NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
452291 | 2v1v | 4246 | cing | 4-filtered-FRED | STAR | entry | full | 231 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2v1v # This FRED archive file contains, for PDB entry <2v1v>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2v1v _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2v1v _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3249.79 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 $TRYPSIN_INHIBITOR_1 A . 1 1 stop_ save_ save_TRYPSIN_INHIBITOR_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "TRYPSIN INHIBITOR 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code RVCPRILLECKKDSDCLAECVCLEHGYCG _Entity.Number_of_monomers 29 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 ARG . 1 1 2 VAL . 1 1 3 CYS . 1 1 4 PRO . 1 1 5 ARG . 1 1 6 ILE . 1 1 7 LEU . 1 1 8 LEU . 1 1 9 GLU . 1 1 10 CYS . 1 1 11 LYS . 1 1 12 LYS . 1 1 13 ASP . 1 1 14 SER . 1 1 15 ASP . 1 1 16 CYS . 1 1 17 LEU . 1 1 18 ALA . 1 1 19 GLU . 1 1 20 CYS . 1 1 21 VAL . 1 1 22 CYS . 1 1 23 LEU . 1 1 24 GLU . 1 1 25 HIS . 1 1 26 GLY . 1 1 27 TYR . 1 1 28 CYS . 1 1 29 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 ARG 1 1 1 1 VAL 2 2 1 1 CYS 3 3 1 1 PRO 4 4 1 1 ARG 5 5 1 1 ILE 6 6 1 1 LEU 7 7 1 1 LEU 8 8 1 1 GLU 9 9 1 1 CYS 10 10 1 1 LYS 11 11 1 1 LYS 12 12 1 1 ASP 13 13 1 1 SER 14 14 1 1 ASP 15 15 1 1 CYS 16 16 1 1 LEU 17 17 1 1 ALA 18 18 1 1 GLU 19 19 1 1 CYS 20 20 1 1 VAL 21 21 1 1 CYS 22 22 1 1 LEU 23 23 1 1 GLU 24 24 1 1 HIS 25 25 1 1 GLY 26 26 1 1 TYR 27 27 1 1 CYS 28 28 1 1 GLY 29 29 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 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 2 VAL HA . 2 . HA 1 1 1 1 2 1 1 3 CYS H . 3 . HN 1 1 2 1 1 1 1 2 VAL HA . 2 . HA 1 1 2 1 2 1 1 18 ALA MB . 18 . HB# 1 1 3 1 1 1 1 2 VAL HB . 2 . HB 1 1 3 1 2 1 1 3 CYS H . 3 . HN 1 1 4 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 4 1 2 1 1 3 CYS H . 3 . HN 1 1 5 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 5 1 2 1 1 3 CYS HA . 3 . HA 1 1 6 1 1 1 1 3 CYS H . 3 . HN 1 1 6 1 2 1 1 4 PRO HD2 . 4 . HD2 1 1 7 1 1 1 1 3 CYS H . 3 . HN 1 1 7 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1 8 1 1 1 1 3 CYS HA . 3 . HA 1 1 8 1 2 1 1 4 PRO HD2 . 4 . HD2 1 1 9 1 1 1 1 3 CYS HA . 3 . HA 1 1 9 1 2 1 1 4 PRO HD3 . 4 . HD1 1 1 10 1 1 1 1 3 CYS HA . 3 . HA 1 1 10 1 2 1 1 4 PRO QG . 4 . HG# 1 1 11 1 1 1 1 3 CYS HA . 3 . HA 1 1 11 1 2 1 1 17 LEU QD . 17 . HD1# 1 1 12 1 1 1 1 3 CYS HA . 3 . HA 1 1 12 1 2 1 1 18 ALA MB . 18 . HB# 1 1 13 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 13 1 2 1 1 4 PRO HD2 . 4 . HD2 1 1 14 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 14 1 2 1 1 4 PRO HD2 . 4 . HD2 1 1 15 1 1 1 1 4 PRO HA . 4 . HA 1 1 15 1 2 1 1 5 ARG H . 5 . HN 1 1 16 1 1 1 1 4 PRO HB2 . 4 . HB2 1 1 16 1 2 1 1 6 ILE H . 6 . HN 1 1 17 1 1 1 1 4 PRO HB2 . 4 . HB2 1 1 17 1 2 1 1 6 ILE QG . 6 . HG1# 1 1 18 1 1 1 1 4 PRO HB2 . 4 . HB2 1 1 18 1 2 1 1 17 LEU MD1 . 17 . HD1# 1 1 19 1 1 1 1 4 PRO HB2 . 4 . HB2 1 1 19 1 2 1 1 17 LEU QD . 17 . HD1# 1 1 20 1 1 1 1 4 PRO HB2 . 4 . HB2 1 1 20 1 2 1 1 17 LEU MD2 . 17 . HD2# 1 1 21 1 1 1 1 4 PRO HB3 . 4 . HB1 1 1 21 1 2 1 1 5 ARG H . 5 . HN 1 1 22 1 1 1 1 4 PRO HB3 . 4 . HB1 1 1 22 1 2 1 1 6 ILE H . 6 . HN 1 1 23 1 1 1 1 4 PRO HD2 . 4 . HD2 1 1 23 1 2 1 1 17 LEU MD1 . 17 . HD1# 1 1 24 1 1 1 1 4 PRO HD2 . 4 . HD2 1 1 24 1 2 1 1 17 LEU QD . 17 . HD1# 1 1 25 1 1 1 1 4 PRO HD2 . 4 . HD2 1 1 25 1 2 1 1 17 LEU MD2 . 17 . HD2# 1 1 26 1 1 1 1 4 PRO HD2 . 4 . HD2 1 1 26 1 2 1 1 17 LEU HG . 17 . HG 1 1 27 1 1 1 1 4 PRO HD2 . 4 . HD2 1 1 27 1 2 1 1 18 ALA H . 18 . HN 1 1 28 1 1 1 1 4 PRO HD2 . 4 . HD2 1 1 28 1 2 1 1 18 ALA MB . 18 . HB# 1 1 29 1 1 1 1 4 PRO HD3 . 4 . HD1 1 1 29 1 2 1 1 17 LEU QD . 17 . HD1# 1 1 30 1 1 1 1 4 PRO HD3 . 4 . HD1 1 1 30 1 2 1 1 18 ALA MB . 18 . HB# 1 1 31 1 1 1 1 5 ARG H . 5 . HN 1 1 31 1 2 1 1 6 ILE H . 6 . HN 1 1 32 1 1 1 1 5 ARG HA . 5 . HA 1 1 32 1 2 1 1 6 ILE H . 6 . HN 1 1 33 1 1 1 1 5 ARG QB . 5 . HB# 1 1 33 1 2 1 1 6 ILE H . 6 . HN 1 1 34 1 1 1 1 6 ILE H . 6 . HN 1 1 34 1 2 1 1 6 ILE QG . 6 . HG1# 1 1 35 1 1 1 1 6 ILE H . 6 . HN 1 1 35 1 2 1 1 7 LEU H . 7 . HN 1 1 36 1 1 1 1 6 ILE HA . 6 . HA 1 1 36 1 2 1 1 7 LEU H . 7 . HN 1 1 37 1 1 1 1 6 ILE HA . 6 . HA 1 1 37 1 2 1 1 7 LEU QB . 7 . HB# 1 1 38 1 1 1 1 6 ILE HA . 6 . HA 1 1 38 1 2 1 1 7 LEU HG . 7 . HG 1 1 39 1 1 1 1 7 LEU H . 7 . HN 1 1 39 1 2 1 1 8 LEU H . 8 . HN 1 1 40 1 1 1 1 7 LEU QD . 7 . HD1# 1 1 40 1 2 1 1 8 LEU H . 8 . HN 1 1 41 1 1 1 1 7 LEU QD . 7 . HD1# 1 1 41 1 2 1 1 8 LEU HA . 8 . HA 1 1 42 1 1 1 1 7 LEU QD . 7 . HD1# 1 1 42 1 2 1 1 27 TYR HB2 . 27 . HB2 1 1 43 1 1 1 1 7 LEU QD . 7 . HD1# 1 1 43 1 2 1 1 27 TYR HB3 . 27 . HB1 1 1 44 1 1 1 1 7 LEU HG . 7 . HG 1 1 44 1 2 1 1 8 LEU H . 8 . HN 1 1 45 1 1 1 1 8 LEU H . 8 . HN 1 1 45 1 2 1 1 8 LEU MD1 . 8 . HD1# 1 1 46 1 1 1 1 8 LEU H . 8 . HN 1 1 46 1 2 1 1 8 LEU QD . 8 . HD1# 1 1 47 1 1 1 1 8 LEU H . 8 . HN 1 1 47 1 2 1 1 8 LEU MD2 . 8 . HD2# 1 1 48 1 1 1 1 8 LEU H . 8 . HN 1 1 48 1 2 1 1 9 GLU H . 9 . HN 1 1 49 1 1 1 1 8 LEU H . 8 . HN 1 1 49 1 2 1 1 27 TYR HB2 . 27 . HB2 1 1 50 1 1 1 1 8 LEU H . 8 . HN 1 1 50 1 2 1 1 28 CYS H . 28 . HN 1 1 51 1 1 1 1 8 LEU H . 8 . HN 1 1 51 1 2 1 1 28 CYS HB2 . 28 . HB2 1 1 52 1 1 1 1 8 LEU HA . 8 . HA 1 1 52 1 2 1 1 9 GLU HA . 9 . HA 1 1 53 1 1 1 1 8 LEU HB2 . 8 . HB2 1 1 53 1 2 1 1 9 GLU H . 9 . HN 1 1 54 1 1 1 1 8 LEU HB2 . 8 . HB2 1 1 54 1 2 1 1 28 CYS H . 28 . HN 1 1 55 1 1 1 1 8 LEU HB2 . 