -1.496 1.00 . A A . 2 TYR HE2 1 1 15 6395 1 1 2 TYR HH H 11.944 -1.893 -0.875 1.00 . A A . 2 TYR HH 1 1 15 6396 1 1 2 TYR N N 4.193 1.042 -0.928 1.00 . A A . 2 TYR N 1 1 15 6397 1 1 2 TYR O O 6.054 3.333 -0.723 1.00 . A A . 2 TYR O 1 1 15 6398 1 1 2 TYR OH O 11.301 -1.973 -0.166 1.00 . A A . 2 TYR OH 1 1 15 6399 1 1 3 CYS C C 8.501 3.621 1.893 1.00 . A A . 3 CYS C 1 1 15 6400 1 1 3 CYS CA C 6.975 3.580 1.879 1.00 . A A . 3 CYS CA 1 1 15 6401 1 1 3 CYS CB C 6.438 3.695 3.307 1.00 . A A . 3 CYS CB 1 1 15 6402 1 1 3 CYS H H 6.483 1.524 1.777 1.00 . A A . 3 CYS H 1 1 15 6403 1 1 3 CYS HA H 6.610 4.414 1.299 1.00 . A A . 3 CYS HA 1 1 15 6404 1 1 3 CYS HB2 H 7.171 3.294 3.992 1.00 . A A . 3 CYS HB2 1 1 15 6405 1 1 3 CYS HB3 H 6.269 4.736 3.538 1.00 . A A . 3 CYS HB3 1 1 15 6406 1 1 3 CYS N N 6.494 2.354 1.254 1.00 . A A . 3 CYS N 1 1 15 6407 1 1 3 CYS O O 9.160 2.766 1.302 1.00 . A A . 3 CYS O 1 1 15 6408 1 1 3 CYS SG S 4.875 2.803 3.587 1.00 . A A . 3 CYS SG 1 1 15 6409 1 1 4 ALA C C 11.063 3.970 3.833 1.00 . A A . 4 ALA C 1 1 15 6410 1 1 4 ALA CA C 10.501 4.772 2.664 1.00 . A A . 4 ALA CA 1 1 15 6411 1 1 4 ALA CB C 10.870 6.242 2.804 1.00 . A A . 4 ALA CB 1 1 15 6412 1 1 4 ALA H H 8.476 5.271 3.021 1.00 . A A . 4 ALA H 1 1 15 6413 1 1 4 ALA HA H 10.935 4.404 1.746 1.00 . A A . 4 ALA HA 1 1 15 6414 1 1 4 ALA HB1 H 10.141 6.737 3.429 1.00 . A A . 4 ALA HB1 1 1 15 6415 1 1 4 ALA HB2 H 11.847 6.326 3.255 1.00 . A A . 4 ALA HB2 1 1 15 6416 1 1 4 ALA HB3 H 10.882 6.704 1.829 1.00 . A A . 4 ALA HB3 1 1 15 6417 1 1 4 ALA N N 9.054 4.621 2.571 1.00 . A A . 4 ALA N 1 1 15 6418 1 1 4 ALA O O 10.863 4.323 4.996 1.00 . A A . 4 ALA O 1 1 15 6419 1 1 5 THR C C 13.700 2.581 5.007 1.00 . A A . 5 THR C 1 1 15 6420 1 1 5 THR CA C 12.356 2.034 4.541 1.00 . A A . 5 THR CA 1 1 15 6421 1 1 5 THR CB C 12.550 0.594 4.029 1.00 . A A . 5 THR CB 1 1 15 6422 1 1 5 THR CG2 C 11.258 -0.201 4.145 1.00 . A A . 5 THR CG2 1 1 15 6423 1 1 5 THR H H 11.891 2.658 2.573 1.00 . A A . 5 THR H 1 1 15 6424 1 1 5 THR HA H 11.679 2.006 5.383 1.00 . A A . 5 THR HA 1 1 15 6425 1 1 5 THR HB H 13.307 0.113 4.632 1.00 . A A . 5 THR HB 1 1 15 6426 1 1 5 THR HG1 H 13.403 -0.223 2.449 1.00 . A A . 5 THR HG1 1 1 15 6427 1 1 5 THR HG21 H 10.996 -0.605 3.178 1.00 . A A . 5 THR HG21 1 1 15 6428 1 1 5 THR HG22 H 10.467 0.448 4.491 1.00 . A A . 5 THR HG22 1 1 15 6429 1 1 5 THR HG23 H 11.395 -1.009 4.847 1.00 . A A . 5 THR HG23 1 1 15 6430 1 1 5 THR N N 11.767 2.887 3.518 1.00 . A A . 5 THR N 1 1 15 6431 1 1 5 THR O O 14.225 3.537 4.435 1.00 . A A . 5 THR O 1 1 15 6432 1 1 5 THR OG1 O 12.984 0.614 2.664 1.00 . A A . 5 THR OG1 1 1 15 6433 1 1 6 LYS C C 16.565 2.583 5.475 1.00 . A A . 6 LYS C 1 1 15 6434 1 1 6 LYS CA C 15.541 2.393 6.589 1.00 . A A . 6 LYS CA 1 1 15 6435 1 1 6 LYS CB C 16.055 1.366 7.600 1.00 . A A . 6 LYS CB 1 1 15 6436 1 1 6 LYS CD C 17.170 -0.849 8.001 1.00 . A A . 6 LYS CD 1 1 15 6437 1 1 6 LYS CE C 16.668 -2.249 7.684 1.00 . A A . 6 LYS CE 1 1 15 6438 1 1 6 LYS CG C 16.712 0.157 6.958 1.00 . A A . 6 LYS CG 1 1 15 6439 1 1 6 LYS H H 13.789 1.212 6.461 1.00 . A A . 6 LYS H 1 1 15 6440 1 1 6 LYS HA H 15.394 3.337 7.092 1.00 . A A . 6 LYS HA 1 1 15 6441 1 1 6 LYS HB2 H 16.779 1.844 8.244 1.00 . A A . 6 LYS HB2 1 1 15 6442 1 1 6 LYS HB3 H 15.225 1.022 8.200 1.00 . A A . 6 LYS HB3 1 1 15 6443 1 1 6 LYS HD2 H 18.250 -0.863 8.025 1.00 . A A . 6 LYS HD2 1 1 15 6444 1 1 6 LYS HD3 H 16.791 -0.550 8.968 1.00 . A A . 6 LYS HD3 1 1 15 6445 1 1 6 LYS HE2 H 15.797 -2.170 7.051 1.00 . A A . 6 LYS HE2 1 1 15 6446 1 1 6 LYS HE3 H 17.445 -2.786 7.160 1.00 . A A . 6 LYS HE3 1 1 15 6447 1 1 6 LYS HG2 H 16.002 -0.321 6.300 1.00 . A A . 6 LYS HG2 1 1 15 6448 1 1 6 LYS HG3 H 17.569 0.485 6.387 1.00 . A A . 6 LYS HG3 1 1 15 6449 1 1 6 LYS HZ1 H 16.761 -2.569 9.746 1.00 . A A . 6 LYS HZ1 1 1 15 6450 1 1 6 LYS HZ2 H 16.618 -3.989 8.838 1.00 . A A . 6 LYS HZ2 1 1 15 6451 1 1 6 LYS HZ3 H 15.274 -2.984 9.055 1.00 . A A . 6 LYS HZ3 1 1 15 6452 1 1 6 LYS N N 14.255 1.969 6.047 1.00 . A A . 6 LYS N 1 1 15 6453 1 1 6 LYS NZ N 16.304 -3.000 8.917 1.00 . A A . 6 LYS NZ 1 1 15 6454 1 1 6 LYS O O 16.655 1.770 4.556 1.00 . A A . 6 LYS O 1 1 15 6455 1 1 7 GLY C C 17.802 4.751 3.400 1.00 . A A . 7 GLY C 1 1 15 6456 1 1 7 GLY CA C 18.346 3.938 4.558 1.00 . A A . 7 GLY CA 1 1 15 6457 1 1 7 GLY H H 17.221 4.276 6.320 1.00 . A A . 7 GLY H 1 1 15 6458 1 1 7 GLY HA2 H 19.157 4.482 5.017 1.00 . A A . 7 GLY HA2 1 1 15 6459 1 1 7 GLY HA3 H 18.724 3.000 4.178 1.00 . A A . 7 GLY HA3 1 1 15 6460 1 1 7 GLY N N 17.337 3.662 5.565 1.00 . A A . 7 GLY N 1 1 15 6461 1 1 7 GLY O O 18.566 5.278 2.591 1.00 . A A . 7 GLY O 1 1 15 6462 1 1 8 ILE C C 15.579 7.048 2.674 1.00 . A A . 8 ILE C 1 1 15 6463 1 1 8 ILE CA C 15.836 5.606 2.251 1.00 . A A . 8 ILE CA 1 1 15 6464 1 1 8 ILE CB C 14.501 4.961 1.832 1.00 . A A . 8 ILE CB 1 1 15 6465 1 1 8 ILE CD1 C 15.587 3.202 0.346 1.00 . A A . 8 ILE CD1 1 1 15 6466 1 1 8 ILE CG1 C 14.699 3.471 1.541 1.00 . A A . 8 ILE CG1 1 1 15 6467 1 1 8 ILE CG2 C 13.928 5.672 0.615 1.00 . A A . 8 ILE CG2 1 1 15 6468 1 1 8 ILE H H 15.924 4.409 3.994 1.00 . A A . 8 ILE H 1 1 15 6469 1 1 8 ILE HA H 16.497 5.605 1.397 1.00 . A A . 8 ILE HA 1 1 15 6470 1 1 8 ILE HB H 13.802 5.071 2.646 1.00 . A A . 8 ILE HB 1 1 15 6471 1 1 8 ILE HD11 H 15.025 2.669 -0.407 1.00 . A A . 8 ILE HD11 1 1 15 6472 1 1 8 ILE HD12 H 15.938 4.138 -0.061 1.00 . A A . 8 ILE HD12 1 1 15 6473 1 1 8 ILE HD13 H 16.433 2.604 0.654 1.00 . A A . 8 ILE HD13 1 1 15 6474 1 1 8 ILE HG12 H 15.149 3.000 2.401 1.00 . A A . 8 ILE HG12 1 1 15 6475 1 1 8 ILE HG13 H 13.737 3.019 1.350 1.00 . A A . 8 ILE HG13 1 1 15 6476 1 1 8 ILE HG21 H 14.735 6.078 0.023 1.00 . A A . 8 ILE HG21 1 1 15 6477 1 1 8 ILE HG22 H 13.365 4.969 0.021 1.00 . A A . 8 ILE HG22 1 1 15 6478 1 1 8 ILE HG23 H 13.280 6.473 0.938 1.00 . A A . 8 ILE HG23 1 1 15 6479 1 1 8 ILE N N 16.480 4.852 3.319 1.00 . A A . 8 ILE N 1 1 15 6480 1 1 8 ILE O O 14.993 7.304 3.727 1.00 . A A . 8 ILE O 1 1 15 6481 1 1 9 LYS C C 14.377 9.713 2.453 1.00 . A A . 9 LYS C 1 1 15 6482 1 1 9 LYS CA C 15.836 9.407 2.132 1.00 . A A . 9 LYS CA 1 1 15 6483 1 1 9 LYS CB C 16.295 10.252 0.941 1.00 . A A . 9 LYS CB 1 1 15 6484 1 1 9 LYS CD C 18.544 11.369 1.008 1.00 . A A . 9 LYS CD 1 1 15 6485 1 1 9 LYS CE C 19.879 11.444 0.281 1.00 . A A . 9 LYS CE 1 1 15 6486 1 1 9 LYS CG C 17.776 10.113 0.631 1.00 . A A . 9 LYS CG 1 1 15 6487 1 1 9 LYS H H 16.481 7.723 1.023 1.00 . A A . 9 LYS H 1 1 15 6488 1 1 9 LYS HA H 16.441 9.654 2.991 1.00 . A A . 9 LYS HA 1 1 15 6489 1 1 9 LYS HB2 H 15.736 9.953 0.066 1.00 . A A . 9 LYS HB2 1 1 15 6490 1 1 9 LYS HB3 H 16.089 11.291 1.151 1.00 . A A . 9 LYS HB3 1 1 15 6491 1 1 9 LYS HD2 H 17.955 12.234 0.744 1.00 . A A . 9 LYS HD2 1 1 15 6492 1 1 9 LYS HD3 H 18.724 11.364 2.073 1.00 . A A . 9 LYS HD3 1 1 15 6493 1 1 9 LYS HE2 H 20.237 10.441 0.109 1.00 . A A . 9 LYS HE2 1 1 15 6494 1 1 9 LYS HE3 H 19.730 11.941 -0.666 1.00 . A A . 9 LYS HE3 1 1 15 6495 1 1 9 LYS HG2 H 18.175 9.279 1.190 1.00 . A A . 9 LYS HG2 1 1 15 6496 1 1 9 LYS HG3 H 17.898 9.931 -0.427 1.00 . A A . 9 LYS HG3 1 1 15 6497 1 1 9 LYS HZ1 H 21.854 11.905 0.781 1.00 . A A . 9 LYS HZ1 1 1 15 6498 1 1 9 LYS HZ2 H 20.778 12.001 2.082 1.00 . A A . 9 LYS HZ2 1 1 15 6499 1 1 9 LYS HZ3 H 20.791 13.216 0.906 1.00 . A A . 9 LYS HZ3 1 1 15 6500 1 1 9 LYS N N 16.020 7.989 1.847 1.00 . A A . 9 LYS N 1 1 15 6501 1 1 9 LYS NZ N 20.896 12.195 1.068 1.00 . A A . 9 LYS NZ 1 1 15 6502 1 1 9 LYS O O 13.466 9.177 1.820 1.00 . A A . 9 LYS O 1 1 15 6503 1 1 10 CYS C C 12.620 12.468 3.747 1.00 . A A . 10 CYS C 1 1 15 6504 1 1 10 CYS CA C 12.813 10.957 3.842 1.00 . A A . 10 CYS CA 1 1 15 6505 1 1 10 CYS CB C 12.535 10.485 5.271 1.00 . A A . 10 CYS CB 1 1 15 6506 1 1 10 CYS H H 14.928 10.973 3.905 1.00 . A A . 10 CYS H 1 1 15 6507 1 1 10 CYS HA H 12.117 10.475 3.172 1.00 . A A . 10 CYS HA 1 1 15 6508 1 1 10 CYS HB2 H 11.469 10.503 5.447 1.00 . A A . 10 CYS HB2 1 1 15 6509 1 1 10 CYS HB3 H 12.896 9.474 5.385 1.00 . A A . 10 CYS HB3 1 1 15 6510 1 1 10 CYS N N 14.161 10.578 3.438 1.00 . A A . 10 CYS N 1 1 15 6511 1 1 10 CYS O O 11.752 13.036 4.409 1.00 . A A . 10 CYS O 1 1 15 6512 1 1 10 CYS SG S 13.324 11.506 6.557 1.00 . A A . 10 CYS SG 1 1 15 6513 1 1 11 ASN C C 11.951 14.974 2.311 1.00 . A A . 11 ASN C 1 1 15 6514 1 1 11 ASN CA C 13.355 14.556 2.736 1.00 . A A . 11 ASN CA 1 1 15 6515 1 1 11 ASN CB C 14.374 15.017 1.691 1.00 . A A . 11 ASN CB 1 1 15 6516 1 1 11 ASN CG C 15.712 15.376 2.308 1.00 . A A . 11 ASN CG 1 1 15 6517 1 1 11 ASN H H 14.107 12.603 2.417 1.00 . A A . 11 ASN H 1 1 15 6518 1 1 11 ASN HA H 13.586 15.023 3.681 1.00 . A A . 11 ASN HA 1 1 15 6519 1 1 11 ASN HB2 H 14.531 14.223 0.976 1.00 . A A . 11 ASN HB2 1 1 15 6520 1 1 11 ASN HB3 H 13.989 15.886 1.180 1.00 . A A . 11 ASN HB3 1 1 15 6521 1 1 11 ASN HD21 H 14.818 16.603 3.593 1.00 . A A . 11 ASN HD21 1 1 15 6522 1 1 11 ASN HD22 H 16.538 16.496 3.728 1.00 . A A . 11 ASN HD22 1 1 15 6523 1 1 11 ASN N N 13.435 13.111 2.918 1.00 . A A . 11 ASN N 1 1 15 6524 1 1 11 ASN ND2 N 15.687 16.246 3.311 1.00 . A A . 11 ASN ND2 1 1 15 6525 1 1 11 ASN O O 11.536 16.111 2.534 1.00 . A A . 11 ASN O 1 1 15 6526 1 1 11 ASN OD1 O 16.756 14.876 1.888 1.00 . A A . 11 ASN OD1 1 1 15 6527 1 1 12 ASP C C 8.963 13.108 1.475 1.00 . A A . 12 ASP C 1 1 15 6528 1 1 12 ASP CA C 9.865 14.317 1.242 1.00 . A A . 12 ASP CA 1 1 15 6529 1 1 12 ASP CB C 9.866 14.690 -0.241 1.00 . A A . 12 ASP CB 1 1 15 6530 1 1 12 ASP CG C 8.700 15.585 -0.613 1.00 . A A . 12 ASP CG 1 1 15 6531 1 1 12 ASP H H 11.610 13.158 1.548 1.00 . A A . 12 ASP H 1 1 15 6532 1 1 12 ASP HA H 9.484 15.149 1.813 1.00 . A A . 12 ASP HA 1 1 15 6533 1 1 12 ASP HB2 H 10.783 15.210 -0.474 1.00 . A A . 12 ASP HB2 1 1 15 6534 1 1 12 ASP HB3 H 9.808 13.788 -0.832 1.00 . A A . 12 ASP HB3 1 1 15 6535 1 1 12 ASP N N 11.224 14.046 1.697 1.00 . A A . 12 ASP N 1 1 15 6536 1 1 12 ASP O O 7.841 13.244 1.963 1.00 . A A . 12 ASP O 1 1 15 6537 1 1 12 ASP OD1 O 8.262 15.534 -1.782 1.00 . A A . 12 ASP OD1 1 1 15 6538 1 1 12 ASP OD2 O 8.225 16.336 0.264 1.00 . A A . 12 ASP OD2 1 1 15 6539 1 1 13 ILE C C 8.664 10.271 2.757 1.00 . A A . 13 ILE C 1 1 15 6540 1 1 13 ILE CA C 8.701 10.696 1.293 1.00 . A A . 13 ILE CA 1 1 15 6541 1 1 13 ILE CB C 9.291 9.549 0.451 1.00 . A A . 13 ILE CB 1 1 15 6542 1 1 13 ILE CD1 C 8.743 7.265 -0.528 1.00 . A A . 13 ILE CD1 1 1 15 6543 1 1 13 ILE CG1 C 8.339 8.352 0.444 1.00 . A A . 13 ILE CG1 1 1 15 6544 1 1 13 ILE CG2 C 10.655 9.145 0.990 1.00 . A A . 13 ILE CG2 1 1 15 6545 1 1 13 ILE H H 10.362 11.885 0.739 1.00 . A A . 13 ILE H 1 1 15 6546 1 1 13 ILE HA H 7.690 10.880 0.957 1.00 . A A . 13 ILE HA 1 1 15 6547 1 1 13 ILE HB H 9.420 9.904 -0.560 1.00 . A A . 13 ILE HB 1 1 15 6548 1 1 13 ILE HD11 H 7.860 6.844 -0.986 1.00 . A A . 13 ILE HD11 1 1 15 6549 1 1 13 ILE HD12 H 9.382 7.682 -1.291 1.00 . A A . 13 ILE HD12 1 1 15 6550 1 1 13 ILE HD13 H 9.277 6.488 0.003 1.00 . A A . 13 ILE HD13 1 1 15 6551 1 1 13 ILE HG12 H 8.307 7.918 1.431 1.00 . A A . 13 ILE HG12 1 1 15 6552 1 1 13 ILE HG13 H 7.349 8.690 0.171 1.00 . A A . 13 ILE HG13 1 1 15 6553 1 1 13 ILE HG21 H 10.536 8.669 1.952 1.00 . A A . 13 ILE HG21 1 1 15 6554 1 1 13 ILE HG22 H 11.122 8.455 0.303 1.00 . A A . 13 ILE HG22 1 1 15 6555 1 1 13 ILE HG23 H 11.275 10.022 1.097 1.00 . A A . 13 ILE HG23 1 1 15 6556 1 1 13 ILE N N 9.462 11.928 1.122 1.00 . A A . 13 ILE N 1 1 15 6557 1 1 13 ILE O O 9.644 10.430 3.485 1.00 . A A . 13 ILE O 1 1 15 6558 1 1 14 HIS C C 7.656 7.784 4.680 1.00 . A A . 14 HIS C 1 1 15 6559 1 1 14 HIS CA C 7.363 9.277 4.559 1.00 . A A . 14 HIS CA 1 1 15 6560 1 1 14 HIS CB C 5.946 9.572 5.049 1.00 . A A . 14 HIS CB 1 1 15 6561 1 1 14 HIS CD2 C 4.630 7.586 4.022 1.00 . A A . 14 HIS CD2 1 1 15 6562 1 1 14 HIS CE1 C 3.119 8.735 2.925 1.00 . A A . 14 HIS CE1 1 1 15 6563 1 1 14 HIS CG C 4.880 8.898 4.240 1.00 . A A . 14 HIS CG 1 1 15 6564 1 1 14 HIS H H 6.782 9.628 2.553 1.00 . A A . 14 HIS H 1 1 15 6565 1 1 14 HIS HA H 8.067 9.820 5.171 1.00 . A A . 14 HIS HA 1 1 15 6566 1 1 14 HIS HB2 H 5.848 9.236 6.070 1.00 . A A . 14 HIS HB2 1 1 15 6567 1 1 14 HIS HB3 H 5.771 10.637 5.007 1.00 . A A . 14 HIS HB3 1 1 15 6568 1 1 14 HIS HD1 H 3.829 10.567 3.497 1.00 . A A . 14 HIS HD1 1 1 15 6569 1 1 14 HIS HD2 H 5.191 6.751 4.419 1.00 . A A . 14 HIS HD2 1 1 15 6570 1 1 14 HIS HE1 H 2.275 8.991 2.303 1.00 . A A . 14 HIS HE1 1 1 15 6571 1 1 14 HIS N N 7.528 9.728 3.181 1.00 . A A . 14 HIS N 1 1 15 6572 1 1 14 HIS ND1 N 3.917 9.592 3.538 1.00 . A A . 14 HIS ND1 1 1 15 6573 1 1 14 HIS NE2 N 3.531 7.511 3.202 1.00 . A A . 14 HIS NE2 1 1 15 6574 1 1 14 HIS O O 7.532 7.036 3.710 1.00 . A A . 14 HIS O 1 1 15 6575 1 1 15 CYS C C 7.117 5.196 6.584 1.00 . A A . 15 CYS C 1 1 15 6576 1 1 15 CYS CA C 8.358 5.956 6.125 1.00 . A A . 15 CYS CA 1 1 15 6577 1 1 15 CYS CB C 9.461 5.836 7.178 1.00 . A A . 15 CYS CB 1 1 15 6578 1 1 15 CYS H H 8.126 8.003 6.611 1.00 . A A . 15 CYS H 1 1 15 6579 1 1 15 CYS HA H 8.707 5.524 5.199 1.00 . A A . 15 CYS HA 1 1 15 6580 1 1 15 CYS HB2 H 9.012 5.831 8.160 1.00 . A A . 15 CYS HB2 1 1 15 6581 1 1 15 CYS HB3 H 9.993 4.908 7.027 1.00 . A A . 15 CYS HB3 1 1 15 6582 1 1 15 CYS N N 8.046 7.358 5.876 1.00 . A A . 15 CYS N 1 1 15 6583 1 1 15 CYS O O 6.196 5.777 7.159 1.00 . A A . 15 CYS O 1 1 15 6584 1 1 15 CYS SG S 10.680 7.189 7.135 1.00 . A A . 15 CYS SG 1 1 15 6585 1 1 16 CYS C C 5.793 3.044 8.227 1.00 . A A . 16 CYS C 1 1 15 6586 1 1 16 CYS CA C 5.973 3.051 6.712 1.00 . A A . 16 CYS CA 1 1 15 6587 1 1 16 CYS CB C 6.179 1.622 6.205 1.00 . A A . 16 CYS CB 1 1 15 6588 1 1 16 CYS H H 7.863 3.485 5.865 1.00 . A A . 16 CYS H 1 1 15 6589 1 1 16 CYS HA H 5.083 3.460 6.258 1.00 . A A . 16 CYS HA 1 1 15 6590 1 1 16 CYS HB2 H 7.238 1.430 6.115 1.00 . A A . 16 CYS HB2 1 1 15 6591 1 1 16 CYS HB3 H 5.751 0.931 6.916 1.00 . A A . 16 CYS HB3 1 1 15 6592 1 1 16 CYS N N 7.099 3.892 6.326 1.00 . A A . 16 CYS N 1 1 15 6593 1 1 16 CYS O O 6.746 3.255 8.977 1.00 . A A . 16 CYS O 1 1 15 6594 1 1 16 CYS SG S 5.418 1.292 4.583 1.00 . A A . 16 CYS SG 1 1 15 6595 1 1 17 SER C C 5.227 1.853 10.840 1.00 . A A . 17 SER C 1 1 15 6596 1 1 17 SER CA C 4.258 2.767 10.096 1.00 . A A . 17 SER CA 1 1 15 6597 1 1 17 SER CB C 2.820 2.295 10.320 1.00 . A A . 17 SER CB 1 1 15 6598 1 1 17 SER H H 3.846 2.638 8.023 1.00 . A A . 17 SER H 1 1 15 6599 1 1 17 SER HA H 4.363 3.771 10.480 1.00 . A A . 17 SER HA 1 1 15 6600 1 1 17 SER HB2 H 2.800 1.217 10.364 1.00 . A A . 17 SER HB2 1 1 15 6601 1 1 17 SER HB3 H 2.452 2.701 11.252 1.00 . A A . 17 SER HB3 1 1 15 6602 1 1 17 SER HG H 1.361 2.021 9.042 1.00 . A A . 17 SER HG 1 1 15 6603 1 1 17 SER N N 4.564 2.799 8.671 1.00 . A A . 17 SER N 1 1 15 6604 1 1 17 SER O O 5.166 0.630 10.713 1.00 . A A . 17 SER O 1 1 15 6605 1 1 17 SER OG O 1.973 2.726 9.269 1.00 . A A . 17 SER OG 1 1 15 6606 1 1 18 GLY C C 8.495 2.242 12.255 1.00 . A A . 18 GLY C 1 1 15 6607 1 1 18 GLY CA C 7.092 1.681 12.370 1.00 . A A . 18 GLY CA 1 1 15 6608 1 1 18 GLY H H 6.124 3.434 11.679 1.00 . A A . 18 GLY H 1 1 15 6609 1 1 18 GLY HA2 H 6.802 1.675 13.410 1.00 . A A . 18 GLY HA2 1 1 15 6610 1 1 18 GLY HA3 H 7.090 0.667 12.000 1.00 . A A . 18 GLY HA3 1 1 15 6611 1 1 18 GLY N N 6.122 2.455 11.617 1.00 . A A . 18 GLY N 1 1 15 6612 1 1 18 GLY O O 9.383 1.878 13.028 1.00 . A A . 18 GLY O 1 1 15 6613 1 1 19 LEU C C 9.952 5.243 11.315 1.00 . A A . 19 LEU C 1 1 15 6614 1 1 19 LEU CA C 10.007 3.739 11.071 1.00 . A A . 19 LEU CA 1 1 15 6615 1 1 19 LEU CB C 10.494 3.458 9.649 1.00 . A A . 19 LEU CB 1 1 15 6616 1 1 19 LEU CD1 C 11.056 1.823 7.834 1.00 . A A . 19 LEU CD1 1 1 15 6617 1 1 19 LEU CD2 C 12.031 1.534 10.120 1.00 . A A . 19 LEU CD2 1 1 15 6618 1 1 19 LEU CG C 10.819 1.999 9.326 1.00 . A A . 19 LEU CG 1 1 15 6619 1 1 19 LEU H H 7.954 3.379 10.702 1.00 . A A . 19 LEU H 1 1 15 6620 1 1 19 LEU HA H 10.698 3.298 11.774 1.00 . A A . 19 LEU HA 1 1 15 6621 1 1 19 LEU HB2 H 9.726 3.785 8.965 1.00 . A A . 19 LEU HB2 1 1 15 6622 1 1 19 LEU HB3 H 11.390 4.041 9.486 1.00 . A A . 19 LEU HB3 1 1 15 6623 1 1 19 LEU HD11 H 10.182 2.146 7.290 1.00 . A A . 19 LEU HD11 1 1 15 6624 1 1 19 LEU HD12 H 11.249 0.782 7.621 1.00 . A A . 19 LEU HD12 1 1 15 6625 1 1 19 LEU HD13 H 11.908 2.415 7.533 1.00 . A A . 19 LEU HD13 1 1 15 6626 1 1 19 LEU HD21 H 12.060 0.454 10.131 1.00 . A A . 19 LEU HD21 1 1 15 6627 1 1 19 LEU HD22 H 11.961 1.903 11.133 1.00 . A A . 19 LEU HD22 1 1 15 6628 1 1 19 LEU HD23 H 12.930 1.914 9.659 1.00 . A A . 19 LEU HD23 1 1 15 6629 1 1 19 LEU HG H 9.977 1.380 9.605 1.00 . A A . 19 LEU HG 1 1 15 6630 1 1 19 LEU N N 8.699 3.128 11.286 1.00 . A A . 19 LEU N 1 1 15 6631 1 1 19 LEU O O 8.908 5.874 11.141 1.00 . A A . 19 LEU O 1 1 15 6632 1 1 20 LYS C C 11.923 7.962 10.866 1.00 . A A . 20 LYS C 1 1 15 6633 1 1 20 LYS CA C 11.165 7.246 11.980 1.00 . A A . 20 LYS CA 1 1 15 6634 1 1 20 LYS CB C 11.853 7.498 13.323 1.00 . A A . 20 LYS CB 1 1 15 6635 1 1 20 LYS CD C 9.998 7.967 14.951 1.00 . A A . 20 LYS CD 1 1 15 6636 1 1 20 LYS CE C 8.958 7.304 15.841 1.00 . A A . 20 LYS CE 1 1 15 6637 1 1 20 LYS CG C 11.068 6.979 14.515 1.00 . A A . 20 LYS CG 1 1 15 6638 1 1 20 LYS H H 11.882 5.259 11.836 1.00 . A A . 20 LYS H 1 1 15 6639 1 1 20 LYS HA H 10.159 7.634 12.021 1.00 . A A . 20 LYS HA 1 1 15 6640 1 1 20 LYS HB2 H 12.819 7.014 13.316 1.00 . A A . 20 LYS HB2 1 1 15 6641 1 1 20 LYS HB3 H 11.994 8.562 13.447 1.00 . A A . 20 LYS HB3 1 1 15 6642 1 1 20 LYS HD2 H 10.464 8.772 15.499 1.00 . A A . 20 LYS HD2 1 1 15 6643 1 1 20 LYS HD3 H 9.508 8.363 14.072 1.00 . A A . 20 LYS HD3 1 1 15 6644 1 1 20 LYS HE2 H 8.004 7.326 15.336 1.00 . A A . 20 LYS HE2 1 1 15 6645 1 1 20 LYS HE3 H 9.251 6.279 16.013 1.00 . A A . 20 LYS HE3 1 1 15 6646 1 1 20 LYS HG2 H 10.594 6.047 14.245 1.00 . A A . 20 LYS HG2 1 1 15 6647 1 1 20 LYS HG3 H 11.749 6.814 15.339 1.00 . A A . 20 LYS HG3 1 1 15 6648 1 1 20 LYS HZ1 H 8.405 7.357 17.855 1.00 . A A . 20 LYS HZ1 1 1 15 6649 1 1 20 LYS HZ2 H 8.220 8.836 17.055 1.00 . A A . 20 LYS HZ2 1 1 15 6650 1 1 20 LYS HZ3 H 9.764 8.298 17.492 1.00 . A A . 20 LYS HZ3 1 1 15 6651 1 1 20 LYS N N 11.082 5.814 11.715 1.00 . A A . 20 LYS N 1 1 15 6652 1 1 20 LYS NZ N 8.828 7.998 17.153 1.00 . A A . 20 LYS NZ 1 1 15 6653 1 1 20 LYS O O 12.862 7.413 10.288 1.00 . A A . 20 LYS O 1 1 15 6654 1 1 21 CYS C C 13.215 10.904 10.121 1.00 . A A . 21 CYS C 1 1 15 6655 1 1 21 CYS CA C 12.152 9.982 9.529 1.00 . A A . 21 CYS CA 1 1 15 6656 1 1 21 CYS CB C 11.109 10.808 8.773 1.00 . A A . 21 CYS CB 1 1 15 6657 1 1 21 CYS H H 10.758 9.574 11.068 1.00 . A A . 21 CYS H 1 1 15 6658 1 1 21 CYS HA H 12.628 9.301 8.840 1.00 . A A . 21 CYS HA 1 1 15 6659 1 1 21 CYS HB2 H 10.523 10.149 8.149 1.00 . A A . 21 CYS HB2 1 1 15 6660 1 1 21 CYS HB3 H 10.459 11.292 9.486 1.00 . A A . 21 CYS HB3 1 1 15 6661 1 1 21 CYS N N 11.512 9.190 10.572 1.00 . A A . 21 CYS N 1 1 15 6662 1 1 21 CYS O O 12.908 12.000 10.592 1.00 . A A . 21 CYS O 1 1 15 6663 1 1 21 CYS SG S 11.817 12.098 7.700 1.00 . A A . 21 CYS SG 1 1 15 6664 1 1 22 ASP C C 15.715 12.556 9.873 1.00 . A A . 22 ASP C 1 1 15 6665 1 1 22 ASP CA C 15.572 11.237 10.625 1.00 . A A . 22 ASP CA 1 1 15 6666 1 1 22 ASP CB C 16.876 10.442 10.536 1.00 . A A . 22 ASP CB 1 1 15 6667 1 1 22 ASP CG C 17.859 10.819 11.627 1.00 . A A . 22 ASP CG 1 1 15 6668 1 1 22 ASP H H 14.645 9.571 9.703 1.00 . A A . 22 ASP H 1 1 15 6669 1 1 22 ASP HA H 15.360 11.449 11.662 1.00 . A A . 22 ASP HA 1 1 15 6670 1 1 22 ASP HB2 H 16.654 9.388 10.626 1.00 . A A . 22 ASP HB2 1 1 15 6671 1 1 22 ASP HB3 H 17.339 10.627 9.578 1.00 . A A . 22 ASP HB3 1 1 15 6672 1 1 22 ASP N N 14.464 10.453 10.092 1.00 . A A . 22 ASP N 1 1 15 6673 1 1 22 ASP O O 16.227 12.593 8.754 1.00 . A A . 22 ASP O 1 1 15 6674 1 1 22 ASP OD1 O 18.708 9.973 11.979 1.00 . A A . 22 ASP OD1 1 1 15 6675 1 1 22 ASP OD2 O 17.780 11.960 12.128 1.00 . A A . 22 ASP OD2 1 1 15 6676 1 1 23 SER C C 16.762 15.484 9.888 1.00 . A A . 23 SER C 1 1 15 6677 1 1 23 SER CA C 15.329 14.960 9.882 1.00 . A A . 23 SER CA 1 1 15 6678 1 1 23 SER CB C 14.413 15.938 10.620 1.00 . A A . 23 SER CB 1 1 15 6679 1 1 23 SER H H 14.860 13.545 11.385 1.00 . A A . 23 SER H 1 1 15 6680 1 1 23 SER HA H 14.996 14.870 8.859 1.00 . A A . 23 SER HA 1 1 15 6681 1 1 23 SER HB2 H 14.820 16.935 10.544 1.00 . A A . 23 SER HB2 1 1 15 6682 1 1 23 SER HB3 H 13.431 15.914 10.172 1.00 . A A . 23 SER HB3 1 1 15 6683 1 1 23 SER HG H 13.371 15.507 12.222 1.00 . A A . 23 SER HG 1 1 15 6684 1 1 23 SER N N 15.257 13.638 10.494 1.00 . A A . 23 SER N 1 1 15 6685 1 1 23 SER O O 17.080 16.465 9.215 1.00 . A A . 23 SER O 1 1 15 6686 1 1 23 SER OG O 14.299 15.595 11.990 1.00 . A A . 23 SER OG 1 1 15 6687 1 1 24 LYS C C 19.839 14.613 9.611 1.00 . A A . 24 LYS C 1 1 15 6688 1 1 24 LYS CA C 19.024 15.219 10.749 1.00 . A A . 24 LYS CA 1 1 15 6689 1 1 24 LYS CB C 19.607 14.787 12.096 1.00 . A A . 24 LYS CB 1 1 15 6690 1 1 24 LYS CD C 20.080 16.143 14.157 1.00 . A A . 24 LYS CD 1 1 15 6691 1 1 24 LYS CE C 20.748 17.321 13.465 1.00 . A A . 24 LYS CE 1 1 15 6692 1 1 24 LYS CG C 19.005 15.519 13.283 1.00 . A A . 24 LYS CG 1 1 15 6693 1 1 24 LYS H H 17.310 14.049 11.167 1.00 . A A . 24 LYS H 1 1 15 6694 1 1 24 LYS HA H 19.070 16.295 10.675 1.00 . A A . 24 LYS HA 1 1 15 6695 1 1 24 LYS HB2 H 19.434 13.729 12.227 1.00 . A A . 24 LYS HB2 1 1 15 6696 1 1 24 LYS HB3 H 20.672 14.971 12.089 1.00 . A A . 24 LYS HB3 1 1 15 6697 1 1 24 LYS HD2 H 19.630 16.487 15.076 1.00 . A A . 24 LYS HD2 1 1 15 6698 1 1 24 LYS HD3 H 20.829 15.396 14.379 1.00 . A A . 24 LYS HD3 1 1 15 6699 1 1 24 LYS HE2 H 21.817 17.226 13.571 1.00 . A A . 24 LYS HE2 1 1 15 6700 1 1 24 LYS HE3 H 20.486 17.302 12.417 1.00 . A A . 24 LYS HE3 1 1 15 6701 1 1 24 LYS HG2 H 18.354 16.300 12.920 1.00 . A A . 24 LYS HG2 1 1 15 6702 1 1 24 LYS HG3 H 18.434 14.818 13.874 1.00 . A A . 24 LYS HG3 1 1 15 6703 1 1 24 LYS HZ1 H 19.320 18.570 14.340 1.00 . A A . 24 LYS HZ1 1 1 15 6704 1 1 24 LYS HZ2 H 20.421 19.381 13.343 1.00 . A A . 24 LYS HZ2 1 1 15 6705 1 1 24 LYS HZ3 H 20.900 18.853 14.877 1.00 . A A . 24 LYS HZ3 1 1 15 6706 1 1 24 LYS N N 17.624 14.823 10.654 1.00 . A A . 24 LYS N 1 1 15 6707 1 1 24 LYS NZ N 20.317 18.623 14.047 1.00 . A A . 24 LYS NZ 1 1 15 6708 1 1 24 LYS O O 20.679 15.283 9.011 1.00 . A A . 24 LYS O 1 1 15 6709 1 1 25 ARG C C 19.438 12.558 6.995 1.00 . A A . 25 ARG C 1 1 15 6710 1 1 25 ARG CA C 20.296 12.645 8.254 1.00 . A A . 25 ARG CA 1 1 15 6711 1 1 25 ARG CB C 20.695 11.240 8.711 1.00 . A A . 25 ARG CB 1 1 15 6712 1 1 25 ARG CD C 22.725 10.508 9.999 1.00 . A A . 25 ARG CD 1 1 15 6713 1 1 25 ARG CG C 21.379 11.212 10.068 1.00 . A A . 25 ARG CG 1 1 15 6714 1 1 25 ARG CZ C 23.668 8.289 10.479 1.00 . A A . 25 ARG CZ 1 1 15 6715 1 1 25 ARG H H 18.904 12.859 9.835 1.00 . A A . 25 ARG H 1 1 15 6716 1 1 25 ARG HA H 21.190 13.207 8.029 1.00 . A A . 25 ARG HA 1 1 15 6717 1 1 25 ARG HB2 H 19.807 10.627 8.768 1.00 . A A . 25 ARG HB2 1 1 15 6718 1 1 25 ARG HB3 H 21.369 10.816 7.983 1.00 . A A . 25 ARG HB3 1 1 15 6719 1 1 25 ARG HD2 H 23.116 10.605 8.997 1.00 . A A . 25 ARG HD2 1 1 15 6720 1 1 25 ARG HD3 H 23.400 10.982 10.695 1.00 . A A . 25 ARG HD3 1 1 15 6721 1 1 25 ARG HE H 21.720 8.718 10.449 1.00 . A A . 25 ARG HE 1 1 15 6722 1 1 25 ARG HG2 H 21.533 12.227 10.404 1.00 . A A . 25 ARG HG2 1 1 15 6723 1 1 25 ARG HG3 H 20.745 10.691 10.770 1.00 . A A . 25 ARG HG3 1 1 15 6724 1 1 25 ARG HH11 H 25.033 9.729 10.098 1.00 . A A . 25 ARG HH11 1 1 15 6725 1 1 25 ARG HH12 H 25.685 8.160 10.438 1.00 . A A . 25 ARG HH12 1 1 15 6726 1 1 25 ARG HH21 H 22.566 6.647 10.898 1.00 . A A . 25 ARG HH21 1 1 15 6727 1 1 25 ARG HH22 H 24.281 6.408 10.892 1.00 . A A . 25 ARG HH22 1 1 15 6728 1 1 25 ARG N N 19.585 13.341 9.320 1.00 . A A . 25 ARG N 1 1 15 6729 1 1 25 ARG NE N 22.619 9.090 10.331 1.00 . A A . 25 ARG NE 1 1 15 6730 1 1 25 ARG NH1 N 24.896 8.765 10.325 1.00 . A A . 25 ARG NH1 1 1 15 6731 1 1 25 ARG NH2 N 23.490 7.009 10.781 1.00 . A A . 25 ARG NH2 1 1 15 6732 1 1 25 ARG O O 19.844 11.968 5.994 1.00 . A A . 25 ARG O 1 1 15 6733 1 1 26 LYS C C 17.102 11.717 5.418 1.00 . A A . 