8 . HB2 1 1 55 1 2 1 1 28 CYS HB3 . 28 . HB1 1 1 56 1 1 1 1 8 LEU HB3 . 8 . HB1 1 1 56 1 2 1 1 9 GLU H . 9 . HN 1 1 57 1 1 1 1 8 LEU HB3 . 8 . HB1 1 1 57 1 2 1 1 28 CYS H . 28 . HN 1 1 58 1 1 1 1 8 LEU HB3 . 8 . HB1 1 1 58 1 2 1 1 28 CYS HB2 . 28 . HB2 1 1 59 1 1 1 1 8 LEU QD . 8 . HD1# 1 1 59 1 2 1 1 9 GLU H . 9 . HN 1 1 60 1 1 1 1 8 LEU QD . 8 . HD1# 1 1 60 1 2 1 1 15 ASP QB . 15 . HB# 1 1 61 1 1 1 1 8 LEU QD . 8 . HD1# 1 1 61 1 2 1 1 16 CYS H . 16 . HN 1 1 62 1 1 1 1 8 LEU QD . 8 . HD1# 1 1 62 1 2 1 1 17 LEU H . 17 . HN 1 1 63 1 1 1 1 8 LEU QD . 8 . HD1# 1 1 63 1 2 1 1 28 CYS HA . 28 . HA 1 1 64 1 1 1 1 8 LEU QD . 8 . HD1# 1 1 64 1 2 1 1 28 CYS HB3 . 28 . HB1 1 1 65 1 1 1 1 8 LEU MD1 . 8 . HD1# 1 1 65 1 2 1 1 9 GLU H . 9 . HN 1 1 66 1 1 1 1 8 LEU MD1 . 8 . HD1# 1 1 66 1 2 1 1 28 CYS H . 28 . HN 1 1 67 1 1 1 1 8 LEU MD1 . 8 . HD1# 1 1 67 1 2 1 1 28 CYS HB2 . 28 . HB2 1 1 68 1 1 1 1 8 LEU MD1 . 8 . HD1# 1 1 68 1 2 1 1 28 CYS HB3 . 28 . HB1 1 1 69 1 1 1 1 8 LEU MD2 . 8 . HD2# 1 1 69 1 2 1 1 9 GLU H . 9 . HN 1 1 70 1 1 1 1 8 LEU MD2 . 8 . HD2# 1 1 70 1 2 1 1 28 CYS H . 28 . HN 1 1 71 1 1 1 1 8 LEU MD2 . 8 . HD2# 1 1 71 1 2 1 1 28 CYS HB2 . 28 . HB2 1 1 72 1 1 1 1 8 LEU MD2 . 8 . HD2# 1 1 72 1 2 1 1 28 CYS HB3 . 28 . HB1 1 1 73 1 1 1 1 9 GLU H . 9 . HN 1 1 73 1 2 1 1 10 CYS H . 10 . HN 1 1 74 1 1 1 1 9 GLU HA . 9 . HA 1 1 74 1 2 1 1 10 CYS H . 10 . HN 1 1 75 1 1 1 1 9 GLU HA . 9 . HA 1 1 75 1 2 1 1 27 TYR H . 27 . HN 1 1 76 1 1 1 1 9 GLU HA . 9 . HA 1 1 76 1 2 1 1 27 TYR HA . 27 . HA 1 1 77 1 1 1 1 9 GLU HA . 9 . HA 1 1 77 1 2 1 1 27 TYR HB2 . 27 . HB2 1 1 78 1 1 1 1 9 GLU HA . 9 . HA 1 1 78 1 2 1 1 28 CYS H . 28 . HN 1 1 79 1 1 1 1 9 GLU QB . 9 . HB# 1 1 79 1 2 1 1 27 TYR H . 27 . HN 1 1 80 1 1 1 1 9 GLU QB . 9 . HB# 1 1 80 1 2 1 1 27 TYR HA . 27 . HA 1 1 81 1 1 1 1 9 GLU QG . 9 . HG# 1 1 81 1 2 1 1 10 CYS H . 10 . HN 1 1 82 1 1 1 1 10 CYS H . 10 . HN 1 1 82 1 2 1 1 22 CYS HB2 . 22 . HB2 1 1 83 1 1 1 1 10 CYS H . 10 . HN 1 1 83 1 2 1 1 22 CYS HB3 . 22 . HB1 1 1 84 1 1 1 1 10 CYS H . 10 . HN 1 1 84 1 2 1 1 27 TYR HA . 27 . HA 1 1 85 1 1 1 1 10 CYS H . 10 . HN 1 1 85 1 2 1 1 28 CYS H . 28 . HN 1 1 86 1 1 1 1 10 CYS HA . 10 . HA 1 1 86 1 2 1 1 11 LYS H . 11 . HN 1 1 87 1 1 1 1 10 CYS HB2 . 10 . HB2 1 1 87 1 2 1 1 11 LYS H . 11 . HN 1 1 88 1 1 1 1 10 CYS HB2 . 10 . HB2 1 1 88 1 2 1 1 22 CYS HB3 . 22 . HB1 1 1 89 1 1 1 1 10 CYS HB3 . 10 . HB1 1 1 89 1 2 1 1 11 LYS H . 11 . HN 1 1 90 1 1 1 1 11 LYS H . 11 . HN 1 1 90 1 2 1 1 12 LYS H . 12 . HN 1 1 91 1 1 1 1 11 LYS HA . 11 . HA 1 1 91 1 2 1 1 24 GLU HA . 24 . HA 1 1 92 1 1 1 1 11 LYS QB . 11 . HB# 1 1 92 1 2 1 1 12 LYS H . 12 . HN 1 1 93 1 1 1 1 11 LYS QB . 11 . HB# 1 1 93 1 2 1 1 24 GLU HA . 24 . HA 1 1 94 1 1 1 1 12 LYS H . 12 . HN 1 1 94 1 2 1 1 22 CYS HB3 . 22 . HB1 1 1 95 1 1 1 1 12 LYS HB2 . 12 . HB2 1 1 95 1 2 1 1 13 ASP H . 13 . HN 1 1 96 1 1 1 1 12 LYS HB2 . 12 . HB2 1 1 96 1 2 1 1 15 ASP H . 15 . HN 1 1 97 1 1 1 1 12 LYS HB3 . 12 . HB1 1 1 97 1 2 1 1 13 ASP H . 13 . HN 1 1 98 1 1 1 1 12 LYS QD . 12 . HD# 1 1 98 1 2 1 1 15 ASP H . 15 . HN 1 1 99 1 1 1 1 12 LYS QG . 12 . HG# 1 1 99 1 2 1 1 14 SER QB . 14 . HB# 1 1 100 1 1 1 1 12 LYS QG . 12 . HG# 1 1 100 1 2 1 1 15 ASP H . 15 . HN 1 1 101 1 1 1 1 12 LYS QG . 12 . HG# 1 1 101 1 2 1 1 15 ASP HA . 15 . HA 1 1 102 1 1 1 1 12 LYS HG2 . 12 . HG2 1 1 102 1 2 1 1 15 ASP H . 15 . HN 1 1 103 1 1 1 1 12 LYS HG3 . 12 . HG1 1 1 103 1 2 1 1 15 ASP H . 15 . HN 1 1 104 1 1 1 1 13 ASP H . 13 . HN 1 1 104 1 2 1 1 14 SER H . 14 . HN 1 1 105 1 1 1 1 13 ASP H . 13 . HN 1 1 105 1 2 1 1 22 CYS HB3 . 22 . HB1 1 1 106 1 1 1 1 13 ASP HA . 13 . HA 1 1 106 1 2 1 1 16 CYS HB3 . 16 . HB1 1 1 107 1 1 1 1 13 ASP HA . 13 . HA 1 1 107 1 2 1 1 21 VAL HB . 21 . HB 1 1 108 1 1 1 1 13 ASP HA . 13 . HA 1 1 108 1 2 1 1 21 VAL MG1 . 21 . HG1# 1 1 109 1 1 1 1 13 ASP HA . 13 . HA 1 1 109 1 2 1 1 21 VAL MG2 . 21 . HG2# 1 1 110 1 1 1 1 13 ASP HA . 13 . HA 1 1 110 1 2 1 1 22 CYS H . 22 . HN 1 1 111 1 1 1 1 13 ASP HA . 13 . HA 1 1 111 1 2 1 1 22 CYS HA . 22 . HA 1 1 112 1 1 1 1 13 ASP HA . 13 . HA 1 1 112 1 2 1 1 22 CYS HB3 . 22 . HB1 1 1 113 1 1 1 1 13 ASP HB2 . 13 . HB2 1 1 113 1 2 1 1 14 SER H . 14 . HN 1 1 114 1 1 1 1 13 ASP HB2 . 13 . HB2 1 1 114 1 2 1 1 14 SER HA . 14 . HA 1 1 115 1 1 1 1 13 ASP HB2 . 13 . HB2 1 1 115 1 2 1 1 21 VAL HA . 21 . HA 1 1 116 1 1 1 1 13 ASP HB2 . 13 . HB2 1 1 116 1 2 1 1 21 VAL HB . 21 . HB 1 1 117 1 1 1 1 13 ASP HB2 . 13 . HB2 1 1 117 1 2 1 1 21 VAL MG1 . 21 . HG1# 1 1 118 1 1 1 1 13 ASP HB2 . 13 . HB2 1 1 118 1 2 1 1 22 CYS H . 22 . HN 1 1 119 1 1 1 1 13 ASP HB3 . 13 . HB1 1 1 119 1 2 1 1 14 SER H . 14 . HN 1 1 120 1 1 1 1 14 SER H . 14 . HN 1 1 120 1 2 1 1 15 ASP H . 15 . HN 1 1 121 1 1 1 1 14 SER H . 14 . HN 1 1 121 1 2 1 1 21 VAL HB . 21 . HB 1 1 122 1 1 1 1 14 SER HA . 14 . HA 1 1 122 1 2 1 1 15 ASP HA . 15 . HA 1 1 123 1 1 1 1 14 SER HA . 14 . HA 1 1 123 1 2 1 1 16 CYS H . 16 . HN 1 1 124 1 1 1 1 14 SER QB . 14 . HB# 1 1 124 1 2 1 1 15 ASP H . 15 . HN 1 1 125 1 1 1 1 15 ASP H . 15 . HN 1 1 125 1 2 1 1 22 CYS HB3 . 22 . HB1 1 1 126 1 1 1 1 16 CYS H . 16 . HN 1 1 126 1 2 1 1 20 CYS QB . 20 . HB# 1 1 127 1 1 1 1 16 CYS H . 16 . HN 1 1 127 1 2 1 1 22 CYS HB3 . 22 . HB1 1 1 128 1 1 1 1 16 CYS HB2 . 16 . HB2 1 1 128 1 2 1 1 17 LEU H . 17 . HN 1 1 129 1 1 1 1 16 CYS HB2 . 16 . HB2 1 1 129 1 2 1 1 20 CYS H . 20 . HN 1 1 130 1 1 1 1 16 CYS HB2 . 16 . HB2 1 1 130 1 2 1 1 20 CYS HA . 20 . HA 1 1 131 1 1 1 1 16 CYS HB2 . 16 . HB2 1 1 131 1 2 1 1 21 VAL H . 21 . HN 1 1 132 1 1 1 1 16 CYS HB2 . 16 . HB2 1 1 132 1 2 1 1 21 VAL HA . 21 . HA 1 1 133 1 1 1 1 16 CYS HB2 . 16 . HB2 1 1 133 1 2 1 1 22 CYS H . 22 . HN 1 1 134 1 1 1 1 16 CYS HB3 . 16 . HB1 1 1 134 1 2 1 1 21 VAL H . 21 . HN 1 1 135 1 1 1 1 16 CYS HB3 . 16 . HB1 1 1 135 1 2 1 1 21 VAL HA . 21 . HA 1 1 136 1 1 1 1 16 CYS HB3 . 16 . HB1 1 1 136 1 2 1 1 29 GLY H . 29 . HN 1 1 137 1 1 1 1 17 LEU H . 17 . HN 1 1 137 1 2 1 1 18 ALA H . 18 . HN 1 1 138 1 1 1 1 17 LEU H . 17 . HN 1 1 138 1 2 1 1 20 CYS H . 20 . HN 1 1 139 1 1 1 1 17 LEU H . 17 . HN 1 1 139 1 2 1 1 20 CYS QB . 20 . HB# 1 1 140 1 1 1 1 17 LEU HA . 17 . HA 1 1 140 1 2 1 1 18 ALA H . 18 . HN 1 1 141 1 1 1 1 17 LEU HB3 . 17 . HB1 1 1 141 1 2 1 1 18 ALA H . 18 . HN 1 1 142 1 1 1 1 17 LEU QD . 17 . HD1# 1 1 142 1 2 1 1 18 ALA H . 18 . HN 1 1 143 1 1 1 1 17 LEU QD . 17 . HD1# 1 1 143 1 2 1 1 19 GLU H . 19 . HN 1 1 144 1 1 1 1 18 ALA MB . 18 . HB# 1 1 144 1 2 1 1 20 CYS H . 20 . HN 1 1 145 1 1 1 1 20 CYS H . 20 . HN 1 1 145 1 2 1 1 21 VAL H . 21 . HN 1 1 146 1 1 1 1 20 CYS HA . 20 . HA 1 1 146 1 2 1 1 21 VAL H . 21 . HN 1 1 147 1 1 1 1 20 CYS HA . 20 . HA 1 1 147 1 2 1 1 21 VAL MG1 . 21 . HG1# 1 1 148 1 1 1 1 20 CYS HA . 20 . HA 1 1 148 1 2 1 1 21 VAL MG2 . 21 . HG2# 1 1 149 1 1 1 1 20 CYS HA . 20 . HA 1 1 149 1 2 1 1 29 GLY H . 29 . HN 1 1 150 1 1 1 1 20 CYS QB . 20 . HB# 1 1 150 1 2 1 1 21 VAL H . 21 . HN 1 1 151 1 1 1 1 20 CYS QB . 20 . HB# 1 1 151 1 2 1 1 21 VAL HA . 21 . HA 1 1 152 1 1 1 1 20 CYS QB . 20 . HB# 1 1 152 1 2 1 1 21 VAL MG1 . 21 . HG1# 1 1 153 1 1 1 1 20 CYS QB . 20 . HB# 1 1 153 1 2 1 1 21 VAL MG2 . 21 . HG2# 1 1 154 1 1 1 1 20 CYS QB . 20 . HB# 1 1 154 1 2 1 1 28 CYS HA . 28 . HA 1 1 155 1 1 1 1 20 CYS QB . 20 . HB# 1 1 155 1 2 1 1 29 GLY H . 29 . HN 1 1 156 1 1 1 1 20 CYS QB . 20 . HB# 1 1 156 1 2 1 1 29 GLY HA3 . 29 . HA1 1 1 157 1 1 1 1 21 VAL H . 21 . HN 1 1 157 1 2 1 1 28 CYS HA . 28 . HA 1 1 158 1 1 1 1 21 VAL H . 21 . HN 1 1 158 1 2 1 1 29 GLY H . 29 . HN 1 1 159 1 1 1 1 21 VAL HA . 21 . HA 1 1 159 1 2 1 1 22 CYS H . 22 . HN 1 1 160 1 1 1 1 21 VAL HA . 21 . HA 1 1 160 1 2 1 1 22 CYS HB3 . 22 . HB1 1 1 161 1 1 1 1 21 VAL HA . 21 . HA 1 1 161 1 2 1 1 29 GLY H . 29 . HN 1 1 162 1 1 1 1 21 VAL HB . 21 . HB 1 1 162 1 2 1 1 22 CYS H . 22 . HN 1 1 163 1 1 1 1 21 VAL HB . 21 . HB 1 1 163 1 2 1 1 23 LEU H . 23 . HN 1 1 164 1 1 1 1 21 VAL MG1 . 21 . HG1# 1 1 164 1 2 1 1 22 CYS H . 22 . HN 1 1 165 1 1 1 1 21 VAL MG2 . 21 . HG2# 1 1 165 1 2 1 1 22 CYS H . 22 . HN 1 1 166 1 1 1 1 21 VAL MG2 . 21 . HG2# 1 1 166 1 2 1 1 23 LEU H . 23 . HN 1 1 167 1 1 1 1 21 VAL MG2 . 21 . HG2# 1 1 167 1 2 1 1 28 CYS HA . 28 . HA 1 1 168 1 1 1 1 21 VAL MG2 . 21 . HG2# 1 1 168 1 2 1 1 29 GLY H . 29 . HN 1 1 169 1 1 1 1 22 CYS H . 22 . HN 1 1 169 1 2 1 1 23 LEU H . 23 . HN 1 1 170 1 1 1 1 22 CYS H . 22 . HN 1 1 170 1 2 1 1 23 LEU MD2 . 23 . HD2# 1 1 171 1 1 1 1 22 CYS H . 22 . HN 1 1 171 1 2 1 1 28 CYS HA . 28 . HA 1 1 172 1 1 1 1 22 CYS HA . 22 . HA 1 1 172 1 2 1 1 28 CYS HA . 28 . HA 1 1 173 1 1 1 1 22 CYS HA . 22 . HA 1 1 173 1 2 1 1 29 GLY H . 29 . HN 1 1 174 1 1 1 1 22 CYS HB3 . 22 . HB1 1 1 174 1 2 1 1 23 LEU H . 23 . HN 1 1 175 1 1 1 1 23 LEU H . 23 . HN 1 1 175 1 2 1 1 23 LEU HG . 23 . HG 1 1 176 1 1 1 1 23 LEU H . 23 . HN 1 1 176 1 2 1 1 24 GLU H . 24 . HN 1 1 177 1 1 1 1 23 LEU H . 23 . HN 1 1 177 1 2 1 1 26 GLY HA3 . 26 . HA2 1 1 178 1 1 1 1 23 LEU H . 23 . HN 1 1 178 1 2 1 1 27 TYR H . 27 . HN 1 1 179 1 1 1 1 23 LEU H . 23 . HN 1 1 179 1 2 1 1 27 TYR HA . 27 . HA 1 1 180 1 1 1 1 23 LEU H . 23 . HN 1 1 180 1 2 1 1 28 CYS H . 28 . HN 1 1 181 1 1 1 1 23 LEU H . 23 . HN 1 1 181 1 2 1 1 28 CYS HA . 28 . HA 1 1 182 1 1 1 1 23 LEU H . 23 . HN 1 1 182 1 2 1 1 29 GLY H . 29 . HN 1 1 183 1 1 1 1 23 LEU HA . 23 . HA 1 1 183 1 2 1 1 24 GLU H . 24 . HN 1 1 184 1 1 1 1 23 LEU HA . 23 . HA 1 1 184 1 2 1 1 27 TYR H . 27 . HN 1 1 185 1 1 1 1 23 LEU HB2 . 23 . HB2 1 1 185 1 2 1 1 24 GLU H . 24 . HN 1 1 186 1 1 1 1 23 LEU HB2 . 23 . HB2 1 1 186 1 2 1 1 25 HIS H . 25 . HN 1 1 187 1 1 1 1 23 LEU HB2 . 23 . HB2 1 1 187 1 2 1 1 25 HIS HE1 . 25 . HE1 1 1 188 1 1 1 1 23 LEU HB2 . 23 . HB2 1 1 188 1 2 1 1 26 GLY HA3 . 26 . HA2 1 1 189 1 1 1 1 23 LEU HB3 . 23 . HB1 1 1 189 1 2 1 1 25 HIS H . 25 . HN 1 1 190 1 1 1 1 23 LEU HB3 . 23 . HB1 1 1 190 1 2 1 1 25 HIS HE1 . 25 . HE1 1 1 191 1 1 1 1 23 LEU HB3 . 23 . HB1 1 1 191 1 2 1 1 26 GLY H . 26 . HN 1 1 192 1 1 1 1 23 LEU HB3 . 23 . HB1 1 1 192 1 2 1 1 27 TYR H . 27 . HN 1 1 193 1 1 1 1 23 LEU MD1 . 23 . HD1# 1 1 193 1 2 1 1 24 GLU H . 24 . HN 1 1 194 1 1 1 1 23 LEU MD1 . 23 . HD1# 1 1 194 1 2 1 1 25 HIS H . 25 . HN 1 1 195 1 1 1 1 23 LEU MD1 . 23 . HD1# 1 1 195 1 2 1 1 25 HIS HE1 . 25 . HE1 1 1 196 1 1 1 1 23 LEU MD1 . 23 . HD1# 1 1 196 1 2 1 1 27 TYR H . 27 . HN 1 1 197 1 1 1 1 23 LEU MD1 . 23 . HD1# 1 1 197 1 2 1 1 29 GLY H . 29 . HN 1 1 198 1 1 1 1 23 LEU MD1 . 23 . HD1# 1 1 198 1 2 1 1 29 GLY HA2 . 29 . HA2 1 1 199 1 1 1 1 23 LEU MD2 . 23 . HD2# 1 1 199 1 2 1 1 24 GLU H . 24 . HN 1 1 200 1 1 1 1 23 LEU MD2 . 23 . HD2# 1 1 200 1 2 1 1 25 HIS H . 25 . HN 1 1 201 1 1 1 1 23 LEU MD2 . 23 . HD2# 1 1 201 1 2 1 1 25 HIS HE1 . 25 . HE1 1 1 202 1 1 1 1 23 LEU MD2 . 23 . HD2# 1 1 202 1 2 1 1 27 TYR H . 27 . HN 1 1 203 1 1 1 1 23 LEU MD2 . 23 . HD2# 1 1 203 1 2 1 1 29 GLY H . 29 . HN 1 1 204 1 1 1 1 23 LEU MD2 . 23 . HD2# 1 1 204 1 2 1 1 29 GLY HA2 . 29 . HA2 1 1 205 1 1 1 1 23 LEU HG . 23 . HG 1 1 205 1 2 1 1 24 GLU H . 24 . HN 1 1 206 1 1 1 1 23 LEU HG . 23 . HG 1 1 206 1 2 1 1 25 HIS H . 25 . HN 1 1 207 1 1 1 1 23 LEU HG . 23 . HG 1 1 207 1 2 1 1 27 TYR H . 