26 LYS C 1 1 15 6734 1 1 26 LYS CA C 17.333 13.139 5.919 1.00 . A A . 26 LYS CA 1 1 15 6735 1 1 26 LYS CB C 17.884 14.007 4.786 1.00 . A A . 26 LYS CB 1 1 15 6736 1 1 26 LYS CD C 19.119 16.107 4.173 1.00 . A A . 26 LYS CD 1 1 15 6737 1 1 26 LYS CE C 19.965 17.216 4.781 1.00 . A A . 26 LYS CE 1 1 15 6738 1 1 26 LYS CG C 18.281 15.405 5.228 1.00 . A A . 26 LYS CG 1 1 15 6739 1 1 26 LYS H H 17.982 13.603 7.881 1.00 . A A . 26 LYS H 1 1 15 6740 1 1 26 LYS HA H 16.391 13.549 6.250 1.00 . A A . 26 LYS HA 1 1 15 6741 1 1 26 LYS HB2 H 18.755 13.524 4.368 1.00 . A A . 26 LYS HB2 1 1 15 6742 1 1 26 LYS HB3 H 17.129 14.097 4.018 1.00 . A A . 26 LYS HB3 1 1 15 6743 1 1 26 LYS HD2 H 19.773 15.385 3.707 1.00 . A A . 26 LYS HD2 1 1 15 6744 1 1 26 LYS HD3 H 18.462 16.534 3.429 1.00 . A A . 26 LYS HD3 1 1 15 6745 1 1 26 LYS HE2 H 19.962 17.106 5.854 1.00 . A A . 26 LYS HE2 1 1 15 6746 1 1 26 LYS HE3 H 20.976 17.122 4.412 1.00 . A A . 26 LYS HE3 1 1 15 6747 1 1 26 LYS HG2 H 17.387 15.984 5.406 1.00 . A A . 26 LYS HG2 1 1 15 6748 1 1 26 LYS HG3 H 18.854 15.335 6.142 1.00 . A A . 26 LYS HG3 1 1 15 6749 1 1 26 LYS HZ1 H 18.425 18.618 4.627 1.00 . A A . 26 LYS HZ1 1 1 15 6750 1 1 26 LYS HZ2 H 19.601 18.758 3.420 1.00 . A A . 26 LYS HZ2 1 1 15 6751 1 1 26 LYS HZ3 H 19.933 19.294 4.989 1.00 . A A . 26 LYS HZ3 1 1 15 6752 1 1 26 LYS N N 18.249 13.148 7.054 1.00 . A A . 26 LYS N 1 1 15 6753 1 1 26 LYS NZ N 19.445 18.566 4.430 1.00 . A A . 26 LYS NZ 1 1 15 6754 1 1 26 LYS O O 17.063 11.472 4.212 1.00 . A A . 26 LYS O 1 1 15 6755 1 1 27 VAL C C 15.902 8.679 7.080 1.00 . A A . 27 VAL C 1 1 15 6756 1 1 27 VAL CA C 16.719 9.386 6.004 1.00 . A A . 27 VAL CA 1 1 15 6757 1 1 27 VAL CB C 18.047 8.631 5.805 1.00 . A A . 27 VAL CB 1 1 15 6758 1 1 27 VAL CG1 C 18.738 9.093 4.532 1.00 . A A . 27 VAL CG1 1 1 15 6759 1 1 27 VAL CG2 C 18.953 8.821 7.012 1.00 . A A . 27 VAL CG2 1 1 15 6760 1 1 27 VAL H H 16.990 11.040 7.296 1.00 . A A . 27 VAL H 1 1 15 6761 1 1 27 VAL HA H 16.171 9.359 5.074 1.00 . A A . 27 VAL HA 1 1 15 6762 1 1 27 VAL HB H 17.828 7.578 5.708 1.00 . A A . 27 VAL HB 1 1 15 6763 1 1 27 VAL HG11 H 19.689 8.589 4.436 1.00 . A A . 27 VAL HG11 1 1 15 6764 1 1 27 VAL HG12 H 18.117 8.858 3.679 1.00 . A A . 27 VAL HG12 1 1 15 6765 1 1 27 VAL HG13 H 18.900 10.160 4.577 1.00 . A A . 27 VAL HG13 1 1 15 6766 1 1 27 VAL HG21 H 19.485 7.902 7.210 1.00 . A A . 27 VAL HG21 1 1 15 6767 1 1 27 VAL HG22 H 19.662 9.611 6.810 1.00 . A A . 27 VAL HG22 1 1 15 6768 1 1 27 VAL HG23 H 18.356 9.084 7.873 1.00 . A A . 27 VAL HG23 1 1 15 6769 1 1 27 VAL N N 16.949 10.783 6.352 1.00 . A A . 27 VAL N 1 1 15 6770 1 1 27 VAL O O 15.799 9.156 8.211 1.00 . A A . 27 VAL O 1 1 15 6771 1 1 28 CYS C C 15.393 5.885 8.538 1.00 . A A . 28 CYS C 1 1 15 6772 1 1 28 CYS CA C 14.513 6.765 7.655 1.00 . A A . 28 CYS CA 1 1 15 6773 1 1 28 CYS CB C 13.507 5.899 6.895 1.00 . A A . 28 CYS CB 1 1 15 6774 1 1 28 CYS H H 15.440 7.209 5.805 1.00 . A A . 28 CYS H 1 1 15 6775 1 1 28 CYS HA H 13.975 7.459 8.283 1.00 . A A . 28 CYS HA 1 1 15 6776 1 1 28 CYS HB2 H 14.038 5.282 6.185 1.00 . A A . 28 CYS HB2 1 1 15 6777 1 1 28 CYS HB3 H 12.986 5.265 7.597 1.00 . A A . 28 CYS HB3 1 1 15 6778 1 1 28 CYS N N 15.322 7.539 6.721 1.00 . A A . 28 CYS N 1 1 15 6779 1 1 28 CYS O O 16.376 5.307 8.073 1.00 . A A . 28 CYS O 1 1 15 6780 1 1 28 CYS SG S 12.256 6.849 5.972 1.00 . A A . 28 CYS SG 1 1 15 6781 1 1 29 VAL C C 14.860 4.131 11.624 1.00 . A A . 29 VAL C 1 1 15 6782 1 1 29 VAL CA C 15.789 4.978 10.761 1.00 . A A . 29 VAL CA 1 1 15 6783 1 1 29 VAL CB C 16.664 5.854 11.677 1.00 . A A . 29 VAL CB 1 1 15 6784 1 1 29 VAL CG1 C 17.865 6.393 10.913 1.00 . A A . 29 VAL CG1 1 1 15 6785 1 1 29 VAL CG2 C 15.844 6.992 12.267 1.00 . A A . 29 VAL CG2 1 1 15 6786 1 1 29 VAL H H 14.241 6.273 10.125 1.00 . A A . 29 VAL H 1 1 15 6787 1 1 29 VAL HA H 16.438 4.323 10.198 1.00 . A A . 29 VAL HA 1 1 15 6788 1 1 29 VAL HB H 17.027 5.241 12.489 1.00 . A A . 29 VAL HB 1 1 15 6789 1 1 29 VAL HG11 H 18.508 5.572 10.631 1.00 . A A . 29 VAL HG11 1 1 15 6790 1 1 29 VAL HG12 H 17.526 6.908 10.027 1.00 . A A . 29 VAL HG12 1 1 15 6791 1 1 29 VAL HG13 H 18.413 7.079 11.542 1.00 . A A . 29 VAL HG13 1 1 15 6792 1 1 29 VAL HG21 H 16.321 7.348 13.168 1.00 . A A . 29 VAL HG21 1 1 15 6793 1 1 29 VAL HG22 H 15.778 7.798 11.551 1.00 . A A . 29 VAL HG22 1 1 15 6794 1 1 29 VAL HG23 H 14.851 6.637 12.501 1.00 . A A . 29 VAL HG23 1 1 15 6795 1 1 29 VAL N N 15.034 5.788 9.814 1.00 . A A . 29 VAL N 1 1 15 6796 1 1 29 VAL O O 13.646 4.336 11.635 1.00 . A A . 29 VAL O 1 1 15 6797 1 1 30 LYS C C 14.185 3.045 14.457 1.00 . A A . 30 LYS C 1 1 15 6798 1 1 30 LYS CA C 14.663 2.299 13.215 1.00 . A A . 30 LYS CA 1 1 15 6799 1 1 30 LYS CB C 15.501 1.086 13.626 1.00 . A A . 30 LYS CB 1 1 15 6800 1 1 30 LYS CD C 15.495 -1.042 14.960 1.00 . A A . 30 LYS CD 1 1 15 6801 1 1 30 LYS CE C 15.399 -2.472 14.449 1.00 . A A . 30 LYS CE 1 1 15 6802 1 1 30 LYS CG C 14.671 -0.091 14.109 1.00 . A A . 30 LYS CG 1 1 15 6803 1 1 30 LYS H H 16.411 3.063 12.296 1.00 . A A . 30 LYS H 1 1 15 6804 1 1 30 LYS HA H 13.802 1.960 12.660 1.00 . A A . 30 LYS HA 1 1 15 6805 1 1 30 LYS HB2 H 16.085 0.763 12.777 1.00 . A A . 30 LYS HB2 1 1 15 6806 1 1 30 LYS HB3 H 16.170 1.379 14.422 1.00 . A A . 30 LYS HB3 1 1 15 6807 1 1 30 LYS HD2 H 16.529 -0.732 14.934 1.00 . A A . 30 LYS HD2 1 1 15 6808 1 1 30 LYS HD3 H 15.132 -1.008 15.978 1.00 . A A . 30 LYS HD3 1 1 15 6809 1 1 30 LYS HE2 H 14.642 -2.992 15.015 1.00 . A A . 30 LYS HE2 1 1 15 6810 1 1 30 LYS HE3 H 15.118 -2.449 13.407 1.00 . A A . 30 LYS HE3 1 1 15 6811 1 1 30 LYS HG2 H 13.846 0.280 14.700 1.00 . A A . 30 LYS HG2 1 1 15 6812 1 1 30 LYS HG3 H 14.290 -0.627 13.252 1.00 . A A . 30 LYS HG3 1 1 15 6813 1 1 30 LYS HZ1 H 17.129 -3.329 13.653 1.00 . A A . 30 LYS HZ1 1 1 15 6814 1 1 30 LYS HZ2 H 16.533 -4.132 15.017 1.00 . A A . 30 LYS HZ2 1 1 15 6815 1 1 30 LYS HZ3 H 17.343 -2.657 15.190 1.00 . A A . 30 LYS HZ3 1 1 15 6816 1 1 30 LYS N N 15.438 3.178 12.347 1.00 . A A . 30 LYS N 1 1 15 6817 1 1 30 LYS NZ N 16.692 -3.198 14.587 1.00 . A A . 30 LYS NZ 1 1 15 6818 1 1 30 LYS O O 14.976 3.679 15.155 1.00 . A A . 30 LYS O 1 1 15 6819 1 1 31 GLY C C 10.869 3.283 16.112 1.00 . A A . 31 GLY C 1 1 15 6820 1 1 31 GLY CA C 12.326 3.633 15.887 1.00 . A A . 31 GLY CA 1 1 15 6821 1 1 31 GLY H H 12.303 2.443 14.136 1.00 . A A . 31 GLY H 1 1 15 6822 1 1 31 GLY HA2 H 12.893 3.351 16.761 1.00 . A A . 31 GLY HA2 1 1 15 6823 1 1 31 GLY HA3 H 12.410 4.701 15.746 1.00 . A A . 31 GLY HA3 1 1 15 6824 1 1 31 GLY N N 12.886 2.963 14.728 1.00 . A A . 31 GLY N 1 1 15 6825 1 1 31 GLY O O 10.439 3.088 17.248 1.00 . A A . 31 GLY O 1 1 16 6826 1 1 1 GLY C C 3.391 1.351 -0.575 1.00 . A A . 1 GLY C 1 1 16 6827 1 1 1 GLY CA C 1.977 1.001 -0.158 1.00 . A A . 1 GLY CA 1 1 16 6828 1 1 1 GLY H1 H 0.346 0.021 -1.088 1.00 . A A . 1 GLY H1 1 1 16 6829 1 1 1 GLY HA2 H 1.402 1.911 -0.074 1.00 . A A . 1 GLY HA2 1 1 16 6830 1 1 1 GLY HA3 H 2.008 0.517 0.807 1.00 . A A . 1 GLY HA3 1 1 16 6831 1 1 1 GLY N N 1.322 0.117 -1.104 1.00 . A A . 1 GLY N 1 1 16 6832 1 1 1 GLY O O 3.623 2.384 -1.202 1.00 . A A . 1 GLY O 1 1 16 6833 1 1 2 TYR C C 6.206 2.082 -0.070 1.00 . A A . 2 TYR C 1 1 16 6834 1 1 2 TYR CA C 5.740 0.715 -0.562 1.00 . A A . 2 TYR CA 1 1 16 6835 1 1 2 TYR CB C 5.945 0.608 -2.074 1.00 . A A . 2 TYR CB 1 1 16 6836 1 1 2 TYR CD1 C 8.457 0.385 -1.934 1.00 . A A . 2 TYR CD1 1 1 16 6837 1 1 2 TYR CD2 C 7.549 1.900 -3.535 1.00 . A A . 2 TYR CD2 1 1 16 6838 1 1 2 TYR CE1 C 9.735 0.715 -2.340 1.00 . A A . 2 TYR CE1 1 1 16 6839 1 1 2 TYR CE2 C 8.824 2.234 -3.949 1.00 . A A . 2 TYR CE2 1 1 16 6840 1 1 2 TYR CG C 7.343 0.971 -2.523 1.00 . A A . 2 TYR CG 1 1 16 6841 1 1 2 TYR CZ C 9.914 1.639 -3.348 1.00 . A A . 2 TYR CZ 1 1 16 6842 1 1 2 TYR H H 4.093 -0.317 0.275 1.00 . A A . 2 TYR H 1 1 16 6843 1 1 2 TYR HA H 6.327 -0.050 -0.074 1.00 . A A . 2 TYR HA 1 1 16 6844 1 1 2 TYR HB2 H 5.751 -0.407 -2.386 1.00 . A A . 2 TYR HB2 1 1 16 6845 1 1 2 TYR HB3 H 5.253 1.271 -2.572 1.00 . A A . 2 TYR HB3 1 1 16 6846 1 1 2 TYR HD1 H 8.314 -0.338 -1.144 1.00 . A A . 2 TYR HD1 1 1 16 6847 1 1 2 TYR HD2 H 6.693 2.364 -4.003 1.00 . A A . 2 TYR HD2 1 1 16 6848 1 1 2 TYR HE1 H 10.589 0.249 -1.870 1.00 . A A . 2 TYR HE1 1 1 16 6849 1 1 2 TYR HE2 H 8.964 2.958 -4.738 1.00 . A A . 2 TYR HE2 1 1 16 6850 1 1 2 TYR HH H 11.204 2.890 -4.032 1.00 . A A . 2 TYR HH 1 1 16 6851 1 1 2 TYR N N 4.340 0.489 -0.224 1.00 . A A . 2 TYR N 1 1 16 6852 1 1 2 TYR O O 6.182 3.064 -0.813 1.00 . A A . 2 TYR O 1 1 16 6853 1 1 2 TYR OH O 11.186 1.970 -3.756 1.00 . A A . 2 TYR OH 1 1 16 6854 1 1 3 CYS C C 8.627 3.435 1.794 1.00 . A A . 3 CYS C 1 1 16 6855 1 1 3 CYS CA C 7.102 3.382 1.782 1.00 . A A . 3 CYS CA 1 1 16 6856 1 1 3 CYS CB C 6.564 3.528 3.207 1.00 . A A . 3 CYS CB 1 1 16 6857 1 1 3 CYS H H 6.625 1.320 1.731 1.00 . A A . 3 CYS H 1 1 16 6858 1 1 3 CYS HA H 6.731 4.198 1.181 1.00 . A A . 3 CYS HA 1 1 16 6859 1 1 3 CYS HB2 H 7.300 3.150 3.901 1.00 . A A . 3 CYS HB2 1 1 16 6860 1 1 3 CYS HB3 H 6.388 4.574 3.411 1.00 . A A . 3 CYS HB3 1 1 16 6861 1 1 3 CYS N N 6.630 2.137 1.188 1.00 . A A . 3 CYS N 1 1 16 6862 1 1 3 CYS O O 9.293 2.571 1.224 1.00 . A A . 3 CYS O 1 1 16 6863 1 1 3 CYS SG S 5.008 2.632 3.509 1.00 . A A . 3 CYS SG 1 1 16 6864 1 1 4 ALA C C 11.185 3.858 3.733 1.00 . A A . 4 ALA C 1 1 16 6865 1 1 4 ALA CA C 10.619 4.618 2.539 1.00 . A A . 4 ALA CA 1 1 16 6866 1 1 4 ALA CB C 10.978 6.094 2.632 1.00 . A A . 4 ALA CB 1 1 16 6867 1 1 4 ALA H H 8.590 5.110 2.884 1.00 . A A . 4 ALA H 1 1 16 6868 1 1 4 ALA HA H 11.056 4.223 1.633 1.00 . A A . 4 ALA HA 1 1 16 6869 1 1 4 ALA HB1 H 10.294 6.587 3.308 1.00 . A A . 4 ALA HB1 1 1 16 6870 1 1 4 ALA HB2 H 11.987 6.196 3.002 1.00 . A A . 4 ALA HB2 1 1 16 6871 1 1 4 ALA HB3 H 10.905 6.544 1.654 1.00 . A A . 4 ALA HB3 1 1 16 6872 1 1 4 ALA N N 9.173 4.454 2.449 1.00 . A A . 4 ALA N 1 1 16 6873 1 1 4 ALA O O 10.969 4.237 4.884 1.00 . A A . 4 ALA O 1 1 16 6874 1 1 5 THR C C 13.838 2.548 4.963 1.00 . A A . 5 THR C 1 1 16 6875 1 1 5 THR CA C 12.507 1.965 4.503 1.00 . A A . 5 THR CA 1 1 16 6876 1 1 5 THR CB C 12.731 0.516 4.031 1.00 . A A . 5 THR CB 1 1 16 6877 1 1 5 THR CG2 C 11.453 -0.299 4.161 1.00 . A A . 5 THR CG2 1 1 16 6878 1 1 5 THR H H 12.048 2.528 2.515 1.00 . A A . 5 THR H 1 1 16 6879 1 1 5 THR HA H 11.824 1.947 5.339 1.00 . A A . 5 THR HA 1 1 16 6880 1 1 5 THR HB H 13.493 0.065 4.651 1.00 . A A . 5 THR HB 1 1 16 6881 1 1 5 THR HG1 H 12.409 0.460 2.086 1.00 . A A . 5 THR HG1 1 1 16 6882 1 1 5 THR HG21 H 11.198 -0.725 3.202 1.00 . A A . 5 THR HG21 1 1 16 6883 1 1 5 THR HG22 H 10.650 0.341 4.496 1.00 . A A . 5 THR HG22 1 1 16 6884 1 1 5 THR HG23 H 11.604 -1.092 4.878 1.00 . A A . 5 THR HG23 1 1 16 6885 1 1 5 THR N N 11.912 2.780 3.452 1.00 . A A . 5 THR N 1 1 16 6886 1 1 5 THR O O 14.331 3.523 4.395 1.00 . A A . 5 THR O 1 1 16 6887 1 1 5 THR OG1 O 13.172 0.506 2.668 1.00 . A A . 5 THR OG1 1 1 16 6888 1 1 6 LYS C C 16.705 2.628 5.415 1.00 . A A . 6 LYS C 1 1 16 6889 1 1 6 LYS CA C 15.693 2.404 6.534 1.00 . A A . 6 LYS CA 1 1 16 6890 1 1 6 LYS CB C 16.243 1.386 7.536 1.00 . A A . 6 LYS CB 1 1 16 6891 1 1 6 LYS CD C 17.418 -0.800 7.918 1.00 . A A . 6 LYS CD 1 1 16 6892 1 1 6 LYS CE C 17.598 -2.185 7.315 1.00 . A A . 6 LYS CE 1 1 16 6893 1 1 6 LYS CG C 16.929 0.199 6.883 1.00 . A A . 6 LYS CG 1 1 16 6894 1 1 6 LYS H H 13.975 1.173 6.408 1.00 . A A . 6 LYS H 1 1 16 6895 1 1 6 LYS HA H 15.522 3.341 7.041 1.00 . A A . 6 LYS HA 1 1 16 6896 1 1 6 LYS HB2 H 16.957 1.881 8.177 1.00 . A A . 6 LYS HB2 1 1 16 6897 1 1 6 LYS HB3 H 15.426 1.017 8.140 1.00 . A A . 6 LYS HB3 1 1 16 6898 1 1 6 LYS HD2 H 18.367 -0.465 8.310 1.00 . A A . 6 LYS HD2 1 1 16 6899 1 1 6 LYS HD3 H 16.696 -0.857 8.721 1.00 . A A . 6 LYS HD3 1 1 16 6900 1 1 6 LYS HE2 H 17.505 -2.111 6.242 1.00 . A A . 6 LYS HE2 1 1 16 6901 1 1 6 LYS HE3 H 18.583 -2.548 7.567 1.00 . A A . 6 LYS HE3 1 1 16 6902 1 1 6 LYS HG2 H 16.228 -0.294 6.226 1.00 . A A . 6 LYS HG2 1 1 16 6903 1 1 6 LYS HG3 H 17.774 0.554 6.311 1.00 . A A . 6 LYS HG3 1 1 16 6904 1 1 6 LYS HZ1 H 16.795 -3.403 8.810 1.00 . A A . 6 LYS HZ1 1 1 16 6905 1 1 6 LYS HZ2 H 16.588 -4.012 7.245 1.00 . A A . 6 LYS HZ2 1 1 16 6906 1 1 6 LYS HZ3 H 15.634 -2.722 7.783 1.00 . A A . 6 LYS HZ3 1 1 16 6907 1 1 6 LYS N N 14.417 1.946 5.997 1.00 . A A . 6 LYS N 1 1 16 6908 1 1 6 LYS NZ N 16.582 -3.148 7.824 1.00 . A A . 6 LYS NZ 1 1 16 6909 1 1 6 LYS O O 16.812 1.823 4.491 1.00 . A A . 6 LYS O 1 1 16 6910 1 1 7 GLY C C 17.880 4.884 3.369 1.00 . A A . 7 GLY C 1 1 16 6911 1 1 7 GLY CA C 18.441 4.037 4.495 1.00 . A A . 7 GLY CA 1 1 16 6912 1 1 7 GLY H H 17.318 4.334 6.265 1.00 . A A . 7 GLY H 1 1 16 6913 1 1 7 GLY HA2 H 19.258 4.570 4.960 1.00 . A A . 7 GLY HA2 1 1 16 6914 1 1 7 GLY HA3 H 18.817 3.113 4.081 1.00 . A A . 7 GLY HA3 1 1 16 6915 1 1 7 GLY N N 17.447 3.728 5.505 1.00 . A A . 7 GLY N 1 1 16 6916 1 1 7 GLY O O 18.632 5.494 2.609 1.00 . A A . 7 GLY O 1 1 16 6917 1 1 8 ILE C C 15.624 7.123 2.688 1.00 . A A . 8 ILE C 1 1 16 6918 1 1 8 ILE CA C 15.896 5.698 2.220 1.00 . A A . 8 ILE CA 1 1 16 6919 1 1 8 ILE CB C 14.568 5.048 1.790 1.00 . A A . 8 ILE CB 1 1 16 6920 1 1 8 ILE CD1 C 15.673 3.323 0.279 1.00 . A A . 8 ILE CD1 1 1 16 6921 1 1 8 ILE CG1 C 14.779 3.565 1.475 1.00 . A A . 8 ILE CG1 1 1 16 6922 1 1 8 ILE CG2 C 13.990 5.774 0.584 1.00 . A A . 8 ILE CG2 1 1 16 6923 1 1 8 ILE H H 16.011 4.412 3.898 1.00 . A A . 8 ILE H 1 1 16 6924 1 1 8 ILE HA H 16.553 5.731 1.363 1.00 . A A . 8 ILE HA 1 1 16 6925 1 1 8 ILE HB H 13.867 5.139 2.605 1.00 . A A . 8 ILE HB 1 1 16 6926 1 1 8 ILE HD11 H 16.649 3.746 0.467 1.00 . A A . 8 ILE HD11 1 1 16 6927 1 1 8 ILE HD12 H 15.767 2.261 0.109 1.00 . A A . 8 ILE HD12 1 1 16 6928 1 1 8 ILE HD13 H 15.241 3.790 -0.594 1.00 . A A . 8 ILE HD13 1 1 16 6929 1 1 8 ILE HG12 H 15.229 3.083 2.328 1.00 . A A . 8 ILE HG12 1 1 16 6930 1 1 8 ILE HG13 H 13.821 3.109 1.272 1.00 . A A . 8 ILE HG13 1 1 16 6931 1 1 8 ILE HG21 H 13.818 6.810 0.836 1.00 . A A . 8 ILE HG21 1 1 16 6932 1 1 8 ILE HG22 H 14.686 5.715 -0.239 1.00 . A A . 8 ILE HG22 1 1 16 6933 1 1 8 ILE HG23 H 13.056 5.313 0.300 1.00 . A A . 8 ILE HG23 1 1 16 6934 1 1 8 ILE N N 16.557 4.920 3.262 1.00 . A A . 8 ILE N 1 1 16 6935 1 1 8 ILE O O 15.085 7.340 3.774 1.00 . A A . 8 ILE O 1 1 16 6936 1 1 9 LYS C C 14.343 9.758 2.590 1.00 . A A . 9 LYS C 1 1 16 6937 1 1 9 LYS CA C 15.791 9.499 2.187 1.00 . A A . 9 LYS CA 1 1 16 6938 1 1 9 LYS CB C 16.164 10.381 0.992 1.00 . A A . 9 LYS CB 1 1 16 6939 1 1 9 LYS CD C 18.476 11.319 0.705 1.00 . A A . 9 LYS CD 1 1 16 6940 1 1 9 LYS CE C 18.467 12.277 -0.476 1.00 . A A . 9 LYS CE 1 1 16 6941 1 1 9 LYS CG C 17.565 10.128 0.463 1.00 . A A . 9 LYS CG 1 1 16 6942 1 1 9 LYS H H 16.422 7.857 1.009 1.00 . A A . 9 LYS H 1 1 16 6943 1 1 9 LYS HA H 16.434 9.745 3.019 1.00 . A A . 9 LYS HA 1 1 16 6944 1 1 9 LYS HB2 H 15.461 10.199 0.193 1.00 . A A . 9 LYS HB2 1 1 16 6945 1 1 9 LYS HB3 H 16.096 11.417 1.290 1.00 . A A . 9 LYS HB3 1 1 16 6946 1 1 9 LYS HD2 H 18.139 11.847 1.585 1.00 . A A . 9 LYS HD2 1 1 16 6947 1 1 9 LYS HD3 H 19.485 10.964 0.862 1.00 . A A . 9 LYS HD3 1 1 16 6948 1 1 9 LYS HE2 H 17.493 12.248 -0.939 1.00 . A A . 9 LYS HE2 1 1 16 6949 1 1 9 LYS HE3 H 18.663 13.276 -0.114 1.00 . A A . 9 LYS HE3 1 1 16 6950 1 1 9 LYS HG2 H 17.979 9.264 0.963 1.00 . A A . 9 LYS HG2 1 1 16 6951 1 1 9 LYS HG3 H 17.510 9.938 -0.599 1.00 . A A . 9 LYS HG3 1 1 16 6952 1 1 9 LYS HZ1 H 20.447 12.128 -1.123 1.00 . A A . 9 LYS HZ1 1 1 16 6953 1 1 9 LYS HZ2 H 19.345 12.463 -2.362 1.00 . A A . 9 LYS HZ2 1 1 16 6954 1 1 9 LYS HZ3 H 19.440 10.904 -1.713 1.00 . A A . 9 LYS HZ3 1 1 16 6955 1 1 9 LYS N N 15.998 8.093 1.861 1.00 . A A . 9 LYS N 1 1 16 6956 1 1 9 LYS NZ N 19.497 11.918 -1.490 1.00 . A A . 9 LYS NZ 1 1 16 6957 1 1 9 LYS O O 13.415 9.209 1.996 1.00 . A A . 9 LYS O 1 1 16 6958 1 1 10 CYS C C 12.573 12.433 4.004 1.00 . A A . 10 CYS C 1 1 16 6959 1 1 10 CYS CA C 12.822 10.930 4.086 1.00 . A A . 10 CYS CA 1 1 16 6960 1 1 10 CYS CB C 12.644 10.450 5.527 1.00 . A A . 10 CYS CB 1 1 16 6961 1 1 10 CYS H H 14.937 11.004 4.037 1.00 . A A . 10 CYS H 1 1 16 6962 1 1 10 CYS HA H 12.106 10.424 3.456 1.00 . A A . 10 CYS HA 1 1 16 6963 1 1 10 CYS HB2 H 11.590 10.326 5.730 1.00 . A A . 10 CYS HB2 1 1 16 6964 1 1 10 CYS HB3 H 13.142 9.499 5.646 1.00 . A A . 10 CYS HB3 1 1 16 6965 1 1 10 CYS N N 14.157 10.597 3.603 1.00 . A A . 10 CYS N 1 1 16 6966 1 1 10 CYS O O 11.627 12.949 4.597 1.00 . A A . 10 CYS O 1 1 16 6967 1 1 10 CYS SG S 13.317 11.590 6.779 1.00 . A A . 10 CYS SG 1 1 16 6968 1 1 11 ASN C C 11.970 14.934 2.453 1.00 . A A . 11 ASN C 1 1 16 6969 1 1 11 ASN CA C 13.302 14.574 3.104 1.00 . A A . 11 ASN CA 1 1 16 6970 1 1 11 ASN CB C 14.458 15.118 2.262 1.00 . A A . 11 ASN CB 1 1 16 6971 1 1 11 ASN CG C 14.269 16.577 1.895 1.00 . A A . 11 ASN CG 1 1 16 6972 1 1 11 ASN H H 14.164 12.662 2.814 1.00 . A A . 11 ASN H 1 1 16 6973 1 1 11 ASN HA H 13.342 15.021 4.086 1.00 . A A . 11 ASN HA 1 1 16 6974 1 1 11 ASN HB2 H 15.378 15.024 2.821 1.00 . A A . 11 ASN HB2 1 1 16 6975 1 1 11 ASN HB3 H 14.535 14.544 1.351 1.00 . A A . 11 ASN HB3 1 1 16 6976 1 1 11 ASN HD21 H 14.233 17.082 3.818 1.00 . A A . 11 ASN HD21 1 1 16 6977 1 1 11 ASN HD22 H 14.052 18.384 2.696 1.00 . A A . 11 ASN HD22 1 1 16 6978 1 1 11 ASN N N 13.429 13.130 3.264 1.00 . A A . 11 ASN N 1 1 16 6979 1 1 11 ASN ND2 N 14.176 17.434 2.905 1.00 . A A . 11 ASN ND2 1 1 16 6980 1 1 11 ASN O O 11.507 16.071 2.551 1.00 . A A . 11 ASN O 1 1 16 6981 1 1 11 ASN OD1 O 14.208 16.930 0.717 1.00 . A A . 11 ASN OD1 1 1 16 6982 1 1 12 ASP C C 9.146 12.988 1.348 1.00 . A A . 12 ASP C 1 1 16 6983 1 1 12 ASP CA C 10.080 14.173 1.122 1.00 . A A . 12 ASP CA 1 1 16 6984 1 1 12 ASP CB C 10.292 14.392 -0.377 1.00 . A A . 12 ASP CB 1 1 16 6985 1 1 12 ASP CG C 11.408 13.532 -0.936 1.00 . A A . 12 ASP CG 1 1 16 6986 1 1 12 ASP H H 11.780 13.074 1.746 1.00 . A A . 12 ASP H 1 1 16 6987 1 1 12 ASP HA H 9.629 15.057 1.546 1.00 . A A . 12 ASP HA 1 1 16 6988 1 1 12 ASP HB2 H 9.379 14.151 -0.902 1.00 . A A . 12 ASP HB2 1 1 16 6989 1 1 12 ASP HB3 H 10.539 15.429 -0.550 1.00 . A A . 12 ASP HB3 1 1 16 6990 1 1 12 ASP N N 11.360 13.959 1.788 1.00 . A A . 12 ASP N 1 1 16 6991 1 1 12 ASP O O 8.024 13.153 1.828 1.00 . A A . 12 ASP O 1 1 16 6992 1 1 12 ASP OD1 O 11.111 12.428 -1.440 1.00 . A A . 12 ASP OD1 1 1 16 6993 1 1 12 ASP OD2 O 12.578 13.963 -0.871 1.00 . A A . 12 ASP OD2 1 1 16 6994 1 1 13 ILE C C 8.760 10.163 2.629 1.00 . A A . 13 ILE C 1 1 16 6995 1 1 13 ILE CA C 8.822 10.584 1.164 1.00 . A A . 13 ILE CA 1 1 16 6996 1 1 13 ILE CB C 9.391 9.420 0.331 1.00 . A A . 13 ILE CB 1 1 16 6997 1 1 13 ILE CD1 C 8.324 7.527 -0.993 1.00 . A A . 13 ILE CD1 1 1 16 6998 1 1 13 ILE CG1 C 8.421 8.237 0.339 1.00 . A A . 13 ILE CG1 1 1 16 6999 1 1 13 ILE CG2 C 10.752 9.001 0.867 1.00 . A A . 13 ILE CG2 1 1 16 7000 1 1 13 ILE H H 10.518 11.728 0.623 1.00 . A A . 13 ILE H 1 1 16 7001 1 1 13 ILE HA H 7.820 10.792 0.818 1.00 . A A . 13 ILE HA 1 1 16 7002 1 1 13 ILE HB H 9.521 9.763 -0.684 1.00 . A A . 13 ILE HB 1 1 16 7003 1 1 13 ILE HD11 H 9.261 7.621 -1.521 1.00 . A A . 13 ILE HD11 1 1 16 7004 1 1 13 ILE HD12 H 8.104 6.483 -0.830 1.00 . A A . 13 ILE HD12 1 1 16 7005 1 1 13 ILE HD13 H 7.534 7.973 -1.581 1.00 . A A . 13 ILE HD13 1 1 16 7006 1 1 13 ILE HG12 H 8.747 7.518 1.074 1.00 . A A . 13 ILE HG12 1 1 16 7007 1 1 13 ILE HG13 H 7.435 8.591 0.600 1.00 . A A . 13 ILE HG13 1 1 16 7008 1 1 13 ILE HG21 H 11.385 9.870 0.962 1.00 . A A . 13 ILE HG21 1 1 16 7009 1 1 13 ILE HG22 H 10.630 8.538 1.835 1.00 . A A . 13 ILE HG22 1 1 16 7010 1 1 13 ILE HG23 H 11.206 8.297 0.186 1.00 . A A . 13 ILE HG23 1 1 16 7011 1 1 13 ILE N N 9.616 11.795 0.999 1.00 . A A . 13 ILE N 1 1 16 7012 1 1 13 ILE O O 9.722 10.335 3.377 1.00 . A A . 13 ILE O 1 1 16 7013 1 1 14 HIS C C 7.740 7.671 4.539 1.00 . A A . 14 HIS C 1 1 16 7014 1 1 14 HIS CA C 7.433 9.160 4.406 1.00 . A A . 14 HIS CA 1 1 16 7015 1 1 14 HIS CB C 6.002 9.440 4.866 1.00 . A A . 14 HIS CB 1 1 16 7016 1 1 14 HIS CD2 C 5.967 12.017 5.157 1.00 . A A . 14 HIS CD2 1 1 16 7017 1 1 14 HIS CE1 C 4.396 12.483 3.701 1.00 . A A . 14 HIS CE1 1 1 16 7018 1 1 14 HIS CG C 5.557 10.847 4.613 1.00 . A A . 14 HIS CG 1 1 16 7019 1 1 14 HIS H H 6.890 9.497 2.388 1.00 . A A . 14 HIS H 1 1 16 7020 1 1 14 HIS HA H 8.117 9.712 5.032 1.00 . A A . 14 HIS HA 1 1 16 7021 1 1 14 HIS HB2 H 5.327 8.780 4.341 1.00 . A A . 14 HIS HB2 1 1 16 7022 1 1 14 HIS HB3 H 5.928 9.253 5.927 1.00 . A A . 14 HIS HB3 1 1 16 7023 1 1 14 HIS HD1 H 4.075 10.540 3.147 1.00 . A A . 14 HIS HD1 1 1 16 7024 1 1 14 HIS HD2 H 6.733 12.141 5.910 1.00 . A A . 14 HIS HD2 1 1 16 7025 1 1 14 HIS HE1 H 3.690 13.024 3.089 1.00 . A A . 14 HIS HE1 1 1 16 7026 1 1 14 HIS N N 7.621 9.608 3.031 1.00 . A A . 14 HIS N 1 1 16 7027 1 1 14 HIS ND1 N 4.571 11.174 3.706 1.00 . A A . 14 HIS ND1 1 1 16 7028 1 1 14 HIS NE2 N 5.231 13.018 4.573 1.00 . A A . 14 HIS NE2 1 1 16 7029 1 1 14 HIS O O 7.627 6.915 3.574 1.00 . A A . 14 HIS O 1 1 16 7030 1 1 15 CYS C C 7.220 5.091 6.462 1.00 . A A . 15 CYS C 1 1 16 7031 1 1 15 CYS CA C 8.454 5.859 6.000 1.00 . A A . 15 CYS CA 1 1 16 7032 1 1 15 CYS CB C 9.557 5.758 7.055 1.00 . A A . 15 CYS CB 1 1 16 7033 1 1 15 CYS H H 8.200 7.907 6.471 1.00 . A A . 15 CYS H 1 1 16 7034 1 1 15 CYS HA H 8.809 5.424 5.078 1.00 . A A . 15 CYS HA 1 1 16 7035 1 1 15 CYS HB2 H 9.105 5.752 8.037 1.00 . A A . 15 CYS HB2 1 1 16 7036 1 1 15 CYS HB3 H 10.100 4.836 6.910 1.00 . A A . 15 CYS HB3 1 1 16 7037 1 1 15 CYS N N 8.129 7.257 5.740 1.00 . A A . 15 CYS N 1 1 16 7038 1 1 15 CYS O O 6.283 5.671 7.011 1.00 . A A . 15 CYS O 1 1 16 7039 1 1 15 CYS SG S 10.760 7.125 7.008 1.00 . A A . 15 CYS SG 1 1 16 7040 1 1 16 CYS C C 5.924 2.940 8.144 1.00 . A A . 16 CYS C 1 1 16 7041 1 1 16 CYS CA C 6.108 2.932 6.629 1.00 . A A . 16 CYS CA 1 1 16 7042 1 1 16 CYS CB C 6.332 1.500 6.139 1.00 . A A . 16 CYS CB 1 1 16 7043 1 1 16 CYS H H 8.002 3.376 5.795 1.00 . A A . 16 CYS H 1 1 16 7044 1 1 16 CYS HA H 5.215 3.325 6.168 1.00 . A A . 16 CYS HA 1 1 16 7045 1 1 16 CYS HB2 H 7.394 1.320 6.051 1.00 . A A . 16 CYS HB2 1 1 16 7046 1 1 16 CYS HB3 H 5.915 0.812 6.859 1.00 . A A . 16 CYS HB3 1 1 16 7047 1 1 16 CYS N N 7.226 3.781 6.236 1.00 . A A . 16 CYS N 1 1 16 7048 1 1 16 CYS O O 6.871 3.179 8.893 1.00 . A A . 16 CYS O 1 1 16 7049 1 1 16 CYS SG S 5.574 1.140 4.523 1.00 . A A . 16 CYS SG 1 1 16 7050 1 1 17 SER C C 5.373 1.770 10.769 1.00 . A A . 17 SER C 1 1 16 7051 1 1 17 SER CA C 4.390 2.658 10.012 1.00 . A A . 17 SER CA 1 1 16 7052 1 1 17 SER CB C 2.960 2.163 10.238 1.00 . A A . 17 SER CB 1 1 16 7053 1 1 17 SER H H 3.986 2.495 7.940 1.00 . A A . 17 SER H 1 1 16 7054 1 1 17 SER HA H 4.475 3.668 10.383 1.00 . A A . 17 SER HA 1 1 16 7055 1 1 17 SER HB2 H 2.760 1.333 9.578 1.00 . A A . 17 SER HB2 1 1 16 7056 1 1 17 SER HB3 H 2.851 1.842 11.264 1.00 . A A . 17 SER HB3 1 1 16 7057 1 1 17 SER HG H 1.548 2.995 9.164 1.00 . A A . 17 SER HG 1 1 16 7058 1 1 17 SER N N 4.699 2.677 8.587 1.00 . A A . 17 SER N 1 1 16 7059 1 1 17 SER O O 5.369 0.550 10.617 1.00 . A A . 17 SER O 1 1 16 7060 1 1 17 SER OG O 2.018 3.190 9.978 1.00 . A A . 17 SER OG 1 1 16 7061 1 1 18 GLY C C 8.583 2.244 12.262 1.00 . A A . 18 GLY C 1 1 16 7062 1 1 18 GLY CA C 7.193 1.647 12.357 1.00 . A A . 18 GLY CA 1 1 16 7063 1 1 18 GLY H H 6.172 3.370 11.669 1.00 . A A . 18 GLY H 1 1 16 7064 1 1 18 GLY HA2 H 6.887 1.635 13.392 1.00 . A A . 18 GLY HA2 1 1 16 7065 1 1 18 GLY HA3 H 7.223 0.632 11.989 1.00 . A A . 18 GLY HA3 1 1 16 7066 1 1 18 GLY N N 6.215 2.395 11.587 1.00 . A A . 18 GLY N 1 1 16 7067 1 1 18 GLY O O 9.451 1.948 13.085 1.00 . A A . 18 GLY O 1 1 16 7068 1 1 19 LEU C C 10.008 5.223 11.321 1.00 . A A . 19 LEU C 1 1 16 7069 1 1 19 LEU CA C 10.093 3.723 11.056 1.00 . A A . 19 LEU CA 1 1 16 7070 1 1 19 LEU CB C 10.593 3.473 9.632 1.00 . A A . 19 LEU CB 1 1 16 7071 1 1 19 LEU CD1 C 11.174 1.873 7.792 1.00 . A A . 19 LEU CD1 1 1 16 7072 1 1 19 LEU CD2 C 12.154 1.561 10.072 1.00 . A A . 19 LEU CD2 1 1 16 7073 1 1 19 LEU CG C 10.935 2.023 9.286 1.00 . A A . 19 LEU CG 1 1 16 7074 1 1 19 LEU H H 8.067 3.281 10.634 1.00 . A A . 19 LEU H 1 1 16 7075 1 1 19 LEU HA H 10.790 3.285 11.755 1.00 . A A . 19 LEU HA 1 1 16 7076 1 1 19 LEU HB2 H 9.824 3.802 8.950 1.00 . A A . 19 LEU HB2 1 1 16 7077 1 1 19 LEU HB3 H 11.482 4.068 9.485 1.00 . A A . 19 LEU HB3 1 1 16 7078 1 1 19 LEU HD11 H 12.020 2.477 7.500 1.00 . A A . 19 LEU HD11 1 1 16 7079 1 1 19 LEU HD12 H 10.297 2.198 7.253 1.00 . A A . 19 LEU HD12 1 1 16 7080 1 1 19 LEU HD13 H 11.374 0.837 7.561 1.00 . A A . 19 LEU HD13 1 1 16 7081 1 1 19 LEU HD21 H 13.051 1.898 9.574 1.00 . A A . 19 LEU HD21 1 1 16 7082 1 1 19 LEU HD22 H 12.158 0.482 10.129 1.00 . A A . 19 LEU HD22 1 1 16 7083 1 1 19 LEU HD23 H 12.118 1.975 11.068 1.00 . A A . 19 LEU HD23 1 1 16 7084 1 1 19 LEU HG H 10.102 1.389 9.556 1.00 . A A . 19 LEU HG 1 1 16 7085 1 1 19 LEU N N 8.797 3.085 11.257 1.00 . A A . 19 LEU N 1 1 16 7086 1 1 19 LEU O O 8.942 5.827 11.199 1.00 . A A . 19 LEU O 1 1 16 7087 1 1 20 LYS C C 11.903 7.996 10.836 1.00 . A A . 20 LYS C 1 1 16 7088 1 1 20 LYS CA C 11.195 7.250 11.962 1.00 . A A . 20 LYS CA 1 1 16 7089 1 1 20 LYS CB C 11.915 7.504 13.288 1.00 . A A . 20 LYS CB 1 1 16 7090 1 1 20 LYS CD C 10.314 8.744 14.774 1.00 . A A . 20 LYS CD 1 1 16 7091 1 1 20 LYS CE C 9.024 8.550 15.557 1.00 . A A . 20 LYS CE 1 1 16 7092 1 1 20 LYS CG C 11.004 7.418 14.501 1.00 . A A . 20 LYS CG 1 1 16 7093 1 1 20 LYS H H 11.957 5.285 11.763 1.00 . A A . 20 LYS H 1 1 16 7094 1 1 20 LYS HA H 10.181 7.613 12.037 1.00 . A A . 20 LYS HA 1 1 16 7095 1 1 20 LYS HB2 H 12.701 6.773 13.403 1.00 . A A . 20 LYS HB2 1 1 16 7096 1 1 20 LYS HB3 H 12.353 8.491 13.263 1.00 . A A . 20 LYS HB3 1 1 16 7097 1 1 20 LYS HD2 H 10.978 9.374 15.348 1.00 . A A . 20 LYS HD2 1 1 16 7098 1 1 20 LYS HD3 H 10.085 9.222 13.832 1.00 . A A . 20 LYS HD3 1 1 16 7099 1 1 20 LYS HE2 H 8.193 8.840 14.932 1.00 . A A . 20 LYS HE2 1 1 16 7100 1 1 20 LYS HE3 H 8.931 7.507 15.819 1.00 . A A . 20 LYS HE3 1 1 16 7101 1 1 20 LYS HG2 H 10.252 6.664 14.322 1.00 . A A . 20 LYS HG2 1 1 16 7102 1 1 20 LYS HG3 H 11.593 7.144 15.364 1.00 . A A . 20 LYS HG3 1 1 16 7103 1 1 20 LYS HZ1 H 8.975 10.379 16.564 1.00 . A A . 20 LYS HZ1 1 1 16 7104 1 1 20 LYS HZ2 H 9.855 9.179 17.367 1.00 . A A . 20 LYS HZ2 1 1 16 7105 1 1 20 LYS HZ3 H 8.164 9.131 17.369 1.00 . A A . 20 LYS HZ3 1 1 16 7106 1 1 20 LYS N N 11.139 5.819 11.683 1.00 . A A . 20 LYS N 1 1 16 7107 1 1 20 LYS NZ N 9.002 9.367 16.802 1.00 . A A . 20 LYS NZ 1 1 16 7108 1 1 20 LYS O O 12.803 7.459 10.191 1.00 . A A . 20 LYS O 1 1 16 7109 1 1 21 CYS C C 13.188 10.951 10.127 1.00 . A A . 21 CYS C 1 1 16 7110 1 1 21 CYS CA C 12.087 10.060 9.559 1.00 . A A . 21 CYS CA 1 1 16 7111 1 1 21 CYS CB C 11.016 10.921 8.886 1.00 . A A . 21 CYS CB 1 1 16 7112 1 1 21 CYS H H 10.769 9.613 11.154 1.00 . A A . 21 CYS H 1 1 16 7113 1 1 21 CYS HA H 12.519 9.399 8.824 1.00 . A A . 21 CYS HA 1 1 16 7114 1 1 21 CYS HB2 H 10.371 10.285 8.298 1.00 . A A . 21 CYS HB2 1 1 16 7115 1 1 21 CYS HB3 H 10.430 11.414 9.648 1.00 . A A . 21 CYS HB3 1 1 16 7116 1 1 21 CYS N N 11.492 9.239 10.606 1.00 . A A . 21 CYS N 1 1 16 7117 1 1 21 CYS O O 12.923 12.053 10.607 1.00 . A A . 21 CYS O 1 1 16 7118 1 1 21 CYS SG S 11.681 12.206 7.780 1.00 . A A . 21 CYS SG 1 1 16 7119 1 1 22 ASP C C 15.688 12.563 9.866 1.00 . A A . 22 ASP C 1 1 16 7120 1 1 22 ASP CA C 15.565 11.217 10.575 1.00 . A A . 22 ASP CA 1 1 16 7121 1 1 22 ASP CB C 16.853 10.412 10.395 1.00 . A A . 22 ASP CB 1 1 16 7122 1 1 22 ASP CG C 17.900 10.754 11.437 1.00 . A A . 22 ASP CG 1 1 16 7123 1 1 22 ASP H H 14.570 9.580 9.673 1.00 . A A . 22 ASP H 1 1 16 7124 1 1 22 ASP HA H 15.406 11.393 11.628 1.00 . A A . 22 ASP HA 1 1 16 7125 1 1 22 ASP HB2 H 16.626 9.359 10.472 1.00 . A A . 22 ASP HB2 1 1 16 7126 1 1 22 ASP HB3 H 17.264 10.617 9.417 1.00 . A A . 22 ASP HB3 1 1 16 7127 1 1 22 ASP N N 14.423 10.466 10.068 1.00 . A A . 22 ASP N 1 1 16 7128 1 1 22 ASP O O 16.173 12.639 8.737 1.00 . A A . 22 ASP O 1 1 16 7129 1 1 22 ASP OD1 O 18.880 9.991 11.566 1.00 . A A . 22 ASP OD1 1 1 16 7130 1 1 22 ASP OD2 O 17.740 11.785 12.122 1.00 . A A . 22 ASP OD2 1 1 16 7131 1 1 23 SER C C 16.731 15.496 9.972 1.00 . A A . 23 SER C 1 1 16 7132 1 1 23 SER CA C 15.301 14.964 9.968 1.00 . A A . 23 SER CA 1 1 16 7133 1 1 23 SER CB C 14.390 15.910 10.753 1.00 . A A . 23 SER CB 1 1 16 7134 1 1 23 SER H H 14.869 13.496 11.432 1.00 . A A . 23 SER H 1 1 16 7135 1 1 23 SER HA H 14.953 14.907 8.948 1.00 . A A . 23 SER HA 1 1 16 7136 1 1 23 SER HB2 H 13.359 15.658 10.557 1.00 . A A . 23 SER HB2 1 1 16 7137 1 1 23 SER HB3 H 14.592 15.806 11.809 1.00 . A A . 23 SER HB3 1 1 16 7138 1 1 23 SER HG H 15.307 17.633 10.919 1.00 . A A . 23 SER HG 1 1 16 7139 1 1 23 SER N N 15.245 13.622 10.536 1.00 . A A . 23 SER N 1 1 16 7140 1 1 23 SER O O 17.034 16.499 9.326 1.00 . A A . 23 SER O 1 1 16 7141 1 1 23 SER OG O 14.610 17.258 10.376 1.00 . A A . 23 SER OG 1 1 16 7142 1 1 24 LYS C C 19.812 14.640 9.635 1.00 . A A . 24 LYS C 1 1 16 7143 1 1 24 LYS CA C 19.005 15.218 10.793 1.00 . A A . 24 LYS CA 1 1 16 7144 1 1 24 LYS CB C 19.605 14.759 12.125 1.00 . A A . 24 LYS CB 1 1 16 7145 1 1 24 LYS CD C 20.458 16.638 13.557 1.00 . A A . 24 LYS CD 1 1 16 7146 1 1 24 LYS CE C 19.970 17.986 14.065 1.00 . A A . 24 LYS CE 1 1 16 7147 1 1 24 LYS CG C 19.300 15.694 13.283 1.00 . A A . 24 LYS CG 1 1 16 7148 1 1 24 LYS H H 17.304 14.024 11.197 1.00 . A A . 24 LYS H 1 1 16 7149 1 1 24 LYS HA H 19.045 16.295 10.742 1.00 . A A . 24 LYS HA 1 1 16 7150 1 1 24 LYS HB2 H 19.213 13.782 12.365 1.00 . A A . 24 LYS HB2 1 1 16 7151 1 1 24 LYS HB3 H 20.678 14.691 12.018 1.00 . A A . 24 LYS HB3 1 1 16 7152 1 1 24 LYS HD2 H 21.102 16.197 14.304 1.00 . A A . 24 LYS HD2 1 1 16 7153 1 1 24 LYS HD3 H 21.014 16.788 12.642 1.00 . A A . 24 LYS HD3 1 1 16 7154 1 1 24 LYS HE2 H 20.620 18.757 13.683 1.00 . A A . 24 LYS HE2 1 1 16 7155 1 1 24 LYS HE3 H 18.965 18.150 13.703 1.00 . A A . 24 LYS HE3 1 1 16 7156 1 1 24 LYS HG2 H 18.423 16.277 13.042 1.00 . A A . 24 LYS HG2 1 1 16 7157 1 1 24 LYS HG3 H 19.110 15.104 14.169 1.00 . A A . 24 LYS HG3 1 1 16 7158 1 1 24 LYS HZ1 H 19.712 17.122 15.949 1.00 . A A . 24 LYS HZ1 1 1 16 7159 1 1 24 LYS HZ2 H 19.273 18.754 15.879 1.00 . A A . 24 LYS HZ2 1 1 16 7160 1 1 24 LYS HZ3 H 20.907 18.318 15.902 1.00 . A A . 24 LYS HZ3 1 1 16 7161 1 1 24 LYS N N 17.606 14.816 10.705 1.00 . A A . 24 LYS N 1 1 16 7162 1 1 24 LYS NZ N 19.965 18.050 15.553 1.00 . A A . 24 LYS NZ 1 1 16 7163 1 1 24 LYS O O 20.637 15.330 9.036 1.00 . A A . 24 LYS O 1 1 16 7164 1 1 25 ARG C C 19.398 12.634 6.985 1.00 . A A . 25 ARG C 1 1 16 7165 1 1 25 ARG CA C 20.269 12.702 8.236 1.00 . A A . 25 ARG CA 1 1 16 7166 1 1 25 ARG CB C 20.683 11.292 8.660 1.00 . A A . 25 ARG CB 1 1 16 7167 1 1 25 ARG CD C 22.648 10.136 9.717 1.00 . A A . 25 ARG CD 1 1 16 7168 1 1 25 ARG CG C 21.640 11.267 9.841 1.00 . A A . 25 ARG CG 1 1 16 7169 1 1 25 ARG CZ C 24.449 10.763 11.270 1.00 . A A . 25 ARG CZ 1 1 16 7170 1 1 25 ARG H H 18.896 12.874 9.837 1.00 . A A . 25 ARG H 1 1 16 7171 1 1 25 ARG HA H 21.156 13.276 8.011 1.00 . A A . 25 ARG HA 1 1 16 7172 1 1 25 ARG HB2 H 19.798 10.735 8.930 1.00 . A A . 25 ARG HB2 1 1 16 7173 1 1 25 ARG HB3 H 21.164 10.805 7.825 1.00 . A A . 25 ARG HB3 1 1 16 7174 1 1 25 ARG HD2 H 22.117 9.217 9.516 1.00 . A A . 25 ARG HD2 1 1 16 7175 1 1 25 ARG HD3 H 23.314 10.353 8.895 1.00 . A A . 25 ARG HD3 1 1 16 7176 1 1 25 ARG HE H 23.199 9.230 11.533 1.00 . A A . 25 ARG HE 1 1 16 7177 1 1 25 ARG HG2 H 22.172 12.206 9.881 1.00 . A A . 25 ARG HG2 1 1 16 7178 1 1 25 ARG HG3 H 21.071 11.133 10.749 1.00 . A A . 25 ARG HG3 1 1 16 7179 1 1 25 ARG HH11 H 24.289 11.937 9.633 1.00 . A A . 25 ARG HH11 1 1 16 7180 1 1 25 ARG HH12 H 25.554 12.368 10.736 1.00 . A A . 25 ARG HH12 1 1 16 7181 1 1 25 ARG HH21 H 24.861 9.788 12.992 1.00 . A A . 25 ARG HH21 1 1 16 7182 1 1 25 ARG HH22 H 25.879 11.145 12.645 1.00 . A A . 25 ARG HH22 1 1 16 7183 1 1 25 ARG N N 19.566 13.372 9.323 1.00 . A A . 25 ARG N 1 1 16 7184 1 1 25 ARG NE N 23.437 9.970 10.935 1.00 . A A . 25 ARG NE 1 1 16 7185 1 1 25 ARG NH1 N 24.793 11.772 10.481 1.00 . A A . 25 ARG NH1 1 1 16 7186 1 1 25 ARG NH2 N 25.118 10.548 12.395 1.00 . A A . 25 ARG NH2 1 1 16 7187 1 1 25 ARG O O 19.795 12.065 5.968 1.00 . A A . 25 ARG O 1 1 16 7188 1 1 26 LYS C C 17.066 11.813 5.404 1.00 . A A . 26 LYS C 1 1 16 7189 1 1 26 LYS CA C 17.278 13.223 5.944 1.00 . A A . 26 LYS CA 1 1 16 7190 1 1 26 LYS CB C 17.800 14.134 4.830 1.00 . A A . 26 LYS CB 1 1 16 7191 1 1 26 LYS CD C 18.411 16.466 4.124 1.00 . A A . 26 LYS CD 1 1 16 7192 1 1 26 LYS CE C 19.431 17.380 4.786 1.00 . A A . 26 LYS CE 1 1 16 7193 1 1 26 LYS CG C 17.680 15.614 5.148 1.00 . A A . 26 LYS CG 1 1 16 7194 1 1 26 LYS H H 17.946 13.654 7.906 1.00 . A A . 26 LYS H 1 1 16 7195 1 1 26 LYS HA H 16.333 13.607 6.297 1.00 . A A . 26 LYS HA 1 1 16 7196 1 1 26 LYS HB2 H 18.841 13.908 4.655 1.00 . A A . 26 LYS HB2 1 1 16 7197 1 1 26 LYS HB3 H 17.241 13.935 3.927 1.00 . A A . 26 LYS HB3 1 1 16 7198 1 1 26 LYS HD2 H 18.924 15.817 3.429 1.00 . A A . 26 LYS HD2 1 1 16 7199 1 1 26 LYS HD3 H 17.691 17.070 3.591 1.00 . A A . 26 LYS HD3 1 1 16 7200 1 1 26 LYS HE2 H 19.724 16.948 5.730 1.00 . A A . 26 LYS HE2 1 1 16 7201 1 1 26 LYS HE3 H 20.295 17.459 4.142 1.00 . A A . 26 LYS HE3 1 1 16 7202 1 1 26 LYS HG2 H 16.636 15.890 5.149 1.00 . A A . 26 LYS HG2 1 1 16 7203 1 1 26 LYS HG3 H 18.104 15.799 6.125 1.00 . A A . 26 LYS HG3 1 1 16 7204 1 1 26 LYS HZ1 H 19.008 19.334 4.181 1.00 . A A . 26 LYS HZ1 1 1 16 7205 1 1 26 LYS HZ2 H 19.371 19.190 5.827 1.00 . A A . 26 LYS HZ2 1 1 16 7206 1 1 26 LYS HZ3 H 17.865 18.684 5.246 1.00 . A A . 26 LYS HZ3 1 1 16 7207 1 1 26 LYS N N 18.207 13.217 7.068 1.00 . A A . 26 LYS N 1 1 16 7208 1 1 26 LYS NZ N 18.880 18.743 5.027 1.00 . A A . 26 LYS NZ 1 1 16 7209 1 1 26 LYS O O 17.066 11.594 4.193 1.00 . A A . 26 LYS O 1 1 16 7210 1 1 27 VAL C C 15.812 8.740 6.955 1.00 . A A . 27 VAL C 1 1 16 7211 1 1 27 VAL CA C 16.670 9.468 5.926 1.00 . A A . 27 VAL CA 1 1 16 7212 1 1 27 VAL CB C 18.005 8.718 5.762 1.00 . A A . 27 VAL CB 1 1 16 7213 1 1 27 VAL CG1 C 18.732 9.188 4.512 1.00 . A A . 27 VAL CG1 1 1 16 7214 1 1 27 VAL CG2 C 18.874 8.903 6.997 1.00 . A A . 27 VAL CG2 1 1 16 7215 1 1 27 VAL H H 16.896 11.094 7.262 1.00 . A A . 27 VAL H 1 1 16 7216 1 1 27 VAL HA H 16.158 9.461 4.975 1.00 . A A . 27 VAL HA 1 1 16 7217 1 1 27 VAL HB H 17.791 7.664 5.653 1.00 . A A . 27 VAL HB 1 1 16 7218 1 1 27 VAL HG11 H 19.689 8.691 4.444 1.00 . A A . 27 VAL HG11 1 1 16 7219 1 1 27 VAL HG12 H 18.139 8.952 3.640 1.00 . A A . 27 VAL HG12 1 1 16 7220 1 1 27 VAL HG13 H 18.885 10.256 4.566 1.00 . A A . 27 VAL HG13 1 1 16 7221 1 1 27 VAL HG21 H 18.248 9.130 7.846 1.00 . A A . 27 VAL HG21 1 1 16 7222 1 1 27 VAL HG22 H 19.425 7.993 7.189 1.00 . A A . 27 VAL HG22 1 1 16 7223 1 1 27 VAL HG23 H 19.567 9.714 6.831 1.00 . A A . 27 VAL HG23 1 1 16 7224 1 1 27 VAL N N 16.885 10.858 6.311 1.00 . A A . 27 VAL N 1 1 16 7225 1 1 27 VAL O O 15.634 9.213 8.078 1.00 . A A . 27 VAL O 1 1 16 7226 1 1 28 CYS C C 15.296 5.900 8.354 1.00 . A A . 28 CYS C 1 1 16 7227 1 1 28 CYS CA C 14.444 6.789 7.452 1.00 . A A . 28 CYS CA 1 1 16 7228 1 1 28 CYS CB C 13.476 5.929 6.637 1.00 . A A . 28 CYS CB 1 1 16 7229 1 1 28 CYS H H 15.462 7.259 5.657 1.00 . A A . 28 CYS H 1 1 16 7230 1 1 28 CYS HA H 13.877 7.468 8.070 1.00 . A A . 28 CYS HA 1 1 16 7231 1 1 28 CYS HB2 H 14.039 5.339 5.929 1.00 . A A . 28 CYS HB2 1 1 16 7232 1 1 28 CYS HB3 H 12.944 5.268 7.305 1.00 . A A . 28 CYS HB3 1 1 16 7233 1 1 28 CYS N N 15.284 7.585 6.565 1.00 . A A . 28 CYS N 1 1 16 7234 1 1 28 CYS O O 16.327 5.375 7.932 1.00 . A A . 28 CYS O 1 1 16 7235 1 1 28 CYS SG S 12.240 6.885 5.701 1.00 . A A . 28 CYS SG 1 1 16 7236 1 1 29 VAL C C 14.613 4.097 11.417 1.00 . A A . 29 VAL C 1 1 16 7237 1 1 29 VAL CA C 15.577 4.908 10.559 1.00 . A A . 29 VAL CA 1 1 16 7238 1 1 29 VAL CB C 16.469 5.763 11.477 1.00 . A A . 29 VAL CB 1 1 16 7239 1 1 29 VAL CG1 C 17.684 6.274 10.717 1.00 . A A . 29 VAL CG1 1 1 16 7240 1 1 29 VAL CG2 C 15.674 6.919 12.066 1.00 . A A . 29 VAL CG2 1 1 16 7241 1 1 29 VAL H H 14.028 6.178 9.875 1.00 . A A . 29 VAL H 1 1 16 7242 1 1 29 VAL HA H 16.211 4.229 10.007 1.00 . A A . 29 VAL HA 1 1 16 7243 1 1 29 VAL HB H 16.816 5.142 12.290 1.00 . A A . 29 VAL HB 1 1 16 7244 1 1 29 VAL HG11 H 18.495 6.448 11.410 1.00 . A A . 29 VAL HG11 1 1 16 7245 1 1 29 VAL HG12 H 17.986 5.539 9.985 1.00 . A A . 29 VAL HG12 1 1 16 7246 1 1 29 VAL HG13 H 17.434 7.198 10.218 1.00 . A A . 29 VAL HG13 1 1 16 7247 1 1 29 VAL HG21 H 14.741 6.548 12.463 1.00 . A A . 29 VAL HG21 1 1 16 7248 1 1 29 VAL HG22 H 16.244 7.381 12.859 1.00 . A A . 29 VAL HG22 1 1 16 7249 1 1 29 VAL HG23 H 15.474 7.648 11.295 1.00 . A A . 29 VAL HG23 1 1 16 7250 1 1 29 VAL N N 14.857 5.734 9.598 1.00 . A A . 29 VAL N 1 1 16 7251 1 1 29 VAL O O 13.395 4.244 11.311 1.00 . A A . 29 VAL O 1 1 16 7252 1 1 30 LYS C C 13.640 3.252 14.196 1.00 . A A . 30 LYS C 1 1 16 7253 1 1 30 LYS CA C 14.356 2.405 13.149 1.00 . A A . 30 LYS CA 1 1 16 7254 1 1 30 LYS CB C 15.231 1.355 13.837 1.00 . A A . 30 LYS CB 1 1 16 7255 1 1 30 LYS CD C 15.142 -1.134 14.163 1.00 . A A . 30 LYS CD 1 1 16 7256 1 1 30 LYS CE C 14.208 -2.310 14.403 1.00 . A A . 30 LYS CE 1 1 16 7257 1 1 30 LYS CG C 14.444 0.192 14.416 1.00 . A A . 30 LYS CG 1 1 16 7258 1 1 30 LYS H H 16.143 3.167 12.308 1.00 . A A . 30 LYS H 1 1 16 7259 1 1 30 LYS HA H 13.617 1.903 12.542 1.00 . A A . 30 LYS HA 1 1 16 7260 1 1 30 LYS HB2 H 15.936 0.964 13.119 1.00 . A A . 30 LYS HB2 1 1 16 7261 1 1 30 LYS HB3 H 15.775 1.829 14.642 1.00 . A A . 30 LYS HB3 1 1 16 7262 1 1 30 LYS HD2 H 15.481 -1.163 13.138 1.00 . A A . 30 LYS HD2 1 1 16 7263 1 1 30 LYS HD3 H 15.990 -1.217 14.827 1.00 . A A . 30 LYS HD3 1 1 16 7264 1 1 30 LYS HE2 H 14.801 -3.184 14.626 1.00 . A A . 30 LYS HE2 1 1 16 7265 1 1 30 LYS HE3 H 13.573 -2.082 15.246 1.00 . A A . 30 LYS HE3 1 1 16 7266 1 1 30 LYS HG2 H 14.340 0.334 15.481 1.00 . A A . 30 LYS HG2 1 1 16 7267 1 1 30 LYS HG3 H 13.466 0.167 13.957 1.00 . A A . 30 LYS HG3 1 1 16 7268 1 1 30 LYS HZ1 H 13.934 -2.594 12.352 1.00 . A A . 30 LYS HZ1 1 1 16 7269 1 1 30 LYS HZ2 H 12.617 -1.865 13.124 1.00 . A A . 30 LYS HZ2 1 1 16 7270 1 1 30 LYS HZ3 H 12.898 -3.522 13.316 1.00 . A A . 30 LYS HZ3 1 1 16 7271 1 1 30 LYS N N 15.165 3.239 12.269 1.00 . A A . 30 LYS N 1 1 16 7272 1 1 30 LYS NZ N 13.354 -2.593 13.216 1.00 . A A . 30 LYS NZ 1 1 16 7273 1 1 30 LYS O O 14.225 4.168 14.772 1.00 . A A . 30 LYS O 1 1 16 7274 1 1 31 GLY C C 10.204 3.113 15.604 1.00 . A A . 31 GLY C 1 1 16 7275 1 1 31 GLY CA C 11.597 3.679 15.417 1.00 . A A . 31 GLY CA 1 1 16 7276 1 1 31 GLY H H 11.957 2.197 13.948 1.00 . A A . 31 GLY H 1 1 16 7277 1 1 31 GLY HA2 H 12.116 3.653 16.364 1.00 . A A . 31 GLY HA2 1 1 16 7278 1 1 31 GLY HA3 H 11.515 4.706 15.091 1.00 . A A . 31 GLY HA3 1 1 16 7279 1 1 31 GLY N N 12.371 2.938 14.438 1.00 . A A . 31 GLY N 1 1 16 7280 1 1 31 GLY O O 10.043 1.941 15.944 1.00 . A A . 31 GLY O 1 1 17 7281 1 1 1 GLY C C 4.396 -0.726 0.022 1.00 . A A . 1 GLY C 1 1 17 7282 1 1 1 GLY CA C 3.585 -1.349 1.141 1.00 . A A . 1 GLY CA 1 1 17 7283 1 1 1 GLY H1 H 2.149 -1.999 -0.273 1.00 . A A . 1 GLY H1 1 1 17 7284 1 1 1 GLY HA2 H 3.211 -0.563 1.781 1.00 . A A . 1 GLY HA2 1 1 17 7285 1 1 1 GLY HA3 H 4.228 -1.995 1.720 1.00 . A A . 1 GLY HA3 1 1 17 7286 1 1 1 GLY N N 2.463 -2.126 0.647 1.00 . A A . 1 GLY N 1 1 17 7287 1 1 1 GLY O O 4.739 -1.395 -0.953 1.00 . A A . 1 GLY O 1 1 17 7288 1 1 2 TYR C C 5.982 2.606 -0.304 1.00 . A A . 2 TYR C 1 1 17 7289 1 1 2 TYR CA C 5.475 1.274 -0.848 1.00 . A A . 2 TYR CA 1 1 17 7290 1 1 2 TYR CB C 4.626 1.510 -2.098 1.00 . A A . 2 TYR CB 1 1 17 7291 1 1 2 TYR CD1 C 5.686 2.926 -3.900 1.00 . A A . 2 TYR CD1 1 1 17 7292 1 1 2 TYR CD2 C 5.963 0.562 -4.019 1.00 . A A . 2 TYR CD2 1 1 17 7293 1 1 2 TYR CE1 C 6.428 3.076 -5.056 1.00 . A A . 2 TYR CE1 1 1 17 7294 1 1 2 TYR CE2 C 6.708 0.703 -5.174 1.00 . A A . 2 TYR CE2 1 1 17 7295 1 1 2 TYR CG C 5.440 1.669 -3.362 1.00 . A A . 2 TYR CG 1 1 17 7296 1 1 2 TYR CZ C 6.938 1.962 -5.688 1.00 . A A . 2 TYR CZ 1 1 17 7297 1 1 2 TYR H H 4.402 1.039 0.960 1.00 . A A . 2 TYR H 1 1 17 7298 1 1 2 TYR HA H 6.324 0.660 -1.112 1.00 . A A . 2 TYR HA 1 1 17 7299 1 1 2 TYR HB2 H 3.960 0.672 -2.236 1.00 . A A . 2 TYR HB2 1 1 17 7300 1 1 2 TYR HB3 H 4.043 2.409 -1.964 1.00 . A A . 2 TYR HB3 1 1 17 7301 1 1 2 TYR HD1 H 5.285 3.798 -3.403 1.00 . A A . 2 TYR HD1 1 1 17 7302 1 1 2 TYR HD2 H 5.781 -0.423 -3.614 1.00 . A A . 2 TYR HD2 1 1 17 7303 1 1 2 TYR HE1 H 6.608 4.062 -5.459 1.00 . A A . 2 TYR HE1 1 1 17 7304 1 1 2 TYR HE2 H 7.107 -0.170 -5.670 1.00 . A A . 2 TYR HE2 1 1 17 7305 1 1 2 TYR HH H 7.980 3.014 -6.914 1.00 . A A . 2 TYR HH 1 1 17 7306 1 1 2 TYR N N 4.703 0.559 0.161 1.00 . A A . 2 TYR N 1 1 17 7307 1 1 2 TYR O O 5.993 3.615 -1.011 1.00 . A A . 2 TYR O 1 1 17 7308 1 1 2 TYR OH O 7.678 2.106 -6.839 1.00 . A A . 2 TYR OH 1 1 17 7309 1 1 3 CYS C C 8.435 3.813 1.618 1.00 . A A . 3 CYS C 1 1 17 7310 1 1 3 CYS CA C 6.909 3.809 1.598 1.00 . A A . 3 CYS CA 1 1 17 7311 1 1 3 CYS CB C 6.369 3.919 3.025 1.00 . A A . 3 CYS CB 1 1 17 7312 1 1 3 CYS H H 6.367 1.767 1.469 1.00 . A A . 3 CYS H 1 1 17 7313 1 1 3 CYS HA H 6.567 4.658 1.026 1.00 . A A . 3 CYS HA 1 1 17 7314 1 1 3 CYS HB2 H 7.089 3.493 3.708 1.00 . A A . 3 CYS HB2 1 1 17 7315 1 1 3 CYS HB3 H 6.224 4.961 3.268 1.00 . A A . 3 CYS HB3 1 1 17 7316 1 1 3 CYS N N 6.401 2.602 0.957 1.00 . A A . 3 CYS N 1 1 17 7317 1 1 3 CYS O O 9.076 2.953 1.015 1.00 . A A . 3 CYS O 1 1 17 7318 1 1 3 CYS SG S 4.783 3.062 3.288 1.00 . A A . 3 CYS SG 1 1 17 7319 1 1 4 ALA C C 10.995 4.073 3.580 1.00 . A A . 4 ALA C 1 1 17 7320 1 1 4 ALA CA C 10.459 4.901 2.418 1.00 . A A . 4 ALA CA 1 1 17 7321 1 1 4 ALA CB C 10.863 6.360 2.575 1.00 . A A . 4 ALA CB 1 1 17 7322 1 1 4 ALA H H 8.445 5.442 2.776 1.00 . A A . 4 ALA H 1 1 17 7323 1 1 4 ALA HA H 10.888 4.532 1.497 1.00 . A A . 4 ALA HA 1 1 17 7324 1 1 4 ALA HB1 H 10.194 6.845 3.271 1.00 . A A . 4 ALA HB1 1 1 17 7325 1 1 4 ALA HB2 H 11.874 6.414 2.949 1.00 . A A . 4 ALA HB2 1 1 17 7326 1 1 4 ALA HB3 H 10.806 6.854 1.617 1.00 . A A . 4 ALA HB3 1 1 17 7327 1 1 4 ALA N N 9.009 4.787 2.316 1.00 . A A . 4 ALA N 1 1 17 7328 1 1 4 ALA O O 10.786 4.411 4.746 1.00 . A A . 4 ALA O 1 1 17 7329 1 1 5 THR C C 13.601 2.628 4.761 1.00 . A A . 5 THR C 1 1 17 7330 1 1 5 THR CA C 12.254 2.108 4.273 1.00 . A A . 5 THR CA 1 1 17 7331 1 1 5 THR CB C 12.431 0.674 3.742 1.00 . A A . 5 THR CB 1 1 17 7332 1 1 5 THR CG2 C 11.128 -0.105 3.840 1.00 . A A . 5 THR CG2 1 1 17 7333 1 1 5 THR H H 11.822 2.770 2.310 1.00 . A A . 5 THR H 1 1 17 7334 1 1 5 THR HA H 11.567 2.079 5.107 1.00 . A A . 5 THR HA 1 1 17 7335 1 1 5 THR HB H 13.178 0.174 4.342 1.00 . A A . 5 THR HB 1 1 17 7336 1 1 5 THR HG1 H 13.811 0.512 2.342 1.00 . A A . 5 THR HG1 1 1 17 7337 1 1 5 THR HG21 H 10.859 -0.482 2.864 1.00 . A A . 5 THR HG21 1 1 17 7338 1 1 5 THR HG22 H 10.346 0.546 4.202 1.00 . A A . 5 THR HG22 1 1 17 7339 1 1 5 THR HG23 H 11.254 -0.932 4.522 1.00 . A A . 5 THR HG23 1 1 17 7340 1 1 5 THR N N 11.689 2.986 3.256 1.00 . A A . 5 THR N 1 1 17 7341 1 1 5 THR O O 14.133 3.602 4.227 1.00 . A A . 5 THR O 1 1 17 7342 1 1 5 THR OG1 O 12.871 0.707 2.380 1.00 . A A . 5 THR OG1 1 1 17 7343 1 1 6 LYS C C 16.466 2.588 5.231 1.00 . A A . 6 LYS C 1 1 17 7344 1 1 6 LYS CA C 15.438 2.365 6.336 1.00 . A A . 6 LYS CA 1 1 17 7345 1 1 6 LYS CB C 15.943 1.298 7.309 1.00 . A A . 6 LYS CB 1 1 17 7346 1 1 6 LYS CD C 17.042 -0.938 7.630 1.00 . A A . 6 LYS CD 1 1 17 7347 1 1 6 LYS CE C 17.104 -2.323 7.004 1.00 . A A . 6 LYS CE 1 1 17 7348 1 1 6 LYS CG C 16.591 0.107 6.624 1.00 . A A . 6 LYS CG 1 1 17 7349 1 1 6 LYS H H 13.678 1.203 6.160 1.00 . A A . 6 LYS H 1 1 17 7350 1 1 6 LYS HA H 15.298 3.292 6.872 1.00 . A A . 6 LYS HA 1 1 17 7351 1 1 6 LYS HB2 H 16.670 1.745 7.971 1.00 . A A . 6 LYS HB2 1 1 17 7352 1 1 6 LYS HB3 H 15.109 0.939 7.895 1.00 . A A . 6 LYS HB3 1 1 17 7353 1 1 6 LYS HD2 H 18.024 -0.676 7.994 1.00 . A A . 6 LYS HD2 1 1 17 7354 1 1 6 LYS HD3 H 16.343 -0.957 8.454 1.00 . A A . 6 LYS HD3 1 1 17 7355 1 1 6 LYS HE2 H 16.135 -2.564 6.596 1.00 . A A . 6 LYS HE2 1 1 17 7356 1 1 6 LYS HE3 H 17.836 -2.312 6.209 1.00 . A A . 6 LYS HE3 1 1 17 7357 1 1 6 LYS HG2 H 15.877 -0.342 5.950 1.00 . A A . 6 LYS HG2 1 1 17 7358 1 1 6 LYS HG3 H 17.450 0.450 6.065 1.00 . A A . 6 LYS HG3 1 1 17 7359 1 1 6 LYS HZ1 H 18.366 -3.093 8.480 1.00 . A A . 6 LYS HZ1 1 1 17 7360 1 1 6 LYS HZ2 H 17.631 -4.277 7.522 1.00 . A A . 6 LYS HZ2 1 1 17 7361 1 1 6 LYS HZ3 H 16.733 -3.473 8.708 1.00 . A A . 6 LYS HZ3 1 1 17 7362 1 1 6 LYS N N 14.150 1.972 5.777 1.00 . A A . 6 LYS N 1 1 17 7363 1 1 6 LYS NZ N 17.485 -3.365 7.998 1.00 . A A . 6 LYS NZ 1 1 17 7364 1 1 6 LYS O O 16.550 1.809 4.283 1.00 . A A . 6 LYS O 1 1 17 7365 1 1 7 GLY C C 17.736 4.855 3.262 1.00 . A A . 7 GLY C 1 1 17 7366 1 1 7 GLY CA C 18.260 3.960 4.368 1.00 . A A . 7 GLY CA 1 1 17 7367 1 1 7 GLY H H 17.135 4.242 6.139 1.00 . A A . 7 GLY H 1 1 17 7368 1 1 7 GLY HA2 H 19.089 4.453 4.853 1.00 . A A . 7 GLY HA2 1 1 17 7369 1 1 7 GLY HA3 H 18.609 3.035 3.932 1.00 . A A . 7 GLY HA3 1 1 17 7370 1 1 7 GLY N N 17.247 3.656 5.362 1.00 . A A . 7 GLY N 1 1 17 7371 1 1 7 GLY O O 18.514 5.453 2.518 1.00 . A A . 7 GLY O 1 1 17 7372 1 1 8 ILE C C 15.560 7.192 2.633 1.00 . A A . 8 ILE C 1 1 17 7373 1 1 8 ILE CA C 15.790 5.772 2.128 1.00 . A A . 8 ILE CA 1 1 17 7374 1 1 8 ILE CB C 14.444 5.179 1.669 1.00 . A A . 8 ILE CB 1 1 17 7375 1 1 8 ILE CD1 C 15.511 3.463 0.121 1.00 . A A . 8 ILE CD1 1 1 17 7376 1 1 8 ILE CG1 C 14.610 3.700 1.312 1.00 . A A . 8 ILE CG1 1 1 17 7377 1 1 8 ILE CG2 C 13.900 5.958 0.481 1.00 . A A . 8 ILE CG2 1 1 17 7378 1 1 8 ILE H H 15.848 4.444 3.774 1.00 . A A . 8 ILE H 1 1 17 7379 1 1 8 ILE HA H 16.454 5.808 1.276 1.00 . A A . 8 ILE HA 1 1 17 7380 1 1 8 ILE HB H 13.740 5.270 2.482 1.00 . A A . 8 ILE HB 1 1 17 7381 1 1 8 ILE HD11 H 16.350 2.851 0.419 1.00 . A A . 8 ILE HD11 1 1 17 7382 1 1 8 ILE HD12 H 14.956 2.959 -0.656 1.00 . A A . 8 ILE HD12 1 1 17 7383 1 1 8 ILE HD13 H 15.872 4.411 -0.251 1.00 . A A . 8 ILE HD13 1 1 17 7384 1 1 8 ILE HG12 H 15.032 3.178 2.156 1.00 . A A . 8 ILE HG12 1 1 17 7385 1 1 8 ILE HG13 H 13.640 3.282 1.085 1.00 . A A . 8 ILE HG13 1 1 17 7386 1 1 8 ILE HG21 H 13.498 6.900 0.823 1.00 . A A . 8 ILE HG21 1 1 17 7387 1 1 8 ILE HG22 H 14.696 6.142 -0.224 1.00 . A A . 8 ILE HG22 1 1 17 7388 1 1 8 ILE HG23 H 13.119 5.386 0.002 1.00 . A A . 8 ILE HG23 1 1 17 7389 1 1 8 ILE N N 16.415 4.945 3.151 1.00 . A A . 8 ILE N 1 1 17 7390 1 1 8 ILE O O 15.017 7.397 3.720 1.00 . A A . 8 ILE O 1 1 17 7391 1 1 9 LYS C C 14.368 9.871 2.594 1.00 . A A . 9 LYS C 1 1 17 7392 1 1 9 LYS CA C 15.812 9.575 2.201 1.00 . A A . 9 LYS CA 1 1 17 7393 1 1 9 LYS CB C 16.230 10.477 1.038 1.00 . A A . 9 LYS CB 1 1 17 7394 1 1 9 LYS CD C 18.564 11.338 0.688 1.00 . A A . 9 LYS CD 1 1 17 7395 1 1 9 LYS CE C 19.542 11.459 -0.471 1.00 . A A . 9 LYS CE 1 1 17 7396 1 1 9 LYS CG C 17.615 10.167 0.496 1.00 . A A . 9 LYS CG 1 1 17 7397 1 1 9 LYS H H 16.400 7.946 0.983 1.00 . A A . 9 LYS H 1 1 17 7398 1 1 9 LYS HA H 16.451 9.774 3.048 1.00 . A A . 9 LYS HA 1 1 17 7399 1 1 9 LYS HB2 H 15.518 10.361 0.234 1.00 . A A . 9 LYS HB2 1 1 17 7400 1 1 9 LYS HB3 H 16.219 11.504 1.372 1.00 . A A . 9 LYS HB3 1 1 17 7401 1 1 9 LYS HD2 H 17.989 12.249 0.756 1.00 . A A . 9 LYS HD2 1 1 17 7402 1 1 9 LYS HD3 H 19.120 11.193 1.603 1.00 . A A . 9 LYS HD3 1 1 17 7403 1 1 9 LYS HE2 H 20.171 10.583 -0.487 1.00 . A A . 9 LYS HE2 1 1 17 7404 1 1 9 LYS HE3 H 18.981 11.517 -1.392 1.00 . A A . 9 LYS HE3 1 1 17 7405 1 1 9 LYS HG2 H 18.011 9.307 1.015 1.00 . A A . 9 LYS HG2 1 1 17 7406 1 1 9 LYS HG3 H 17.538 9.948 -0.560 1.00 . A A . 9 LYS HG3 1 1 17 7407 1 1 9 LYS HZ1 H 21.077 12.551 0.432 1.00 . A A . 9 LYS HZ1 1 1 17 7408 1 1 9 LYS HZ2 H 19.811 13.507 -0.157 1.00 . A A . 9 LYS HZ2 1 1 17 7409 1 1 9 LYS HZ3 H 20.927 12.826 -1.231 1.00 . A A . 9 LYS HZ3 1 1 17 7410 1 1 9 LYS N N 15.975 8.172 1.837 1.00 . A A . 9 LYS N 1 1 17 7411 1 1 9 LYS NZ N 20.399 12.671 -0.348 1.00 . A A . 9 LYS NZ 1 1 17 7412 1 1 9 LYS O O 13.430 9.375 1.970 1.00 . A A . 