27 . HN 1 1 208 1 1 1 1 23 LEU HG . 23 . HG 1 1 208 1 2 1 1 29 GLY H . 29 . HN 1 1 209 1 1 1 1 23 LEU HG . 23 . HG 1 1 209 1 2 1 1 29 GLY HA3 . 29 . HA1 1 1 210 1 1 1 1 24 GLU H . 24 . HN 1 1 210 1 2 1 1 24 GLU HB2 . 24 . HB2 1 1 211 1 1 1 1 24 GLU H . 24 . HN 1 1 211 1 2 1 1 25 HIS H . 25 . HN 1 1 212 1 1 1 1 24 GLU H . 24 . HN 1 1 212 1 2 1 1 26 GLY H . 26 . HN 1 1 213 1 1 1 1 24 GLU QG . 24 . HG# 1 1 213 1 2 1 1 25 HIS HE1 . 25 . HE1 1 1 214 1 1 1 1 25 HIS H . 25 . HN 1 1 214 1 2 1 1 25 HIS HE1 . 25 . HE1 1 1 215 1 1 1 1 25 HIS H . 25 . HN 1 1 215 1 2 1 1 26 GLY H . 26 . HN 1 1 216 1 1 1 1 25 HIS H . 25 . HN 1 1 216 1 2 1 1 26 GLY HA3 . 26 . HA2 1 1 217 1 1 1 1 25 HIS H . 25 . HN 1 1 217 1 2 1 1 27 TYR H . 27 . HN 1 1 218 1 1 1 1 25 HIS HA . 25 . HA 1 1 218 1 2 1 1 26 GLY HA3 . 26 . HA2 1 1 219 1 1 1 1 25 HIS HA . 25 . HA 1 1 219 1 2 1 1 27 TYR H . 27 . HN 1 1 220 1 1 1 1 25 HIS HB3 . 25 . HB1 1 1 220 1 2 1 1 26 GLY H . 26 . HN 1 1 221 1 1 1 1 26 GLY H . 26 . HN 1 1 221 1 2 1 1 27 TYR H . 27 . HN 1 1 222 1 1 1 1 26 GLY H . 26 . HN 1 1 222 1 2 1 1 27 TYR HB3 . 27 . HB1 1 1 223 1 1 1 1 26 GLY HA2 . 26 . HA1 1 1 223 1 2 1 1 27 TYR H . 27 . HN 1 1 224 1 1 1 1 26 GLY HA3 . 26 . HA2 1 1 224 1 2 1 1 27 TYR H . 27 . HN 1 1 225 1 1 1 1 27 TYR H . 27 . HN 1 1 225 1 2 1 1 28 CYS H . 28 . HN 1 1 226 1 1 1 1 27 TYR HB2 . 27 . HB2 1 1 226 1 2 1 1 28 CYS H . 28 . HN 1 1 227 1 1 1 1 27 TYR HB3 . 27 . HB1 1 1 227 1 2 1 1 28 CYS H . 28 . HN 1 1 228 1 1 1 1 28 CYS H . 28 . HN 1 1 228 1 2 1 1 29 GLY H . 29 . HN 1 1 229 1 1 1 1 28 CYS HA . 28 . HA 1 1 229 1 2 1 1 29 GLY H . 29 . HN 1 1 230 1 1 1 1 28 CYS HB2 . 28 . HB2 1 1 230 1 2 1 1 29 GLY H . 29 . HN 1 1 231 1 1 1 1 28 CYS HB3 . 28 . HB1 1 1 231 1 2 1 1 29 GLY H . 29 . HN 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 . . . . . 3.3 1.8 3.7 1 1 2 1 . . . . . 5.2 1.8 6.0 1 1 3 1 . . . . . 4.5 1.8 5.0 1 1 4 1 . . . . . 4.5 1.8 5.0 1 1 5 1 . . . . . 5.2 1.8 6.0 1 1 6 1 . . . . . 5.2 1.8 6.0 1 1 7 1 . . . . . 5.2 1.8 6.0 1 1 8 1 . . . . . 3.3 1.8 3.5 1 1 9 1 . . . . . 3.3 1.8 3.5 1 1 10 1 . . . . . 4.5 1.8 5.0 1 1 11 1 . . . . . 5.2 1.8 6.0 1 1 12 1 . . . . . 4.5 1.8 5.0 1 1 13 1 . . . . . 5.2 1.8 6.0 1 1 14 1 . . . . . 4.5 1.8 5.0 1 1 15 1 . . . . . 3.3 1.8 3.7 1 1 16 1 . . . . . 5.2 1.8 6.0 1 1 17 1 . . . . . 4.5 1.8 5.0 1 1 18 1 . . . . . 4.5 1.8 5.0 1 1 19 1 . . . . . 4.5 1.8 5.0 1 1 20 1 . . . . . 4.5 1.8 5.5 1 1 21 1 . . . . . 3.3 1.8 3.7 1 1 22 1 . . . . . 4.5 1.8 5.0 1 1 23 1 . . . . . 4.5 1.8 5.0 1 1 24 1 . . . . . 4.5 1.8 5.0 1 1 25 1 . . . . . 4.5 1.8 5.5 1 1 26 1 . . . . . 4.5 1.8 5.0 1 1 27 1 . . . . . 5.2 1.8 6.0 1 1 28 1 . . . . . 4.5 1.8 5.0 1 1 29 1 . . . . . 4.5 1.8 5.0 1 1 30 1 . . . . . 4.5 1.8 5.0 1 1 31 1 . . . . . 4.5 1.8 5.0 1 1 32 1 . . . . . 3.3 1.8 3.7 1 1 33 1 . . . . . 4.5 1.8 5.0 1 1 34 1 . . . . . 4.5 1.8 5.0 1 1 35 1 . . . . . 4.5 1.8 5.0 1 1 36 1 . . . . . 3.3 1.8 3.7 1 1 37 1 . . . . . 4.5 1.8 5.0 1 1 38 1 . . . . . 5.2 1.8 6.0 1 1 39 1 . . . . . 4.5 1.8 5.0 1 1 40 1 . . . . . 4.5 1.8 5.0 1 1 41 1 . . . . . 4.5 1.8 5.0 1 1 42 1 . . . . . 4.5 1.8 5.0 1 1 43 1 . . . . . 5.2 1.8 6.0 1 1 44 1 . . . . . 5.2 1.8 6.0 1 1 45 1 . . . . . 5.2 1.8 6.0 1 1 46 1 . . . . . 4.5 1.8 5.0 1 1 47 1 . . . . . 5.2 1.8 6.5 1 1 48 1 . . . . . 4.5 1.8 5.0 1 1 49 1 . . . . . 4.5 1.8 5.0 1 1 50 1 . . . . . 4.5 1.8 5.0 1 1 51 1 . . . . . 4.5 1.8 5.0 1 1 52 1 . . . . . 4.5 1.8 5.0 1 1 53 1 . . . . . 4.5 1.8 5.0 1 1 54 1 . . . . . 4.5 1.8 5.0 1 1 55 1 . . . . . 4.5 1.8 5.0 1 1 56 1 . . . . . 4.5 1.8 5.0 1 1 57 1 . . . . . 4.5 1.8 5.0 1 1 58 1 . . . . . 4.5 1.8 5.0 1 1 59 1 . . . . . 4.5 1.8 5.0 1 1 60 1 . . . . . 4.5 1.8 5.0 1 1 61 1 . . . . . 5.2 1.8 6.0 1 1 62 1 . . . . . 4.5 1.8 5.0 1 1 63 1 . . . . . 4.5 1.8 5.0 1 1 64 1 . . . . . 4.5 1.8 5.0 1 1 65 1 . . . . . 4.5 1.8 5.0 1 1 66 1 . . . . . 5.2 1.8 6.0 1 1 67 1 . . . . . 5.2 1.8 6.0 1 1 68 1 . . . . . 4.5 1.8 5.0 1 1 69 1 . . . . . 4.5 1.8 5.0 1 1 70 1 . . . . . 5.2 1.8 6.0 1 1 71 1 . . . . . 5.2 1.8 6.0 1 1 72 1 . . . . . 4.5 1.8 5.0 1 1 73 1 . . . . . 4.5 1.8 5.0 1 1 74 1 . . . . . 3.3 1.8 3.7 1 1 75 1 . . . . . 4.5 1.8 5.0 1 1 76 1 . . . . . 3.3 1.8 3.5 1 1 77 1 . . . . . 4.5 1.8 5.0 1 1 78 1 . . . . . 4.5 1.8 5.0 1 1 79 1 . . . . . 4.5 1.8 5.0 1 1 80 1 . . . . . 4.5 1.8 5.0 1 1 81 1 . . . . . 5.2 1.8 6.0 1 1 82 1 . . . . . 4.5 1.8 5.0 1 1 83 1 . . . . . 4.5 1.8 5.0 1 1 84 1 . . . . . 4.5 1.8 5.0 1 1 85 1 . . . . . 5.2 1.8 6.0 1 1 86 1 . . . . . 3.3 1.8 3.7 1 1 87 1 . . . . . 4.5 1.8 5.0 1 1 88 1 . . . . . 5.2 1.8 6.0 1 1 89 1 . . . . . 4.5 1.8 5.0 1 1 90 1 . . . . . 3.3 1.8 3.7 1 1 91 1 . . . . . 5.2 1.8 6.0 1 1 92 1 . . . . . 4.5 1.8 5.0 1 1 93 1 . . . . . 5.2 1.8 6.0 1 1 94 1 . . . . . 4.5 1.8 5.0 1 1 95 1 . . . . . 4.5 1.8 5.0 1 1 96 1 . . . . . 4.5 1.8 5.0 1 1 97 1 . . . . . 4.5 1.8 5.0 1 1 98 1 . . . . . 4.5 1.8 5.0 1 1 99 1 . . . . . 4.5 1.8 5.0 1 1 100 1 . . . . . 4.5 1.8 5.0 1 1 101 1 . . . . . 4.5 1.8 5.0 1 1 102 1 . . . . . 4.5 1.8 5.0 1 1 103 1 . . . . . 4.5 1.8 5.0 1 1 104 1 . . . . . 4.5 1.8 5.0 1 1 105 1 . . . . . 4.5 1.8 5.0 1 1 106 1 . . . . . 4.5 1.8 5.0 1 1 107 1 . . . . . 4.5 1.8 5.0 1 1 108 1 . . . . . 4.5 1.8 5.0 1 1 109 1 . . . . . 4.5 1.8 5.0 1 1 110 1 . . . . . 4.5 1.8 5.0 1 1 111 1 . . . . . 4.5 1.8 5.0 1 1 112 1 . . . . . 3.3 1.8 3.5 1 1 113 1 . . . . . 4.5 1.8 5.0 1 1 114 1 . . . . . 4.5 1.8 5.0 1 1 115 1 . . . . . 4.5 1.8 5.0 1 1 116 1 . . . . . 3.3 1.8 3.5 1 1 117 1 . . . . . 4.5 1.8 5.0 1 1 118 1 . . . . . 5.2 1.8 6.0 1 1 119 1 . . . . . 