9 LYS O 1 1 17 7413 1 1 10 CYS C C 12.669 12.560 4.060 1.00 . A A . 10 CYS C 1 1 17 7414 1 1 10 CYS CA C 12.868 11.048 4.107 1.00 . A A . 10 CYS CA 1 1 17 7415 1 1 10 CYS CB C 12.658 10.539 5.535 1.00 . A A . 10 CYS CB 1 1 17 7416 1 1 10 CYS H H 14.985 11.049 4.089 1.00 . A A . 10 CYS H 1 1 17 7417 1 1 10 CYS HA H 12.144 10.581 3.458 1.00 . A A . 10 CYS HA 1 1 17 7418 1 1 10 CYS HB2 H 11.598 10.453 5.725 1.00 . A A . 10 CYS HB2 1 1 17 7419 1 1 10 CYS HB3 H 13.117 9.567 5.633 1.00 . A A . 10 CYS HB3 1 1 17 7420 1 1 10 CYS N N 14.197 10.684 3.631 1.00 . A A . 10 CYS N 1 1 17 7421 1 1 10 CYS O O 11.739 13.093 4.664 1.00 . A A . 10 CYS O 1 1 17 7422 1 1 10 CYS SG S 13.364 11.619 6.821 1.00 . A A . 10 CYS SG 1 1 17 7423 1 1 11 ASN C C 12.151 15.115 2.569 1.00 . A A . 11 ASN C 1 1 17 7424 1 1 11 ASN CA C 13.470 14.696 3.211 1.00 . A A . 11 ASN CA 1 1 17 7425 1 1 11 ASN CB C 14.643 15.221 2.381 1.00 . A A . 11 ASN CB 1 1 17 7426 1 1 11 ASN CG C 14.425 16.645 1.908 1.00 . A A . 11 ASN CG 1 1 17 7427 1 1 11 ASN H H 14.268 12.764 2.878 1.00 . A A . 11 ASN H 1 1 17 7428 1 1 11 ASN HA H 13.524 15.118 4.203 1.00 . A A . 11 ASN HA 1 1 17 7429 1 1 11 ASN HB2 H 15.541 15.195 2.982 1.00 . A A . 11 ASN HB2 1 1 17 7430 1 1 11 ASN HB3 H 14.776 14.590 1.516 1.00 . A A . 11 ASN HB3 1 1 17 7431 1 1 11 ASN HD21 H 14.532 17.309 3.780 1.00 . A A . 11 ASN HD21 1 1 17 7432 1 1 11 ASN HD22 H 14.266 18.513 2.570 1.00 . A A . 11 ASN HD22 1 1 17 7433 1 1 11 ASN N N 13.549 13.245 3.337 1.00 . A A . 11 ASN N 1 1 17 7434 1 1 11 ASN ND2 N 14.406 17.584 2.847 1.00 . A A . 11 ASN ND2 1 1 17 7435 1 1 11 ASN O O 11.726 16.264 2.692 1.00 . A A . 11 ASN O 1 1 17 7436 1 1 11 ASN OD1 O 14.276 16.898 0.713 1.00 . A A . 11 ASN OD1 1 1 17 7437 1 1 12 ASP C C 9.250 13.305 1.454 1.00 . A A . 12 ASP C 1 1 17 7438 1 1 12 ASP CA C 10.236 14.446 1.223 1.00 . A A . 12 ASP CA 1 1 17 7439 1 1 12 ASP CB C 10.450 14.656 -0.276 1.00 . A A . 12 ASP CB 1 1 17 7440 1 1 12 ASP CG C 9.258 15.312 -0.945 1.00 . A A . 12 ASP CG 1 1 17 7441 1 1 12 ASP H H 11.898 13.278 1.821 1.00 . A A . 12 ASP H 1 1 17 7442 1 1 12 ASP HA H 9.827 15.350 1.649 1.00 . A A . 12 ASP HA 1 1 17 7443 1 1 12 ASP HB2 H 11.315 15.287 -0.425 1.00 . A A . 12 ASP HB2 1 1 17 7444 1 1 12 ASP HB3 H 10.623 13.699 -0.746 1.00 . A A . 12 ASP HB3 1 1 17 7445 1 1 12 ASP N N 11.508 14.176 1.884 1.00 . A A . 12 ASP N 1 1 17 7446 1 1 12 ASP O O 8.160 13.512 1.987 1.00 . A A . 12 ASP O 1 1 17 7447 1 1 12 ASP OD1 O 8.261 14.607 -1.206 1.00 . A A . 12 ASP OD1 1 1 17 7448 1 1 12 ASP OD2 O 9.322 16.531 -1.207 1.00 . A A . 12 ASP OD2 1 1 17 7449 1 1 13 ILE C C 8.770 10.463 2.663 1.00 . A A . 13 ILE C 1 1 17 7450 1 1 13 ILE CA C 8.792 10.928 1.211 1.00 . A A . 13 ILE CA 1 1 17 7451 1 1 13 ILE CB C 9.262 9.765 0.318 1.00 . A A . 13 ILE CB 1 1 17 7452 1 1 13 ILE CD1 C 6.874 9.000 -0.122 1.00 . A A . 13 ILE CD1 1 1 17 7453 1 1 13 ILE CG1 C 8.253 8.615 0.367 1.00 . A A . 13 ILE CG1 1 1 17 7454 1 1 13 ILE CG2 C 10.640 9.287 0.751 1.00 . A A . 13 ILE CG2 1 1 17 7455 1 1 13 ILE H H 10.521 12.000 0.630 1.00 . A A . 13 ILE H 1 1 17 7456 1 1 13 ILE HA H 7.788 11.200 0.916 1.00 . A A . 13 ILE HA 1 1 17 7457 1 1 13 ILE HB H 9.335 10.126 -0.697 1.00 . A A . 13 ILE HB 1 1 17 7458 1 1 13 ILE HD11 H 6.173 8.946 0.698 1.00 . A A . 13 ILE HD11 1 1 17 7459 1 1 13 ILE HD12 H 6.898 10.006 -0.512 1.00 . A A . 13 ILE HD12 1 1 17 7460 1 1 13 ILE HD13 H 6.567 8.318 -0.903 1.00 . A A . 13 ILE HD13 1 1 17 7461 1 1 13 ILE HG12 H 8.609 7.805 -0.249 1.00 . A A . 13 ILE HG12 1 1 17 7462 1 1 13 ILE HG13 H 8.160 8.272 1.388 1.00 . A A . 13 ILE HG13 1 1 17 7463 1 1 13 ILE HG21 H 10.572 8.834 1.730 1.00 . A A . 13 ILE HG21 1 1 17 7464 1 1 13 ILE HG22 H 11.007 8.560 0.044 1.00 . A A . 13 ILE HG22 1 1 17 7465 1 1 13 ILE HG23 H 11.317 10.127 0.790 1.00 . A A . 13 ILE HG23 1 1 17 7466 1 1 13 ILE N N 9.641 12.102 1.048 1.00 . A A . 13 ILE N 1 1 17 7467 1 1 13 ILE O O 9.768 10.569 3.375 1.00 . A A . 13 ILE O 1 1 17 7468 1 1 14 HIS C C 7.719 7.956 4.536 1.00 . A A . 14 HIS C 1 1 17 7469 1 1 14 HIS CA C 7.472 9.460 4.462 1.00 . A A . 14 HIS CA 1 1 17 7470 1 1 14 HIS CB C 6.074 9.786 4.989 1.00 . A A . 14 HIS CB 1 1 17 7471 1 1 14 HIS CD2 C 6.296 11.099 7.215 1.00 . A A . 14 HIS CD2 1 1 17 7472 1 1 14 HIS CE1 C 5.722 9.493 8.593 1.00 . A A . 14 HIS CE1 1 1 17 7473 1 1 14 HIS CG C 6.028 10.001 6.471 1.00 . A A . 14 HIS CG 1 1 17 7474 1 1 14 HIS H H 6.864 9.887 2.480 1.00 . A A . 14 HIS H 1 1 17 7475 1 1 14 HIS HA H 8.205 9.962 5.076 1.00 . A A . 14 HIS HA 1 1 17 7476 1 1 14 HIS HB2 H 5.719 10.688 4.513 1.00 . A A . 14 HIS HB2 1 1 17 7477 1 1 14 HIS HB3 H 5.407 8.971 4.750 1.00 . A A . 14 HIS HB3 1 1 17 7478 1 1 14 HIS HD1 H 5.419 8.094 7.130 1.00 . A A . 14 HIS HD1 1 1 17 7479 1 1 14 HIS HD2 H 6.607 12.065 6.844 1.00 . A A . 14 HIS HD2 1 1 17 7480 1 1 14 HIS HE1 H 5.494 8.946 9.495 1.00 . A A . 14 HIS HE1 1 1 17 7481 1 1 14 HIS N N 7.624 9.945 3.095 1.00 . A A . 14 HIS N 1 1 17 7482 1 1 14 HIS ND1 N 5.672 9.012 7.363 1.00 . A A . 14 HIS ND1 1 1 17 7483 1 1 14 HIS NE2 N 6.098 10.757 8.530 1.00 . A A . 14 HIS NE2 1 1 17 7484 1 1 14 HIS O O 7.588 7.245 3.539 1.00 . A A . 14 HIS O 1 1 17 7485 1 1 15 CYS C C 7.074 5.323 6.349 1.00 . A A . 15 CYS C 1 1 17 7486 1 1 15 CYS CA C 8.342 6.059 5.927 1.00 . A A . 15 CYS CA 1 1 17 7487 1 1 15 CYS CB C 9.430 5.870 6.986 1.00 . A A . 15 CYS CB 1 1 17 7488 1 1 15 CYS H H 8.164 8.094 6.481 1.00 . A A . 15 CYS H 1 1 17 7489 1 1 15 CYS HA H 8.688 5.648 4.991 1.00 . A A . 15 CYS HA 1 1 17 7490 1 1 15 CYS HB2 H 8.969 5.836 7.963 1.00 . A A . 15 CYS HB2 1 1 17 7491 1 1 15 CYS HB3 H 9.942 4.937 6.803 1.00 . A A . 15 CYS HB3 1 1 17 7492 1 1 15 CYS N N 8.076 7.478 5.723 1.00 . A A . 15 CYS N 1 1 17 7493 1 1 15 CYS O O 6.154 5.919 6.909 1.00 . A A . 15 CYS O 1 1 17 7494 1 1 15 CYS SG S 10.681 7.194 7.012 1.00 . A A . 15 CYS SG 1 1 17 7495 1 1 16 CYS C C 5.679 3.161 7.936 1.00 . A A . 16 CYS C 1 1 17 7496 1 1 16 CYS CA C 5.878 3.204 6.424 1.00 . A A . 16 CYS CA 1 1 17 7497 1 1 16 CYS CB C 6.050 1.784 5.881 1.00 . A A . 16 CYS CB 1 1 17 7498 1 1 16 CYS H H 7.797 3.604 5.625 1.00 . A A . 16 CYS H 1 1 17 7499 1 1 16 CYS HA H 5.005 3.650 5.972 1.00 . A A . 16 CYS HA 1 1 17 7500 1 1 16 CYS HB2 H 7.105 1.566 5.794 1.00 . A A . 16 CYS HB2 1 1 17 7501 1 1 16 CYS HB3 H 5.599 1.086 6.570 1.00 . A A . 16 CYS HB3 1 1 17 7502 1 1 16 CYS N N 7.032 4.023 6.074 1.00 . A A . 16 CYS N 1 1 17 7503 1 1 16 CYS O O 6.627 3.338 8.702 1.00 . A A . 16 CYS O 1 1 17 7504 1 1 16 CYS SG S 5.295 1.518 4.244 1.00 . A A . 16 CYS SG 1 1 17 7505 1 1 17 SER C C 5.062 1.913 10.510 1.00 . A A . 17 SER C 1 1 17 7506 1 1 17 SER CA C 4.117 2.861 9.779 1.00 . A A . 17 SER CA 1 1 17 7507 1 1 17 SER CB C 2.669 2.407 9.974 1.00 . A A . 17 SER CB 1 1 17 7508 1 1 17 SER H H 3.729 2.792 7.699 1.00 . A A . 17 SER H 1 1 17 7509 1 1 17 SER HA H 4.233 3.853 10.190 1.00 . A A . 17 SER HA 1 1 17 7510 1 1 17 SER HB2 H 2.575 1.376 9.671 1.00 . A A . 17 SER HB2 1 1 17 7511 1 1 17 SER HB3 H 2.402 2.502 11.016 1.00 . A A . 17 SER HB3 1 1 17 7512 1 1 17 SER HG H 2.057 4.113 9.229 1.00 . A A . 17 SER HG 1 1 17 7513 1 1 17 SER N N 4.442 2.924 8.359 1.00 . A A . 17 SER N 1 1 17 7514 1 1 17 SER O O 4.987 0.696 10.347 1.00 . A A . 17 SER O 1 1 17 7515 1 1 17 SER OG O 1.780 3.194 9.201 1.00 . A A . 17 SER OG 1 1 17 7516 1 1 18 GLY C C 8.312 2.223 11.994 1.00 . A A . 18 GLY C 1 1 17 7517 1 1 18 GLY CA C 6.901 1.673 12.063 1.00 . A A . 18 GLY CA 1 1 17 7518 1 1 18 GLY H H 5.967 3.457 11.409 1.00 . A A . 18 GLY H 1 1 17 7519 1 1 18 GLY HA2 H 6.590 1.634 13.096 1.00 . A A . 18 GLY HA2 1 1 17 7520 1 1 18 GLY HA3 H 6.898 0.671 11.659 1.00 . A A . 18 GLY HA3 1 1 17 7521 1 1 18 GLY N N 5.953 2.481 11.318 1.00 . A A . 18 GLY N 1 1 17 7522 1 1 18 GLY O O 9.173 1.844 12.789 1.00 . A A . 18 GLY O 1 1 17 7523 1 1 19 LEU C C 9.829 5.212 11.184 1.00 . A A . 19 LEU C 1 1 17 7524 1 1 19 LEU CA C 9.868 3.720 10.871 1.00 . A A . 19 LEU CA 1 1 17 7525 1 1 19 LEU CB C 10.369 3.500 9.442 1.00 . A A . 19 LEU CB 1 1 17 7526 1 1 19 LEU CD1 C 10.905 1.943 7.553 1.00 . A A . 19 LEU CD1 1 1 17 7527 1 1 19 LEU CD2 C 11.863 1.523 9.825 1.00 . A A . 19 LEU CD2 1 1 17 7528 1 1 19 LEU CG C 10.664 2.052 9.050 1.00 . A A . 19 LEU CG 1 1 17 7529 1 1 19 LEU H H 7.824 3.380 10.439 1.00 . A A . 19 LEU H 1 1 17 7530 1 1 19 LEU HA H 10.545 3.237 11.560 1.00 . A A . 19 LEU HA 1 1 17 7531 1 1 19 LEU HB2 H 9.618 3.879 8.766 1.00 . A A . 19 LEU HB2 1 1 17 7532 1 1 19 LEU HB3 H 11.280 4.069 9.321 1.00 . A A . 19 LEU HB3 1 1 17 7533 1 1 19 LEU HD11 H 10.035 2.299 7.022 1.00 . A A . 19 LEU HD11 1 1 17 7534 1 1 19 LEU HD12 H 11.088 0.911 7.292 1.00 . A A . 19 LEU HD12 1 1 17 7535 1 1 19 LEU HD13 H 11.763 2.540 7.282 1.00 . A A . 19 LEU HD13 1 1 17 7536 1 1 19 LEU HD21 H 11.819 0.445 9.863 1.00 . A A . 19 LEU HD21 1 1 17 7537 1 1 19 LEU HD22 H 11.845 1.920 10.830 1.00 . A A . 19 LEU HD22 1 1 17 7538 1 1 19 LEU HD23 H 12.773 1.829 9.332 1.00 . A A . 19 LEU HD23 1 1 17 7539 1 1 19 LEU HG H 9.809 1.438 9.296 1.00 . A A . 19 LEU HG 1 1 17 7540 1 1 19 LEU N N 8.550 3.118 11.042 1.00 . A A . 19 LEU N 1 1 17 7541 1 1 19 LEU O O 8.779 5.850 11.095 1.00 . A A . 19 LEU O 1 1 17 7542 1 1 20 LYS C C 11.824 7.940 10.776 1.00 . A A . 20 LYS C 1 1 17 7543 1 1 20 LYS CA C 11.081 7.183 11.872 1.00 . A A . 20 LYS CA 1 1 17 7544 1 1 20 LYS CB C 11.796 7.373 13.212 1.00 . A A . 20 LYS CB 1 1 17 7545 1 1 20 LYS CD C 10.256 8.733 14.657 1.00 . A A . 20 LYS CD 1 1 17 7546 1 1 20 LYS CE C 10.753 9.332 15.963 1.00 . A A . 20 LYS CE 1 1 17 7547 1 1 20 LYS CG C 10.860 7.361 14.408 1.00 . A A . 20 LYS CG 1 1 17 7548 1 1 20 LYS H H 11.784 5.205 11.601 1.00 . A A . 20 LYS H 1 1 17 7549 1 1 20 LYS HA H 10.079 7.578 11.949 1.00 . A A . 20 LYS HA 1 1 17 7550 1 1 20 LYS HB2 H 12.517 6.579 13.337 1.00 . A A . 20 LYS HB2 1 1 17 7551 1 1 20 LYS HB3 H 12.316 8.320 13.198 1.00 . A A . 20 LYS HB3 1 1 17 7552 1 1 20 LYS HD2 H 10.530 9.390 13.845 1.00 . A A . 20 LYS HD2 1 1 17 7553 1 1 20 LYS HD3 H 9.179 8.640 14.700 1.00 . A A . 20 LYS HD3 1 1 17 7554 1 1 20 LYS HE2 H 11.667 8.834 16.248 1.00 . A A . 20 LYS HE2 1 1 17 7555 1 1 20 LYS HE3 H 10.949 10.383 15.810 1.00 . A A . 20 LYS HE3 1 1 17 7556 1 1 20 LYS HG2 H 10.063 6.657 14.223 1.00 . A A . 20 LYS HG2 1 1 17 7557 1 1 20 LYS HG3 H 11.415 7.058 15.284 1.00 . A A . 20 LYS HG3 1 1 17 7558 1 1 20 LYS HZ1 H 10.238 8.949 17.951 1.00 . A A . 20 LYS HZ1 1 1 17 7559 1 1 20 LYS HZ2 H 9.088 8.416 16.830 1.00 . A A . 20 LYS HZ2 1 1 17 7560 1 1 20 LYS HZ3 H 9.224 10.065 17.183 1.00 . A A . 20 LYS HZ3 1 1 17 7561 1 1 20 LYS N N 10.981 5.765 11.549 1.00 . A A . 20 LYS N 1 1 17 7562 1 1 20 LYS NZ N 9.755 9.180 17.058 1.00 . A A . 20 LYS NZ 1 1 17 7563 1 1 20 LYS O O 12.715 7.394 10.124 1.00 . A A . 20 LYS O 1 1 17 7564 1 1 21 CYS C C 13.205 10.875 10.166 1.00 . A A . 21 CYS C 1 1 17 7565 1 1 21 CYS CA C 12.084 10.033 9.561 1.00 . A A . 21 CYS CA 1 1 17 7566 1 1 21 CYS CB C 11.047 10.944 8.901 1.00 . A A . 21 CYS CB 1 1 17 7567 1 1 21 CYS H H 10.736 9.581 11.129 1.00 . A A . 21 CYS H 1 1 17 7568 1 1 21 CYS HA H 12.506 9.381 8.812 1.00 . A A . 21 CYS HA 1 1 17 7569 1 1 21 CYS HB2 H 10.393 10.345 8.285 1.00 . A A . 21 CYS HB2 1 1 17 7570 1 1 21 CYS HB3 H 10.463 11.429 9.670 1.00 . A A . 21 CYS HB3 1 1 17 7571 1 1 21 CYS N N 11.453 9.201 10.577 1.00 . A A . 21 CYS N 1 1 17 7572 1 1 21 CYS O O 12.966 11.966 10.682 1.00 . A A . 21 CYS O 1 1 17 7573 1 1 21 CYS SG S 11.763 12.245 7.846 1.00 . A A . 21 CYS SG 1 1 17 7574 1 1 22 ASP C C 15.758 12.420 9.964 1.00 . A A . 22 ASP C 1 1 17 7575 1 1 22 ASP CA C 15.585 11.062 10.637 1.00 . A A . 22 ASP CA 1 1 17 7576 1 1 22 ASP CB C 16.850 10.222 10.453 1.00 . A A . 22 ASP CB 1 1 17 7577 1 1 22 ASP CG C 17.921 10.557 11.472 1.00 . A A . 22 ASP CG 1 1 17 7578 1 1 22 ASP H H 14.553 9.484 9.674 1.00 . A A . 22 ASP H 1 1 17 7579 1 1 22 ASP HA H 15.417 11.217 11.692 1.00 . A A . 22 ASP HA 1 1 17 7580 1 1 22 ASP HB2 H 16.598 9.176 10.554 1.00 . A A . 22 ASP HB2 1 1 17 7581 1 1 22 ASP HB3 H 17.250 10.398 9.465 1.00 . A A . 22 ASP HB3 1 1 17 7582 1 1 22 ASP N N 14.427 10.359 10.098 1.00 . A A . 22 ASP N 1 1 17 7583 1 1 22 ASP O O 16.258 12.508 8.842 1.00 . A A . 22 ASP O 1 1 17 7584 1 1 22 ASP OD1 O 17.814 11.622 12.117 1.00 . A A . 22 ASP OD1 1 1 17 7585 1 1 22 ASP OD2 O 18.865 9.755 11.626 1.00 . A A . 22 ASP OD2 1 1 17 7586 1 1 23 SER C C 16.891 15.313 10.150 1.00 . A A . 23 SER C 1 1 17 7587 1 1 23 SER CA C 15.445 14.829 10.122 1.00 . A A . 23 SER CA 1 1 17 7588 1 1 23 SER CB C 14.559 15.785 10.922 1.00 . A A . 23 SER CB 1 1 17 7589 1 1 23 SER H H 14.950 13.340 11.544 1.00 . A A . 23 SER H 1 1 17 7590 1 1 23 SER HA H 15.105 14.808 9.097 1.00 . A A . 23 SER HA 1 1 17 7591 1 1 23 SER HB2 H 13.540 15.428 10.904 1.00 . A A . 23 SER HB2 1 1 17 7592 1 1 23 SER HB3 H 14.908 15.825 11.944 1.00 . A A . 23 SER HB3 1 1 17 7593 1 1 23 SER HG H 14.047 17.124 9.587 1.00 . A A . 23 SER HG 1 1 17 7594 1 1 23 SER N N 15.341 13.475 10.655 1.00 . A A . 23 SER N 1 1 17 7595 1 1 23 SER O O 17.233 16.323 9.533 1.00 . A A . 23 SER O 1 1 17 7596 1 1 23 SER OG O 14.595 17.092 10.375 1.00 . A A . 23 SER OG 1 1 17 7597 1 1 24 LYS C C 19.945 14.369 9.813 1.00 . A A . 24 LYS C 1 1 17 7598 1 1 24 LYS CA C 19.149 14.940 10.982 1.00 . A A . 24 LYS CA 1 1 17 7599 1 1 24 LYS CB C 19.723 14.424 12.303 1.00 . A A . 24 LYS CB 1 1 17 7600 1 1 24 LYS CD C 18.695 14.677 14.581 1.00 . A A . 24 LYS CD 1 1 17 7601 1 1 24 LYS CE C 18.424 15.625 15.740 1.00 . A A . 24 LYS CE 1 1 17 7602 1 1 24 LYS CG C 19.483 15.359 13.476 1.00 . A A . 24 LYS CG 1 1 17 7603 1 1 24 LYS H H 17.406 13.792 11.341 1.00 . A A . 24 LYS H 1 1 17 7604 1 1 24 LYS HA H 19.224 16.016 10.962 1.00 . A A . 24 LYS HA 1 1 17 7605 1 1 24 LYS HB2 H 19.269 13.471 12.532 1.00 . A A . 24 LYS HB2 1 1 17 7606 1 1 24 LYS HB3 H 20.789 14.289 12.190 1.00 . A A . 24 LYS HB3 1 1 17 7607 1 1 24 LYS HD2 H 17.751 14.337 14.182 1.00 . A A . 24 LYS HD2 1 1 17 7608 1 1 24 LYS HD3 H 19.260 13.830 14.945 1.00 . A A . 24 LYS HD3 1 1 17 7609 1 1 24 LYS HE2 H 19.288 16.256 15.881 1.00 . A A . 24 LYS HE2 1 1 17 7610 1 1 24 LYS HE3 H 17.568 16.236 15.495 1.00 . A A . 24 LYS HE3 1 1 17 7611 1 1 24 LYS HG2 H 20.437 15.677 13.872 1.00 . A A . 24 LYS HG2 1 1 17 7612 1 1 24 LYS HG3 H 18.930 16.221 13.131 1.00 . A A . 24 LYS HG3 1 1 17 7613 1 1 24 LYS HZ1 H 19.014 14.836 17.582 1.00 . A A . 24 LYS HZ1 1 1 17 7614 1 1 24 LYS HZ2 H 17.827 13.924 16.795 1.00 . A A . 24 LYS HZ2 1 1 17 7615 1 1 24 LYS HZ3 H 17.412 15.380 17.551 1.00 . A A . 24 LYS HZ3 1 1 17 7616 1 1 24 LYS N N 17.738 14.587 10.872 1.00 . A A . 24 LYS N 1 1 17 7617 1 1 24 LYS NZ N 18.150 14.890 17.005 1.00 . A A . 24 LYS NZ 1 1 17 7618 1 1 24 LYS O O 20.797 15.049 9.240 1.00 . A A . 24 LYS O 1 1 17 7619 1 1 25 ARG C C 19.487 12.452 7.104 1.00 . A A . 25 ARG C 1 1 17 7620 1 1 25 ARG CA C 20.351 12.458 8.362 1.00 . A A . 25 ARG CA 1 1 17 7621 1 1 25 ARG CB C 20.718 11.024 8.749 1.00 . A A . 25 ARG CB 1 1 17 7622 1 1 25 ARG CD C 22.689 9.865 9.791 1.00 . A A . 25 ARG CD 1 1 17 7623 1 1 25 ARG CG C 21.622 10.934 9.967 1.00 . A A . 25 ARG CG 1 1 17 7624 1 1 25 ARG CZ C 21.683 7.897 10.869 1.00 . A A . 25 ARG CZ 1 1 17 7625 1 1 25 ARG H H 18.972 12.629 9.958 1.00 . A A . 25 ARG H 1 1 17 7626 1 1 25 ARG HA H 21.257 13.010 8.159 1.00 . A A . 25 ARG HA 1 1 17 7627 1 1 25 ARG HB2 H 19.810 10.478 8.960 1.00 . A A . 25 ARG HB2 1 1 17 7628 1 1 25 ARG HB3 H 21.223 10.558 7.917 1.00 . A A . 25 ARG HB3 1 1 17 7629 1 1 25 ARG HD2 H 23.200 10.036 8.856 1.00 . A A . 25 ARG HD2 1 1 17 7630 1 1 25 ARG HD3 H 23.393 9.941 10.606 1.00 . A A . 25 ARG HD3 1 1 17 7631 1 1 25 ARG HE H 22.060 8.059 8.917 1.00 . A A . 25 ARG HE 1 1 17 7632 1 1 25 ARG HG2 H 22.105 11.888 10.116 1.00 . A A . 25 ARG HG2 1 1 17 7633 1 1 25 ARG HG3 H 21.022 10.693 10.832 1.00 . A A . 25 ARG HG3 1 1 17 7634 1 1 25 ARG HH11 H 22.130 9.418 12.122 1.00 . A A . 25 ARG HH11 1 1 17 7635 1 1 25 ARG HH12 H 21.420 8.025 12.869 1.00 . A A . 25 ARG HH12 1 1 17 7636 1 1 25 ARG HH21 H 21.125 6.220 9.889 1.00 . A A . 25 ARG HH21 1 1 17 7637 1 1 25 ARG HH22 H 20.850 6.206 11.598 1.00 . A A . 25 ARG HH22 1 1 17 7638 1 1 25 ARG N N 19.661 13.119 9.463 1.00 . A A . 25 ARG N 1 1 17 7639 1 1 25 ARG NE N 22.119 8.520 9.780 1.00 . A A . 25 ARG NE 1 1 17 7640 1 1 25 ARG NH1 N 21.750 8.496 12.050 1.00 . A A . 25 ARG NH1 1 1 17 7641 1 1 25 ARG NH2 N 21.178 6.674 10.778 1.00 . A A . 25 ARG NH2 1 1 17 7642 1 1 25 ARG O O 19.874 11.899 6.075 1.00 . A A . 25 ARG O 1 1 17 7643 1 1 26 LYS C C 17.140 11.751 5.488 1.00 . A A . 26 LYS C 1 1 17 7644 1 1 26 LYS CA C 17.396 13.139 6.065 1.00 . A A . 26 LYS CA 1 1 17 7645 1 1 26 LYS CB C 17.957 14.060 4.979 1.00 . A A . 26 LYS CB 1 1 17 7646 1 1 26 LYS CD C 18.488 16.403 4.247 1.00 . A A . 26 LYS CD 1 1 17 7647 1 1 26 LYS CE C 18.455 17.875 4.628 1.00 . A A . 26 LYS CE 1 1 17 7648 1 1 26 LYS CG C 18.013 15.521 5.390 1.00 . A A . 26 LYS CG 1 1 17 7649 1 1 26 LYS H H 18.063 13.495 8.043 1.00 . A A . 26 LYS H 1 1 17 7650 1 1 26 LYS HA H 16.461 13.546 6.422 1.00 . A A . 26 LYS HA 1 1 17 7651 1 1 26 LYS HB2 H 18.957 13.737 4.733 1.00 . A A . 26 LYS HB2 1 1 17 7652 1 1 26 LYS HB3 H 17.335 13.979 4.099 1.00 . A A . 26 LYS HB3 1 1 17 7653 1 1 26 LYS HD2 H 19.502 16.132 3.991 1.00 . A A . 26 LYS HD2 1 1 17 7654 1 1 26 LYS HD3 H 17.846 16.247 3.392 1.00 . A A . 26 LYS HD3 1 1 17 7655 1 1 26 LYS HE2 H 18.059 17.966 5.628 1.00 . A A . 26 LYS HE2 1 1 17 7656 1 1 26 LYS HE3 H 19.463 18.262 4.604 1.00 . A A . 26 LYS HE3 1 1 17 7657 1 1 26 LYS HG2 H 17.026 15.840 5.690 1.00 . A A . 26 LYS HG2 1 1 17 7658 1 1 26 LYS HG3 H 18.696 15.626 6.221 1.00 . A A . 26 LYS HG3 1 1 17 7659 1 1 26 LYS HZ1 H 16.603 18.558 3.945 1.00 . A A . 26 LYS HZ1 1 1 17 7660 1 1 26 LYS HZ2 H 17.750 18.347 2.720 1.00 . A A . 26 LYS HZ2 1 1 17 7661 1 1 26 LYS HZ3 H 17.858 19.678 3.758 1.00 . A A . 26 LYS HZ3 1 1 17 7662 1 1 26 LYS N N 18.315 13.072 7.195 1.00 . A A . 26 LYS N 1 1 17 7663 1 1 26 LYS NZ N 17.608 18.670 3.697 1.00 . A A . 26 LYS NZ 1 1 17 7664 1 1 26 LYS O O 17.131 11.566 4.271 1.00 . A A . 26 LYS O 1 1 17 7665 1 1 27 VAL C C 15.790 8.678 6.955 1.00 . A A . 27 VAL C 1 1 17 7666 1 1 27 VAL CA C 16.671 9.407 5.947 1.00 . A A . 27 VAL CA 1 1 17 7667 1 1 27 VAL CB C 17.982 8.619 5.763 1.00 . A A . 27 VAL CB 1 1 17 7668 1 1 27 VAL CG1 C 18.720 9.092 4.519 1.00 . A A . 27 VAL CG1 1 1 17 7669 1 1 27 VAL CG2 C 18.861 8.753 6.997 1.00 . A A . 27 VAL CG2 1 1 17 7670 1 1 27 VAL H H 16.950 10.987 7.326 1.00 . A A . 27 VAL H 1 1 17 7671 1 1 27 VAL HA H 16.160 9.441 4.995 1.00 . A A . 27 VAL HA 1 1 17 7672 1 1 27 VAL HB H 17.736 7.575 5.633 1.00 . A A . 27 VAL HB 1 1 17 7673 1 1 27 VAL HG11 H 18.901 10.154 4.591 1.00 . A A . 27 VAL HG11 1 1 17 7674 1 1 27 VAL HG12 H 19.662 8.569 4.438 1.00 . A A . 27 VAL HG12 1 1 17 7675 1 1 27 VAL HG13 H 18.118 8.888 3.645 1.00 . A A . 27 VAL HG13 1 1 17 7676 1 1 27 VAL HG21 H 19.383 7.823 7.169 1.00 . A A . 27 VAL HG21 1 1 17 7677 1 1 27 VAL HG22 H 19.579 9.546 6.844 1.00 . A A . 27 VAL HG22 1 1 17 7678 1 1 27 VAL HG23 H 18.247 8.985 7.854 1.00 . A A . 27 VAL HG23 1 1 17 7679 1 1 27 VAL N N 16.930 10.778 6.369 1.00 . A A . 27 VAL N 1 1 17 7680 1 1 27 VAL O O 15.628 9.124 8.091 1.00 . A A . 27 VAL O 1 1 17 7681 1 1 28 CYS C C 15.180 5.819 8.274 1.00 . A A . 28 CYS C 1 1 17 7682 1 1 28 CYS CA C 14.358 6.761 7.398 1.00 . A A . 28 CYS CA 1 1 17 7683 1 1 28 CYS CB C 13.362 5.956 6.560 1.00 . A A . 28 CYS CB 1 1 17 7684 1 1 28 CYS H H 15.390 7.248 5.616 1.00 . A A . 28 CYS H 1 1 17 7685 1 1 28 CYS HA H 13.813 7.440 8.035 1.00 . A A . 28 CYS HA 1 1 17 7686 1 1 28 CYS HB2 H 13.905 5.382 5.823 1.00 . A A . 28 CYS HB2 1 1 17 7687 1 1 28 CYS HB3 H 12.822 5.281 7.207 1.00 . A A . 28 CYS HB3 1 1 17 7688 1 1 28 CYS N N 15.223 7.553 6.533 1.00 . A A . 28 CYS N 1 1 17 7689 1 1 28 CYS O O 16.191 5.270 7.836 1.00 . A A . 28 CYS O 1 1 17 7690 1 1 28 CYS SG S 12.140 6.976 5.676 1.00 . A A . 28 CYS SG 1 1 17 7691 1 1 29 VAL C C 14.441 3.956 11.285 1.00 . A A . 29 VAL C 1 1 17 7692 1 1 29 VAL CA C 15.431 4.762 10.452 1.00 . A A . 29 VAL CA 1 1 17 7693 1 1 29 VAL CB C 16.347 5.563 11.397 1.00 . A A . 29 VAL CB 1 1 17 7694 1 1 29 VAL CG1 C 17.536 6.128 10.635 1.00 . A A . 29 VAL CG1 1 1 17 7695 1 1 29 VAL CG2 C 15.565 6.675 12.081 1.00 . A A . 29 VAL CG2 1 1 17 7696 1 1 29 VAL H H 13.927 6.103 9.806 1.00 . A A . 29 VAL H 1 1 17 7697 1 1 29 VAL HA H 16.045 4.081 9.882 1.00 . A A . 29 VAL HA 1 1 17 7698 1 1 29 VAL HB H 16.720 4.894 12.158 1.00 . A A . 29 VAL HB 1 1 17 7699 1 1 29 VAL HG11 H 17.838 5.429 9.869 1.00 . A A . 29 VAL HG11 1 1 17 7700 1 1 29 VAL HG12 H 17.259 7.067 10.179 1.00 . A A . 29 VAL HG12 1 1 17 7701 1 1 29 VAL HG13 H 18.357 6.288 11.319 1.00 . A A . 29 VAL HG13 1 1 17 7702 1 1 29 VAL HG21 H 16.054 6.942 13.005 1.00 . A A . 29 VAL HG21 1 1 17 7703 1 1 29 VAL HG22 H 15.524 7.538 11.433 1.00 . A A . 29 VAL HG22 1 1 17 7704 1 1 29 VAL HG23 H 14.561 6.334 12.289 1.00 . A A . 29 VAL HG23 1 1 17 7705 1 1 29 VAL N N 14.738 5.638 9.515 1.00 . A A . 29 VAL N 1 1 17 7706 1 1 29 VAL O O 13.229 4.145 11.184 1.00 . A A . 29 VAL O 1 1 17 7707 1 1 30 LYS C C 13.664 2.993 14.194 1.00 . A A . 30 LYS C 1 1 17 7708 1 1 30 LYS CA C 14.129 2.220 12.963 1.00 . A A . 30 LYS CA 1 1 17 7709 1 1 30 LYS CB C 14.896 0.968 13.395 1.00 . A A . 30 LYS CB 1 1 17 7710 1 1 30 LYS CD C 14.157 -1.426 13.582 1.00 . A A . 30 LYS CD 1 1 17 7711 1 1 30 LYS CE C 12.935 -2.267 13.918 1.00 . A A . 30 LYS CE 1 1 17 7712 1 1 30 LYS CG C 14.048 -0.028 14.168 1.00 . A A . 30 LYS CG 1 1 17 7713 1 1 30 LYS H H 15.940 2.951 12.146 1.00 . A A . 30 LYS H 1 1 17 7714 1 1 30 LYS HA H 13.264 1.923 12.391 1.00 . A A . 30 LYS HA 1 1 17 7715 1 1 30 LYS HB2 H 15.280 0.474 12.514 1.00 . A A . 30 LYS HB2 1 1 17 7716 1 1 30 LYS HB3 H 15.725 1.265 14.021 1.00 . A A . 30 LYS HB3 1 1 17 7717 1 1 30 LYS HD2 H 14.244 -1.351 12.508 1.00 . A A . 30 LYS HD2 1 1 17 7718 1 1 30 LYS HD3 H 15.037 -1.908 13.984 1.00 . A A . 30 LYS HD3 1 1 17 7719 1 1 30 LYS HE2 H 12.735 -2.182 14.975 1.00 . A A . 30 LYS HE2 1 1 17 7720 1 1 30 LYS HE3 H 12.090 -1.890 13.361 1.00 . A A . 30 LYS HE3 1 1 17 7721 1 1 30 LYS HG2 H 14.384 -0.052 15.194 1.00 . A A . 30 LYS HG2 1 1 17 7722 1 1 30 LYS HG3 H 13.015 0.288 14.132 1.00 . A A . 30 LYS HG3 1 1 17 7723 1 1 30 LYS HZ1 H 14.148 -3.888 13.402 1.00 . A A . 30 LYS HZ1 1 1 17 7724 1 1 30 LYS HZ2 H 12.600 -3.947 12.722 1.00 . A A . 30 LYS HZ2 1 1 17 7725 1 1 30 LYS HZ3 H 12.818 -4.305 14.361 1.00 . A A . 30 LYS HZ3 1 1 17 7726 1 1 30 LYS N N 14.966 3.056 12.110 1.00 . A A . 30 LYS N 1 1 17 7727 1 1 30 LYS NZ N 13.139 -3.702 13.577 1.00 . A A . 30 LYS NZ 1 1 17 7728 1 1 30 LYS O O 14.387 3.097 15.183 1.00 . A A . 30 LYS O 1 1 17 7729 1 1 31 GLY C C 11.802 3.457 16.504 1.00 . A A . 31 GLY C 1 1 17 7730 1 1 31 GLY CA C 11.909 4.287 15.239 1.00 . A A . 31 GLY CA 1 1 17 7731 1 1 31 GLY H H 11.918 3.416 13.309 1.00 . A A . 31 GLY H 1 1 17 7732 1 1 31 GLY HA2 H 12.550 5.134 15.431 1.00 . A A . 31 GLY HA2 1 1 17 7733 1 1 31 GLY HA3 H 10.925 4.644 14.973 1.00 . A A . 31 GLY HA3 1 1 17 7734 1 1 31 GLY N N 12.450 3.532 14.124 1.00 . A A . 31 GLY N 1 1 17 7735 1 1 31 GLY O O 10.802 3.528 17.217 1.00 . A A . 31 GLY O 1 1 18 7736 1 1 1 GLY C C 3.519 -0.132 -1.054 1.00 . A A . 1 GLY C 1 1 18 7737 1 1 1 GLY CA C 2.044 0.055 -1.349 1.00 . A A . 1 GLY CA 1 1 18 7738 1 1 1 GLY H1 H 0.419 0.859 -0.254 1.00 . A A . 1 GLY H1 1 1 18 7739 1 1 1 GLY HA2 H 1.560 -0.910 -1.341 1.00 . A A . 1 GLY HA2 1 1 18 7740 1 1 1 GLY HA3 H 1.937 0.492 -2.331 1.00 . A A . 1 GLY HA3 1 1 18 7741 1 1 1 GLY N N 1.389 0.916 -0.381 1.00 . A A . 1 GLY N 1 1 18 7742 1 1 1 GLY O O 3.999 -1.261 -0.950 1.00 . A A . 1 GLY O 1 1 18 7743 1 1 2 TYR C C 6.167 2.273 -0.120 1.00 . A A . 2 TYR C 1 1 18 7744 1 1 2 TYR CA C 5.669 0.929 -0.642 1.00 . A A . 2 TYR CA 1 1 18 7745 1 1 2 TYR CB C 6.444 0.539 -1.902 1.00 . A A . 2 TYR CB 1 1 18 7746 1 1 2 TYR CD1 C 8.829 0.888 -1.148 1.00 . A A . 2 TYR CD1 1 1 18 7747 1 1 2 TYR CD2 C 8.173 -1.300 -1.830 1.00 . A A . 2 TYR CD2 1 1 18 7748 1 1 2 TYR CE1 C 10.107 0.430 -0.891 1.00 . A A . 2 TYR CE1 1 1 18 7749 1 1 2 TYR CE2 C 9.448 -1.767 -1.574 1.00 . A A . 2 TYR CE2 1 1 18 7750 1 1 2 TYR CG C 7.841 0.033 -1.621 1.00 . A A . 2 TYR CG 1 1 18 7751 1 1 2 TYR CZ C 10.411 -0.899 -1.105 1.00 . A A . 2 TYR CZ 1 1 18 7752 1 1 2 TYR H H 3.799 1.847 -1.015 1.00 . A A . 2 TYR H 1 1 18 7753 1 1 2 TYR HA H 5.834 0.178 0.117 1.00 . A A . 2 TYR HA 1 1 18 7754 1 1 2 TYR HB2 H 5.907 -0.240 -2.420 1.00 . A A . 2 TYR HB2 1 1 18 7755 1 1 2 TYR HB3 H 6.527 1.402 -2.546 1.00 . A A . 2 TYR HB3 1 1 18 7756 1 1 2 TYR HD1 H 8.588 1.927 -0.981 1.00 . A A . 2 TYR HD1 1 1 18 7757 1 1 2 TYR HD2 H 7.416 -1.978 -2.198 1.00 . A A . 2 TYR HD2 1 1 18 7758 1 1 2 TYR HE1 H 10.861 1.109 -0.523 1.00 . A A . 2 TYR HE1 1 1 18 7759 1 1 2 TYR HE2 H 9.686 -2.807 -1.743 1.00 . A A . 2 TYR HE2 1 1 18 7760 1 1 2 TYR HH H 12.230 -1.235 -1.629 1.00 . A A . 2 TYR HH 1 1 18 7761 1 1 2 TYR N N 4.239 0.976 -0.922 1.00 . A A . 2 TYR N 1 1 18 7762 1 1 2 TYR O O 6.163 3.272 -0.841 1.00 . A A . 2 TYR O 1 1 18 7763 1 1 2 TYR OH O 11.682 -1.360 -0.851 1.00 . A A . 2 TYR OH 1 1 18 7764 1 1 3 CYS C C 8.623 3.529 1.766 1.00 . A A . 3 CYS C 1 1 18 7765 1 1 3 CYS CA C 7.097 3.511 1.758 1.00 . A A . 3 CYS CA 1 1 18 7766 1 1 3 CYS CB C 6.567 3.636 3.188 1.00 . A A . 3 CYS CB 1 1 18 7767 1 1 3 CYS H H 6.574 1.462 1.662 1.00 . A A . 3 CYS H 1 1 18 7768 1 1 3 CYS HA H 6.743 4.349 1.177 1.00 . A A . 3 CYS HA 1 1 18 7769 1 1 3 CYS HB2 H 7.296 3.224 3.871 1.00 . A A . 3 CYS HB2 1 1 18 7770 1 1 3 CYS HB3 H 6.416 4.680 3.417 1.00 . A A . 3 CYS HB3 1 1 18 7771 1 1 3 CYS N N 6.595 2.291 1.137 1.00 . A A . 3 CYS N 1 1 18 7772 1 1 3 CYS O O 9.268 2.664 1.174 1.00 . A A . 3 CYS O 1 1 18 7773 1 1 3 CYS SG S 4.990 2.770 3.474 1.00 . A A . 3 CYS SG 1 1 18 7774 1 1 4 ALA C C 11.191 3.888 3.730 1.00 . A A . 4 ALA C 1 1 18 7775 1 1 4 ALA CA C 10.643 4.651 2.529 1.00 . A A . 4 ALA CA 1 1 18 7776 1 1 4 ALA CB C 11.037 6.119 2.610 1.00 . A A . 4 ALA CB 1 1 18 7777 1 1 4 ALA H H 8.626 5.181 2.893 1.00 . A A . 4 ALA H 1 1 18 7778 1 1 4 ALA HA H 11.070 4.238 1.627 1.00 . A A . 4 ALA HA 1 1 18 7779 1 1 4 ALA HB1 H 10.981 6.560 1.625 1.00 . A A . 4 ALA HB1 1 1 18 7780 1 1 4 ALA HB2 H 10.363 6.636 3.275 1.00 . A A . 4 ALA HB2 1 1 18 7781 1 1 4 ALA HB3 H 12.047 6.200 2.984 1.00 . A A . 4 ALA HB3 1 1 18 7782 1 1 4 ALA N N 9.194 4.521 2.442 1.00 . A A . 4 ALA N 1 1 18 7783 1 1 4 ALA O O 10.987 4.285 4.878 1.00 . A A . 4 ALA O 1 1 18 7784 1 1 5 THR C C 13.806 2.526 4.977 1.00 . A A . 5 THR C 1 1 18 7785 1 1 5 THR CA C 12.464 1.968 4.517 1.00 . A A . 5 THR CA 1 1 18 7786 1 1 5 THR CB C 12.657 0.511 4.056 1.00 . A A . 5 THR CB 1 1 18 7787 1 1 5 THR CG2 C 11.359 -0.272 4.178 1.00 . A A . 5 THR CG2 1 1 18 7788 1 1 5 THR H H 12.016 2.524 2.524 1.00 . A A . 5 THR H 1 1 18 7789 1 1 5 THR HA H 11.778 1.971 5.352 1.00 . A A . 5 THR HA 1 1 18 7790 1 1 5 THR HB H 13.402 0.046 4.686 1.00 . A A . 5 THR HB 1 1 18 7791 1 1 5 THR HG1 H 14.071 0.517 2.681 1.00 . A A . 5 THR HG1 1 1 18 7792 1 1 5 THR HG21 H 11.107 -0.703 3.220 1.00 . A A . 5 THR HG21 1 1 18 7793 1 1 5 THR HG22 H 10.567 0.391 4.493 1.00 . A A . 5 THR HG22 1 1 18 7794 1 1 5 THR HG23 H 11.481 -1.059 4.906 1.00 . A A . 5 THR HG23 1 1 18 7795 1 1 5 THR N N 11.888 2.789 3.459 1.00 . A A . 5 THR N 1 1 18 7796 1 1 5 THR O O 14.314 3.494 4.411 1.00 . A A . 5 THR O 1 1 18 7797 1 1 5 THR OG1 O 13.112 0.484 2.698 1.00 . A A . 5 THR OG1 1 1 18 7798 1 1 6 LYS C C 16.667 2.578 5.420 1.00 . A A . 6 LYS C 1 1 18 7799 1 1 6 LYS CA C 15.661 2.343 6.542 1.00 . A A . 6 LYS CA 1 1 18 7800 1 1 6 LYS CB C 16.206 1.301 7.521 1.00 . A A . 6 LYS CB 1 1 18 7801 1 1 6 LYS CD C 17.862 0.779 9.337 1.00 . A A . 6 LYS CD 1 1 18 7802 1 1 6 LYS CE C 18.259 -0.592 8.811 1.00 . A A . 6 LYS CE 1 1 18 7803 1 1 6 LYS CG C 17.495 1.724 8.205 1.00 . A A . 6 LYS CG 1 1 18 7804 1 1 6 LYS H H 13.921 1.143 6.416 1.00 . A A . 6 LYS H 1 1 18 7805 1 1 6 LYS HA H 15.504 3.272 7.069 1.00 . A A . 6 LYS HA 1 1 18 7806 1 1 6 LYS HB2 H 15.463 1.116 8.282 1.00 . A A . 6 LYS HB2 1 1 18 7807 1 1 6 LYS HB3 H 16.394 0.383 6.982 1.00 . A A . 6 LYS HB3 1 1 18 7808 1 1 6 LYS HD2 H 18.693 1.196 9.887 1.00 . A A . 6 LYS HD2 1 1 18 7809 1 1 6 LYS HD3 H 17.011 0.671 9.994 1.00 . A A . 6 LYS HD3 1 1 18 7810 1 1 6 LYS HE2 H 18.268 -1.289 9.635 1.00 . A A . 6 LYS HE2 1 1 18 7811 1 1 6 LYS HE3 H 17.529 -0.907 8.080 1.00 . A A . 6 LYS HE3 1 1 18 7812 1 1 6 LYS HG2 H 18.294 1.726 7.478 1.00 . A A . 6 LYS HG2 1 1 18 7813 1 1 6 LYS HG3 H 17.368 2.720 8.606 1.00 . A A . 6 LYS HG3 1 1 18 7814 1 1 6 LYS HZ1 H 19.718 -1.400 7.554 1.00 . A A . 6 LYS HZ1 1 1 18 7815 1 1 6 LYS HZ2 H 20.345 -0.602 8.906 1.00 . A A . 6 LYS HZ2 1 1 18 7816 1 1 6 LYS HZ3 H 19.723 0.291 7.611 1.00 . A A . 6 LYS HZ3 1 1 18 7817 1 1 6 LYS N N 14.376 1.910 6.007 1.00 . A A . 6 LYS N 1 1 18 7818 1 1 6 LYS NZ N 19.606 -0.574 8.176 1.00 . A A . 6 LYS NZ 1 1 18 7819 1 1 6 LYS O O 16.795 1.763 4.508 1.00 . A A . 6 LYS O 1 1 18 7820 1 1 7 GLY C C 17.804 4.901 3.383 1.00 . A A . 7 GLY C 1 1 18 7821 1 1 7 GLY CA C 18.366 4.018 4.480 1.00 . A A . 7 GLY CA 1 1 18 7822 1 1 7 GLY H H 17.235 4.311 6.246 1.00 . A A . 7 GLY H 1 1 18 7823 1 1 7 GLY HA2 H 19.196 4.528 4.948 1.00 . A A . 7 GLY HA2 1 1 18 7824 1 1 7 GLY HA3 H 18.724 3.099 4.039 1.00 . A A . 7 GLY HA3 1 1 18 7825 1 1 7 GLY N N 17.380 3.698 5.495 1.00 . A A . 7 GLY N 1 1 18 7826 1 1 7 GLY O O 18.551 5.589 2.687 1.00 . A A . 7 GLY O 1 1 18 7827 1 1 8 ILE C C 15.547 7.095 2.713 1.00 . A A . 8 ILE C 1 1 18 7828 1 1 8 ILE CA C 15.824 5.684 2.207 1.00 . A A . 8 ILE CA 1 1 18 7829 1 1 8 ILE CB C 14.497 5.043 1.757 1.00 . A A . 8 ILE CB 1 1 18 7830 1 1 8 ILE CD1 C 15.631 3.318 0.268 1.00 . A A . 8 ILE CD1 1 1 18 7831 1 1 8 ILE CG1 C 14.704 3.561 1.438 1.00 . A A . 8 ILE CG1 1 1 18 7832 1 1 8 ILE CG2 C 13.937 5.777 0.549 1.00 . A A . 8 ILE CG2 1 1 18 7833 1 1 8 ILE H H 15.943 4.311 3.813 1.00 . A A . 8 ILE H 1 1 18 7834 1 1 8 ILE HA H 16.481 5.741 1.351 1.00 . A A . 8 ILE HA 1 1 18 7835 1 1 8 ILE HB H 13.787 5.134 2.565 1.00 . A A . 8 ILE HB 1 1 18 7836 1 1 8 ILE HD11 H 15.966 4.265 -0.129 1.00 . A A . 8 ILE HD11 1 1 18 7837 1 1 8 ILE HD12 H 16.484 2.743 0.596 1.00 . A A . 8 ILE HD12 1 1 18 7838 1 1 8 ILE HD13 H 15.104 2.772 -0.502 1.00 . A A . 8 ILE HD13 1 1 18 7839 1 1 8 ILE HG12 H 15.124 3.068 2.301 1.00 . A A . 8 ILE HG12 1 1 18 7840 1 1 8 ILE HG13 H 13.748 3.114 1.204 1.00 . A A . 8 ILE HG13 1 1 18 7841 1 1 8 ILE HG21 H 13.603 6.760 0.847 1.00 . A A . 8 ILE HG21 1 1 18 7842 1 1 8 ILE HG22 H 14.707 5.873 -0.203 1.00 . A A . 8 ILE HG22 1 1 18 7843 1 1 8 ILE HG23 H 13.105 5.222 0.143 1.00 . A A . 8 ILE HG23 1 1 18 7844 1 1 8 ILE N N 16.485 4.880 3.228 1.00 . A A . 8 ILE N 1 1 18 7845 1 1 8 ILE O O 15.080 7.285 3.836 1.00 . A A . 8 ILE O 1 1 18 7846 1 1 9 LYS C C 14.196 9.695 2.743 1.00 . A A . 9 LYS C 1 1 18 7847 1 1 9 LYS CA C 15.618 9.481 2.234 1.00 . A A . 9 LYS CA 1 1 18 7848 1 1 9 LYS CB C 15.881 10.387 1.029 1.00 . A A . 9 LYS CB 1 1 18 7849 1 1 9 LYS CD C 18.364 10.401 1.409 1.00 . A A . 9 LYS CD 1 1 18 7850 1 1 9 LYS CE C 19.570 11.072 0.769 1.00 . A A . 9 LYS CE 1 1 18 7851 1 1 9 LYS CG C 17.249 10.181 0.401 1.00 . A A . 9 LYS CG 1 1 18 7852 1 1 9 LYS H H 16.208 7.871 0.992 1.00 . A A . 9 LYS H 1 1 18 7853 1 1 9 LYS HA H 16.311 9.734 3.022 1.00 . A A . 9 LYS HA 1 1 18 7854 1 1 9 LYS HB2 H 15.130 10.193 0.277 1.00 . A A . 9 LYS HB2 1 1 18 7855 1 1 9 LYS HB3 H 15.804 11.417 1.344 1.00 . A A . 9 LYS HB3 1 1 18 7856 1 1 9 LYS HD2 H 17.998 11.029 2.207 1.00 . A A . 9 LYS HD2 1 1 18 7857 1 1 9 LYS HD3 H 18.667 9.444 1.812 1.00 . A A . 9 LYS HD3 1 1 18 7858 1 1 9 LYS HE2 H 20.118 10.334 0.204 1.00 . A A . 9 LYS HE2 1 1 18 7859 1 1 9 LYS HE3 H 19.222 11.849 0.105 1.00 . A A . 9 LYS HE3 1 1 18 7860 1 1 9 LYS HG2 H 17.313 9.172 0.022 1.00 . A A . 9 LYS HG2 1 1 18 7861 1 1 9 LYS HG3 H 17.369 10.882 -0.414 1.00 . A A . 9 LYS HG3 1 1 18 7862 1 1 9 LYS HZ1 H 21.438 11.300 1.675 1.00 . A A . 9 LYS HZ1 1 1 18 7863 1 1 9 LYS HZ2 H 20.137 11.447 2.745 1.00 . A A . 9 LYS HZ2 1 1 18 7864 1 1 9 LYS HZ3 H 20.500 12.708 1.677 1.00 . A A . 9 LYS HZ3 1 1 18 7865 1 1 9 LYS N N 15.837 8.085 1.875 1.00 . A A . 9 LYS N 1 1 18 7866 1 1 9 LYS NZ N 20.474 11.674 1.788 1.00 . A A . 9 LYS NZ 1 1 18 7867 1 1 9 LYS O O 13.251 9.075 2.255 1.00 . A A . 9 LYS O 1 1 18 7868 1 1 10 CYS C C 12.444 12.369 4.226 1.00 . A A . 10 CYS C 1 1 18 7869 1 1 10 CYS CA C 12.745 10.875 4.301 1.00 . A A . 10 CYS CA 1 1 18 7870 1 1 10 CYS CB C 12.685 10.404 5.755 1.00 . A A . 10 CYS CB 1 1 18 7871 1 1 10 CYS H H 14.842 11.041 4.074 1.00 . A A . 10 CYS H 1 1 18 7872 1 1 10 CYS HA H 12.001 10.342 3.728 1.00 . A A . 10 CYS HA 1 1 18 7873 1 1 10 CYS HB2 H 11.661 10.168 6.008 1.00 . A A . 10 CYS HB2 1 1 18 7874 1 1 10 CYS HB3 H 13.290 9.516 5.863 1.00 . A A . 10 CYS HB3 1 1 18 7875 1 1 10 CYS N N 14.051 10.578 3.726 1.00 . A A . 10 CYS N 1 1 18 7876 1 1 10 CYS O O 11.452 12.841 4.780 1.00 . A A . 10 CYS O 1 1 18 7877 1 1 10 CYS SG S 13.282 11.633 6.960 1.00 . A A . 10 CYS SG 1 1 18 7878 1 1 11 ASN C C 11.872 14.866 2.596 1.00 . A A . 11 ASN C 1 1 18 7879 1 1 11 ASN CA C 13.136 14.547 3.389 1.00 . A A . 11 ASN CA 1 1 18 7880 1 1 11 ASN CB C 14.355 15.159 2.695 1.00 . A A . 11 ASN CB 1 1 18 7881 1 1 11 ASN CG C 14.814 14.339 1.505 1.00 . A A . 11 ASN CG 1 1 18 7882 1 1 11 ASN H H 14.081 12.672 3.118 1.00 . A A . 11 ASN H 1 1 18 7883 1 1 11 ASN HA H 13.045 14.973 4.377 1.00 . A A . 11 ASN HA 1 1 18 7884 1 1 11 ASN HB2 H 14.104 16.151 2.348 1.00 . A A . 11 ASN HB2 1 1 18 7885 1 1 11 ASN HB3 H 15.169 15.224 3.400 1.00 . A A . 11 ASN HB3 1 1 18 7886 1 1 11 ASN HD21 H 13.209 14.895 0.471 1.00 . A A . 11 ASN HD21 1 1 18 7887 1 1 11 ASN HD22 H 14.302 13.838 -0.350 1.00 . A A . 11 ASN HD22 1 1 18 7888 1 1 11 ASN N N 13.309 13.107 3.537 1.00 . A A . 11 ASN N 1 1 18 7889 1 1 11 ASN ND2 N 14.029 14.360 0.434 1.00 . A A . 11 ASN ND2 1 1 18 7890 1 1 11 ASN O O 11.267 15.924 2.772 1.00 . A A . 11 ASN O 1 1 18 7891 1 1 11 ASN OD1 O 15.863 13.695 1.548 1.00 . A A . 11 ASN OD1 1 1 18 7892 1 1 12 ASP C C 9.298 12.983 1.125 1.00 . A A . 12 ASP C 1 1 18 7893 1 1 12 ASP CA C 10.286 14.124 0.906 1.00 . A A . 12 ASP CA 1 1 18 7894 1 1 12 ASP CB C 10.665 14.211 -0.573 1.00 . A A . 12 ASP CB 1 1 18 7895 1 1 12 ASP CG C 11.188 15.581 -0.958 1.00 . A A . 12 ASP CG 1 1 18 7896 1 1 12 ASP H H 12.004 13.121 1.631 1.00 . A A . 12 ASP H 1 1 18 7897 1 1 12 ASP HA H 9.818 15.051 1.203 1.00 . A A . 12 ASP HA 1 1 18 7898 1 1 12 ASP HB2 H 11.433 13.481 -0.785 1.00 . A A . 12 ASP HB2 1 1 18 7899 1 1 12 ASP HB3 H 9.794 13.995 -1.174 1.00 . A A . 12 ASP HB3 1 1 18 7900 1 1 12 ASP N N 11.479 13.943 1.725 1.00 . A A . 12 ASP N 1 1 18 7901 1 1 12 ASP O O 8.169 13.202 1.565 1.00 . A A . 12 ASP O 1 1 18 7902 1 1 12 ASP OD1 O 10.474 16.577 -0.719 1.00 . A A . 12 ASP OD1 1 1 18 7903 1 1 12 ASP OD2 O 12.311 15.657 -1.498 1.00 . A A . 12 ASP OD2 1 1 18 7904 1 1 13 ILE C C 8.760 10.202 2.447 1.00 . A A . 13 ILE C 1 1 18 7905 1 1 13 ILE CA C 8.885 10.590 0.978 1.00 . A A . 13 ILE CA 1 1 18 7906 1 1 13 ILE CB C 9.432 9.388 0.186 1.00 . A A . 13 ILE CB 1 1 18 7907 1 1 13 ILE CD1 C 8.449 7.357 -0.992 1.00 . A A . 13 ILE CD1 1 1 18 7908 1 1 13 ILE CG1 C 8.451 8.215 0.253 1.00 . A A . 13 ILE CG1 1 1 18 7909 1 1 13 ILE CG2 C 10.795 8.976 0.722 1.00 . A A . 13 ILE CG2 1 1 18 7910 1 1 13 ILE H H 10.641 11.655 0.468 1.00 . A A . 13 ILE H 1 1 18 7911 1 1 13 ILE HA H 7.903 10.830 0.595 1.00 . A A . 13 ILE HA 1 1 18 7912 1 1 13 ILE HB H 9.553 9.688 -0.844 1.00 . A A . 13 ILE HB 1 1 18 7913 1 1 13 ILE HD11 H 7.510 7.477 -1.512 1.00 . A A . 13 ILE HD11 1 1 18 7914 1 1 13 ILE HD12 H 9.260 7.657 -1.639 1.00 . A A . 13 ILE HD12 1 1 18 7915 1 1 13 ILE HD13 H 8.575 6.320 -0.715 1.00 . A A . 13 ILE HD13 1 1 18 7916 1 1 13 ILE HG12 H 8.710 7.585 1.089 1.00 . A A . 13 ILE HG12 1 1 18 7917 1 1 13 ILE HG13 H 7.452 8.600 0.394 1.00 . A A . 13 ILE HG13 1 1 18 7918 1 1 13 ILE HG21 H 10.678 8.531 1.699 1.00 . A A . 13 ILE HG21 1 1 18 7919 1 1 13 ILE HG22 H 11.244 8.259 0.052 1.00 . A A . 13 ILE HG22 1 1 18 7920 1 1 13 ILE HG23 H 11.431 9.846 0.796 1.00 . A A . 13 ILE HG23 1 1 18 7921 1 1 13 ILE N N 9.731 11.765 0.815 1.00 . A A . 13 ILE N 1 1 18 7922 1 1 13 ILE O O 9.685 10.403 3.234 1.00 . A A . 13 ILE O 1 1 18 7923 1 1 14 HIS C C 7.685 7.742 4.367 1.00 . A A . 14 HIS C 1 1 18 7924 1 1 14 HIS CA C 7.365 9.223 4.185 1.00 . A A . 14 HIS CA 1 1 18 7925 1 1 14 HIS CB C 5.910 9.493 4.572 1.00 . A A . 14 HIS CB 1 1 18 7926 1 1 14 HIS CD2 C 5.027 11.932 4.527 1.00 . A A . 14 HIS CD2 1 1 18 7927 1 1 14 HIS CE1 C 5.774 12.579 6.484 1.00 . A A . 14 HIS CE1 1 1 18 7928 1 1 14 HIS CG C 5.675 10.881 5.083 1.00 . A A . 14 HIS CG 1 1 18 7929 1 1 14 HIS H H 6.911 9.508 2.137 1.00 . A A . 14 HIS H 1 1 18 7930 1 1 14 HIS HA H 8.012 9.800 4.829 1.00 . A A . 14 HIS HA 1 1 18 7931 1 1 14 HIS HB2 H 5.282 9.349 3.705 1.00 . A A . 14 HIS HB2 1 1 18 7932 1 1 14 HIS HB3 H 5.615 8.799 5.345 1.00 . A A . 14 HIS HB3 1 1 18 7933 1 1 14 HIS HD1 H 6.641 10.786 6.953 1.00 . A A . 14 HIS HD1 1 1 18 7934 1 1 14 HIS HD2 H 4.540 11.948 3.562 1.00 . A A . 14 HIS HD2 1 1 18 7935 1 1 14 HIS HE1 H 5.993 13.183 7.352 1.00 . A A . 14 HIS HE1 1 1 18 7936 1 1 14 HIS N N 7.610 9.642 2.810 1.00 . A A . 14 HIS N 1 1 18 7937 1 1 14 HIS ND1 N 6.132 11.319 6.308 1.00 . A A . 14 HIS ND1 1 1 18 7938 1 1 14 HIS NE2 N 5.103 12.974 5.417 1.00 . A A . 14 HIS NE2 1 1 18 7939 1 1 14 HIS O O 7.582 6.954 3.427 1.00 . A A . 14 HIS O 1 1 18 7940 1 1 15 CYS C C 7.181 5.221 6.371 1.00 . A A . 15 CYS C 1 1 18 7941 1 1 15 CYS CA C 8.411 5.986 5.888 1.00 . A A . 15 CYS CA 1 1 18 7942 1 1 15 CYS CB C 9.511 5.928 6.950 1.00 . A A . 15 CYS CB 1 1 18 7943 1 1 15 CYS H H 8.137 8.045 6.292 1.00 . A A . 15 CYS H 1 1 18 7944 1 1 15 CYS HA H 8.773 5.524 4.982 1.00 . A A . 15 CYS HA 1 1 18 7945 1 1 15 CYS HB2 H 9.056 5.954 7.930 1.00 . A A . 15 CYS HB2 1 1 18 7946 1 1 15 CYS HB3 H 10.061 5.006 6.838 1.00 . A A . 15 CYS HB3 1 1 18 7947 1 1 15 CYS N N 8.074 7.371 5.582 1.00 . A A . 15 CYS N 1 1 18 7948 1 1 15 CYS O O 6.241 5.810 6.906 1.00 . A A . 15 CYS O 1 1 18 7949 1 1 15 CYS SG S 10.704 7.302 6.859 1.00 . A A . 15 CYS SG 1 1 18 7950 1 1 16 CYS C C 5.928 3.073 8.113 1.00 . A A . 16 CYS C 1 1 18 7951 1 1 16 CYS CA C 6.084 3.060 6.595 1.00 . A A . 16 CYS CA 1 1 18 7952 1 1 16 CYS CB C 6.297 1.626 6.106 1.00 . A A . 16 CYS CB 1 1 18 7953 1 1 16 CYS H H 7.975 3.494 5.748 1.00 . A A . 16 CYS H 1 1 18 7954 1 1 16 CYS HA H 5.183 3.453 6.149 1.00 . A A . 16 CYS HA 1 1 18 7955 1 1 16 CYS HB2 H 7.357 1.443 6.002 1.00 . A A . 16 CYS HB2 1 1 18 7956 1 1 16 CYS HB3 H 5.888 0.941 6.834 1.00 . A A . 16 CYS HB3 1 1 18 7957 1 1 16 CYS N N 7.196 3.906 6.180 1.00 . A A . 16 CYS N 1 1 18 7958 1 1 16 CYS O O 6.890 3.309 8.844 1.00 . A A . 16 CYS O 1 1 18 7959 1 1 16 CYS SG S 5.514 1.264 4.502 1.00 . A A . 16 CYS SG 1 1 18 7960 1 1 17 SER C C 5.418 1.915 10.752 1.00 . A A . 17 SER C 1 1 18 7961 1 1 17 SER CA C 4.426 2.804 10.009 1.00 . A A . 17 SER CA 1 1 18 7962 1 1 17 SER CB C 2.998 2.317 10.263 1.00 . A A . 17 SER CB 1 1 18 7963 1 1 17 SER H H 3.984 2.637 7.945 1.00 . A A . 17 SER H 1 1 18 7964 1 1 17 SER HA H 4.522 3.815 10.376 1.00 . A A . 17 SER HA 1 1 18 7965 1 1 17 SER HB2 H 2.374 2.585 9.424 1.00 . A A . 17 SER HB2 1 1 18 7966 1 1 17 SER HB3 H 3.003 1.243 10.379 1.00 . A A . 17 SER HB3 1 1 18 7967 1 1 17 SER HG H 1.917 3.656 11.199 1.00 . A A . 17 SER HG 1 1 18 7968 1 1 17 SER N N 4.710 2.818 8.579 1.00 . A A . 17 SER N 1 1 18 7969 1 1 17 SER O O 5.536 0.724 10.465 1.00 . A A . 17 SER O 1 1 18 7970 1 1 17 SER OG O 2.460 2.901 11.437 1.00 . A A . 17 SER OG 1 1 18 7971 1 1 18 GLY C C 8.502 2.326 12.366 1.00 . A A . 18 GLY C 1 1 18 7972 1 1 18 GLY CA C 7.104 1.750 12.477 1.00 . A A . 18 GLY CA 1 1 18 7973 1 1 18 GLY H H 5.994 3.456 11.892 1.00 . A A . 18 GLY H 1 1 18 7974 1 1 18 GLY HA2 H 6.806 1.752 13.515 1.00 . A A . 18 GLY HA2 1 1 18 7975 1 1 18 GLY HA3 H 7.118 0.731 12.119 1.00 . A A . 18 GLY HA3 1 1 18 7976 1 1 18 GLY N N 6.131 2.503 11.708 1.00 . A A . 18 GLY N 1 1 18 7977 1 1 18 GLY O O 9.354 2.078 13.220 1.00 . A A . 18 GLY O 1 1 18 7978 1 1 19 LEU C C 10.003 5.204 11.384 1.00 . A A . 19 LEU C 1 1 18 7979 1 1 19 LEU CA C 10.046 3.709 11.089 1.00 . A A . 19 LEU CA 1 1 18 7980 1 1 19 LEU CB C 10.503 3.475 9.648 1.00 . A A . 19 LEU CB 1 1 18 7981 1 1 19 LEU CD1 C 11.106 1.907 7.787 1.00 . A A . 19 LEU CD1 1 1 18 7982 1 1 19 LEU CD2 C 12.084 1.575 10.065 1.00 . A A . 19 LEU CD2 1 1 18 7983 1 1 19 LEU CG C 10.862 2.034 9.283 1.00 . A A . 19 LEU CG 1 1 18 7984 1 1 19 LEU H H 8.022 3.258 10.664 1.00 . A A . 19 LEU H 1 1 18 7985 1 1 19 LEU HA H 10.749 3.241 11.761 1.00 . A A . 19 LEU HA 1 1 18 7986 1 1 19 LEU HB2 H 9.706 3.793 8.993 1.00 . A A . 19 LEU HB2 1 1 18 7987 1 1 19 LEU HB3 H 11.375 4.089 9.475 1.00 . A A . 19 LEU HB3 1 1 18 7988 1 1 19 LEU HD11 H 10.250 2.285 7.250 1.00 . A A . 19 LEU HD11 1 1 18 7989 1 1 19 LEU HD12 H 11.259 0.868 7.535 1.00 . A A . 19 LEU HD12 1 1 18 7990 1 1 19 LEU HD13 H 11.983 2.476 7.516 1.00 . A A . 19 LEU HD13 1 1 18 7991 1 1 19 LEU HD21 H 12.959 2.095 9.703 1.00 . A A . 19 LEU HD21 1 1 18 7992 1 1 19 LEU HD22 H 12.218 0.511 9.932 1.00 . A A . 19 LEU HD22 1 1 18 7993 1 1 19 LEU HD23 H 11.943 1.792 11.113 1.00 . A A . 19 LEU HD23 1 1 18 7994 1 1 19 LEU HG H 10.035 1.387 9.542 1.00 . A A . 19 LEU HG 1 1 18 7995 1 1 19 LEU N N 8.740 3.096 11.310 1.00 . A A . 19 LEU N 1 1 18 7996 1 1 19 LEU O O 8.957 5.843 11.264 1.00 . A A . 19 LEU O 1 1 18 7997 1 1 20 LYS C C 11.925 7.940 10.947 1.00 . A A . 20 LYS C 1 1 18 7998 1 1 20 LYS CA C 11.243 7.180 12.080 1.00 . A A . 20 LYS CA 1 1 18 7999 1 1 20 LYS CB C 12.015 7.388 13.385 1.00 . A A . 20 LYS CB 1 1 18 8000 1 1 20 LYS CD C 10.376 8.656 14.804 1.00 . A A . 20 LYS CD 1 1 18 8001 1 1 20 LYS CE C 9.871 8.813 16.230 1.00 . A A . 20 LYS CE 1 1 18 8002 1 1 20 LYS CG C 11.138 7.353 14.624 1.00 . A A . 20 LYS CG 1 1 18 8003 1 1 20 LYS H H 11.948 5.198 11.848 1.00 . A A . 20 LYS H 1 1 18 8004 1 1 20 LYS HA H 10.240 7.562 12.201 1.00 . A A . 20 LYS HA 1 1 18 8005 1 1 20 LYS HB2 H 12.761 6.612 13.475 1.00 . A A . 20 LYS HB2 1 1 18 8006 1 1 20 LYS HB3 H 12.510 8.348 13.347 1.00 . A A . 20 LYS HB3 1 1 18 8007 1 1 20 LYS HD2 H 11.032 9.482 14.574 1.00 . A A . 20 LYS HD2 1 1 18 8008 1 1 20 LYS HD3 H 9.532 8.665 14.129 1.00 . A A . 20 LYS HD3 1 1 18 8009 1 1 20 LYS HE2 H 10.709 8.737 16.906 1.00 . A A . 20 LYS HE2 1 1 18 8010 1 1 20 LYS HE3 H 9.414 9.786 16.331 1.00 . A A . 20 LYS HE3 1 1 18 8011 1 1 20 LYS HG2 H 10.429 6.544 14.529 1.00 . A A . 20 LYS HG2 1 1 18 8012 1 1 20 LYS HG3 H 11.761 7.188 15.491 1.00 . A A . 20 LYS HG3 1 1 18 8013 1 1 20 LYS HZ1 H 8.239 8.117 17.333 1.00 . A A . 20 LYS HZ1 1 1 18 8014 1 1 20 LYS HZ2 H 9.350 6.911 16.920 1.00 . A A . 20 LYS HZ2 1 1 18 8015 1 1 20 LYS HZ3 H 8.296 7.527 15.748 1.00 . A A . 20 LYS HZ3 1 1 18 8016 1 1 20 LYS N N 11.147 5.759 11.770 1.00 . A A . 20 LYS N 1 1 18 8017 1 1 20 LYS NZ N 8.869 7.769 16.582 1.00 . A A . 20 LYS NZ 1 1 18 8018 1 1 20 LYS O O 12.814 7.412 10.279 1.00 . A A . 20 LYS O 1 1 18 8019 1 1 21 CYS C C 13.181 10.907 10.237 1.00 . A A . 21 CYS C 1 1 18 8020 1 1 21 CYS CA C 12.073 10.015 9.684 1.00 . A A . 21 CYS CA 1 1 18 8021 1 1 21 CYS CB C 10.985 10.876 9.039 1.00 . A A . 21 CYS CB 1 1 18 8022 1 1 21 CYS H H 10.790 9.548 11.301 1.00 . A A . 21 CYS H 1 1 18 8023 1 1 21 CYS HA H 12.494 9.362 8.934 1.00 . A A . 21 CYS HA 1 1 18 8024 1 1 21 CYS HB2 H 10.334 10.241 8.454 1.00 . A A . 21 CYS HB2 1 1 18 8025 1 1 21 CYS HB3 H 10.408 11.355 9.816 1.00 . A A . 21 CYS HB3 1 1 18 8026 1 1 21 CYS N N 11.503 9.182 10.735 1.00 . A A . 21 CYS N 1 1 18 8027 1 1 21 CYS O O 12.919 11.996 10.747 1.00 . A A . 21 CYS O 1 1 18 8028 1 1 21 CYS SG S 11.622 12.178 7.937 1.00 . A A . 21 CYS SG 1 1 18 8029 1 1 22 ASP C C 15.681 12.533 9.902 1.00 . A A . 22 ASP C 1 1 18 8030 1 1 22 ASP CA C 15.568 11.192 10.619 1.00 . A A . 22 ASP CA 1 1 18 8031 1 1 22 ASP CB C 16.853 10.386 10.427 1.00 . A A . 22 ASP CB 1 1 18 8032 1 1 22 ASP CG C 17.940 10.788 11.405 1.00 . A A . 22 ASP CG 1 1 18 8033 1 1 22 ASP H H 14.564 9.562 9.714 1.00 . A A . 22 ASP H 1 1 18 8034 1 1 22 ASP HA H 15.422 11.373 11.674 1.00 . A A . 22 ASP HA 1 1 18 8035 1 1 22 ASP HB2 H 16.638 9.337 10.569 1.00 . A A . 22 ASP HB2 1 1 18 8036 1 1 22 ASP HB3 H 17.221 10.542 9.424 1.00 . A A . 22 ASP HB3 1 1 18 8037 1 1 22 ASP N N 14.419 10.437 10.131 1.00 . A A . 22 ASP N 1 1 18 8038 1 1 22 ASP O O 16.151 12.604 8.767 1.00 . A A . 22 ASP O 1 1 18 8039 1 1 22 ASP OD1 O 18.851 9.969 11.650 1.00 . A A . 22 ASP OD1 1 1 18 8040 1 1 22 ASP OD2 O 17.880 11.922 11.925 1.00 . A A . 22 ASP OD2 1 1 18 8041 1 1 23 SER C C 16.723 15.469 9.982 1.00 . A A . 23 SER C 1 1 18 8042 1 1 23 SER CA C 15.294 14.935 9.997 1.00 . A A . 23 SER CA 1 1 18 8043 1 1 23 SER CB C 14.391 15.884 10.786 1.00 . A A . 23 SER CB 1 1 18 8044 1 1 23 SER H H 14.882 13.475 11.474 1.00 . A A . 23 SER H 1 1 18 8045 1 1 23 SER HA H 14.936 14.872 8.980 1.00 . A A . 23 SER HA 1 1 18 8046 1 1 23 SER HB2 H 13.475 15.375 11.043 1.00 . A A . 23 SER HB2 1 1 18 8047 1 1 23 SER HB3 H 14.898 16.192 11.689 1.00 . A A . 23 SER HB3 1 1 18 8048 1 1 23 SER HG H 13.135 17.042 9.827 1.00 . A A . 23 SER HG 1 1 18 8049 1 1 23 SER N N 15.246 13.596 10.572 1.00 . A A . 23 SER N 1 1 18 8050 1 1 23 SER O O 17.019 16.469 9.327 1.00 . A A . 23 SER O 1 1 18 8051 1 1 23 SER OG O 14.074 17.037 10.024 1.00 . A A . 23 SER OG 1 1 18 8052 1 1 24 LYS C C 19.803 14.612 9.621 1.00 . A A . 24 LYS C 1 1 18 8053 1 1 24 LYS CA C 19.007 15.199 10.782 1.00 . A A . 24 LYS CA 1 1 18 8054 1 1 24 LYS CB C 19.620 14.752 12.112 1.00 . A A . 24 LYS CB 1 1 18 8055 1 1 24 LYS CD C 20.457 15.665 14.297 1.00 . A A . 24 LYS CD 1 1 18 8056 1 1 24 LYS CE C 20.172 16.605 15.458 1.00 . A A . 24 LYS CE 1 1 18 8057 1 1 24 LYS CG C 19.349 15.711 13.258 1.00 . A A . 24 LYS CG 1 1 18 8058 1 1 24 LYS H H 17.311 14.005 11.211 1.00 . A A . 24 LYS H 1 1 18 8059 1 1 24 LYS HA H 19.045 16.276 10.721 1.00 . A A . 24 LYS HA 1 1 18 8060 1 1 24 LYS HB2 H 19.215 13.786 12.375 1.00 . A A . 24 LYS HB2 1 1 18 8061 1 1 24 LYS HB3 H 20.690 14.664 11.989 1.00 . A A . 24 LYS HB3 1 1 18 8062 1 1 24 LYS HD2 H 20.541 14.658 14.677 1.00 . A A . 24 LYS HD2 1 1 18 8063 1 1 24 LYS HD3 H 21.388 15.955 13.831 1.00 . A A . 24 LYS HD3 1 1 18 8064 1 1 24 LYS HE2 H 20.358 17.619 15.138 1.00 . A A . 24 LYS HE2 1 1 18 8065 1 1 24 LYS HE3 H 19.134 16.502 15.741 1.00 . A A . 24 LYS HE3 1 1 18 8066 1 1 24 LYS HG2 H 19.278 16.715 12.867 1.00 . A A . 24 LYS HG2 1 1 18 8067 1 1 24 LYS HG3 H 18.415 15.440 13.729 1.00 . A A . 24 LYS HG3 1 1 18 8068 1 1 24 LYS HZ1 H 20.958 15.295 16.883 1.00 . A A . 24 LYS HZ1 1 1 18 8069 1 1 24 LYS HZ2 H 20.721 16.869 17.456 1.00 . A A . 24 LYS HZ2 1 1 18 8070 1 1 24 LYS HZ3 H 22.021 16.531 16.428 1.00 . A A . 24 LYS HZ3 1 1 18 8071 1 1 24 LYS N N 17.607 14.795 10.710 1.00 . A A . 24 LYS N 1 1 18 8072 1 1 24 LYS NZ N 21.028 16.304 16.639 1.00 . A A . 24 LYS NZ 1 1 18 8073 1 1 24 LYS O O 20.631 15.293 9.017 1.00 . A A . 24 LYS O 1 1 18 8074 1 1 25 ARG C C 19.360 12.605 6.977 1.00 . A A . 25 ARG C 1 1 18 8075 1 1 25 ARG CA C 20.237 12.667 8.224 1.00 . A A . 25 ARG CA 1 1 18 8076 1 1 25 ARG CB C 20.639 11.253 8.648 1.00 . A A . 25 ARG CB 1 1 18 8077 1 1 25 ARG CD C 23.094 11.215 9.183 1.00 . A A . 25 ARG CD 1 1 18 8078 1 1 25 ARG CG C 21.684 11.223 9.751 1.00 . A A . 25 ARG CG 1 1 18 8079 1 1 25 ARG CZ C 25.375 11.771 9.914 1.00 . A A . 25 ARG CZ 1 1 18 8080 1 1 25 ARG H H 18.873 12.854 9.831 1.00 . A A . 25 ARG H 1 1 18 8081 1 1 25 ARG HA H 21.128 13.232 7.995 1.00 . A A . 25 ARG HA 1 1 18 8082 1 1 25 ARG HB2 H 19.761 10.732 8.999 1.00 . A A . 25 ARG HB2 1 1 18 8083 1 1 25 ARG HB3 H 21.038 10.733 7.790 1.00 . A A . 25 ARG HB3 1 1 18 8084 1 1 25 ARG HD2 H 23.309 10.227 8.803 1.00 . A A . 25 ARG HD2 1 1 18 8085 1 1 25 ARG HD3 H 23.147 11.930 8.376 1.00 . A A . 25 ARG HD3 1 1 18 8086 1 1 25 ARG HE H 23.791 11.642 11.120 1.00 . A A . 25 ARG HE 1 1 18 8087 1 1 25 ARG HG2 H 21.564 12.098 10.373 1.00 . A A . 