4.5 1.8 5.0 1 1 120 1 . . . . . 4.5 1.8 5.0 1 1 121 1 . . . . . 5.2 1.8 6.0 1 1 122 1 . . . . . 5.2 1.8 6.0 1 1 123 1 . . . . . 4.5 1.8 5.0 1 1 124 1 . . . . . 4.5 1.8 5.0 1 1 125 1 . . . . . 4.5 1.8 5.0 1 1 126 1 . . . . . 5.2 1.8 6.0 1 1 127 1 . . . . . 4.5 1.8 5.0 1 1 128 1 . . . . . 3.3 1.8 3.7 1 1 129 1 . . . . . 4.5 1.8 5.0 1 1 130 1 . . . . . 5.2 1.8 6.0 1 1 131 1 . . . . . 5.2 1.8 6.0 1 1 132 1 . . . . . 4.5 1.8 5.0 1 1 133 1 . . . . . 5.2 1.8 6.0 1 1 134 1 . . . . . 4.5 1.8 5.0 1 1 135 1 . . . . . 4.5 1.8 5.0 1 1 136 1 . . . . . 5.2 1.8 6.0 1 1 137 1 . . . . . 4.5 1.8 5.0 1 1 138 1 . . . . . 4.5 1.8 5.0 1 1 139 1 . . . . . 4.5 1.8 5.0 1 1 140 1 . . . . . 3.3 1.8 3.7 1 1 141 1 . . . . . 4.5 1.8 5.0 1 1 142 1 . . . . . 5.2 1.8 6.0 1 1 143 1 . . . . . 4.5 1.8 5.0 1 1 144 1 . . . . . 4.5 1.8 5.0 1 1 145 1 . . . . . 4.5 1.8 5.0 1 1 146 1 . . . . . 3.3 1.8 3.7 1 1 147 1 . . . . . 4.5 1.8 5.0 1 1 148 1 . . . . . 4.5 1.8 5.0 1 1 149 1 . . . . . 5.2 1.8 6.0 1 1 150 1 . . . . . 3.3 1.8 3.7 1 1 151 1 . . . . . 4.5 1.8 5.0 1 1 152 1 . . . . . 4.5 1.8 5.0 1 1 153 1 . . . . . 4.5 1.8 5.0 1 1 154 1 . . . . . 4.5 1.8 5.0 1 1 155 1 . . . . . 4.5 1.8 5.0 1 1 156 1 . . . . . 5.2 1.8 6.0 1 1 157 1 . . . . . 4.5 1.8 5.0 1 1 158 1 . . . . . 4.5 1.8 5.0 1 1 159 1 . . . . . 4.5 1.8 5.0 1 1 160 1 . . . . . 5.2 1.8 6.0 1 1 161 1 . . . . . 5.2 1.8 6.0 1 1 162 1 . . . . . 4.5 1.8 5.0 1 1 163 1 . . . . . 5.2 1.8 6.0 1 1 164 1 . . . . . 4.5 1.8 5.0 1 1 165 1 . . . . . 4.5 1.8 5.0 1 1 166 1 . . . . . 4.5 1.8 5.0 1 1 167 1 . . . . . 5.2 1.8 6.0 1 1 168 1 . . . . . 4.5 1.8 5.0 1 1 169 1 . . . . . 4.5 1.8 5.0 1 1 170 1 . . . . . 4.5 1.8 5.5 1 1 171 1 . . . . . 4.5 1.8 5.0 1 1 172 1 . . . . . 4.5 1.8 5.0 1 1 173 1 . . . . . 4.5 1.8 5.0 1 1 174 1 . . . . . 5.2 1.8 6.0 1 1 175 1 . . . . . 3.3 1.8 3.7 1 1 176 1 . . . . . 5.2 1.8 6.0 1 1 177 1 . . . . . 4.5 1.8 5.0 1 1 178 1 . . . . . 4.5 1.8 5.0 1 1 179 1 . . . . . 4.5 1.8 5.0 1 1 180 1 . . . . . 5.2 1.8 6.0 1 1 181 1 . . . . . 4.5 1.8 5.0 1 1 182 1 . . . . . 4.5 1.8 5.0 1 1 183 1 . . . . . 4.5 1.8 5.0 1 1 184 1 . . . . . 4.5 1.8 5.0 1 1 185 1 . . . . . 4.5 1.8 5.0 1 1 186 1 . . . . . 4.5 1.8 5.0 1 1 187 1 . . . . . 5.2 1.8 6.0 1 1 188 1 . . . . . 4.5 1.8 5.0 1 1 189 1 . . . . . 4.5 1.8 5.0 1 1 190 1 . . . . . 5.2 1.8 6.0 1 1 191 1 . . . . . 5.2 1.8 6.0 1 1 192 1 . . . . . 4.5 1.8 5.0 1 1 193 1 . . . . . 5.2 1.8 6.0 1 1 194 1 . . . . . 4.5 1.8 5.0 1 1 195 1 . . . . . 4.5 1.8 5.0 1 1 196 1 . . . . . 4.5 1.8 5.0 1 1 197 1 . . . . . 4.5 1.8 5.0 1 1 198 1 . . . . . 4.5 1.8 5.0 1 1 199 1 . . . . . 4.5 1.8 5.0 1 1 200 1 . . . . . 5.2 1.8 6.0 1 1 201 1 . . . . . 5.2 1.8 6.0 1 1 202 1 . . . . . 5.2 1.8 6.0 1 1 203 1 . . . . . 4.5 1.8 5.0 1 1 204 1 . . . . . 4.5 1.8 5.0 1 1 205 1 . . . . . 5.2 1.8 6.0 1 1 206 1 . . . . . 5.2 1.8 6.0 1 1 207 1 . . . . . 4.5 1.8 5.0 1 1 208 1 . . . . . 4.5 1.8 5.0 1 1 209 1 . . . . . 4.5 1.8 5.0 1 1 210 1 . . . . . 3.3 1.8 3.7 1 1 211 1 . . . . . 4.5 1.8 5.0 1 1 212 1 . . . . . 5.2 1.8 6.0 1 1 213 1 . . . . . 4.5 1.8 5.0 1 1 214 1 . . . . . 4.5 1.8 5.0 1 1 215 1 . . . . . 4.5 1.8 5.0 1 1 216 1 . . . . . 4.5 1.8 5.0 1 1 217 1 . . . . . 4.5 1.8 5.0 1 1 218 1 . . . . . 4.5 1.8 5.0 1 1 219 1 . . . . . 5.2 1.8 6.0 1 1 220 1 . . . . . 4.5 1.8 5.0 1 1 221 1 . . . . . 3.3 1.8 3.7 1 1 222 1 . . . . . 5.2 1.8 6.0 1 1 223 1 . . . . . 4.5 1.8 5.0 1 1 224 1 . . . . . 4.5 1.8 5.0 1 1 225 1 . . . . . 4.5 1.8 5.0 1 1 226 1 . . . . . 4.5 1.8 5.0 1 1 227 1 . . . . . 4.5 1.8 5.0 1 1 228 1 . . . . . 4.5 1.8 5.0 1 1 229 1 . . . . . 3.3 1.8 3.7 1 1 230 1 . . . . . 4.5 1.8 5.0 1 1 231 1 . . . . . 5.2 1.8 6.0 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ARG C C -11.068 3.017 1.908 1.00 . A A . 1 ARG C 1 1 1 2 1 1 1 ARG CA C -12.092 4.031 1.404 1.00 . A A . 1 ARG CA 1 1 1 3 1 1 1 ARG CB C -11.869 4.318 -0.083 1.00 . A A . 1 ARG CB 1 1 1 4 1 1 1 ARG CD C -13.930 5.594 -0.745 1.00 . A A . 1 ARG CD 1 1 1 5 1 1 1 ARG CG C -13.149 4.300 -0.903 1.00 . A A . 1 ARG CG 1 1 1 6 1 1 1 ARG CZ C -16.301 6.268 -0.702 1.00 . A A . 1 ARG CZ 1 1 1 7 1 1 1 ARG H1 H -11.843 5.079 3.157 1.00 . A A . 1 ARG H1 1 1 1 8 1 1 1 ARG H2 H -11.189 5.844 1.767 1.00 . A A . 1 ARG H2 1 1 1 9 1 1 1 ARG H3 H -12.885 5.828 2.018 1.00 . A A . 1 ARG H3 1 1 1 10 1 1 1 ARG HA H -13.084 3.627 1.544 1.00 . A A . 1 ARG HA 1 1 1 11 1 1 1 ARG HB2 H -11.415 5.292 -0.185 1.00 . A A . 1 ARG HB2 1 1 1 12 1 1 1 ARG HB3 H -11.198 3.573 -0.487 1.00 . A A . 1 ARG HB3 1 1 1 13 1 1 1 ARG HD2 H -13.852 5.924 0.280 1.00 . A A . 1 ARG HD2 1 1 1 14 1 1 1 ARG HD3 H -13.500 6.342 -1.396 1.00 . A A . 1 ARG HD3 1 1 1 15 1 1 1 ARG HE H -15.588 4.647 -1.622 1.00 . A A . 1 ARG HE 1 1 1 16 1 1 1 ARG HG2 H -12.896 4.169 -1.944 1.00 . A A . 1 ARG HG2 1 1 1 17 1 1 1 ARG HG3 H -13.765 3.476 -0.574 1.00 . A A . 1 ARG HG3 1 1 1 18 1 1 1 ARG HH11 H -15.058 7.512 0.296 1.00 . A A . 1 ARG HH11 1 1 1 19 1 1 1 ARG HH12 H -16.730 7.963 0.311 1.00 . A A . 1 ARG HH12 1 1 1 20 1 1 1 ARG HH21 H -17.787 5.238 -1.604 1.00 . A A . 1 ARG HH21 1 1 1 21 1 1 1 ARG HH22 H -18.279 6.672 -0.766 1.00 . A A . 1 ARG HH22 1 1 1 22 1 1 1 ARG N N -11.993 5.311 2.154 1.00 . A A . 1 ARG N 1 1 1 23 1 1 1 ARG NE N -15.342 5.427 -1.084 1.00 . A A . 1 ARG NE 1 1 1 24 1 1 1 ARG NH1 N -16.005 7.335 0.029 1.00 . A A . 1 ARG NH1 1 1 1 25 1 1 1 ARG NH2 N -17.559 6.041 -1.053 1.00 . A A . 1 ARG NH2 1 1 1 26 1 1 1 ARG O O -9.940 3.375 2.244 1.00 . A A . 1 ARG O 1 1 1 27 1 1 2 VAL C C -10.010 -0.098 1.247 1.00 . A A . 2 VAL C 1 1 1 28 1 1 2 VAL CA C -10.588 0.687 2.420 1.00 . A A . 