25 ARG HG2 1 1 18 8088 1 1 25 ARG HG3 H 21.539 10.333 10.346 1.00 . A A . 25 ARG HG3 1 1 18 8089 1 1 25 ARG HH11 H 25.175 11.436 7.932 1.00 . A A . 25 ARG HH11 1 1 18 8090 1 1 25 ARG HH12 H 26.778 11.830 8.460 1.00 . A A . 25 ARG HH12 1 1 18 8091 1 1 25 ARG HH21 H 25.897 12.161 11.828 1.00 . A A . 25 ARG HH21 1 1 18 8092 1 1 25 ARG HH22 H 27.187 12.241 10.676 1.00 . A A . 25 ARG HH22 1 1 18 8093 1 1 25 ARG N N 19.545 13.345 9.313 1.00 . A A . 25 ARG N 1 1 18 8094 1 1 25 ARG NE N 24.093 11.562 10.191 1.00 . A A . 25 ARG NE 1 1 18 8095 1 1 25 ARG NH1 N 25.812 11.670 8.666 1.00 . A A . 25 ARG NH1 1 1 18 8096 1 1 25 ARG NH2 N 26.222 12.083 10.886 1.00 . A A . 25 ARG NH2 1 1 18 8097 1 1 25 ARG O O 19.753 12.043 5.954 1.00 . A A . 25 ARG O 1 1 18 8098 1 1 26 LYS C C 17.007 11.789 5.414 1.00 . A A . 26 LYS C 1 1 18 8099 1 1 26 LYS CA C 17.235 13.200 5.949 1.00 . A A . 26 LYS CA 1 1 18 8100 1 1 26 LYS CB C 17.760 14.102 4.830 1.00 . A A . 26 LYS CB 1 1 18 8101 1 1 26 LYS CD C 18.964 16.295 5.055 1.00 . A A . 26 LYS CD 1 1 18 8102 1 1 26 LYS CE C 18.978 17.552 5.912 1.00 . A A . 26 LYS CE 1 1 18 8103 1 1 26 LYS CG C 17.623 15.585 5.130 1.00 . A A . 26 LYS CG 1 1 18 8104 1 1 26 LYS H H 17.911 13.619 7.910 1.00 . A A . 26 LYS H 1 1 18 8105 1 1 26 LYS HA H 16.295 13.592 6.305 1.00 . A A . 26 LYS HA 1 1 18 8106 1 1 26 LYS HB2 H 18.805 13.884 4.668 1.00 . A A . 26 LYS HB2 1 1 18 8107 1 1 26 LYS HB3 H 17.212 13.888 3.924 1.00 . A A . 26 LYS HB3 1 1 18 8108 1 1 26 LYS HD2 H 19.736 15.626 5.404 1.00 . A A . 26 LYS HD2 1 1 18 8109 1 1 26 LYS HD3 H 19.160 16.568 4.027 1.00 . A A . 26 LYS HD3 1 1 18 8110 1 1 26 LYS HE2 H 18.231 18.235 5.538 1.00 . A A . 26 LYS HE2 1 1 18 8111 1 1 26 LYS HE3 H 18.740 17.280 6.930 1.00 . A A . 26 LYS HE3 1 1 18 8112 1 1 26 LYS HG2 H 16.952 16.028 4.409 1.00 . A A . 26 LYS HG2 1 1 18 8113 1 1 26 LYS HG3 H 17.217 15.706 6.125 1.00 . A A . 26 LYS HG3 1 1 18 8114 1 1 26 LYS HZ1 H 20.548 18.573 6.838 1.00 . A A . 26 LYS HZ1 1 1 18 8115 1 1 26 LYS HZ2 H 20.287 19.030 5.230 1.00 . A A . 26 LYS HZ2 1 1 18 8116 1 1 26 LYS HZ3 H 21.040 17.556 5.578 1.00 . A A . 26 LYS HZ3 1 1 18 8117 1 1 26 LYS N N 18.169 13.187 7.068 1.00 . A A . 26 LYS N 1 1 18 8118 1 1 26 LYS NZ N 20.307 18.224 5.888 1.00 . A A . 26 LYS NZ 1 1 18 8119 1 1 26 LYS O O 16.987 11.570 4.203 1.00 . A A . 26 LYS O 1 1 18 8120 1 1 27 VAL C C 15.763 8.724 6.989 1.00 . A A . 27 VAL C 1 1 18 8121 1 1 27 VAL CA C 16.605 9.448 5.944 1.00 . A A . 27 VAL CA 1 1 18 8122 1 1 27 VAL CB C 17.933 8.691 5.757 1.00 . A A . 27 VAL CB 1 1 18 8123 1 1 27 VAL CG1 C 18.631 9.144 4.483 1.00 . A A . 27 VAL CG1 1 1 18 8124 1 1 27 VAL CG2 C 18.834 8.888 6.967 1.00 . A A . 27 VAL CG2 1 1 18 8125 1 1 27 VAL H H 16.860 11.074 7.275 1.00 . A A . 27 VAL H 1 1 18 8126 1 1 27 VAL HA H 16.076 9.442 5.002 1.00 . A A . 27 VAL HA 1 1 18 8127 1 1 27 VAL HB H 17.714 7.637 5.666 1.00 . A A . 27 VAL HB 1 1 18 8128 1 1 27 VAL HG11 H 19.578 8.632 4.391 1.00 . A A . 27 VAL HG11 1 1 18 8129 1 1 27 VAL HG12 H 18.010 8.911 3.630 1.00 . A A . 27 VAL HG12 1 1 18 8130 1 1 27 VAL HG13 H 18.801 10.209 4.526 1.00 . A A . 27 VAL HG13 1 1 18 8131 1 1 27 VAL HG21 H 19.402 7.987 7.143 1.00 . A A . 27 VAL HG21 1 1 18 8132 1 1 27 VAL HG22 H 19.511 9.710 6.782 1.00 . A A . 27 VAL HG22 1 1 18 8133 1 1 27 VAL HG23 H 18.229 9.109 7.834 1.00 . A A . 27 VAL HG23 1 1 18 8134 1 1 27 VAL N N 16.834 10.837 6.325 1.00 . A A . 27 VAL N 1 1 18 8135 1 1 27 VAL O O 15.615 9.193 8.117 1.00 . A A . 27 VAL O 1 1 18 8136 1 1 28 CYS C C 15.246 5.866 8.370 1.00 . A A . 28 CYS C 1 1 18 8137 1 1 28 CYS CA C 14.386 6.785 7.508 1.00 . A A . 28 CYS CA 1 1 18 8138 1 1 28 CYS CB C 13.375 5.957 6.712 1.00 . A A . 28 CYS CB 1 1 18 8139 1 1 28 CYS H H 15.368 7.253 5.692 1.00 . A A . 28 CYS H 1 1 18 8140 1 1 28 CYS HA H 13.852 7.467 8.152 1.00 . A A . 28 CYS HA 1 1 18 8141 1 1 28 CYS HB2 H 13.909 5.276 6.066 1.00 . A A . 28 CYS HB2 1 1 18 8142 1 1 28 CYS HB3 H 12.765 5.389 7.400 1.00 . A A . 28 CYS HB3 1 1 18 8143 1 1 28 CYS N N 15.213 7.576 6.605 1.00 . A A . 28 CYS N 1 1 18 8144 1 1 28 CYS O O 16.276 5.361 7.923 1.00 . A A . 28 CYS O 1 1 18 8145 1 1 28 CYS SG S 12.258 6.949 5.669 1.00 . A A . 28 CYS SG 1 1 18 8146 1 1 29 VAL C C 14.589 3.978 11.397 1.00 . A A . 29 VAL C 1 1 18 8147 1 1 29 VAL CA C 15.546 4.795 10.535 1.00 . A A . 29 VAL CA 1 1 18 8148 1 1 29 VAL CB C 16.471 5.617 11.453 1.00 . A A . 29 VAL CB 1 1 18 8149 1 1 29 VAL CG1 C 17.532 6.337 10.634 1.00 . A A . 29 VAL CG1 1 1 18 8150 1 1 29 VAL CG2 C 15.661 6.604 12.279 1.00 . A A . 29 VAL CG2 1 1 18 8151 1 1 29 VAL H H 13.988 6.085 9.909 1.00 . A A . 29 VAL H 1 1 18 8152 1 1 29 VAL HA H 16.157 4.120 9.954 1.00 . A A . 29 VAL HA 1 1 18 8153 1 1 29 VAL HB H 16.970 4.937 12.129 1.00 . A A . 29 VAL HB 1 1 18 8154 1 1 29 VAL HG11 H 17.078 7.163 10.106 1.00 . A A . 29 VAL HG11 1 1 18 8155 1 1 29 VAL HG12 H 18.303 6.709 11.292 1.00 . A A . 29 VAL HG12 1 1 18 8156 1 1 29 VAL HG13 H 17.965 5.650 9.922 1.00 . A A . 29 VAL HG13 1 1 18 8157 1 1 29 VAL HG21 H 14.679 6.716 11.844 1.00 . A A . 29 VAL HG21 1 1 18 8158 1 1 29 VAL HG22 H 15.567 6.235 13.291 1.00 . A A . 29 VAL HG22 1 1 18 8159 1 1 29 VAL HG23 H 16.162 7.561 12.291 1.00 . A A . 29 VAL HG23 1 1 18 8160 1 1 29 VAL N N 14.816 5.654 9.610 1.00 . A A . 29 VAL N 1 1 18 8161 1 1 29 VAL O O 13.371 4.136 11.313 1.00 . A A . 29 VAL O 1 1 18 8162 1 1 30 LYS C C 13.862 3.049 14.319 1.00 . A A . 30 LYS C 1 1 18 8163 1 1 30 LYS CA C 14.347 2.262 13.106 1.00 . A A . 30 LYS CA 1 1 18 8164 1 1 30 LYS CB C 15.160 1.048 13.564 1.00 . A A . 30 LYS CB 1 1 18 8165 1 1 30 LYS CD C 14.406 -1.341 13.389 1.00 . A A . 30 LYS CD 1 1 18 8166 1 1 30 LYS CE C 13.455 -2.123 12.496 1.00 . A A . 30 LYS CE 1 1 18 8167 1 1 30 LYS CG C 15.015 -0.159 12.654 1.00 . A A . 30 LYS CG 1 1 18 8168 1 1 30 LYS H H 16.126 3.024 12.248 1.00 . A A . 30 LYS H 1 1 18 8169 1 1 30 LYS HA H 13.490 1.920 12.547 1.00 . A A . 30 LYS HA 1 1 18 8170 1 1 30 LYS HB2 H 16.204 1.322 13.601 1.00 . A A . 30 LYS HB2 1 1 18 8171 1 1 30 LYS HB3 H 14.835 0.767 14.556 1.00 . A A . 30 LYS HB3 1 1 18 8172 1 1 30 LYS HD2 H 15.198 -1.999 13.715 1.00 . A A . 30 LYS HD2 1 1 18 8173 1 1 30 LYS HD3 H 13.861 -0.978 14.249 1.00 . A A . 30 LYS HD3 1 1 18 8174 1 1 30 LYS HE2 H 12.846 -1.426 11.942 1.00 . A A . 30 LYS HE2 1 1 18 8175 1 1 30 LYS HE3 H 14.037 -2.718 11.807 1.00 . A A . 30 LYS HE3 1 1 18 8176 1 1 30 LYS HG2 H 14.377 0.102 11.823 1.00 . A A . 30 LYS HG2 1 1 18 8177 1 1 30 LYS HG3 H 15.992 -0.440 12.286 1.00 . A A . 30 LYS HG3 1 1 18 8178 1 1 30 LYS HZ1 H 13.137 -3.623 13.915 1.00 . A A . 30 LYS HZ1 1 1 18 8179 1 1 30 LYS HZ2 H 12.021 -3.634 12.644 1.00 . A A . 30 LYS HZ2 1 1 18 8180 1 1 30 LYS HZ3 H 11.908 -2.461 13.858 1.00 . A A . 30 LYS HZ3 1 1 18 8181 1 1 30 LYS N N 15.149 3.104 12.226 1.00 . A A . 30 LYS N 1 1 18 8182 1 1 30 LYS NZ N 12.568 -3.023 13.283 1.00 . A A . 30 LYS NZ 1 1 18 8183 1 1 30 LYS O O 14.645 3.387 15.206 1.00 . A A . 30 LYS O 1 1 18 8184 1 1 31 GLY C C 11.758 3.212 16.680 1.00 . A A . 31 GLY C 1 1 18 8185 1 1 31 GLY CA C 11.997 4.081 15.461 1.00 . A A . 31 GLY CA 1 1 18 8186 1 1 31 GLY H H 11.987 3.041 13.616 1.00 . A A . 31 GLY H 1 1 18 8187 1 1 31 GLY HA2 H 12.673 4.879 15.728 1.00 . A A . 31 GLY HA2 1 1 18 8188 1 1 31 GLY HA3 H 11.055 4.508 15.149 1.00 . A A . 31 GLY HA3 1 1 18 8189 1 1 31 GLY N N 12.564 3.337 14.352 1.00 . A A . 31 GLY N 1 1 18 8190 1 1 31 GLY O O 11.615 3.718 17.793 1.00 . A A . 31 GLY O 1 1 19 8191 1 1 1 GLY C C 4.505 -0.684 -0.014 1.00 . A A . 1 GLY C 1 1 19 8192 1 1 1 GLY CA C 3.680 -1.323 1.086 1.00 . A A . 1 GLY CA 1 1 19 8193 1 1 1 GLY H1 H 1.795 -2.255 0.836 1.00 . A A . 1 GLY H1 1 1 19 8194 1 1 1 GLY HA2 H 3.789 -0.741 1.988 1.00 . A A . 1 GLY HA2 1 1 19 8195 1 1 1 GLY HA3 H 4.052 -2.321 1.265 1.00 . A A . 1 GLY HA3 1 1 19 8196 1 1 1 GLY N N 2.271 -1.403 0.747 1.00 . A A . 1 GLY N 1 1 19 8197 1 1 1 GLY O O 4.976 -1.368 -0.923 1.00 . A A . 1 GLY O 1 1 19 8198 1 1 2 TYR C C 5.964 2.681 -0.364 1.00 . A A . 2 TYR C 1 1 19 8199 1 1 2 TYR CA C 5.449 1.362 -0.932 1.00 . A A . 2 TYR CA 1 1 19 8200 1 1 2 TYR CB C 4.594 1.627 -2.172 1.00 . A A . 2 TYR CB 1 1 19 8201 1 1 2 TYR CD1 C 5.940 0.667 -4.080 1.00 . A A . 2 TYR CD1 1 1 19 8202 1 1 2 TYR CD2 C 5.621 3.028 -4.005 1.00 . A A . 2 TYR CD2 1 1 19 8203 1 1 2 TYR CE1 C 6.677 0.798 -5.241 1.00 . A A . 2 TYR CE1 1 1 19 8204 1 1 2 TYR CE2 C 6.356 3.168 -5.166 1.00 . A A . 2 TYR CE2 1 1 19 8205 1 1 2 TYR CG C 5.399 1.777 -3.443 1.00 . A A . 2 TYR CG 1 1 19 8206 1 1 2 TYR CZ C 6.882 2.051 -5.780 1.00 . A A . 2 TYR CZ 1 1 19 8207 1 1 2 TYR H H 4.278 1.121 0.815 1.00 . A A . 2 TYR H 1 1 19 8208 1 1 2 TYR HA H 6.293 0.750 -1.213 1.00 . A A . 2 TYR HA 1 1 19 8209 1 1 2 TYR HB2 H 3.907 0.807 -2.310 1.00 . A A . 2 TYR HB2 1 1 19 8210 1 1 2 TYR HB3 H 4.033 2.539 -2.025 1.00 . A A . 2 TYR HB3 1 1 19 8211 1 1 2 TYR HD1 H 5.778 -0.313 -3.655 1.00 . A A . 2 TYR HD1 1 1 19 8212 1 1 2 TYR HD2 H 5.208 3.901 -3.521 1.00 . A A . 2 TYR HD2 1 1 19 8213 1 1 2 TYR HE1 H 7.089 -0.077 -5.722 1.00 . A A . 2 TYR HE1 1 1 19 8214 1 1 2 TYR HE2 H 6.517 4.149 -5.589 1.00 . A A . 2 TYR HE2 1 1 19 8215 1 1 2 TYR HH H 8.381 1.609 -6.899 1.00 . A A . 2 TYR HH 1 1 19 8216 1 1 2 TYR N N 4.679 0.630 0.067 1.00 . A A . 2 TYR N 1 1 19 8217 1 1 2 TYR O O 5.973 3.704 -1.048 1.00 . A A . 2 TYR O 1 1 19 8218 1 1 2 TYR OH O 7.616 2.187 -6.936 1.00 . A A . 2 TYR OH 1 1 19 8219 1 1 3 CYS C C 8.436 3.838 1.565 1.00 . A A . 3 CYS C 1 1 19 8220 1 1 3 CYS CA C 6.910 3.839 1.557 1.00 . A A . 3 CYS CA 1 1 19 8221 1 1 3 CYS CB C 6.381 3.921 2.990 1.00 . A A . 3 CYS CB 1 1 19 8222 1 1 3 CYS H H 6.360 1.802 1.389 1.00 . A A . 3 CYS H 1 1 19 8223 1 1 3 CYS HA H 6.566 4.702 1.006 1.00 . A A . 3 CYS HA 1 1 19 8224 1 1 3 CYS HB2 H 7.105 3.476 3.658 1.00 . A A . 3 CYS HB2 1 1 19 8225 1 1 3 CYS HB3 H 6.244 4.958 3.257 1.00 . A A . 3 CYS HB3 1 1 19 8226 1 1 3 CYS N N 6.392 2.648 0.894 1.00 . A A . 3 CYS N 1 1 19 8227 1 1 3 CYS O O 9.069 2.996 0.929 1.00 . A A . 3 CYS O 1 1 19 8228 1 1 3 CYS SG S 4.793 3.066 3.247 1.00 . A A . 3 CYS SG 1 1 19 8229 1 1 4 ALA C C 11.009 4.053 3.536 1.00 . A A . 4 ALA C 1 1 19 8230 1 1 4 ALA CA C 10.470 4.893 2.384 1.00 . A A . 4 ALA CA 1 1 19 8231 1 1 4 ALA CB C 10.882 6.348 2.551 1.00 . A A . 4 ALA CB 1 1 19 8232 1 1 4 ALA H H 8.460 5.429 2.775 1.00 . A A . 4 ALA H 1 1 19 8233 1 1 4 ALA HA H 10.891 4.529 1.458 1.00 . A A . 4 ALA HA 1 1 19 8234 1 1 4 ALA HB1 H 10.833 6.847 1.594 1.00 . A A . 4 ALA HB1 1 1 19 8235 1 1 4 ALA HB2 H 10.213 6.834 3.245 1.00 . A A . 4 ALA HB2 1 1 19 8236 1 1 4 ALA HB3 H 11.892 6.395 2.930 1.00 . A A . 4 ALA HB3 1 1 19 8237 1 1 4 ALA N N 9.019 4.786 2.290 1.00 . A A . 4 ALA N 1 1 19 8238 1 1 4 ALA O O 10.811 4.384 4.706 1.00 . A A . 4 ALA O 1 1 19 8239 1 1 5 THR C C 13.611 2.584 4.691 1.00 . A A . 5 THR C 1 1 19 8240 1 1 5 THR CA C 12.258 2.074 4.206 1.00 . A A . 5 THR CA 1 1 19 8241 1 1 5 THR CB C 12.426 0.643 3.661 1.00 . A A . 5 THR CB 1 1 19 8242 1 1 5 THR CG2 C 11.120 -0.130 3.758 1.00 . A A . 5 THR CG2 1 1 19 8243 1 1 5 THR H H 11.816 2.753 2.250 1.00 . A A . 5 THR H 1 1 19 8244 1 1 5 THR HA H 11.576 2.041 5.043 1.00 . A A . 5 THR HA 1 1 19 8245 1 1 5 THR HB H 13.174 0.135 4.254 1.00 . A A . 5 THR HB 1 1 19 8246 1 1 5 THR HG1 H 13.812 0.821 2.269 1.00 . A A . 5 THR HG1 1 1 19 8247 1 1 5 THR HG21 H 11.242 -0.958 4.441 1.00 . A A . 5 THR HG21 1 1 19 8248 1 1 5 THR HG22 H 10.850 -0.504 2.782 1.00 . A A . 5 THR HG22 1 1 19 8249 1 1 5 THR HG23 H 10.342 0.524 4.122 1.00 . A A . 5 THR HG23 1 1 19 8250 1 1 5 THR N N 11.692 2.963 3.199 1.00 . A A . 5 THR N 1 1 19 8251 1 1 5 THR O O 14.143 3.562 4.165 1.00 . A A . 5 THR O 1 1 19 8252 1 1 5 THR OG1 O 12.861 0.686 2.298 1.00 . A A . 5 THR OG1 1 1 19 8253 1 1 6 LYS C C 16.475 2.539 5.143 1.00 . A A . 6 LYS C 1 1 19 8254 1 1 6 LYS CA C 15.456 2.298 6.252 1.00 . A A . 6 LYS CA 1 1 19 8255 1 1 6 LYS CB C 15.968 1.213 7.202 1.00 . A A . 6 LYS CB 1 1 19 8256 1 1 6 LYS CD C 17.035 -1.045 7.472 1.00 . A A . 6 LYS CD 1 1 19 8257 1 1 6 LYS CE C 16.372 -2.377 7.157 1.00 . A A . 6 LYS CE 1 1 19 8258 1 1 6 LYS CG C 16.609 0.034 6.491 1.00 . A A . 6 LYS CG 1 1 19 8259 1 1 6 LYS H H 13.691 1.143 6.075 1.00 . A A . 6 LYS H 1 1 19 8260 1 1 6 LYS HA H 15.321 3.215 6.806 1.00 . A A . 6 LYS HA 1 1 19 8261 1 1 6 LYS HB2 H 16.701 1.648 7.866 1.00 . A A . 6 LYS HB2 1 1 19 8262 1 1 6 LYS HB3 H 15.138 0.844 7.789 1.00 . A A . 6 LYS HB3 1 1 19 8263 1 1 6 LYS HD2 H 18.107 -1.168 7.416 1.00 . A A . 6 LYS HD2 1 1 19 8264 1 1 6 LYS HD3 H 16.757 -0.741 8.471 1.00 . A A . 6 LYS HD3 1 1 19 8265 1 1 6 LYS HE2 H 15.455 -2.450 7.722 1.00 . A A . 6 LYS HE2 1 1 19 8266 1 1 6 LYS HE3 H 16.148 -2.413 6.101 1.00 . A A . 6 LYS HE3 1 1 19 8267 1 1 6 LYS HG2 H 15.897 -0.387 5.796 1.00 . A A . 6 LYS HG2 1 1 19 8268 1 1 6 LYS HG3 H 17.479 0.381 5.951 1.00 . A A . 6 LYS HG3 1 1 19 8269 1 1 6 LYS HZ1 H 18.231 -3.326 7.233 1.00 . A A . 6 LYS HZ1 1 1 19 8270 1 1 6 LYS HZ2 H 16.932 -4.384 7.005 1.00 . A A . 6 LYS HZ2 1 1 19 8271 1 1 6 LYS HZ3 H 17.214 -3.708 8.530 1.00 . A A . 6 LYS HZ3 1 1 19 8272 1 1 6 LYS N N 14.164 1.915 5.697 1.00 . A A . 6 LYS N 1 1 19 8273 1 1 6 LYS NZ N 17.249 -3.529 7.506 1.00 . A A . 6 LYS NZ 1 1 19 8274 1 1 6 LYS O O 16.549 1.778 4.179 1.00 . A A . 6 LYS O 1 1 19 8275 1 1 7 GLY C C 17.725 4.813 3.189 1.00 . A A . 7 GLY C 1 1 19 8276 1 1 7 GLY CA C 18.265 3.923 4.291 1.00 . A A . 7 GLY CA 1 1 19 8277 1 1 7 GLY H H 17.156 4.174 6.077 1.00 . A A . 7 GLY H 1 1 19 8278 1 1 7 GLY HA2 H 19.088 4.427 4.775 1.00 . A A . 7 GLY HA2 1 1 19 8279 1 1 7 GLY HA3 H 18.626 3.005 3.852 1.00 . A A . 7 GLY HA3 1 1 19 8280 1 1 7 GLY N N 17.260 3.602 5.288 1.00 . A A . 7 GLY N 1 1 19 8281 1 1 7 GLY O O 18.490 5.376 2.406 1.00 . A A . 7 GLY O 1 1 19 8282 1 1 8 ILE C C 15.533 7.183 2.620 1.00 . A A . 8 ILE C 1 1 19 8283 1 1 8 ILE CA C 15.763 5.764 2.110 1.00 . A A . 8 ILE CA 1 1 19 8284 1 1 8 ILE CB C 14.415 5.166 1.666 1.00 . A A . 8 ILE CB 1 1 19 8285 1 1 8 ILE CD1 C 15.475 3.509 0.051 1.00 . A A . 8 ILE CD1 1 1 19 8286 1 1 8 ILE CG1 C 14.590 3.701 1.263 1.00 . A A . 8 ILE CG1 1 1 19 8287 1 1 8 ILE CG2 C 13.831 5.972 0.515 1.00 . A A . 8 ILE CG2 1 1 19 8288 1 1 8 ILE H H 15.847 4.464 3.778 1.00 . A A . 8 ILE H 1 1 19 8289 1 1 8 ILE HA H 16.417 5.803 1.251 1.00 . A A . 8 ILE HA 1 1 19 8290 1 1 8 ILE HB H 13.729 5.224 2.498 1.00 . A A . 8 ILE HB 1 1 19 8291 1 1 8 ILE HD11 H 16.292 2.849 0.302 1.00 . A A . 8 ILE HD11 1 1 19 8292 1 1 8 ILE HD12 H 14.897 3.079 -0.753 1.00 . A A . 8 ILE HD12 1 1 19 8293 1 1 8 ILE HD13 H 15.869 4.466 -0.261 1.00 . A A . 8 ILE HD13 1 1 19 8294 1 1 8 ILE HG12 H 15.031 3.158 2.084 1.00 . A A . 8 ILE HG12 1 1 19 8295 1 1 8 ILE HG13 H 13.621 3.279 1.037 1.00 . A A . 8 ILE HG13 1 1 19 8296 1 1 8 ILE HG21 H 13.131 5.359 -0.034 1.00 . A A . 8 ILE HG21 1 1 19 8297 1 1 8 ILE HG22 H 13.319 6.838 0.906 1.00 . A A . 8 ILE HG22 1 1 19 8298 1 1 8 ILE HG23 H 14.626 6.289 -0.142 1.00 . A A . 8 ILE HG23 1 1 19 8299 1 1 8 ILE N N 16.404 4.938 3.125 1.00 . A A . 8 ILE N 1 1 19 8300 1 1 8 ILE O O 14.999 7.384 3.711 1.00 . A A . 8 ILE O 1 1 19 8301 1 1 9 LYS C C 14.335 9.859 2.595 1.00 . A A . 9 LYS C 1 1 19 8302 1 1 9 LYS CA C 15.776 9.566 2.191 1.00 . A A . 9 LYS CA 1 1 19 8303 1 1 9 LYS CB C 16.184 10.471 1.026 1.00 . A A . 9 LYS CB 1 1 19 8304 1 1 9 LYS CD C 18.496 11.452 0.972 1.00 . A A . 9 LYS CD 1 1 19 8305 1 1 9 LYS CE C 19.957 11.200 0.635 1.00 . A A . 9 LYS CE 1 1 19 8306 1 1 9 LYS CG C 17.622 10.274 0.577 1.00 . A A . 9 LYS CG 1 1 19 8307 1 1 9 LYS H H 16.359 7.942 0.965 1.00 . A A . 9 LYS H 1 1 19 8308 1 1 9 LYS HA H 16.421 9.766 3.033 1.00 . A A . 9 LYS HA 1 1 19 8309 1 1 9 LYS HB2 H 15.536 10.271 0.186 1.00 . A A . 9 LYS HB2 1 1 19 8310 1 1 9 LYS HB3 H 16.061 11.502 1.326 1.00 . A A . 9 LYS HB3 1 1 19 8311 1 1 9 LYS HD2 H 18.162 12.332 0.441 1.00 . A A . 9 LYS HD2 1 1 19 8312 1 1 9 LYS HD3 H 18.405 11.616 2.037 1.00 . A A . 9 LYS HD3 1 1 19 8313 1 1 9 LYS HE2 H 20.211 10.191 0.922 1.00 . A A . 9 LYS HE2 1 1 19 8314 1 1 9 LYS HE3 H 20.092 11.316 -0.431 1.00 . A A . 9 LYS HE3 1 1 19 8315 1 1 9 LYS HG2 H 18.014 9.379 1.036 1.00 . A A . 9 LYS HG2 1 1 19 8316 1 1 9 LYS HG3 H 17.642 10.168 -0.499 1.00 . A A . 9 LYS HG3 1 1 19 8317 1 1 9 LYS HZ1 H 21.386 11.649 2.090 1.00 . A A . 9 LYS HZ1 1 1 19 8318 1 1 9 LYS HZ2 H 20.309 12.914 1.776 1.00 . A A . 9 LYS HZ2 1 1 19 8319 1 1 9 LYS HZ3 H 21.542 12.561 0.674 1.00 . A A . 9 LYS HZ3 1 1 19 8320 1 1 9 LYS N N 15.940 8.165 1.823 1.00 . A A . 9 LYS N 1 1 19 8321 1 1 9 LYS NZ N 20.862 12.147 1.343 1.00 . A A . 9 LYS NZ 1 1 19 8322 1 1 9 LYS O O 13.393 9.355 1.981 1.00 . A A . 9 LYS O 1 1 19 8323 1 1 10 CYS C C 12.642 12.549 4.075 1.00 . A A . 10 CYS C 1 1 19 8324 1 1 10 CYS CA C 12.843 11.037 4.115 1.00 . A A . 10 CYS CA 1 1 19 8325 1 1 10 CYS CB C 12.642 10.522 5.542 1.00 . A A . 10 CYS CB 1 1 19 8326 1 1 10 CYS H H 14.959 11.046 4.078 1.00 . A A . 10 CYS H 1 1 19 8327 1 1 10 CYS HA H 12.115 10.572 3.468 1.00 . A A . 10 CYS HA 1 1 19 8328 1 1 10 CYS HB2 H 11.583 10.425 5.735 1.00 . A A . 10 CYS HB2 1 1 19 8329 1 1 10 CYS HB3 H 13.110 9.553 5.636 1.00 . A A . 10 CYS HB3 1 1 19 8330 1 1 10 CYS N N 14.169 10.676 3.629 1.00 . A A . 10 CYS N 1 1 19 8331 1 1 10 CYS O O 11.708 13.077 4.677 1.00 . A A . 10 CYS O 1 1 19 8332 1 1 10 CYS SG S 13.342 11.604 6.829 1.00 . A A . 10 CYS SG 1 1 19 8333 1 1 11 ASN C C 12.121 15.113 2.613 1.00 . A A . 11 ASN C 1 1 19 8334 1 1 11 ASN CA C 13.445 14.691 3.243 1.00 . A A . 11 ASN CA 1 1 19 8335 1 1 11 ASN CB C 14.612 15.220 2.408 1.00 . A A . 11 ASN CB 1 1 19 8336 1 1 11 ASN CG C 14.389 16.646 1.941 1.00 . A A . 11 ASN CG 1 1 19 8337 1 1 11 ASN H H 14.248 12.762 2.904 1.00 . A A . 11 ASN H 1 1 19 8338 1 1 11 ASN HA H 13.507 15.108 4.237 1.00 . A A . 11 ASN HA 1 1 19 8339 1 1 11 ASN HB2 H 15.514 15.194 3.002 1.00 . A A . 11 ASN HB2 1 1 19 8340 1 1 11 ASN HB3 H 14.740 14.592 1.539 1.00 . A A . 11 ASN HB3 1 1 19 8341 1 1 11 ASN HD21 H 14.966 17.342 3.712 1.00 . A A . 11 ASN HD21 1 1 19 8342 1 1 11 ASN HD22 H 14.512 18.535 2.547 1.00 . A A . 11 ASN HD22 1 1 19 8343 1 1 11 ASN N N 13.525 13.239 3.362 1.00 . A A . 11 ASN N 1 1 19 8344 1 1 11 ASN ND2 N 14.649 17.604 2.822 1.00 . A A . 11 ASN ND2 1 1 19 8345 1 1 11 ASN O O 11.689 16.256 2.759 1.00 . A A . 11 ASN O 1 1 19 8346 1 1 11 ASN OD1 O 13.988 16.882 0.801 1.00 . A A . 11 ASN OD1 1 1 19 8347 1 1 12 ASP C C 9.229 13.304 1.474 1.00 . A A . 12 ASP C 1 1 19 8348 1 1 12 ASP CA C 10.206 14.456 1.263 1.00 . A A . 12 ASP CA 1 1 19 8349 1 1 12 ASP CB C 10.414 14.697 -0.234 1.00 . A A . 12 ASP CB 1 1 19 8350 1 1 12 ASP CG C 11.493 13.807 -0.819 1.00 . A A . 12 ASP CG 1 1 19 8351 1 1 12 ASP H H 11.877 13.289 1.833 1.00 . A A . 12 ASP H 1 1 19 8352 1 1 12 ASP HA H 9.792 15.349 1.707 1.00 . A A . 12 ASP HA 1 1 19 8353 1 1 12 ASP HB2 H 9.489 14.500 -0.755 1.00 . A A . 12 ASP HB2 1 1 19 8354 1 1 12 ASP HB3 H 10.698 15.727 -0.390 1.00 . A A . 12 ASP HB3 1 1 19 8355 1 1 12 ASP N N 11.482 14.182 1.914 1.00 . A A . 12 ASP N 1 1 19 8356 1 1 12 ASP O O 8.130 13.497 1.994 1.00 . A A . 12 ASP O 1 1 19 8357 1 1 12 ASP OD1 O 12.687 14.138 -0.659 1.00 . A A . 12 ASP OD1 1 1 19 8358 1 1 12 ASP OD2 O 11.143 12.779 -1.435 1.00 . A A . 12 ASP OD2 1 1 19 8359 1 1 13 ILE C C 8.761 10.451 2.662 1.00 . A A . 13 ILE C 1 1 19 8360 1 1 13 ILE CA C 8.798 10.924 1.212 1.00 . A A . 13 ILE CA 1 1 19 8361 1 1 13 ILE CB C 9.292 9.770 0.320 1.00 . A A . 13 ILE CB 1 1 19 8362 1 1 13 ILE CD1 C 8.448 7.657 -0.821 1.00 . A A . 13 ILE CD1 1 1 19 8363 1 1 13 ILE CG1 C 8.288 8.616 0.338 1.00 . A A . 13 ILE CG1 1 1 19 8364 1 1 13 ILE CG2 C 10.662 9.294 0.780 1.00 . A A . 13 ILE CG2 1 1 19 8365 1 1 13 ILE H H 10.524 12.017 0.661 1.00 . A A . 13 ILE H 1 1 19 8366 1 1 13 ILE HA H 7.796 11.187 0.905 1.00 . A A . 13 ILE HA 1 1 19 8367 1 1 13 ILE HB H 9.387 10.140 -0.689 1.00 . A A . 13 ILE HB 1 1 19 8368 1 1 13 ILE HD11 H 7.518 7.133 -0.986 1.00 . A A . 13 ILE HD11 1 1 19 8369 1 1 13 ILE HD12 H 8.714 8.208 -1.710 1.00 . A A . 13 ILE HD12 1 1 19 8370 1 1 13 ILE HD13 H 9.227 6.944 -0.593 1.00 . A A . 13 ILE HD13 1 1 19 8371 1 1 13 ILE HG12 H 8.410 8.055 1.251 1.00 . A A . 13 ILE HG12 1 1 19 8372 1 1 13 ILE HG13 H 7.286 9.020 0.300 1.00 . A A . 13 ILE HG13 1 1 19 8373 1 1 13 ILE HG21 H 11.055 8.584 0.067 1.00 . A A . 13 ILE HG21 1 1 19 8374 1 1 13 ILE HG22 H 11.331 10.138 0.850 1.00 . A A . 13 ILE HG22 1 1 19 8375 1 1 13 ILE HG23 H 10.574 8.822 1.747 1.00 . A A . 13 ILE HG23 1 1 19 8376 1 1 13 ILE N N 9.638 12.107 1.067 1.00 . A A . 13 ILE N 1 1 19 8377 1 1 13 ILE O O 9.750 10.561 3.388 1.00 . A A . 13 ILE O 1 1 19 8378 1 1 14 HIS C C 7.706 7.926 4.508 1.00 . A A . 14 HIS C 1 1 19 8379 1 1 14 HIS CA C 7.449 9.428 4.439 1.00 . A A . 14 HIS CA 1 1 19 8380 1 1 14 HIS CB C 6.042 9.740 4.949 1.00 . A A . 14 HIS CB 1 1 19 8381 1 1 14 HIS CD2 C 5.762 11.556 6.780 1.00 . A A . 14 HIS CD2 1 1 19 8382 1 1 14 HIS CE1 C 5.749 13.322 5.481 1.00 . A A . 14 HIS CE1 1 1 19 8383 1 1 14 HIS CG C 5.899 11.124 5.505 1.00 . A A . 14 HIS CG 1 1 19 8384 1 1 14 HIS H H 6.863 9.861 2.451 1.00 . A A . 14 HIS H 1 1 19 8385 1 1 14 HIS HA H 8.169 9.933 5.064 1.00 . A A . 14 HIS HA 1 1 19 8386 1 1 14 HIS HB2 H 5.340 9.636 4.136 1.00 . A A . 14 HIS HB2 1 1 19 8387 1 1 14 HIS HB3 H 5.786 9.040 5.731 1.00 . A A . 14 HIS HB3 1 1 19 8388 1 1 14 HIS HD1 H 5.968 12.271 3.739 1.00 . A A . 14 HIS HD1 1 1 19 8389 1 1 14 HIS HD2 H 5.730 10.939 7.667 1.00 . A A . 14 HIS HD2 1 1 19 8390 1 1 14 HIS HE1 H 5.707 14.345 5.138 1.00 . A A . 14 HIS HE1 1 1 19 8391 1 1 14 HIS N N 7.615 9.921 3.076 1.00 . A A . 14 HIS N 1 1 19 8392 1 1 14 HIS ND1 N 5.887 12.254 4.715 1.00 . A A . 14 HIS ND1 1 1 19 8393 1 1 14 HIS NE2 N 5.670 12.926 6.738 1.00 . A A . 14 HIS NE2 1 1 19 8394 1 1 14 HIS O O 7.575 7.216 3.510 1.00 . A A . 14 HIS O 1 1 19 8395 1 1 15 CYS C C 7.090 5.284 6.317 1.00 . A A . 15 CYS C 1 1 19 8396 1 1 15 CYS CA C 8.351 6.030 5.892 1.00 . A A . 15 CYS CA 1 1 19 8397 1 1 15 CYS CB C 9.445 5.847 6.946 1.00 . A A . 15 CYS CB 1 1 19 8398 1 1 15 CYS H H 8.162 8.063 6.451 1.00 . A A . 15 CYS H 1 1 19 8399 1 1 15 CYS HA H 8.696 5.624 4.953 1.00 . A A . 15 CYS HA 1 1 19 8400 1 1 15 CYS HB2 H 8.989 5.809 7.924 1.00 . A A . 15 CYS HB2 1 1 19 8401 1 1 15 CYS HB3 H 9.962 4.917 6.759 1.00 . A A . 15 CYS HB3 1 1 19 8402 1 1 15 CYS N N 8.074 7.447 5.692 1.00 . A A . 15 CYS N 1 1 19 8403 1 1 15 CYS O O 6.174 5.869 6.896 1.00 . A A . 15 CYS O 1 1 19 8404 1 1 15 CYS SG S 10.689 7.178 6.966 1.00 . A A . 15 CYS SG 1 1 19 8405 1 1 16 CYS C C 5.720 3.096 7.889 1.00 . A A . 16 CYS C 1 1 19 8406 1 1 16 CYS CA C 5.902 3.160 6.375 1.00 . A A . 16 CYS CA 1 1 19 8407 1 1 16 CYS CB C 6.073 1.748 5.811 1.00 . A A . 16 CYS CB 1 1 19 8408 1 1 16 CYS H H 7.811 3.578 5.562 1.00 . A A . 16 CYS H 1 1 19 8409 1 1 16 CYS HA H 5.023 3.609 5.938 1.00 . A A . 16 CYS HA 1 1 19 8410 1 1 16 CYS HB2 H 7.128 1.534 5.712 1.00 . A A . 16 CYS HB2 1 1 19 8411 1 1 16 CYS HB3 H 5.630 1.039 6.494 1.00 . A A . 16 CYS HB3 1 1 19 8412 1 1 16 CYS N N 7.050 3.988 6.025 1.00 . A A . 16 CYS N 1 1 19 8413 1 1 16 CYS O O 6.668 3.296 8.648 1.00 . A A . 16 CYS O 1 1 19 8414 1 1 16 CYS SG S 5.304 1.502 4.178 1.00 . A A . 16 CYS SG 1 1 19 8415 1 1 17 SER C C 5.166 1.799 10.455 1.00 . A A . 17 SER C 1 1 19 8416 1 1 17 SER CA C 4.187 2.727 9.744 1.00 . A A . 17 SER CA 1 1 19 8417 1 1 17 SER CB C 2.754 2.230 9.947 1.00 . A A . 17 SER CB 1 1 19 8418 1 1 17 SER H H 3.780 2.665 7.667 1.00 . A A . 17 SER H 1 1 19 8419 1 1 17 SER HA H 4.278 3.718 10.164 1.00 . A A . 17 SER HA 1 1 19 8420 1 1 17 SER HB2 H 2.711 1.172 9.738 1.00 . A A . 17 SER HB2 1 1 19 8421 1 1 17 SER HB3 H 2.457 2.407 10.971 1.00 . A A . 17 SER HB3 1 1 19 8422 1 1 17 SER HG H 1.476 2.277 8.464 1.00 . A A . 17 SER HG 1 1 19 8423 1 1 17 SER N N 4.495 2.815 8.321 1.00 . A A . 17 SER N 1 1 19 8424 1 1 17 SER O O 5.148 0.586 10.252 1.00 . A A . 17 SER O 1 1 19 8425 1 1 17 SER OG O 1.853 2.903 9.086 1.00 . A A . 17 SER OG 1 1 19 8426 1 1 18 GLY C C 8.396 2.166 11.925 1.00 . A A . 18 GLY C 1 1 19 8427 1 1 18 GLY CA C 6.996 1.591 12.022 1.00 . A A . 18 GLY CA 1 1 19 8428 1 1 18 GLY H H 5.989 3.352 11.414 1.00 . A A . 18 GLY H 1 1 19 8429 1 1 18 GLY HA2 H 6.706 1.550 13.061 1.00 . A A . 18 GLY HA2 1 1 19 8430 1 1 18 GLY HA3 H 7.004 0.588 11.621 1.00 . A A . 18 GLY HA3 1 1 19 8431 1 1 18 GLY N N 6.021 2.380 11.292 1.00 . A A . 18 GLY N 1 1 19 8432 1 1 18 GLY O O 9.284 1.789 12.691 1.00 . A A . 18 GLY O 1 1 19 8433 1 1 19 LEU C C 9.828 5.204 11.066 1.00 . A A . 19 LEU C 1 1 19 8434 1 1 19 LEU CA C 9.898 3.706 10.786 1.00 . A A . 19 LEU CA 1 1 19 8435 1 1 19 LEU CB C 10.393 3.464 9.359 1.00 . A A . 19 LEU CB 1 1 19 8436 1 1 19 LEU CD1 C 10.924 1.882 7.489 1.00 . A A . 19 LEU CD1 1 1 19 8437 1 1 19 LEU CD2 C 11.870 1.481 9.770 1.00 . A A . 19 LEU CD2 1 1 19 8438 1 1 19 LEU CG C 10.678 2.010 8.984 1.00 . A A . 19 LEU CG 1 1 19 8439 1 1 19 LEU H H 7.849 3.338 10.401 1.00 . A A . 19 LEU H 1 1 19 8440 1 1 19 LEU HA H 10.590 3.254 11.480 1.00 . A A . 19 LEU HA 1 1 19 8441 1 1 19 LEU HB2 H 9.641 3.839 8.680 1.00 . A A . 19 LEU HB2 1 1 19 8442 1 1 19 LEU HB3 H 11.306 4.027 9.227 1.00 . A A . 19 LEU HB3 1 1 19 8443 1 1 19 LEU HD11 H 11.101 0.846 7.241 1.00 . A A . 19 LEU HD11 1 1 19 8444 1 1 19 LEU HD12 H 11.787 2.470 7.215 1.00 . A A . 19 LEU HD12 1 1 19 8445 1 1 19 LEU HD13 H 10.059 2.240 6.950 1.00 . A A . 19 LEU HD13 1 1 19 8446 1 1 19 LEU HD21 H 12.785 1.789 9.286 1.00 . A A . 19 LEU HD21 1 1 19 8447 1 1 19 LEU HD22 H 11.827 0.402 9.805 1.00 . A A . 19 LEU HD22 1 1 19 8448 1 1 19 LEU HD23 H 11.843 1.876 10.774 1.00 . A A . 19 LEU HD23 1 1 19 8449 1 1 19 LEU HG H 9.817 1.405 9.233 1.00 . A A . 19 LEU HG 1 1 19 8450 1 1 19 LEU N N 8.595 3.079 10.981 1.00 . A A . 19 LEU N 1 1 19 8451 1 1 19 LEU O O 8.793 5.838 10.860 1.00 . A A . 19 LEU O 1 1 19 8452 1 1 20 LYS C C 11.749 7.945 10.742 1.00 . A A . 20 LYS C 1 1 19 8453 1 1 20 LYS CA C 11.006 7.189 11.839 1.00 . A A . 20 LYS CA 1 1 19 8454 1 1 20 LYS CB C 11.700 7.410 13.185 1.00 . A A . 20 LYS CB 1 1 19 8455 1 1 20 LYS CD C 13.926 8.573 13.199 1.00 . A A . 20 LYS CD 1 1 19 8456 1 1 20 LYS CE C 14.718 8.713 14.490 1.00 . A A . 20 LYS CE 1 1 19 8457 1 1 20 LYS CG C 13.207 7.236 13.128 1.00 . A A . 20 LYS CG 1 1 19 8458 1 1 20 LYS H H 11.732 5.207 11.677 1.00 . A A . 20 LYS H 1 1 19 8459 1 1 20 LYS HA H 9.996 7.564 11.898 1.00 . A A . 20 LYS HA 1 1 19 8460 1 1 20 LYS HB2 H 11.486 8.413 13.526 1.00 . A A . 20 LYS HB2 1 1 19 8461 1 1 20 LYS HB3 H 11.304 6.704 13.901 1.00 . A A . 20 LYS HB3 1 1 19 8462 1 1 20 LYS HD2 H 14.606 8.651 12.363 1.00 . A A . 20 LYS HD2 1 1 19 8463 1 1 20 LYS HD3 H 13.195 9.368 13.146 1.00 . A A . 20 LYS HD3 1 1 19 8464 1 1 20 LYS HE2 H 15.184 7.767 14.716 1.00 . A A . 20 LYS HE2 1 1 19 8465 1 1 20 LYS HE3 H 15.480 9.465 14.349 1.00 . A A . 20 LYS HE3 1 1 19 8466 1 1 20 LYS HG2 H 13.522 6.627 13.962 1.00 . A A . 20 LYS HG2 1 1 19 8467 1 1 20 LYS HG3 H 13.469 6.745 12.202 1.00 . A A . 20 LYS HG3 1 1 19 8468 1 1 20 LYS HZ1 H 14.339 9.813 16.225 1.00 . A A . 20 LYS HZ1 1 1 19 8469 1 1 20 LYS HZ2 H 13.622 8.281 16.215 1.00 . A A . 20 LYS HZ2 1 1 19 8470 1 1 20 LYS HZ3 H 12.964 9.528 15.280 1.00 . A A . 20 LYS HZ3 1 1 19 8471 1 1 20 LYS N N 10.938 5.765 11.534 1.00 . A A . 20 LYS N 1 1 19 8472 1 1 20 LYS NZ N 13.850 9.112 15.632 1.00 . A A . 20 LYS NZ 1 1 19 8473 1 1 20 LYS O O 12.629 7.394 10.081 1.00 . A A . 20 LYS O 1 1 19 8474 1 1 21 CYS C C 13.156 10.868 10.141 1.00 . A A . 21 CYS C 1 1 19 8475 1 1 21 CYS CA C 12.022 10.044 9.539 1.00 . A A . 21 CYS CA 1 1 19 8476 1 1 21 CYS CB C 10.989 10.971 8.895 1.00 . A A . 21 CYS CB 1 1 19 8477 1 1 21 CYS H H 10.680 9.594 11.114 1.00 . A A . 21 CYS H 1 1 19 8478 1 1 21 CYS HA H 12.430 9.392 8.782 1.00 . A A . 21 CYS HA 1 1 19 8479 1 1 21 CYS HB2 H 10.316 10.381 8.289 1.00 . A A . 21 CYS HB2 1 1 19 8480 1 1 21 CYS HB3 H 10.426 11.466 9.672 1.00 . A A . 21 CYS HB3 1 1 19 8481 1 1 21 CYS N N 11.389 9.211 10.555 1.00 . A A . 21 CYS N 1 1 19 8482 1 1 21 CYS O O 12.936 11.967 10.651 1.00 . A A . 21 CYS O 1 1 19 8483 1 1 21 CYS SG S 11.710 12.258 7.826 1.00 . A A . 21 CYS SG 1 1 19 8484 1 1 22 ASP C C 15.720 12.379 9.954 1.00 . A A . 22 ASP C 1 1 19 8485 1 1 22 ASP CA C 15.538 11.016 10.614 1.00 . A A . 22 ASP CA 1 1 19 8486 1 1 22 ASP CB C 16.793 10.166 10.410 1.00 . A A . 22 ASP CB 1 1 19 8487 1 1 22 ASP CG C 17.848 10.427 11.467 1.00 . A A . 22 ASP CG 1 1 19 8488 1 1 22 ASP H H 14.480 9.451 9.658 1.00 . A A . 22 ASP H 1 1 19 8489 1 1 22 ASP HA H 15.381 11.161 11.673 1.00 . A A . 22 ASP HA 1 1 19 8490 1 1 22 ASP HB2 H 16.522 9.121 10.449 1.00 . A A . 22 ASP HB2 1 1 19 8491 1 1 22 ASP HB3 H 17.217 10.388 9.442 1.00 . A A . 22 ASP HB3 1 1 19 8492 1 1 22 ASP N N 14.369 10.330 10.077 1.00 . A A . 22 ASP N 1 1 19 8493 1 1 22 ASP O O 16.217 12.476 8.832 1.00 . A A . 22 ASP O 1 1 19 8494 1 1 22 ASP OD1 O 18.736 9.567 11.645 1.00 . A A . 22 ASP OD1 1 1 19 8495 1 1 22 ASP OD2 O 17.786 11.492 12.116 1.00 . A A . 22 ASP OD2 1 1 19 8496 1 1 23 SER C C 16.875 15.265 10.173 1.00 . A A . 23 SER C 1 1 19 8497 1 1 23 SER CA C 15.426 14.789 10.139 1.00 . A A . 23 SER CA 1 1 19 8498 1 1 23 SER CB C 14.544 15.742 10.948 1.00 . A A . 23 SER CB 1 1 19 8499 1 1 23 SER H H 14.925 13.289 11.547 1.00 . A A . 23 SER H 1 1 19 8500 1 1 23 SER HA H 15.086 14.781 9.114 1.00 . A A . 23 SER HA 1 1 19 8501 1 1 23 SER HB2 H 13.608 15.256 11.177 1.00 . A A . 23 SER HB2 1 1 19 8502 1 1 23 SER HB3 H 15.050 16.002 11.867 1.00 . A A . 23 SER HB3 1 1 19 8503 1 1 23 SER HG H 13.754 17.525 10.764 1.00 . A A . 23 SER HG 1 1 19 8504 1 1 23 SER N N 15.313 13.431 10.658 1.00 . A A . 23 SER N 1 1 19 8505 1 1 23 SER O O 17.223 16.278 9.567 1.00 . A A . 23 SER O 1 1 19 8506 1 1 23 SER OG O 14.276 16.929 10.222 1.00 . A A . 23 SER OG 1 1 19 8507 1 1 24 LYS C C 19.923 14.307 9.827 1.00 . A A . 24 LYS C 1 1 19 8508 1 1 24 LYS CA C 19.129 14.869 11.002 1.00 . A A . 24 LYS CA 1 1 19 8509 1 1 24 LYS CB C 19.700 14.336 12.318 1.00 . A A . 24 LYS CB 1 1 19 8510 1 1 24 LYS CD C 19.456 14.188 14.814 1.00 . A A . 24 LYS CD 1 1 19 8511 1 1 24 LYS CE C 19.912 15.159 15.892 1.00 . A A . 24 LYS CE 1 1 19 8512 1 1 24 LYS CG C 19.030 14.917 13.551 1.00 . A A . 24 LYS CG 1 1 19 8513 1 1 24 LYS H H 17.380 13.728 11.348 1.00 . A A . 24 LYS H 1 1 19 8514 1 1 24 LYS HA H 19.211 15.945 10.994 1.00 . A A . 24 LYS HA 1 1 19 8515 1 1 24 LYS HB2 H 19.579 13.263 12.341 1.00 . A A . 24 LYS HB2 1 1 19 8516 1 1 24 LYS HB3 H 20.753 14.572 12.362 1.00 . A A . 24 LYS HB3 1 1 19 8517 1 1 24 LYS HD2 H 18.620 13.617 15.190 1.00 . A A . 24 LYS HD2 1 1 19 8518 1 1 24 LYS HD3 H 20.271 13.519 14.575 1.00 . A A . 24 LYS HD3 1 1 19 8519 1 1 24 LYS HE2 H 19.189 15.956 15.970 1.00 . A A . 24 LYS HE2 1 1 19 8520 1 1 24 LYS HE3 H 19.969 14.631 16.832 1.00 . A A . 24 LYS HE3 1 1 19 8521 1 1 24 LYS HG2 H 19.302 15.959 13.641 1.00 . A A . 24 LYS HG2 1 1 19 8522 1 1 24 LYS HG3 H 17.958 14.832 13.441 1.00 . A A . 24 LYS HG3 1 1 19 8523 1 1 24 LYS HZ1 H 21.136 16.715 15.227 1.00 . A A . 24 LYS HZ1 1 1 19 8524 1 1 24 LYS HZ2 H 21.727 15.174 14.858 1.00 . A A . 24 LYS HZ2 1 1 19 8525 1 1 24 LYS HZ3 H 21.835 15.765 16.439 1.00 . A A . 24 LYS HZ3 1 1 19 8526 1 1 24 LYS N N 17.717 14.526 10.887 1.00 . A A . 24 LYS N 1 1 19 8527 1 1 24 LYS NZ N 21.246 15.744 15.583 1.00 . A A . 24 LYS NZ 1 1 19 8528 1 1 24 LYS O O 20.773 14.990 9.257 1.00 . A A . 24 LYS O 1 1 19 8529 1 1 25 ARG C C 19.459 12.409 7.106 1.00 . A A . 25 ARG C 1 1 19 8530 1 1 25 ARG CA C 20.326 12.406 8.362 1.00 . A A . 25 ARG CA 1 1 19 8531 1 1 25 ARG CB C 20.692 10.969 8.738 1.00 . A A . 25 ARG CB 1 1 19 8532 1 1 25 ARG CD C 21.901 9.421 10.305 1.00 . A A . 25 ARG CD 1 1 19 8533 1 1 25 ARG CG C 21.590 10.869 9.960 1.00 . A A . 25 ARG CG 1 1 19 8534 1 1 25 ARG CZ C 23.728 8.109 11.297 1.00 . A A . 25 ARG CZ 1 1 19 8535 1 1 25 ARG H H 18.950 12.565 9.963 1.00 . A A . 25 ARG H 1 1 19 8536 1 1 25 ARG HA H 21.231 12.958 8.162 1.00 . A A . 25 ARG HA 1 1 19 8537 1 1 25 ARG HB2 H 19.784 10.419 8.940 1.00 . A A . 25 ARG HB2 1 1 19 8538 1 1 25 ARG HB3 H 21.202 10.511 7.904 1.00 . A A . 25 ARG HB3 1 1 19 8539 1 1 25 ARG HD2 H 21.146 9.057 10.986 1.00 . A A . 25 ARG HD2 1 1 19 8540 1 1 25 ARG HD3 H 21.880 8.836 9.398 1.00 . A A . 25 ARG HD3 1 1 19 8541 1 1 25 ARG HE H 23.732 10.093 11.089 1.00 . A A . 25 ARG HE 1 1 19 8542 1 1 25 ARG HG2 H 22.516 11.386 9.757 1.00 . A A . 25 ARG HG2 1 1 19 8543 1 1 25 ARG HG3 H 21.093 11.331 10.799 1.00 . A A . 25 ARG HG3 1 1 19 8544 1 1 25 ARG HH11 H 22.144 7.023 10.672 1.00 . A A . 25 ARG HH11 1 1 19 8545 1 1 25 ARG HH12 H 23.439 6.110 11.373 1.00 . A A . 25 ARG HH12 1 1 19 8546 1 1 25 ARG HH21 H 25.444 8.902 12.014 1.00 . A A . 25 ARG HH21 1 1 19 8547 1 1 25 ARG HH22 H 25.316 7.180 12.137 1.00 . A A . 25 ARG HH22 1 1 19 8548 1 1 25 ARG N N 19.638 13.059 9.470 1.00 . A A . 25 ARG N 1 1 19 8549 1 1 25 ARG NE N 23.212 9.277 10.932 1.00 . A A . 25 ARG NE 1 1 19 8550 1 1 25 ARG NH1 N 23.048 6.989 11.099 1.00 . A A . 25 ARG NH1 1 1 19 8551 1 1 25 ARG NH2 N 24.928 8.060 11.862 1.00 . A A . 25 ARG NH2 1 1 19 8552 1 1 25 ARG O O 19.842 11.862 6.072 1.00 . A A . 25 ARG O 1 1 19 8553 1 1 26 LYS C C 17.109 11.722 5.489 1.00 . A A . 26 LYS C 1 1 19 8554 1 1 26 LYS CA C 17.366 13.106 6.077 1.00 . A A . 26 LYS CA 1 1 19 8555 1 1 26 LYS CB C 17.925 14.035 4.997 1.00 . A A . 26 LYS CB 1 1 19 8556 1 1 26 LYS CD C 18.937 16.299 4.600 1.00 . A A . 26 LYS CD 1 1 19 8557 1 1 26 LYS CE C 20.029 16.856 5.502 1.00 . A A . 26 LYS CE 1 1 19 8558 1 1 26 LYS CG C 17.914 15.502 5.391 1.00 . A A . 26 LYS CG 1 1 19 8559 1 1 26 LYS H H 18.038 13.447 8.055 1.00 . A A . 26 LYS H 1 1 19 8560 1 1 26 LYS HA H 16.432 13.509 6.439 1.00 . A A . 26 LYS HA 1 1 19 8561 1 1 26 LYS HB2 H 18.944 13.748 4.784 1.00 . A A . 26 LYS HB2 1 1 19 8562 1 1 26 LYS HB3 H 17.333 13.921 4.099 1.00 . A A . 26 LYS HB3 1 1 19 8563 1 1 26 LYS HD2 H 19.390 15.655 3.861 1.00 . A A . 26 LYS HD2 1 1 19 8564 1 1 26 LYS HD3 H 18.437 17.121 4.106 1.00 . A A . 26 LYS HD3 1 1 19 8565 1 1 26 LYS HE2 H 20.004 16.327 6.442 1.00 . A A . 26 LYS HE2 1 1 19 8566 1 1 26 LYS HE3 H 20.985 16.698 5.026 1.00 . A A . 26 LYS HE3 1 1 19 8567 1 1 26 LYS HG2 H 16.932 15.909 5.202 1.00 . A A . 26 LYS HG2 1 1 19 8568 1 1 26 LYS HG3 H 18.143 15.584 6.444 1.00 . A A . 26 LYS HG3 1 1 19 8569 1 1 26 LYS HZ1 H 20.477 18.619 6.527 1.00 . A A . 26 LYS HZ1 1 1 19 8570 1 1 26 LYS HZ2 H 18.864 18.506 6.032 1.00 . A A . 26 LYS HZ2 1 1 19 8571 1 1 26 LYS HZ3 H 20.073 18.856 4.901 1.00 . A A . 26 LYS HZ3 1 1 19 8572 1 1 26 LYS N N 18.288 13.030 7.204 1.00 . A A . 26 LYS N 1 1 19 8573 1 1 26 LYS NZ N 19.848 18.311 5.758 1.00 . A A . 26 LYS NZ 1 1 19 8574 1 1 26 LYS O O 17.108 11.545 4.271 1.00 . A A . 26 LYS O 1 1 19 8575 1 1 27 VAL C C 15.742 8.644 6.929 1.00 . A A . 27 VAL C 1 1 19 8576 1 1 27 VAL CA C 16.629 9.377 5.929 1.00 . A A . 27 VAL CA 1 1 19 8577 1 1 27 VAL CB C 17.938 8.587 5.746 1.00 . A A . 27 VAL CB 1 1 19 8578 1 1 27 VAL CG1 C 18.690 9.078 4.518 1.00 . A A . 27 VAL CG1 1 1 19 8579 1 1 27 VAL CG2 C 18.805 8.696 6.991 1.00 . A A . 27 VAL CG2 1 1 19 8580 1 1 27 VAL H H 16.903 10.948 7.321 1.00 . A A . 27 VAL H 1 1 19 8581 1 1 27 VAL HA H 16.122 9.419 4.976 1.00 . A A . 27 VAL HA 1 1 19 8582 1 1 27 VAL HB H 17.689 7.547 5.596 1.00 . A A . 27 VAL HB 1 1 19 8583 1 1 27 VAL HG11 H 18.879 10.137 4.612 1.00 . A A . 27 VAL HG11 1 1 19 8584 1 1 27 VAL HG12 H 19.629 8.550 4.436 1.00 . A A . 27 VAL HG12 1 1 19 8585 1 1 27 VAL HG13 H 18.096 8.896 3.635 1.00 . A A . 27 VAL HG13 1 1 19 8586 1 1 27 VAL HG21 H 19.521 9.493 6.862 1.00 . A A . 27 VAL HG21 1 1 19 8587 1 1 27 VAL HG22 H 18.181 8.908 7.847 1.00 . A A . 27 VAL HG22 1 1 19 8588 1 1 27 VAL HG23 H 19.327 7.764 7.150 1.00 . A A . 27 VAL HG23 1 1 19 8589 1 1 27 VAL N N 16.890 10.745 6.362 1.00 . A A . 27 VAL N 1 1 19 8590 1 1 27 VAL O O 15.520 9.118 8.044 1.00 . A A . 27 VAL O 1 1 19 8591 1 1 28 CYS C C 15.195 5.720 8.236 1.00 . A A . 28 CYS C 1 1 19 8592 1 1 28 CYS CA C 14.373 6.683 7.384 1.00 . A A . 28 CYS CA 1 1 19 8593 1 1 28 CYS CB C 13.363 5.901 6.541 1.00 . A A . 28 CYS CB 1 1 19 8594 1 1 28 CYS H H 15.450 7.157 5.624 1.00 . A A . 28 CYS H 1 1 19 8595 1 1 28 CYS HA H 13.839 7.356 8.037 1.00 . A A . 28 CYS HA 1 1 19 8596 1 1 28 CYS HB2 H 13.896 5.317 5.805 1.00 . A A . 28 CYS HB2 1 1 19 8597 1 1 28 CYS HB3 H 12.807 5.236 7.185 1.00 . A A . 28 CYS HB3 1 1 19 8598 1 1 28 CYS N N 15.237 7.483 6.524 1.00 . A A . 28 CYS N 1 1 19 8599 1 1 28 CYS O O 16.168 5.132 7.763 1.00 . A A . 28 CYS O 1 1 19 8600 1 1 28 CYS SG S 12.165 6.948 5.655 1.00 . A A . 28 CYS SG 1 1 19 8601 1 1 29 VAL C C 14.540 4.095 11.451 1.00 . A A . 29 VAL C 1 1 19 8602 1 1 29 VAL CA C 15.496 4.673 10.412 1.00 . A A . 29 VAL CA 1 1 19 8603 1 1 29 VAL CB C 16.645 5.400 11.136 1.00 . A A . 29 VAL CB 1 1 19 8604 1 1 29 VAL CG1 C 17.697 5.861 10.139 1.00 . A A . 29 VAL CG1 1 1 19 8605 1 1 29 VAL CG2 C 16.109 6.575 11.940 1.00 . A A . 29 VAL CG2 1 1 19 8606 1 1 29 VAL H H 14.015 6.061 9.813 1.00 . A A . 29 VAL H 1 1 19 8607 1 1 29 VAL HA H 15.917 3.863 9.835 1.00 . A A . 29 VAL HA 1 1 19 8608 1 1 29 VAL HB H 17.109 4.705 11.820 1.00 . A A . 29 VAL HB 1 1 19 8609 1 1 29 VAL HG11 H 17.252 6.559 9.444 1.00 . A A . 29 VAL HG11 1 1 19 8610 1 1 29 VAL HG12 H 18.507 6.342 10.666 1.00 . A A . 29 VAL HG12 1 1 19 8611 1 1 29 VAL HG13 H 18.077 5.007 9.596 1.00 . A A . 29 VAL HG13 1 1 19 8612 1 1 29 VAL HG21 H 15.345 7.082 11.369 1.00 . A A . 29 VAL HG21 1 1 19 8613 1 1 29 VAL HG22 H 15.686 6.215 12.867 1.00 . A A . 29 VAL HG22 1 1 19 8614 1 1 29 VAL HG23 H 16.914 7.261 12.154 1.00 . A A . 29 VAL HG23 1 1 19 8615 1 1 29 VAL N N 14.797 5.565 9.494 1.00 . A A . 29 VAL N 1 1 19 8616 1 1 29 VAL O O 13.397 4.535 11.572 1.00 . A A . 29 VAL O 1 1 19 8617 1 1 30 LYS C C 13.939 3.430 14.385 1.00 . A A . 30 LYS C 1 1 19 8618 1 1 30 LYS CA C 14.207 2.469 13.231 1.00 . A A . 30 LYS CA 1 1 19 8619 1 1 30 LYS CB C 14.907 1.212 13.752 1.00 . A A . 30 LYS CB 1 1 19 8620 1 1 30 LYS CD C 14.613 -1.189 14.430 1.00 . A A . 30 LYS CD 1 1 19 8621 1 1 30 LYS CE C 15.809 -1.152 15.369 1.00 . A A . 30 LYS CE 1 1 19 8622 1 1 30 LYS CG C 13.952 0.174 14.317 1.00 . A A . 30 LYS CG 1 1 19 8623 1 1 30 LYS H H 15.937 2.800 12.057 1.00 . A A . 30 LYS H 1 1 19 8624 1 1 30 LYS HA H 13.265 2.188 12.786 1.00 . A A . 30 LYS HA 1 1 19 8625 1 1 30 LYS HB2 H 15.459 0.759 12.942 1.00 . A A . 30 LYS HB2 1 1 19 8626 1 1 30 LYS HB3 H 15.598 1.496 14.533 1.00 . A A . 30 LYS HB3 1 1 19 8627 1 1 30 LYS HD2 H 13.893 -1.898 14.811 1.00 . A A . 30 LYS HD2 1 1 19 8628 1 1 30 LYS HD3 H 14.945 -1.501 13.450 1.00 . A A . 30 LYS HD3 1 1 19 8629 1 1 30 LYS HE2 H 15.707 -0.304 16.028 1.00 . A A . 30 LYS HE2 1 1 19 8630 1 1 30 LYS HE3 H 15.821 -2.062 15.952 1.00 . A A . 30 LYS HE3 1 1 19 8631 1 1 30 LYS HG2 H 13.631 0.490 15.299 1.00 . A A . 30 LYS HG2 1 1 19 8632 1 1 30 LYS HG3 H 13.094 0.095 13.665 1.00 . A A . 30 LYS HG3 1 1 19 8633 1 1 30 LYS HZ1 H 17.596 -0.172 14.913 1.00 . A A . 30 LYS HZ1 1 1 19 8634 1 1 30 LYS HZ2 H 16.912 -0.994 13.602 1.00 . A A . 30 LYS HZ2 1 1 19 8635 1 1 30 LYS HZ3 H 17.699 -1.858 14.826 1.00 . A A . 30 LYS HZ3 1 1 19 8636 1 1 30 LYS N N 15.017 3.107 12.200 1.00 . A A . 30 LYS N 1 1 19 8637 1 1 30 LYS NZ N 17.094 -1.036 14.625 1.00 . A A . 30 LYS NZ 1 1 19 8638 1 1 30 LYS O O 14.865 4.009 14.951 1.00 . A A . 30 LYS O 1 1 19 8639 1 1 31 GLY C C 11.230 3.894 16.713 1.00 . A A . 31 GLY C 1 1 19 8640 1 1 31 GLY CA C 12.298 4.484 15.814 1.00 . A A . 31 GLY CA 1 1 19 8641 1 1 31 GLY H H 11.968 3.106 14.241 1.00 . A A . 31 GLY H 1 1 19 8642 1 1 31 GLY HA2 H 13.177 4.693 16.406 1.00 . A A . 31 GLY HA2 1 1 19 8643 1 1 31 GLY HA3 H 11.930 5.410 15.397 1.00 . A A . 31 GLY HA3 1 1 19 8644 1 1 31 GLY N N 12.665 3.594 14.729 1.00 . A A . 31 GLY N 1 1 19 8645 1 1 31 GLY O O 10.137 4.447 16.834 1.00 . A A . 31 GLY O 1 1 20 8646 1 1 1 GLY C C 3.540 -0.120 -1.221 1.00 . A A . 1 GLY C 1 1 20 8647 1 1 1 GLY CA C 2.120 0.106 -1.700 1.00 . A A . 1 GLY CA 1 1 20 8648 1 1 1 GLY H1 H 1.195 1.124 -0.090 1.00 . A A . 1 GLY H1 1 1 20 8649 1 1 1 GLY HA2 H 1.809 -0.747 -2.285 1.00 . A A . 1 GLY HA2 1 1 20 8650 1 1 1 GLY HA3 H 2.099 0.986 -2.326 1.00 . A A . 1 GLY HA3 1 1 20 8651 1 1 1 GLY N N 1.187 0.289 -0.604 1.00 . A A . 1 GLY N 1 1 20 8652 1 1 1 GLY O O 3.968 -1.260 -1.039 1.00 . A A . 1 GLY O 1 1 20 8653 1 1 2 TYR C C 6.148 2.238 -0.059 1.00 . A A . 2 TYR C 1 1 20 8654 1 1 2 TYR CA C 5.657 0.884 -0.563 1.00 . A A . 2 TYR CA 1 1 20 8655 1 1 2 TYR CB C 6.560 0.390 -1.694 1.00 . A A . 2 TYR CB 1 1 20 8656 1 1 2 TYR CD1 C 8.261 -1.250 -0.802 1.00 . A A . 2 TYR CD1 1 1 20 8657 1 1 2 TYR CD2 C 8.975 0.980 -1.249 1.00 . A A . 2 TYR CD2 1 1 20 8658 1 1 2 TYR CE1 C 9.537 -1.579 -0.387 1.00 . A A . 2 TYR CE1 1 1 20 8659 1 1 2 TYR CE2 C 10.253 0.659 -0.837 1.00 . A A . 2 TYR CE2 1 1 20 8660 1 1 2 TYR CG C 7.958 0.034 -1.241 1.00 . A A . 2 TYR CG 1 1 20 8661 1 1 2 TYR CZ C 10.529 -0.622 -0.407 1.00 . A A . 2 TYR CZ 1 1 20 8662 1 1 2 TYR H H 3.878 1.850 -1.181 1.00 . A A . 2 TYR H 1 1 20 8663 1 1 2 TYR HA H 5.695 0.175 0.251 1.00 . A A . 2 TYR HA 1 1 20 8664 1 1 2 TYR HB2 H 6.121 -0.491 -2.137 1.00 . A A . 2 TYR HB2 1 1 20 8665 1 1 2 TYR HB3 H 6.641 1.162 -2.444 1.00 . A A . 2 TYR HB3 1 1 20 8666 1 1 2 TYR HD1 H 7.481 -1.997 -0.788 1.00 . A A . 2 TYR HD1 1 1 20 8667 1 1 2 TYR HD2 H 8.755 1.983 -1.587 1.00 . A A . 2 TYR HD2 1 1 20 8668 1 1 2 TYR HE1 H 9.753 -2.582 -0.050 1.00 . A A . 2 TYR HE1 1 1 20 8669 1 1 2 TYR HE2 H 11.031 1.409 -0.852 1.00 . A A . 2 TYR HE2 1 1 20 8670 1 1 2 TYR HH H 11.974 -1.871 -0.184 1.00 . A A . 2 TYR HH 1 1 20 8671 1 1 2 TYR N N 4.274 0.969 -1.019 1.00 . A A . 2 TYR N 1 1 20 8672 1 1 2 TYR O O 6.142 3.226 -0.794 1.00 . A A . 2 TYR O 1 1 20 8673 1 1 2 TYR OH O 11.801 -0.946 0.006 1.00 . A A . 2 TYR OH 1 1 20 8674 1 1 3 CYS C C 8.594 3.531 1.815 1.00 . A A . 3 CYS C 1 1 20 8675 1 1 3 CYS CA C 7.068 3.507 1.803 1.00 . A A . 3 CYS CA 1 1 20 8676 1 1 3 CYS CB C 6.534 3.650 3.230 1.00 . A A . 3 CYS CB 1 1 20 8677 1 1 3 CYS H H 6.553 1.455 1.735 1.00 . A A . 3 CYS H 1 1 20 8678 1 1 3 CYS HA H 6.712 4.334 1.209 1.00 . A A . 3 CYS HA 1 1 20 8679 1 1 3 CYS HB2 H 7.263 3.252 3.921 1.00 . A A . 3 CYS HB2 1 1 20 8680 1 1 3 CYS HB3 H 6.377 4.697 3.443 1.00 . A A . 3 CYS HB3 1 1 20 8681 1 1 3 CYS N N 6.573 2.276 1.199 1.00 . A A . 3 CYS N 1 1 20 8682 1 1 3 CYS O O 9.244 2.659 1.239 1.00 . A A . 3 CYS O 1 1 20 8683 1 1 3 CYS SG S 4.960 2.781 3.525 1.00 . A A . 3 CYS SG 1 1 20 8684 1 1 4 ALA C C 11.159 3.903 3.761 1.00 . A A . 4 ALA C 1 1 20 8685 1 1 4 ALA CA C 10.607 4.673 2.566 1.00 . A A . 4 ALA CA 1 1 20 8686 1 1 4 ALA CB C 10.994 6.142 2.658 1.00 . A A . 4 ALA CB 1 1 20 8687 1 1 4 ALA H H 8.588 5.200 2.915 1.00 . A A . 4 ALA H 1 1 20 8688 1 1 4 ALA HA H 11.037 4.269 1.660 1.00 . A A . 4 ALA HA 1 1 20 8689 1 1 4 ALA HB1 H 10.935 6.591 1.677 1.00 . A A . 4 ALA HB1 1 1 20 8690 1 1 4 ALA HB2 H 10.317 6.650 3.328 1.00 . A A . 4 ALA HB2 1 1 20 8691 1 1 4 ALA HB3 H 12.003 6.226 3.032 1.00 . A A . 4 ALA HB3 1 1 20 8692 1 1 4 ALA N N 9.159 4.536 2.476 1.00 . A A . 4 ALA N 1 1 20 8693 1 1 4 ALA O O 10.950 4.289 4.911 1.00 . A A . 4 ALA O 1 1 20 8694 1 1 5 THR C C 13.787 2.543 4.991 1.00 . A A . 5 THR C 1 1 20 8695 1 1 5 THR CA C 12.444 1.986 4.533 1.00 . A A . 5 THR CA 1 1 20 8696 1 1 5 THR CB C 12.638 0.532 4.063 1.00 . A A . 5 THR CB 1 1 20 8697 1 1 5 THR CG2 C 11.345 -0.258 4.197 1.00 . A A . 5 THR CG2 1 1 20 8698 1 1 5 THR H H 11.995 2.556 2.544 1.00 . A A . 5 THR H 1 1 20 8699 1 1 5 THR HA H 11.761 1.983 5.370 1.00 . A A . 5 THR HA 1 1 20 8700 1 1 5 THR HB H 13.392 0.067 4.682 1.00 . A A . 5 THR HB 1 1 20 8701 1 1 5 THR HG1 H 13.831 -0.075 2.614 1.00 . A A . 5 THR HG1 1 1 20 8702 1 1 5 THR HG21 H 11.080 -0.681 3.239 1.00 . A A . 5 THR HG21 1 1 20 8703 1 1 5 THR HG22 H 10.555 0.399 4.531 1.00 . A A . 5 THR HG22 1 1 20 8704 1 1 5 THR HG23 H 11.481 -1.052 4.916 1.00 . A A . 5 THR HG23 1 1 20 8705 1 1 5 THR N N 11.864 2.811 3.481 1.00 . A A . 5 THR N 1 1 20 8706 1 1 5 THR O O 14.295 3.511 4.426 1.00 . A A . 5 THR O 1 1 20 8707 1 1 5 THR OG1 O 13.076 0.512 2.699 1.00 . A A . 5 THR OG1 1 1 20 8708 1 1 6 LYS C C 16.652 2.581 5.433 1.00 . A A . 6 LYS C 1 1 20 8709 1 1 6 LYS CA C 15.643 2.358 6.555 1.00 . A A . 6 LYS CA 1 1 20 8710 1 1 6 LYS CB C 16.183 1.321 7.542 1.00 . A A . 6 LYS CB 1 1 20 8711 1 1 6 LYS CD C 18.586 0.715 7.955 1.00 . A A . 6 LYS CD 1 1 20 8712 1 1 6 LYS CE C 19.878 1.106 8.655 1.00 . A A . 6 LYS CE 1 1 20 8713 1 1 6 LYS CG C 17.486 1.733 8.205 1.00 . A A . 6 LYS CG 1 1 20 8714 1 1 6 LYS H H 13.903 1.159 6.429 1.00 . A A . 6 LYS H 1 1 20 8715 1 1 6 LYS HA H 15.489 3.292 7.075 1.00 . A A . 6 LYS HA 1 1 20 8716 1 1 6 LYS HB2 H 15.446 1.159 8.314 1.00 . A A . 6 LYS HB2 1 1 20 8717 1 1 6 LYS HB3 H 16.350 0.393 7.015 1.00 . A A . 6 LYS HB3 1 1 20 8718 1 1 6 LYS HD2 H 18.265 -0.247 8.326 1.00 . A A . 6 LYS HD2 1 1 20 8719 1 1 6 LYS HD3 H 18.768 0.649 6.891 1.00 . A A . 6 LYS HD3 1 1 20 8720 1 1 6 LYS HE2 H 19.772 2.107 9.044 1.00 . A A . 6 LYS HE2 1 1 20 8721 1 1 6 LYS HE3 H 20.052 0.420 9.470 1.00 . A A . 6 LYS HE3 1 1 20 8722 1 1 6 LYS HG2 H 17.797 2.687 7.806 1.00 . A A . 6 LYS HG2 1 1 20 8723 1 1 6 LYS HG3 H 17.325 1.821 9.270 1.00 . A A . 6 LYS HG3 1 1 20 8724 1 1 6 LYS HZ1 H 20.739 0.761 6.784 1.00 . A A . 6 LYS HZ1 1 1 20 8725 1 1 6 LYS HZ2 H 21.758 0.397 8.084 1.00 . A A . 6 LYS HZ2 1 1 20 8726 1 1 6 LYS HZ3 H 21.475 2.009 7.657 1.00 . A A . 6 LYS HZ3 1 1 20 8727 1 1 6 LYS N N 14.358 1.926 6.020 1.00 . A A . 6 LYS N 1 1 20 8728 1 1 6 LYS NZ N 21.045 1.066 7.730 1.00 . A A . 6 LYS NZ 1 1 20 8729 1 1 6 LYS O O 16.796 1.747 4.540 1.00 . A A . 6 LYS O 1 1 20 8730 1 1 7 GLY C C 17.779 4.904 3.369 1.00 . A A . 7 GLY C 1 1 20 8731 1 1 7 GLY CA C 18.337 4.023 4.469 1.00 . A A . 7 GLY CA 1 1 20 8732 1 1 7 GLY H H 17.193 4.340 6.222 1.00 . A A . 7 GLY H 1 1 20 8733 1 1 7 GLY HA2 H 19.170 4.529 4.934 1.00 . A A . 7 GLY HA2 1 1 20 8734 1 1 7 GLY HA3 H 18.689 3.100 4.031 1.00 . A A . 7 GLY HA3 1 1 20 8735 1 1 7 GLY N N 17.350 3.712 5.486 1.00 . A A . 7 GLY N 1 1 20 8736 1 1 7 GLY O O 18.529 5.589 2.673 1.00 . A A . 7 GLY O 1 1 20 8737 1 1 8 ILE C C 15.541 7.107 2.685 1.00 . A A . 8 ILE C 1 1 20 8738 1 1 8 ILE CA C 15.803 5.690 2.188 1.00 . A A . 8 ILE CA 1 1 20 8739 1 1 8 ILE CB C 14.469 5.058 1.747 1.00 . A A . 8 ILE CB 1 1 20 8740 1 1 8 ILE CD1 C 15.577 3.313 0.261 1.00 . A A . 8 ILE CD1 1 1 20 8741 1 1 8 ILE CG1 C 14.661 3.572 1.437 1.00 . A A . 8 ILE CG1 1 1 20 8742 1 1 8 ILE CG2 C 13.912 5.789 0.534 1.00 . A A . 8 ILE CG2 1 1 20 8743 1 1 8 ILE H H 15.916 4.320 3.797 1.00 . A A . 8 ILE H 1 1 20 8744 1 1 8 ILE HA H 16.458 5.736 1.329 1.00 . A A . 8 ILE HA 1 1 20 8745 1 1 8 ILE HB H 13.762 5.161 2.555 1.00 . A A . 8 ILE HB 1 1 20 8746 1 1 8 ILE HD11 H 16.041 2.344 0.371 1.00 . A A . 8 ILE HD11 1 1 20 8747 1 1 8 ILE HD12 H 15.004 3.337 -0.654 1.00 . A A . 8 ILE HD12 1 1 20 8748 1 1 8 ILE HD13 H 16.342 4.075 0.226 1.00 . A A . 8 ILE HD13 1 1 20 8749 1 1 8 ILE HG12 H 15.085 3.083 2.300 1.00 . A A . 8 ILE HG12 1 1 20 8750 1 1 8 ILE HG13 H 13.700 3.131 1.214 1.00 . A A . 8 ILE HG13 1 1 20 8751 1 1 8 ILE HG21 H 13.677 6.808 0.806 1.00 . A A . 8 ILE HG21 1 1 20 8752 1 1 8 ILE HG22 H 14.648 5.789 -0.255 1.00 . A A . 8 ILE HG22 1 1 20 8753 1 1 8 ILE HG23 H 13.017 5.291 0.193 1.00 . A A . 8 ILE HG23 1 1 20 8754 1 1 8 ILE N N 16.460 4.886 3.211 1.00 . A A . 8 ILE N 1 1 20 8755 1 1 8 ILE O O 15.031 7.306 3.788 1.00 . A A . 8 ILE O 1 1 20 8756 1 1 9 LYS C C 14.255 9.740 2.665 1.00 . A A . 9 LYS C 1 1 20 8757 1 1 9 LYS CA C 15.692 9.491 2.218 1.00 . A A . 9 LYS CA 1 1 20 8758 1 1 9 LYS CB C 16.030 10.392 1.028 1.00 . A A . 9 LYS CB 1 1 20 8759 1 1 9 LYS CD C 18.412 11.179 1.159 1.00 . A A . 9 LYS CD 1 1 20 8760 1 1 9 LYS CE C 19.726 11.255 0.395 1.00 . A A . 9 LYS CE 1 1 20 8761 1 1 9 LYS CG C 17.445 10.206 0.506 1.00 . A A . 9 LYS CG 1 1 20 8762 1 1 9 LYS H H 16.293 7.869 0.997 1.00 . A A . 9 LYS H 1 1 20 8763 1 1 9 LYS HA H 16.357 9.725 3.035 1.00 . A A . 9 LYS HA 1 1 20 8764 1 1 9 LYS HB2 H 15.341 10.180 0.223 1.00 . A A . 9 LYS HB2 1 1 20 8765 1 1 9 LYS HB3 H 15.913 11.424 1.328 1.00 . A A . 9 LYS HB3 1 1 20 8766 1 1 9 LYS HD2 H 17.963 12.161 1.178 1.00 . A A . 