2 VAL CA 1 1 1 29 1 1 2 VAL CB C -11.324 -0.287 3.359 1.00 . A A . 2 VAL CB 1 1 1 30 1 1 2 VAL CG1 C -11.653 0.391 4.680 1.00 . A A . 2 VAL CG1 1 1 1 31 1 1 2 VAL CG2 C -12.586 -0.817 2.695 1.00 . A A . 2 VAL CG2 1 1 1 32 1 1 2 VAL H H -12.382 1.529 1.676 1.00 . A A . 2 VAL H 1 1 1 33 1 1 2 VAL HA H -9.777 1.142 2.970 1.00 . A A . 2 VAL HA 1 1 1 34 1 1 2 VAL HB H -10.672 -1.123 3.562 1.00 . A A . 2 VAL HB 1 1 1 35 1 1 2 VAL HG11 H -10.868 1.089 4.931 1.00 . A A . 2 VAL HG11 1 1 1 36 1 1 2 VAL HG12 H -12.591 0.919 4.591 1.00 . A A . 2 VAL HG12 1 1 1 37 1 1 2 VAL HG13 H -11.731 -0.355 5.458 1.00 . A A . 2 VAL HG13 1 1 1 38 1 1 2 VAL HG21 H -12.366 -1.098 1.677 1.00 . A A . 2 VAL HG21 1 1 1 39 1 1 2 VAL HG22 H -12.943 -1.679 3.238 1.00 . A A . 2 VAL HG22 1 1 1 40 1 1 2 VAL HG23 H -13.346 -0.049 2.700 1.00 . A A . 2 VAL HG23 1 1 1 41 1 1 2 VAL N N -11.471 1.752 1.957 1.00 . A A . 2 VAL N 1 1 1 42 1 1 2 VAL O O -10.716 -0.408 0.287 1.00 . A A . 2 VAL O 1 1 1 43 1 1 3 CYS C C -7.919 -2.642 0.661 1.00 . A A . 3 CYS C 1 1 1 44 1 1 3 CYS CA C -8.049 -1.168 0.278 1.00 . A A . 3 CYS CA 1 1 1 45 1 1 3 CYS CB C -6.666 -0.572 0.002 1.00 . A A . 3 CYS CB 1 1 1 46 1 1 3 CYS H H -8.214 -0.142 2.123 1.00 . A A . 3 CYS H 1 1 1 47 1 1 3 CYS HA H -8.649 -1.088 -0.615 1.00 . A A . 3 CYS HA 1 1 1 48 1 1 3 CYS HB2 H -6.255 -1.032 -0.885 1.00 . A A . 3 CYS HB2 1 1 1 49 1 1 3 CYS HB3 H -6.766 0.491 -0.165 1.00 . A A . 3 CYS HB3 1 1 1 50 1 1 3 CYS N N -8.723 -0.417 1.332 1.00 . A A . 3 CYS N 1 1 1 51 1 1 3 CYS O O -7.469 -2.965 1.760 1.00 . A A . 3 CYS O 1 1 1 52 1 1 3 CYS SG S -5.464 -0.809 1.352 1.00 . A A . 3 CYS SG 1 1 1 53 1 1 4 PRO C C -6.931 -5.415 0.683 1.00 . A A . 4 PRO C 1 1 1 54 1 1 4 PRO CA C -8.237 -5.003 0.010 1.00 . A A . 4 PRO CA 1 1 1 55 1 1 4 PRO CB C -8.322 -5.596 -1.393 1.00 . A A . 4 PRO CB 1 1 1 56 1 1 4 PRO CD C -8.861 -3.269 -1.583 1.00 . A A . 4 PRO CD 1 1 1 57 1 1 4 PRO CG C -9.170 -4.632 -2.148 1.00 . A A . 4 PRO CG 1 1 1 58 1 1 4 PRO HA H -9.071 -5.347 0.602 1.00 . A A . 4 PRO HA 1 1 1 59 1 1 4 PRO HB2 H -7.330 -5.671 -1.816 1.00 . A A . 4 PRO HB2 1 1 1 60 1 1 4 PRO HB3 H -8.776 -6.574 -1.348 1.00 . A A . 4 PRO HB3 1 1 1 61 1 1 4 PRO HD2 H -8.131 -2.764 -2.196 1.00 . A A . 4 PRO HD2 1 1 1 62 1 1 4 PRO HD3 H -9.764 -2.680 -1.509 1.00 . A A . 4 PRO HD3 1 1 1 63 1 1 4 PRO HG2 H -8.918 -4.668 -3.198 1.00 . A A . 4 PRO HG2 1 1 1 64 1 1 4 PRO HG3 H -10.213 -4.870 -2.004 1.00 . A A . 4 PRO HG3 1 1 1 65 1 1 4 PRO N N -8.313 -3.561 -0.242 1.00 . A A . 4 PRO N 1 1 1 66 1 1 4 PRO O O -5.885 -4.806 0.457 1.00 . A A . 4 PRO O 1 1 1 67 1 1 5 ARG C C -4.899 -7.695 1.255 1.00 . A A . 5 ARG C 1 1 1 68 1 1 5 ARG CA C -5.823 -6.947 2.211 1.00 . A A . 5 ARG CA 1 1 1 69 1 1 5 ARG CB C -6.237 -7.867 3.362 1.00 . A A . 5 ARG CB 1 1 1 70 1 1 5 ARG CD C -5.115 -6.852 5.368 1.00 . A A . 5 ARG CD 1 1 1 71 1 1 5 ARG CG C -5.160 -8.039 4.420 1.00 . A A . 5 ARG CG 1 1 1 72 1 1 5 ARG CZ C -4.458 -6.425 7.703 1.00 . A A . 5 ARG CZ 1 1 1 73 1 1 5 ARG H H -7.862 -6.900 1.647 1.00 . A A . 5 ARG H 1 1 1 74 1 1 5 ARG HA H -5.294 -6.096 2.613 1.00 . A A . 5 ARG HA 1 1 1 75 1 1 5 ARG HB2 H -7.115 -7.455 3.837 1.00 . A A . 5 ARG HB2 1 1 1 76 1 1 5 ARG HB3 H -6.478 -8.840 2.961 1.00 . A A . 5 ARG HB3 1 1 1 77 1 1 5 ARG HD2 H -4.334 -6.180 5.045 1.00 . A A . 5 ARG HD2 1 1 1 78 1 1 5 ARG HD3 H -6.066 -6.341 5.329 1.00 . A A . 5 ARG HD3 1 1 1 79 1 1 5 ARG HE H -4.975 -8.206 6.968 1.00 . A A . 5 ARG HE 1 1 1 80 1 1 5 ARG HG2 H -5.369 -8.933 4.989 1.00 . A A . 5 ARG HG2 1 1 1 81 1 1 5 ARG HG3 H -4.202 -8.137 3.932 1.00 . A A . 5 ARG HG3 1 1 1 82 1 1 5 ARG HH11 H -4.442 -4.787 6.516 1.00 . A A . 5 ARG HH11 1 1 1 83 1 1 5 ARG HH12 H -3.984 -4.514 8.164 1.00 . A A . 5 ARG HH12 1 1 1 84 1 1 5 ARG HH21 H -4.374 -7.848 9.135 1.00 . A A . 5 ARG HH21 1 1 1 85 1 1 5 ARG HH22 H -3.945 -6.251 9.651 1.00 . A A . 5 ARG HH22 1 1 1 86 1 1 5 ARG N N -7.000 -6.455 1.508 1.00 . A A . 5 ARG N 1 1 1 87 1 1 5 ARG NE N -4.852 -7.260 6.745 1.00 . A A . 5 ARG NE 1 1 1 88 1 1 5 ARG NH1 N -4.280 -5.136 7.439 1.00 . A A . 5 ARG NH1 1 1 1 89 1 1 5 ARG NH2 N -4.241 -6.878 8.931 1.00 . A A . 5 ARG NH2 1 1 1 90 1 1 5 ARG O O -4.895 -8.925 1.212 1.00 . A A . 5 ARG O 1 1 1 91 1 1 6 ILE C C -1.818 -6.868 -0.377 1.00 . A A . 6 ILE C 1 1 1 92 1 1 6 ILE CA C -3.191 -7.526 -0.470 1.00 . A A . 6 ILE CA 1 1 1 93 1 1 6 ILE CB C -3.716 -7.394 -1.912 1.00 . A A . 6 ILE CB 1 1 1 94 1 1 6 ILE CD1 C -5.342 -9.339 -1.689 1.00 . A A . 6 ILE CD1 1 1 1 95 1 1 6 ILE CG1 C -5.169 -7.867 -1.994 1.00 . A A . 6 ILE CG1 1 1 1 96 1 1 6 ILE CG2 C -2.839 -8.186 -2.869 1.00 . A A . 6 ILE CG2 1 1 1 97 1 1 6 ILE H H -4.173 -5.965 0.568 1.00 . A A . 6 ILE H 1 1 1 98 1 1 6 ILE HA H -3.093 -8.577 -0.239 1.00 . A A . 6 ILE HA 1 1 1 99 1 1 6 ILE HB H -3.667 -6.353 -2.195 1.00 . A A . 6 ILE HB 1 1 1 100 1 1 6 ILE HD11 H -4.373 -9.810 -1.630 1.00 . A A . 6 ILE HD11 1 1 1 101 1 1 6 ILE HD12 H -5.856 -9.452 -0.746 1.00 . A A . 6 ILE HD12 1 1 1 102 1 1 6 ILE HD13 H -5.922 -9.803 -2.473 1.00 . A A . 6 ILE HD13 1 1 1 103 1 1 6 ILE HG12 H -5.762 -7.309 -1.286 1.00 . A A . 6 ILE HG12 1 1 1 104 1 1 6 ILE HG13 H -5.543 -7.687 -2.992 1.00 . A A . 6 ILE HG13 1 1 1 105 1 1 6 ILE HG21 H -2.795 -9.217 -2.550 1.00 . A A . 6 ILE HG21 1 1 1 106 1 1 6 ILE HG22 H -3.255 -8.136 -3.865 1.00 . A A . 6 ILE HG22 1 1 1 107 1 1 6 ILE HG23 H -1.843 -7.768 -2.875 1.00 . A A . 6 ILE HG23 1 1 1 108 1 1 6 ILE N N -4.121 -6.940 0.488 1.00 . A A . 6 ILE N 1 1 1 109 1 1 6 ILE O O -1.689 -5.654 -0.535 1.00 . A A . 6 ILE O 1 1 1 110 1 1 7 LEU C C 0.981 -6.431 -1.275 1.00 . A A . 7 LEU C 1 1 1 111 1 1 7 LEU CA C 0.570 -7.178 -0.010 1.00 . A A . 7 LEU CA 1 1 1 112 1 1 7 LEU CB C 1.538 -8.333 0.250 1.00 . A A . 7 LEU CB 1 1 1 113 1 1 7 LEU CD1 C 2.191 -10.330 1.619 1.00 . A A . 7 LEU CD1 1 1 1 114 1 1 7 LEU CD2 C 1.494 -8.211 2.756 1.00 . A A . 7 LEU CD2 1 1 1 115 1 1 7 LEU CG C 1.286 -9.109 1.544 1.00 . A A . 7 LEU CG 1 1 1 116 1 1 7 LEU H H -0.964 -8.638 -0.008 1.00 . A A . 7 LEU H 1 1 1 117 1 1 7 LEU HA H 0.605 -6.494 0.825 1.00 . A A . 7 LEU HA 1 1 1 118 1 1 7 LEU HB2 H 1.472 -9.024 -0.578 1.00 . A A . 7 LEU HB2 1 1 1 119 1 1 7 LEU HB3 H 2.541 -7.935 0.286 1.00 . A A . 7 LEU HB3 1 1 1 120 1 1 7 LEU HD11 H 3.078 -10.156 1.028 1.00 . A A . 7 LEU HD11 1 1 1 121 1 1 7 LEU HD12 H 2.472 -10.507 2.646 1.00 . A A . 7 LEU HD12 1 1 1 122 1 1 7 LEU HD13 H 1.666 -11.191 1.235 1.00 . A A . 7 LEU HD13 1 1 1 123 1 1 7 LEU HD21 H 1.602 -7.187 2.432 1.00 . A A . 7 LEU HD21 1 1 1 124 1 1 7 LEU HD22 H 0.640 -8.292 3.412 1.00 . A A . 7 LEU HD22 1 1 1 125 1 1 7 LEU HD23 H 2.384 -8.519 3.284 1.00 . A A . 7 LEU HD23 1 1 1 126 1 1 7 LEU HG H 0.262 -9.455 1.554 1.00 . A A . 7 LEU HG 1 1 1 127 1 1 7 LEU N N -0.796 -7.678 -0.122 1.00 . A A . 7 LEU N 1 1 1 128 1 1 7 LEU O O 0.656 -6.850 -2.387 1.00 . A A . 7 LEU O 1 1 1 129 1 1 8 LEU C C 3.335 -3.651 -1.845 1.00 . A A . 8 LEU C 1 1 1 130 1 1 8 LEU CA C 2.149 -4.526 -2.236 1.00 . A A . 8 LEU CA 1 1 1 131 1 1 8 LEU CB C 1.003 -3.657 -2.762 1.00 . A A . 8 LEU CB 1 1 1 132 1 1 8 LEU CD1 C -0.394 -4.445 -4.693 1.00 . A A . 8 LEU CD1 1 1 1 133 1 1 8 LEU CD2 C 0.756 -2.228 -4.812 1.00 . A A . 8 LEU CD2 1 1 1 134 1 1 8 LEU CG C 0.840 -3.654 -4.285 1.00 . A A . 8 LEU CG 1 1 1 135 1 1 8 LEU H H 1.929 -5.039 -0.191 1.00 . A A . 8 LEU H 1 1 1 136 1 1 8 LEU HA H 2.460 -5.206 -3.016 1.00 . A A . 8 LEU HA 1 1 1 137 1 1 8 LEU HB2 H 0.082 -4.008 -2.321 1.00 . A A . 8 LEU HB2 1 1 1 138 1 1 8 LEU HB3 H 1.173 -2.640 -2.438 1.00 . A A . 8 LEU HB3 1 1 1 139 1 1 8 LEU HD11 H -0.530 -5.274 -4.014 1.00 . A A . 8 LEU HD11 1 1 1 140 1 1 8 LEU HD12 H -1.262 -3.803 -4.657 1.00 . A A . 8 LEU HD12 1 1 1 141 1 1 8 LEU HD13 H -0.264 -4.820 -5.698 1.00 . A A . 8 LEU HD13 1 1 1 142 1 1 8 LEU HD21 H 0.377 -1.579 -4.036 1.00 . A A . 8 LEU HD21 1 1 1 143 1 1 8 LEU HD22 H 1.740 -1.896 -5.109 1.00 . A A . 8 LEU HD22 1 1 1 144 1 1 8 LEU HD23 H 0.093 -2.197 -5.664 1.00 . A A . 8 LEU HD23 1 1 1 145 1 1 8 LEU HG H 1.702 -4.126 -4.733 1.00 . A A . 8 LEU HG 1 1 1 146 1 1 8 LEU N N 1.698 -5.326 -1.102 1.00 . A A . 8 LEU N 1 1 1 147 1 1 8 LEU O O 3.215 -2.780 -0.984 1.00 . A A . 8 LEU O 1 1 1 148 1 1 9 GLU C C 5.919 -2.052 -3.257 1.00 . A A . 9 GLU C 1 1 1 149 1 1 9 GLU CA C 5.691 -3.132 -2.203 1.00 . A A . 9 GLU CA 1 1 1 150 1 1 9 GLU CB C 6.899 -4.069 -2.151 1.00 . A A . 9 GLU CB 1 1 1 151 1 1 9 GLU CD C 8.324 -5.766 -3.362 1.00 . A A . 9 GLU CD 1 1 1 152 1 1 9 GLU CG C 7.155 -4.806 -3.456 1.00 . A A . 9 GLU CG 1 1 1 153 1 1 9 GLU H H 4.506 -4.604 -3.157 1.00 . A A . 9 GLU H 1 1 1 154 1 1 9 GLU HA H 5.572 -2.659 -1.241 1.00 . A A . 9 GLU HA 1 1 1 155 1 1 9 GLU HB2 H 7.779 -3.492 -1.910 1.00 . A A . 9 GLU HB2 1 1 1 156 1 1 9 GLU HB3 H 6.737 -4.803 -1.375 1.00 . A A . 9 GLU HB3 1 1 1 157 1 1 9 GLU HG2 H 6.269 -5.366 -3.717 1.00 . A A . 9 GLU HG2 1 1 1 158 1 1 9 GLU HG3 H 7.363 -4.081 -4.228 1.00 . A A . 9 GLU HG3 1 1 1 159 1 1 9 GLU N N 4.477 -3.893 -2.483 1.00 . A A . 9 GLU N 1 1 1 160 1 1 9 GLU O O 5.909 -2.332 -4.457 1.00 . A A . 9 GLU O 1 1 1 161 1 1 9 GLU OE1 O 9.386 -5.361 -2.845 1.00 . A A . 9 GLU OE1 1 1 1 162 1 1 9 GLU OE2 O 8.178 -6.924 -3.807 1.00 . A A . 9 GLU OE2 1 1 1 163 1 1 10 CYS C C 7.098 1.429 -3.020 1.00 . A A . 10 CYS C 1 1 1 164 1 1 10 CYS CA C 6.338 0.302 -3.714 1.00 . A A . 10 CYS CA 1 1 1 165 1 1 10 CYS CB C 5.002 0.828 -4.253 1.00 . A A . 10 CYS CB 1 1 1 166 1 1 10 CYS H H 6.107 -0.652 -1.838 1.00 . A A . 10 CYS H 1 1 1 167 1 1 10 CYS HA H 6.933 -0.058 -4.541 1.00 . A A . 10 CYS HA 1 1 1 168 1 1 10 CYS HB2 H 4.919 1.880 -4.027 1.00 . A A . 10 CYS HB2 1 1 1 169 1 1 10 CYS HB3 H 4.979 0.694 -5.325 1.00 . A A . 10 CYS HB3 1 1 1 170 1 1 10 CYS N N 6.117 -0.817 -2.804 1.00 . A A . 10 CYS N 1 1 1 171 1 1 10 CYS O O 7.228 1.443 -1.795 1.00 . A A . 10 CYS O 1 1 1 172 1 1 10 CYS SG S 3.531 -0.001 -3.562 1.00 . A A . 10 CYS SG 1 1 1 173 1 1 11 LYS C C 7.390 4.665 -2.949 1.00 . A A . 11 LYS C 1 1 1 174 1 1 11 LYS CA C 8.334 3.513 -3.277 1.00 . A A . 11 LYS CA 1 1 1 175 1 1 11 LYS CB C 9.394 3.977 -4.279 1.00 . A A . 11 LYS CB 1 1 1 176 1 1 11 LYS CD C 11.385 3.304 -5.657 1.00 . A A . 11 LYS CD 1 1 1 177 1 1 11 LYS CE C 12.634 4.112 -5.346 1.00 . A A . 11 LYS CE 1 1 1 178 1 1 11 LYS CG C 10.575 3.027 -4.401 1.00 . A A . 11 LYS CG 1 1 1 179 1 1 11 LYS H H 7.452 2.311 -4.780 1.00 . A A . 11 LYS H 1 1 1 180 1 1 11 LYS HA H 8.824 3.193 -2.370 1.00 . A A . 11 LYS HA 1 1 1 181 1 1 11 LYS HB2 H 8.935 4.073 -5.252 1.00 . A A . 11 LYS HB2 1 1 1 182 1 1 11 LYS HB3 H 9.767 4.942 -3.970 1.00 . A A . 11 LYS HB3 1 1 1 183 1 1 11 LYS HD2 H 11.677 2.364 -6.099 1.00 . A A . 11 LYS HD2 1 1 1 184 1 1 11 LYS HD3 H 10.772 3.858 -6.354 1.00 . A A . 11 LYS HD3 1 1 1 185 1 1 11 LYS HE2 H 12.912 3.940 -4.317 1.00 . A A . 11 LYS HE2 1 1 1 186 1 1 11 LYS HE3 H 13.432 3.781 -5.994 1.00 . A A . 11 LYS HE3 1 1 1 187 1 1 11 LYS HG2 H 11.212 3.149 -3.538 1.00 . A A . 11 LYS HG2 1 1 1 188 1 1 11 LYS HG3 H 10.205 2.012 -4.437 1.00 . A A . 11 LYS HG3 1 1 1 189 1 1 11 LYS HZ1 H 11.406 5.798 -5.469 1.00 . A A . 