9 LYS HD2 1 1 20 8767 1 1 9 LYS HD3 H 18.612 10.852 2.169 1.00 . A A . 9 LYS HD3 1 1 20 8768 1 1 9 LYS HE2 H 20.487 10.745 0.964 1.00 . A A . 9 LYS HE2 1 1 20 8769 1 1 9 LYS HE3 H 19.601 10.766 -0.559 1.00 . A A . 9 LYS HE3 1 1 20 8770 1 1 9 LYS HG2 H 17.767 9.197 0.719 1.00 . A A . 9 LYS HG2 1 1 20 8771 1 1 9 LYS HG3 H 17.449 10.369 -0.562 1.00 . A A . 9 LYS HG3 1 1 20 8772 1 1 9 LYS HZ1 H 20.080 12.898 -0.844 1.00 . A A . 9 LYS HZ1 1 1 20 8773 1 1 9 LYS HZ2 H 21.140 12.790 0.469 1.00 . A A . 9 LYS HZ2 1 1 20 8774 1 1 9 LYS HZ3 H 19.549 13.313 0.708 1.00 . A A . 9 LYS HZ3 1 1 20 8775 1 1 9 LYS N N 15.891 8.091 1.864 1.00 . A A . 9 LYS N 1 1 20 8776 1 1 9 LYS NZ N 20.153 12.663 0.166 1.00 . A A . 9 LYS NZ 1 1 20 8777 1 1 9 LYS O O 13.313 9.183 2.101 1.00 . A A . 9 LYS O 1 1 20 8778 1 1 10 CYS C C 12.500 12.403 4.102 1.00 . A A . 10 CYS C 1 1 20 8779 1 1 10 CYS CA C 12.773 10.905 4.204 1.00 . A A . 10 CYS CA 1 1 20 8780 1 1 10 CYS CB C 12.652 10.452 5.661 1.00 . A A . 10 CYS CB 1 1 20 8781 1 1 10 CYS H H 14.884 10.994 4.091 1.00 . A A . 10 CYS H 1 1 20 8782 1 1 10 CYS HA H 12.042 10.377 3.611 1.00 . A A . 10 CYS HA 1 1 20 8783 1 1 10 CYS HB2 H 11.610 10.289 5.894 1.00 . A A . 10 CYS HB2 1 1 20 8784 1 1 10 CYS HB3 H 13.193 9.526 5.787 1.00 . A A . 10 CYS HB3 1 1 20 8785 1 1 10 CYS N N 14.094 10.581 3.682 1.00 . A A . 10 CYS N 1 1 20 8786 1 1 10 CYS O O 11.544 12.911 4.686 1.00 . A A . 10 CYS O 1 1 20 8787 1 1 10 CYS SG S 13.308 11.647 6.868 1.00 . A A . 10 CYS SG 1 1 20 8788 1 1 11 ASN C C 11.866 14.874 2.510 1.00 . A A . 11 ASN C 1 1 20 8789 1 1 11 ASN CA C 13.198 14.544 3.177 1.00 . A A . 11 ASN CA 1 1 20 8790 1 1 11 ASN CB C 14.352 15.097 2.338 1.00 . A A . 11 ASN CB 1 1 20 8791 1 1 11 ASN CG C 14.112 14.938 0.849 1.00 . A A . 11 ASN CG 1 1 20 8792 1 1 11 ASN H H 14.091 12.642 2.915 1.00 . A A . 11 ASN H 1 1 20 8793 1 1 11 ASN HA H 13.222 15.003 4.154 1.00 . A A . 11 ASN HA 1 1 20 8794 1 1 11 ASN HB2 H 14.473 16.148 2.553 1.00 . A A . 11 ASN HB2 1 1 20 8795 1 1 11 ASN HB3 H 15.260 14.573 2.596 1.00 . A A . 11 ASN HB3 1 1 20 8796 1 1 11 ASN HD21 H 14.591 13.010 0.953 1.00 . A A . 11 ASN HD21 1 1 20 8797 1 1 11 ASN HD22 H 14.160 13.594 -0.615 1.00 . A A . 11 ASN HD22 1 1 20 8798 1 1 11 ASN N N 13.347 13.104 3.356 1.00 . A A . 11 ASN N 1 1 20 8799 1 1 11 ASN ND2 N 14.307 13.725 0.345 1.00 . A A . 11 ASN ND2 1 1 20 8800 1 1 11 ASN O O 11.268 15.917 2.777 1.00 . A A . 11 ASN O 1 1 20 8801 1 1 11 ASN OD1 O 13.756 15.894 0.161 1.00 . A A . 11 ASN OD1 1 1 20 8802 1 1 12 ASP C C 9.196 13.005 1.193 1.00 . A A . 12 ASP C 1 1 20 8803 1 1 12 ASP CA C 10.145 14.173 0.939 1.00 . A A . 12 ASP CA 1 1 20 8804 1 1 12 ASP CB C 10.392 14.329 -0.562 1.00 . A A . 12 ASP CB 1 1 20 8805 1 1 12 ASP CG C 9.269 15.070 -1.260 1.00 . A A . 12 ASP CG 1 1 20 8806 1 1 12 ASP H H 11.929 13.166 1.473 1.00 . A A . 12 ASP H 1 1 20 8807 1 1 12 ASP HA H 9.691 15.077 1.316 1.00 . A A . 12 ASP HA 1 1 20 8808 1 1 12 ASP HB2 H 11.310 14.878 -0.714 1.00 . A A . 12 ASP HB2 1 1 20 8809 1 1 12 ASP HB3 H 10.485 13.349 -1.008 1.00 . A A . 12 ASP HB3 1 1 20 8810 1 1 12 ASP N N 11.407 13.978 1.643 1.00 . A A . 12 ASP N 1 1 20 8811 1 1 12 ASP O O 8.080 13.194 1.677 1.00 . A A . 12 ASP O 1 1 20 8812 1 1 12 ASP OD1 O 9.525 15.667 -2.327 1.00 . A A . 12 ASP OD1 1 1 20 8813 1 1 12 ASP OD2 O 8.134 15.053 -0.740 1.00 . A A . 12 ASP OD2 1 1 20 8814 1 1 13 ILE C C 8.778 10.209 2.524 1.00 . A A . 13 ILE C 1 1 20 8815 1 1 13 ILE CA C 8.837 10.603 1.052 1.00 . A A . 13 ILE CA 1 1 20 8816 1 1 13 ILE CB C 9.385 9.417 0.236 1.00 . A A . 13 ILE CB 1 1 20 8817 1 1 13 ILE CD1 C 7.052 8.554 -0.301 1.00 . A A . 13 ILE CD1 1 1 20 8818 1 1 13 ILE CG1 C 8.409 8.240 0.289 1.00 . A A . 13 ILE CG1 1 1 20 8819 1 1 13 ILE CG2 C 10.753 9.002 0.758 1.00 . A A . 13 ILE CG2 1 1 20 8820 1 1 13 ILE H H 10.545 11.714 0.479 1.00 . A A . 13 ILE H 1 1 20 8821 1 1 13 ILE HA H 7.836 10.819 0.708 1.00 . A A . 13 ILE HA 1 1 20 8822 1 1 13 ILE HB H 9.499 9.736 -0.788 1.00 . A A . 13 ILE HB 1 1 20 8823 1 1 13 ILE HD11 H 7.074 9.533 -0.756 1.00 . A A . 13 ILE HD11 1 1 20 8824 1 1 13 ILE HD12 H 6.803 7.815 -1.047 1.00 . A A . 13 ILE HD12 1 1 20 8825 1 1 13 ILE HD13 H 6.307 8.539 0.483 1.00 . A A . 13 ILE HD13 1 1 20 8826 1 1 13 ILE HG12 H 8.825 7.411 -0.261 1.00 . A A . 13 ILE HG12 1 1 20 8827 1 1 13 ILE HG13 H 8.265 7.947 1.319 1.00 . A A . 13 ILE HG13 1 1 20 8828 1 1 13 ILE HG21 H 11.190 8.278 0.086 1.00 . A A . 13 ILE HG21 1 1 20 8829 1 1 13 ILE HG22 H 11.393 9.869 0.818 1.00 . A A . 13 ILE HG22 1 1 20 8830 1 1 13 ILE HG23 H 10.646 8.564 1.739 1.00 . A A . 13 ILE HG23 1 1 20 8831 1 1 13 ILE N N 9.647 11.800 0.861 1.00 . A A . 13 ILE N 1 1 20 8832 1 1 13 ILE O O 9.747 10.385 3.264 1.00 . A A . 13 ILE O 1 1 20 8833 1 1 14 HIS C C 7.743 7.763 4.484 1.00 . A A . 14 HIS C 1 1 20 8834 1 1 14 HIS CA C 7.451 9.252 4.326 1.00 . A A . 14 HIS CA 1 1 20 8835 1 1 14 HIS CB C 6.025 9.555 4.788 1.00 . A A . 14 HIS CB 1 1 20 8836 1 1 14 HIS CD2 C 6.600 11.845 5.863 1.00 . A A . 14 HIS CD2 1 1 20 8837 1 1 14 HIS CE1 C 4.770 12.923 5.320 1.00 . A A . 14 HIS CE1 1 1 20 8838 1 1 14 HIS CG C 5.812 10.987 5.174 1.00 . A A . 14 HIS CG 1 1 20 8839 1 1 14 HIS H H 6.900 9.560 2.305 1.00 . A A . 14 HIS H 1 1 20 8840 1 1 14 HIS HA H 8.144 9.809 4.938 1.00 . A A . 14 HIS HA 1 1 20 8841 1 1 14 HIS HB2 H 5.338 9.322 3.988 1.00 . A A . 14 HIS HB2 1 1 20 8842 1 1 14 HIS HB3 H 5.793 8.941 5.646 1.00 . A A . 14 HIS HB3 1 1 20 8843 1 1 14 HIS HD1 H 3.908 11.344 4.347 1.00 . A A . 14 HIS HD1 1 1 20 8844 1 1 14 HIS HD2 H 7.576 11.629 6.276 1.00 . A A . 14 HIS HD2 1 1 20 8845 1 1 14 HIS HE1 H 4.028 13.700 5.217 1.00 . A A . 14 HIS HE1 1 1 20 8846 1 1 14 HIS N N 7.636 9.674 2.942 1.00 . A A . 14 HIS N 1 1 20 8847 1 1 14 HIS ND1 N 4.673 11.692 4.849 1.00 . A A . 14 HIS ND1 1 1 20 8848 1 1 14 HIS NE2 N 5.930 13.041 5.940 1.00 . A A . 14 HIS NE2 1 1 20 8849 1 1 14 HIS O O 7.632 6.993 3.529 1.00 . A A . 14 HIS O 1 1 20 8850 1 1 15 CYS C C 7.184 5.218 6.443 1.00 . A A . 15 CYS C 1 1 20 8851 1 1 15 CYS CA C 8.429 5.968 5.978 1.00 . A A . 15 CYS CA 1 1 20 8852 1 1 15 CYS CB C 9.523 5.872 7.043 1.00 . A A . 15 CYS CB 1 1 20 8853 1 1 15 CYS H H 8.189 8.025 6.416 1.00 . A A . 15 CYS H 1 1 20 8854 1 1 15 CYS HA H 8.786 5.515 5.065 1.00 . A A . 15 CYS HA 1 1 20 8855 1 1 15 CYS HB2 H 9.064 5.882 8.021 1.00 . A A . 15 CYS HB2 1 1 20 8856 1 1 15 CYS HB3 H 10.062 4.945 6.912 1.00 . A A . 15 CYS HB3 1 1 20 8857 1 1 15 CYS N N 8.119 7.364 5.695 1.00 . A A . 15 CYS N 1 1 20 8858 1 1 15 CYS O O 6.245 5.816 6.968 1.00 . A A . 15 CYS O 1 1 20 8859 1 1 15 CYS SG S 10.734 7.232 6.988 1.00 . A A . 15 CYS SG 1 1 20 8860 1 1 16 CYS C C 5.877 3.086 8.162 1.00 . A A . 16 CYS C 1 1 20 8861 1 1 16 CYS CA C 6.056 3.070 6.647 1.00 . A A . 16 CYS CA 1 1 20 8862 1 1 16 CYS CB C 6.259 1.634 6.161 1.00 . A A . 16 CYS CB 1 1 20 8863 1 1 16 CYS H H 7.962 3.483 5.824 1.00 . A A . 16 CYS H 1 1 20 8864 1 1 16 CYS HA H 5.166 3.474 6.188 1.00 . A A . 16 CYS HA 1 1 20 8865 1 1 16 CYS HB2 H 7.318 1.439 6.071 1.00 . A A . 16 CYS HB2 1 1 20 8866 1 1 16 CYS HB3 H 5.833 0.954 6.883 1.00 . A A . 16 CYS HB3 1 1 20 8867 1 1 16 CYS N N 7.184 3.903 6.248 1.00 . A A . 16 CYS N 1 1 20 8868 1 1 16 CYS O O 6.831 3.310 8.908 1.00 . A A . 16 CYS O 1 1 20 8869 1 1 16 CYS SG S 5.493 1.280 4.546 1.00 . A A . 16 CYS SG 1 1 20 8870 1 1 17 SER C C 5.313 1.932 10.792 1.00 . A A . 17 SER C 1 1 20 8871 1 1 17 SER CA C 4.344 2.835 10.036 1.00 . A A . 17 SER CA 1 1 20 8872 1 1 17 SER CB C 2.906 2.367 10.268 1.00 . A A . 17 SER CB 1 1 20 8873 1 1 17 SER H H 3.931 2.673 7.966 1.00 . A A . 17 SER H 1 1 20 8874 1 1 17 SER HA H 4.449 3.845 10.405 1.00 . A A . 17 SER HA 1 1 20 8875 1 1 17 SER HB2 H 2.791 1.364 9.886 1.00 . A A . 17 SER HB2 1 1 20 8876 1 1 17 SER HB3 H 2.694 2.375 11.327 1.00 . A A . 17 SER HB3 1 1 20 8877 1 1 17 SER HG H 1.450 3.677 10.263 1.00 . A A . 17 SER HG 1 1 20 8878 1 1 17 SER N N 4.649 2.845 8.610 1.00 . A A . 17 SER N 1 1 20 8879 1 1 17 SER O O 5.305 0.713 10.623 1.00 . A A . 17 SER O 1 1 20 8880 1 1 17 SER OG O 1.981 3.216 9.610 1.00 . A A . 17 SER OG 1 1 20 8881 1 1 18 GLY C C 8.513 2.351 12.308 1.00 . A A . 18 GLY C 1 1 20 8882 1 1 18 GLY CA C 7.114 1.777 12.399 1.00 . A A . 18 GLY CA 1 1 20 8883 1 1 18 GLY H H 6.111 3.515 11.723 1.00 . A A . 18 GLY H 1 1 20 8884 1 1 18 GLY HA2 H 6.806 1.768 13.434 1.00 . A A . 18 GLY HA2 1 1 20 8885 1 1 18 GLY HA3 H 7.129 0.761 12.030 1.00 . A A . 18 GLY HA3 1 1 20 8886 1 1 18 GLY N N 6.149 2.540 11.629 1.00 . A A . 18 GLY N 1 1 20 8887 1 1 18 GLY O O 9.368 2.059 13.145 1.00 . A A . 18 GLY O 1 1 20 8888 1 1 19 LEU C C 10.000 5.285 11.360 1.00 . A A . 19 LEU C 1 1 20 8889 1 1 19 LEU CA C 10.058 3.785 11.089 1.00 . A A . 19 LEU CA 1 1 20 8890 1 1 19 LEU CB C 10.551 3.531 9.663 1.00 . A A . 19 LEU CB 1 1 20 8891 1 1 19 LEU CD1 C 11.104 1.929 7.816 1.00 . A A . 19 LEU CD1 1 1 20 8892 1 1 19 LEU CD2 C 12.077 1.589 10.095 1.00 . A A . 19 LEU CD2 1 1 20 8893 1 1 19 LEU CG C 10.867 2.077 9.311 1.00 . A A . 19 LEU CG 1 1 20 8894 1 1 19 LEU H H 8.030 3.363 10.653 1.00 . A A . 19 LEU H 1 1 20 8895 1 1 19 LEU HA H 10.747 3.331 11.786 1.00 . A A . 19 LEU HA 1 1 20 8896 1 1 19 LEU HB2 H 9.788 3.877 8.983 1.00 . A A . 19 LEU HB2 1 1 20 8897 1 1 19 LEU HB3 H 11.451 4.111 9.518 1.00 . A A . 19 LEU HB3 1 1 20 8898 1 1 19 LEU HD11 H 10.234 2.272 7.278 1.00 . A A . 19 LEU HD11 1 1 20 8899 1 1 19 LEU HD12 H 11.287 0.891 7.582 1.00 . A A . 19 LEU HD12 1 1 20 8900 1 1 19 LEU HD13 H 11.962 2.520 7.528 1.00 . A A . 19 LEU HD13 1 1 20 8901 1 1 19 LEU HD21 H 12.980 1.940 9.618 1.00 . A A . 19 LEU HD21 1 1 20 8902 1 1 19 LEU HD22 H 12.078 0.509 10.119 1.00 . A A . 19 LEU HD22 1 1 20 8903 1 1 19 LEU HD23 H 12.030 1.972 11.104 1.00 . A A . 19 LEU HD23 1 1 20 8904 1 1 19 LEU HG H 10.022 1.457 9.577 1.00 . A A . 19 LEU HG 1 1 20 8905 1 1 19 LEU N N 8.750 3.169 11.288 1.00 . A A . 19 LEU N 1 1 20 8906 1 1 19 LEU O O 8.951 5.913 11.214 1.00 . A A . 19 LEU O 1 1 20 8907 1 1 20 LYS C C 11.912 8.026 10.908 1.00 . A A . 20 LYS C 1 1 20 8908 1 1 20 LYS CA C 11.215 7.280 12.042 1.00 . A A . 20 LYS CA 1 1 20 8909 1 1 20 LYS CB C 11.964 7.514 13.356 1.00 . A A . 20 LYS CB 1 1 20 8910 1 1 20 LYS CD C 11.910 7.080 15.830 1.00 . A A . 20 LYS CD 1 1 20 8911 1 1 20 LYS CE C 11.965 8.279 16.764 1.00 . A A . 20 LYS CE 1 1 20 8912 1 1 20 LYS CG C 11.086 7.379 14.588 1.00 . A A . 20 LYS CG 1 1 20 8913 1 1 20 LYS H H 11.938 5.300 11.852 1.00 . A A . 20 LYS H 1 1 20 8914 1 1 20 LYS HA H 10.208 7.657 12.139 1.00 . A A . 20 LYS HA 1 1 20 8915 1 1 20 LYS HB2 H 12.767 6.797 13.431 1.00 . A A . 20 LYS HB2 1 1 20 8916 1 1 20 LYS HB3 H 12.382 8.511 13.345 1.00 . A A . 20 LYS HB3 1 1 20 8917 1 1 20 LYS HD2 H 11.465 6.249 16.355 1.00 . A A . 20 LYS HD2 1 1 20 8918 1 1 20 LYS HD3 H 12.916 6.822 15.530 1.00 . A A . 20 LYS HD3 1 1 20 8919 1 1 20 LYS HE2 H 10.969 8.682 16.871 1.00 . A A . 20 LYS HE2 1 1 20 8920 1 1 20 LYS HE3 H 12.327 7.952 17.727 1.00 . A A . 20 LYS HE3 1 1 20 8921 1 1 20 LYS HG2 H 10.549 8.304 14.740 1.00 . A A . 20 LYS HG2 1 1 20 8922 1 1 20 LYS HG3 H 10.383 6.574 14.431 1.00 . A A . 20 LYS HG3 1 1 20 8923 1 1 20 LYS HZ1 H 13.356 9.814 17.034 1.00 . A A . 20 LYS HZ1 1 1 20 8924 1 1 20 LYS HZ2 H 12.314 10.057 15.724 1.00 . A A . 20 LYS HZ2 1 1 20 8925 1 1 20 LYS HZ3 H 13.575 8.935 15.605 1.00 . A A . 20 LYS HZ3 1 1 20 8926 1 1 20 LYS N N 11.134 5.853 11.753 1.00 . A A . 20 LYS N 1 1 20 8927 1 1 20 LYS NZ N 12.866 9.346 16.245 1.00 . A A . 20 LYS NZ 1 1 20 8928 1 1 20 LYS O O 12.800 7.485 10.249 1.00 . A A . 20 LYS O 1 1 20 8929 1 1 21 CYS C C 13.202 10.976 10.188 1.00 . A A . 21 CYS C 1 1 20 8930 1 1 21 CYS CA C 12.089 10.092 9.633 1.00 . A A . 21 CYS CA 1 1 20 8931 1 1 21 CYS CB C 11.013 10.959 8.977 1.00 . A A . 21 CYS CB 1 1 20 8932 1 1 21 CYS H H 10.791 9.648 11.245 1.00 . A A . 21 CYS H 1 1 20 8933 1 1 21 CYS HA H 12.508 9.430 8.891 1.00 . A A . 21 CYS HA 1 1 20 8934 1 1 21 CYS HB2 H 10.359 10.328 8.393 1.00 . A A . 21 CYS HB2 1 1 20 8935 1 1 21 CYS HB3 H 10.438 11.450 9.747 1.00 . A A . 21 CYS HB3 1 1 20 8936 1 1 21 CYS N N 11.504 9.271 10.686 1.00 . A A . 21 CYS N 1 1 20 8937 1 1 21 CYS O O 12.949 12.075 10.681 1.00 . A A . 21 CYS O 1 1 20 8938 1 1 21 CYS SG S 11.670 12.247 7.868 1.00 . A A . 21 CYS SG 1 1 20 8939 1 1 22 ASP C C 15.716 12.573 9.876 1.00 . A A . 22 ASP C 1 1 20 8940 1 1 22 ASP CA C 15.588 11.234 10.595 1.00 . A A . 22 ASP CA 1 1 20 8941 1 1 22 ASP CB C 16.867 10.417 10.409 1.00 . A A . 22 ASP CB 1 1 20 8942 1 1 22 ASP CG C 17.912 10.730 11.461 1.00 . A A . 22 ASP CG 1 1 20 8943 1 1 22 ASP H H 14.573 9.606 9.699 1.00 . A A . 22 ASP H 1 1 20 8944 1 1 22 ASP HA H 15.439 11.417 11.648 1.00 . A A . 22 ASP HA 1 1 20 8945 1 1 22 ASP HB2 H 16.628 9.365 10.468 1.00 . A A . 22 ASP HB2 1 1 20 8946 1 1 22 ASP HB3 H 17.286 10.632 9.436 1.00 . A A . 22 ASP HB3 1 1 20 8947 1 1 22 ASP N N 14.435 10.488 10.103 1.00 . A A . 22 ASP N 1 1 20 8948 1 1 22 ASP O O 16.190 12.638 8.742 1.00 . A A . 22 ASP O 1 1 20 8949 1 1 22 ASP OD1 O 18.650 9.804 11.859 1.00 . A A . 22 ASP OD1 1 1 20 8950 1 1 22 ASP OD2 O 17.993 11.901 11.887 1.00 . A A . 22 ASP OD2 1 1 20 8951 1 1 23 SER C C 16.784 15.499 9.955 1.00 . A A . 23 SER C 1 1 20 8952 1 1 23 SER CA C 15.350 14.978 9.967 1.00 . A A . 23 SER CA 1 1 20 8953 1 1 23 SER CB C 14.453 15.937 10.753 1.00 . A A . 23 SER CB 1 1 20 8954 1 1 23 SER H H 14.919 13.524 11.445 1.00 . A A . 23 SER H 1 1 20 8955 1 1 23 SER HA H 14.993 14.918 8.950 1.00 . A A . 23 SER HA 1 1 20 8956 1 1 23 SER HB2 H 13.568 15.413 11.078 1.00 . A A . 23 SER HB2 1 1 20 8957 1 1 23 SER HB3 H 14.992 16.304 11.615 1.00 . A A . 23 SER HB3 1 1 20 8958 1 1 23 SER HG H 13.622 16.724 9.163 1.00 . A A . 23 SER HG 1 1 20 8959 1 1 23 SER N N 15.288 13.640 10.544 1.00 . A A . 23 SER N 1 1 20 8960 1 1 23 SER O O 17.089 16.496 9.301 1.00 . A A . 23 SER O 1 1 20 8961 1 1 23 SER OG O 14.063 17.041 9.954 1.00 . A A . 23 SER OG 1 1 20 8962 1 1 24 LYS C C 19.855 14.615 9.596 1.00 . A A . 24 LYS C 1 1 20 8963 1 1 24 LYS CA C 19.063 15.206 10.758 1.00 . A A . 24 LYS CA 1 1 20 8964 1 1 24 LYS CB C 19.671 14.751 12.087 1.00 . A A . 24 LYS CB 1 1 20 8965 1 1 24 LYS CD C 21.746 14.258 13.413 1.00 . A A . 24 LYS CD 1 1 20 8966 1 1 24 LYS CE C 23.265 14.191 13.388 1.00 . A A . 24 LYS CE 1 1 20 8967 1 1 24 LYS CG C 21.181 14.600 12.044 1.00 . A A . 24 LYS CG 1 1 20 8968 1 1 24 LYS H H 17.356 14.029 11.183 1.00 . A A . 24 LYS H 1 1 20 8969 1 1 24 LYS HA H 19.111 16.283 10.700 1.00 . A A . 24 LYS HA 1 1 20 8970 1 1 24 LYS HB2 H 19.424 15.476 12.848 1.00 . A A . 24 LYS HB2 1 1 20 8971 1 1 24 LYS HB3 H 19.242 13.797 12.357 1.00 . A A . 24 LYS HB3 1 1 20 8972 1 1 24 LYS HD2 H 21.442 15.018 14.118 1.00 . A A . 24 LYS HD2 1 1 20 8973 1 1 24 LYS HD3 H 21.357 13.299 13.724 1.00 . A A . 24 LYS HD3 1 1 20 8974 1 1 24 LYS HE2 H 23.566 13.352 12.779 1.00 . A A . 24 LYS HE2 1 1 20 8975 1 1 24 LYS HE3 H 23.646 15.104 12.955 1.00 . A A . 24 LYS HE3 1 1 20 8976 1 1 24 LYS HG2 H 21.436 13.809 11.354 1.00 . A A . 24 LYS HG2 1 1 20 8977 1 1 24 LYS HG3 H 21.618 15.529 11.706 1.00 . A A . 24 LYS HG3 1 1 20 8978 1 1 24 LYS HZ1 H 24.864 13.881 14.696 1.00 . A A . 24 LYS HZ1 1 1 20 8979 1 1 24 LYS HZ2 H 23.406 13.206 15.225 1.00 . A A . 24 LYS HZ2 1 1 20 8980 1 1 24 LYS HZ3 H 23.649 14.877 15.323 1.00 . A A . 24 LYS HZ3 1 1 20 8981 1 1 24 LYS N N 17.660 14.816 10.683 1.00 . A A . 24 LYS N 1 1 20 8982 1 1 24 LYS NZ N 23.836 14.028 14.754 1.00 . A A . 24 LYS NZ 1 1 20 8983 1 1 24 LYS O O 20.684 15.293 8.989 1.00 . A A . 24 LYS O 1 1 20 8984 1 1 25 ARG C C 19.399 12.603 6.957 1.00 . A A . 25 ARG C 1 1 20 8985 1 1 25 ARG CA C 20.280 12.667 8.201 1.00 . A A . 25 ARG CA 1 1 20 8986 1 1 25 ARG CB C 20.682 11.254 8.628 1.00 . A A . 25 ARG CB 1 1 20 8987 1 1 25 ARG CD C 22.100 9.854 10.159 1.00 . A A . 25 ARG CD 1 1 20 8988 1 1 25 ARG CG C 21.440 11.207 9.944 1.00 . A A . 25 ARG CG 1 1 20 8989 1 1 25 ARG CZ C 22.050 8.095 11.875 1.00 . A A . 25 ARG CZ 1 1 20 8990 1 1 25 ARG H H 18.921 12.860 9.811 1.00 . A A . 25 ARG H 1 1 20 8991 1 1 25 ARG HA H 21.172 13.230 7.968 1.00 . A A . 25 ARG HA 1 1 20 8992 1 1 25 ARG HB2 H 19.789 10.654 8.731 1.00 . A A . 25 ARG HB2 1 1 20 8993 1 1 25 ARG HB3 H 21.308 10.824 7.861 1.00 . A A . 25 ARG HB3 1 1 20 8994 1 1 25 ARG HD2 H 22.031 9.285 9.244 1.00 . A A . 25 ARG HD2 1 1 20 8995 1 1 25 ARG HD3 H 23.139 10.011 10.408 1.00 . A A . 25 ARG HD3 1 1 20 8996 1 1 25 ARG HE H 20.553 9.356 11.492 1.00 . A A . 25 ARG HE 1 1 20 8997 1 1 25 ARG HG2 H 22.204 11.971 9.936 1.00 . A A . 25 ARG HG2 1 1 20 8998 1 1 25 ARG HG3 H 20.750 11.395 10.753 1.00 . A A . 25 ARG HG3 1 1 20 8999 1 1 25 ARG HH11 H 23.770 8.205 10.821 1.00 . A A . 25 ARG HH11 1 1 20 9000 1 1 25 ARG HH12 H 23.721 6.969 12.034 1.00 . A A . 25 ARG HH12 1 1 20 9001 1 1 25 ARG HH21 H 20.477 7.732 13.092 1.00 . A A . 25 ARG HH21 1 1 20 9002 1 1 25 ARG HH22 H 21.848 6.700 13.324 1.00 . A A . 25 ARG HH22 1 1 20 9003 1 1 25 ARG N N 19.592 13.349 9.291 1.00 . A A . 25 ARG N 1 1 20 9004 1 1 25 ARG NE N 21.463 9.100 11.235 1.00 . A A . 25 ARG NE 1 1 20 9005 1 1 25 ARG NH1 N 23.281 7.726 11.550 1.00 . A A . 25 ARG NH1 1 1 20 9006 1 1 25 ARG NH2 N 21.405 7.456 12.844 1.00 . A A . 25 ARG NH2 1 1 20 9007 1 1 25 ARG O O 19.785 12.030 5.938 1.00 . A A . 25 ARG O 1 1 20 9008 1 1 26 LYS C C 17.043 11.796 5.400 1.00 . A A . 26 LYS C 1 1 20 9009 1 1 26 LYS CA C 17.276 13.208 5.930 1.00 . A A . 26 LYS CA 1 1 20 9010 1 1 26 LYS CB C 17.801 14.105 4.807 1.00 . A A . 26 LYS CB 1 1 20 9011 1 1 26 LYS CD C 18.605 16.378 4.102 1.00 . A A . 26 LYS CD 1 1 20 9012 1 1 26 LYS CE C 19.439 17.540 4.620 1.00 . A A . 26 LYS CE 1 1 20 9013 1 1 26 LYS CG C 18.053 15.539 5.242 1.00 . A A . 26 LYS CG 1 1 20 9014 1 1 26 LYS H H 17.962 13.637 7.887 1.00 . A A . 26 LYS H 1 1 20 9015 1 1 26 LYS HA H 16.338 13.604 6.288 1.00 . A A . 26 LYS HA 1 1 20 9016 1 1 26 LYS HB2 H 18.729 13.695 4.439 1.00 . A A . 26 LYS HB2 1 1 20 9017 1 1 26 LYS HB3 H 17.078 14.117 4.004 1.00 . A A . 26 LYS HB3 1 1 20 9018 1 1 26 LYS HD2 H 19.226 15.755 3.476 1.00 . A A . 26 LYS HD2 1 1 20 9019 1 1 26 LYS HD3 H 17.781 16.768 3.522 1.00 . A A . 26 LYS HD3 1 1 20 9020 1 1 26 LYS HE2 H 19.039 18.459 4.220 1.00 . A A . 26 LYS HE2 1 1 20 9021 1 1 26 LYS HE3 H 19.377 17.559 5.698 1.00 . A A . 26 LYS HE3 1 1 20 9022 1 1 26 LYS HG2 H 17.122 15.973 5.576 1.00 . A A . 26 LYS HG2 1 1 20 9023 1 1 26 LYS HG3 H 18.764 15.539 6.055 1.00 . A A . 26 LYS HG3 1 1 20 9024 1 1 26 LYS HZ1 H 21.315 16.627 4.723 1.00 . A A . 26 LYS HZ1 1 1 20 9025 1 1 26 LYS HZ2 H 21.379 18.295 4.450 1.00 . A A . 26 LYS HZ2 1 1 20 9026 1 1 26 LYS HZ3 H 20.939 17.249 3.195 1.00 . A A . 26 LYS HZ3 1 1 20 9027 1 1 26 LYS N N 18.213 13.196 7.047 1.00 . A A . 26 LYS N 1 1 20 9028 1 1 26 LYS NZ N 20.868 17.419 4.219 1.00 . A A . 26 LYS NZ 1 1 20 9029 1 1 26 LYS O O 17.021 11.573 4.190 1.00 . A A . 26 LYS O 1 1 20 9030 1 1 27 VAL C C 15.784 8.742 6.983 1.00 . A A . 27 VAL C 1 1 20 9031 1 1 27 VAL CA C 16.633 9.458 5.939 1.00 . A A . 27 VAL CA 1 1 20 9032 1 1 27 VAL CB C 17.958 8.694 5.758 1.00 . A A . 27 VAL CB 1 1 20 9033 1 1 27 VAL CG1 C 18.671 9.153 4.495 1.00 . A A . 27 VAL CG1 1 1 20 9034 1 1 27 VAL CG2 C 18.848 8.876 6.979 1.00 . A A . 27 VAL CG2 1 1 20 9035 1 1 27 VAL H H 16.895 11.087 7.264 1.00 . A A . 27 VAL H 1 1 20 9036 1 1 27 VAL HA H 16.107 9.452 4.995 1.00 . A A . 27 VAL HA 1 1 20 9037 1 1 27 VAL HB H 17.733 7.643 5.656 1.00 . A A . 27 VAL HB 1 1 20 9038 1 1 27 VAL HG11 H 19.623 8.648 4.417 1.00 . A A . 27 VAL HG11 1 1 20 9039 1 1 27 VAL HG12 H 18.065 8.917 3.633 1.00 . A A . 27 VAL HG12 1 1 20 9040 1 1 27 VAL HG13 H 18.833 10.220 4.541 1.00 . A A . 27 VAL HG13 1 1 20 9041 1 1 27 VAL HG21 H 18.236 9.103 7.839 1.00 . A A . 27 VAL HG21 1 1 20 9042 1 1 27 VAL HG22 H 19.401 7.966 7.161 1.00 . A A . 27 VAL HG22 1 1 20 9043 1 1 27 VAL HG23 H 19.539 9.687 6.803 1.00 . A A . 27 VAL HG23 1 1 20 9044 1 1 27 VAL N N 16.867 10.847 6.314 1.00 . A A . 27 VAL N 1 1 20 9045 1 1 27 VAL O O 15.620 9.226 8.104 1.00 . A A . 27 VAL O 1 1 20 9046 1 1 28 CYS C C 15.273 5.901 8.399 1.00 . A A . 28 CYS C 1 1 20 9047 1 1 28 CYS CA C 14.416 6.800 7.514 1.00 . A A . 28 CYS CA 1 1 20 9048 1 1 28 CYS CB C 13.421 5.953 6.718 1.00 . A A . 28 CYS CB 1 1 20 9049 1 1 28 CYS H H 15.415 7.251 5.703 1.00 . A A . 28 CYS H 1 1 20 9050 1 1 28 CYS HA H 13.869 7.487 8.142 1.00 . A A . 28 CYS HA 1 1 20 9051 1 1 28 CYS HB2 H 13.967 5.310 6.043 1.00 . A A . 28 CYS HB2 1 1 20 9052 1 1 28 CYS HB3 H 12.850 5.344 7.403 1.00 . A A . 28 CYS HB3 1 1 20 9053 1 1 28 CYS N N 15.248 7.585 6.610 1.00 . A A . 28 CYS N 1 1 20 9054 1 1 28 CYS O O 16.270 5.337 7.949 1.00 . A A . 28 CYS O 1 1 20 9055 1 1 28 CYS SG S 12.244 6.925 5.724 1.00 . A A . 28 CYS SG 1 1 20 9056 1 1 29 VAL C C 14.653 4.118 11.470 1.00 . A A . 29 VAL C 1 1 20 9057 1 1 29 VAL CA C 15.607 4.940 10.611 1.00 . A A . 29 VAL CA 1 1 20 9058 1 1 29 VAL CB C 16.504 5.791 11.530 1.00 . A A . 29 VAL CB 1 1 20 9059 1 1 29 VAL CG1 C 17.713 6.309 10.766 1.00 . A A . 29 VAL CG1 1 1 20 9060 1 1 29 VAL CG2 C 15.710 6.941 12.131 1.00 . A A . 29 VAL CG2 1 1 20 9061 1 1 29 VAL H H 14.074 6.247 9.962 1.00 . A A . 29 VAL H 1 1 20 9062 1 1 29 VAL HA H 16.240 4.268 10.049 1.00 . A A . 29 VAL HA 1 1 20 9063 1 1 29 VAL HB H 16.856 5.165 12.336 1.00 . A A . 29 VAL HB 1 1 20 9064 1 1 29 VAL HG11 H 17.913 5.660 9.926 1.00 . A A . 29 VAL HG11 1 1 20 9065 1 1 29 VAL HG12 H 17.513 7.310 10.411 1.00 . A A . 29 VAL HG12 1 1 20 9066 1 1 29 VAL HG13 H 18.572 6.324 11.421 1.00 . A A . 29 VAL HG13 1 1 20 9067 1 1 29 VAL HG21 H 15.366 7.592 11.341 1.00 . A A . 29 VAL HG21 1 1 20 9068 1 1 29 VAL HG22 H 14.859 6.549 12.670 1.00 . A A . 29 VAL HG22 1 1 20 9069 1 1 29 VAL HG23 H 16.339 7.498 12.809 1.00 . A A . 29 VAL HG23 1 1 20 9070 1 1 29 VAL N N 14.877 5.772 9.662 1.00 . A A . 29 VAL N 1 1 20 9071 1 1 29 VAL O O 13.437 4.305 11.419 1.00 . A A . 29 VAL O 1 1 20 9072 1 1 30 LYS C C 13.778 3.172 14.256 1.00 . A A . 30 LYS C 1 1 20 9073 1 1 30 LYS CA C 14.411 2.357 13.132 1.00 . A A . 30 LYS CA 1 1 20 9074 1 1 30 LYS CB C 15.275 1.240 13.722 1.00 . A A . 30 LYS CB 1 1 20 9075 1 1 30 LYS CD C 15.381 -1.170 14.422 1.00 . A A . 30 LYS CD 1 1 20 9076 1 1 30 LYS CE C 15.581 -1.996 13.160 1.00 . A A . 30 LYS CE 1 1 20 9077 1 1 30 LYS CG C 14.479 0.026 14.168 1.00 . A A . 30 LYS CG 1 1 20 9078 1 1 30 LYS H H 16.187 3.106 12.256 1.00 . A A . 30 LYS H 1 1 20 9079 1 1 30 LYS HA H 13.626 1.916 12.537 1.00 . A A . 30 LYS HA 1 1 20 9080 1 1 30 LYS HB2 H 15.990 0.923 12.978 1.00 . A A . 30 LYS HB2 1 1 20 9081 1 1 30 LYS HB3 H 15.808 1.628 14.578 1.00 . A A . 30 LYS HB3 1 1 20 9082 1 1 30 LYS HD2 H 16.343 -0.818 14.764 1.00 . A A . 30 LYS HD2 1 1 20 9083 1 1 30 LYS HD3 H 14.932 -1.793 15.183 1.00 . A A . 30 LYS HD3 1 1 20 9084 1 1 30 LYS HE2 H 14.841 -1.701 12.432 1.00 . A A . 30 LYS HE2 1 1 20 9085 1 1 30 LYS HE3 H 16.568 -1.798 12.770 1.00 . A A . 30 LYS HE3 1 1 20 9086 1 1 30 LYS HG2 H 13.952 0.266 15.080 1.00 . A A . 30 LYS HG2 1 1 20 9087 1 1 30 LYS HG3 H 13.767 -0.229 13.396 1.00 . A A . 30 LYS HG3 1 1 20 9088 1 1 30 LYS HZ1 H 15.207 -3.957 12.546 1.00 . A A . 30 LYS HZ1 1 1 20 9089 1 1 30 LYS HZ2 H 14.695 -3.624 14.124 1.00 . A A . 30 LYS HZ2 1 1 20 9090 1 1 30 LYS HZ3 H 16.341 -3.835 13.796 1.00 . A A . 30 LYS HZ3 1 1 20 9091 1 1 30 LYS N N 15.211 3.208 12.260 1.00 . A A . 30 LYS N 1 1 20 9092 1 1 30 LYS NZ N 15.447 -3.455 13.425 1.00 . A A . 30 LYS NZ 1 1 20 9093 1 1 30 LYS O O 14.347 4.162 14.714 1.00 . A A . 30 LYS O 1 1 20 9094 1 1 31 GLY C C 11.382 2.509 16.830 1.00 . A A . 31 GLY C 1 1 20 9095 1 1 31 GLY CA C 11.908 3.449 15.763 1.00 . A A . 31 GLY CA 1 1 20 9096 1 1 31 GLY H H 12.191 1.952 14.293 1.00 . A A . 31 GLY H 1 1 20 9097 1 1 31 GLY HA2 H 12.592 4.149 16.220 1.00 . A A . 31 GLY HA2 1 1 20 9098 1 1 31 GLY HA3 H 11.078 3.996 15.341 1.00 . A A . 31 GLY HA3 1 1 20 9099 1 1 31 GLY N N 12.597 2.747 14.696 1.00 . A A . 31 GLY N 1 1 20 9100 1 1 31 GLY O O 10.173 2.408 17.037 1.00 . A A . 31 GLY O 1 1 stop_ save_
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