11 LYS HZ1 1 1 1 190 1 1 11 LYS HZ2 H 12.942 6.114 -4.835 1.00 . A A . 11 LYS HZ2 1 1 1 191 1 1 11 LYS HZ3 H 12.749 5.853 -6.496 1.00 . A A . 11 LYS HZ3 1 1 1 192 1 1 11 LYS N N 7.593 2.376 -3.812 1.00 . A A . 11 LYS N 1 1 1 193 1 1 11 LYS NZ N 12.417 5.571 -5.551 1.00 . A A . 11 LYS NZ 1 1 1 194 1 1 11 LYS O O 7.198 5.012 -1.784 1.00 . A A . 11 LYS O 1 1 1 195 1 1 12 LYS C C 4.520 5.844 -3.306 1.00 . A A . 12 LYS C 1 1 1 196 1 1 12 LYS CA C 5.866 6.355 -3.809 1.00 . A A . 12 LYS CA 1 1 1 197 1 1 12 LYS CB C 5.680 7.110 -5.127 1.00 . A A . 12 LYS CB 1 1 1 198 1 1 12 LYS CD C 5.297 9.457 -5.942 1.00 . A A . 12 LYS CD 1 1 1 199 1 1 12 LYS CE C 4.441 9.513 -7.196 1.00 . A A . 12 LYS CE 1 1 1 200 1 1 12 LYS CG C 4.831 8.363 -4.995 1.00 . A A . 12 LYS CG 1 1 1 201 1 1 12 LYS H H 6.987 4.923 -4.891 1.00 . A A . 12 LYS H 1 1 1 202 1 1 12 LYS HA H 6.282 7.026 -3.074 1.00 . A A . 12 LYS HA 1 1 1 203 1 1 12 LYS HB2 H 6.651 7.397 -5.504 1.00 . A A . 12 LYS HB2 1 1 1 204 1 1 12 LYS HB3 H 5.205 6.454 -5.842 1.00 . A A . 12 LYS HB3 1 1 1 205 1 1 12 LYS HD2 H 5.237 10.409 -5.435 1.00 . A A . 12 LYS HD2 1 1 1 206 1 1 12 LYS HD3 H 6.322 9.263 -6.224 1.00 . A A . 12 LYS HD3 1 1 1 207 1 1 12 LYS HE2 H 3.902 8.582 -7.291 1.00 . A A . 12 LYS HE2 1 1 1 208 1 1 12 LYS HE3 H 3.737 10.327 -7.100 1.00 . A A . 12 LYS HE3 1 1 1 209 1 1 12 LYS HG2 H 3.805 8.117 -5.224 1.00 . A A . 12 LYS HG2 1 1 1 210 1 1 12 LYS HG3 H 4.897 8.725 -3.980 1.00 . A A . 12 LYS HG3 1 1 1 211 1 1 12 LYS HZ1 H 6.169 10.168 -8.171 1.00 . A A . 12 LYS HZ1 1 1 1 212 1 1 12 LYS HZ2 H 5.452 8.811 -8.884 1.00 . A A . 12 LYS HZ2 1 1 1 213 1 1 12 LYS HZ3 H 4.758 10.341 -9.088 1.00 . A A . 12 LYS HZ3 1 1 1 214 1 1 12 LYS N N 6.797 5.248 -3.986 1.00 . A A . 12 LYS N 1 1 1 215 1 1 12 LYS NZ N 5.262 9.723 -8.420 1.00 . A A . 12 LYS NZ 1 1 1 216 1 1 12 LYS O O 3.923 4.951 -3.906 1.00 . A A . 12 LYS O 1 1 1 217 1 1 13 ASP C C 1.655 6.043 -2.633 1.00 . A A . 13 ASP C 1 1 1 218 1 1 13 ASP CA C 2.783 5.990 -1.609 1.00 . A A . 13 ASP CA 1 1 1 219 1 1 13 ASP CB C 2.434 6.853 -0.395 1.00 . A A . 13 ASP CB 1 1 1 220 1 1 13 ASP CG C 3.569 6.929 0.609 1.00 . A A . 13 ASP CG 1 1 1 221 1 1 13 ASP H H 4.577 7.103 -1.755 1.00 . A A . 13 ASP H 1 1 1 222 1 1 13 ASP HA H 2.899 4.973 -1.290 1.00 . A A . 13 ASP HA 1 1 1 223 1 1 13 ASP HB2 H 2.202 7.852 -0.723 1.00 . A A . 13 ASP HB2 1 1 1 224 1 1 13 ASP HB3 H 1.571 6.434 0.097 1.00 . A A . 13 ASP HB3 1 1 1 225 1 1 13 ASP N N 4.053 6.405 -2.196 1.00 . A A . 13 ASP N 1 1 1 226 1 1 13 ASP O O 0.748 5.211 -2.612 1.00 . A A . 13 ASP O 1 1 1 227 1 1 13 ASP OD1 O 4.649 6.368 0.330 1.00 . A A . 13 ASP OD1 1 1 1 228 1 1 13 ASP OD2 O 3.375 7.551 1.676 1.00 . A A . 13 ASP OD2 1 1 1 229 1 1 14 SER C C 0.526 5.888 -5.355 1.00 . A A . 14 SER C 1 1 1 230 1 1 14 SER CA C 0.715 7.182 -4.567 1.00 . A A . 14 SER CA 1 1 1 231 1 1 14 SER CB C 1.111 8.318 -5.514 1.00 . A A . 14 SER CB 1 1 1 232 1 1 14 SER H H 2.475 7.647 -3.490 1.00 . A A . 14 SER H 1 1 1 233 1 1 14 SER HA H -0.218 7.436 -4.087 1.00 . A A . 14 SER HA 1 1 1 234 1 1 14 SER HB2 H 1.868 8.927 -5.044 1.00 . A A . 14 SER HB2 1 1 1 235 1 1 14 SER HB3 H 1.501 7.901 -6.431 1.00 . A A . 14 SER HB3 1 1 1 236 1 1 14 SER N N 1.723 7.020 -3.527 1.00 . A A . 14 SER N 1 1 1 237 1 1 14 SER O O -0.576 5.581 -5.809 1.00 . A A . 14 SER O 1 1 1 238 1 1 14 SER OG O -0.005 9.136 -5.824 1.00 . A A . 14 SER OG 1 1 1 239 1 1 15 ASP C C 0.504 2.940 -5.736 1.00 . A A . 15 ASP C 1 1 1 240 1 1 15 ASP CA C 1.578 3.887 -6.269 1.00 . A A . 15 ASP CA 1 1 1 241 1 1 15 ASP CB C 2.945 3.203 -6.220 1.00 . A A . 15 ASP CB 1 1 1 242 1 1 15 ASP CG C 3.277 2.482 -7.512 1.00 . A A . 15 ASP CG 1 1 1 243 1 1 15 ASP H H 2.466 5.442 -5.140 1.00 . A A . 15 ASP H 1 1 1 244 1 1 15 ASP HA H 1.346 4.124 -7.296 1.00 . A A . 15 ASP HA 1 1 1 245 1 1 15 ASP HB2 H 3.707 3.947 -6.040 1.00 . A A . 15 ASP HB2 1 1 1 246 1 1 15 ASP HB3 H 2.953 2.484 -5.415 1.00 . A A . 15 ASP HB3 1 1 1 247 1 1 15 ASP N N 1.613 5.141 -5.525 1.00 . A A . 15 ASP N 1 1 1 248 1 1 15 ASP O O -0.092 2.179 -6.498 1.00 . A A . 15 ASP O 1 1 1 249 1 1 15 ASP OD1 O 2.747 2.882 -8.570 1.00 . A A . 15 ASP OD1 1 1 1 250 1 1 15 ASP OD2 O 4.068 1.515 -7.467 1.00 . A A . 15 ASP OD2 1 1 1 251 1 1 16 CYS C C -2.018 2.071 -4.571 1.00 . A A . 16 CYS C 1 1 1 252 1 1 16 CYS CA C -0.710 2.094 -3.795 1.00 . A A . 16 CYS CA 1 1 1 253 1 1 16 CYS CB C -0.978 2.513 -2.345 1.00 . A A . 16 CYS CB 1 1 1 254 1 1 16 CYS H H 0.795 3.587 -3.864 1.00 . A A . 16 CYS H 1 1 1 255 1 1 16 CYS HA H -0.298 1.096 -3.794 1.00 . A A . 16 CYS HA 1 1 1 256 1 1 16 CYS HB2 H -0.097 2.960 -1.944 1.00 . A A . 16 CYS HB2 1 1 1 257 1 1 16 CYS HB3 H -1.773 3.238 -2.326 1.00 . A A . 16 CYS HB3 1 1 1 258 1 1 16 CYS N N 0.277 2.972 -4.423 1.00 . A A . 16 CYS N 1 1 1 259 1 1 16 CYS O O -2.235 2.869 -5.483 1.00 . A A . 16 CYS O 1 1 1 260 1 1 16 CYS SG S -1.445 1.139 -1.237 1.00 . A A . 16 CYS SG 1 1 1 261 1 1 17 LEU C C -5.287 1.540 -3.947 1.00 . A A . 17 LEU C 1 1 1 262 1 1 17 LEU CA C -4.180 0.993 -4.837 1.00 . A A . 17 LEU CA 1 1 1 263 1 1 17 LEU CB C -4.447 -0.480 -5.156 1.00 . A A . 17 LEU CB 1 1 1 264 1 1 17 LEU CD1 C -5.960 -1.573 -3.483 1.00 . A A . 17 LEU CD1 1 1 1 265 1 1 17 LEU CD2 C -3.896 -2.754 -4.256 1.00 . A A . 17 LEU CD2 1 1 1 266 1 1 17 LEU CG C -4.519 -1.402 -3.939 1.00 . A A . 17 LEU CG 1 1 1 267 1 1 17 LEU H H -2.639 0.548 -3.456 1.00 . A A . 17 LEU H 1 1 1 268 1 1 17 LEU HA H -4.163 1.555 -5.758 1.00 . A A . 17 LEU HA 1 1 1 269 1 1 17 LEU HB2 H -5.384 -0.547 -5.690 1.00 . A A . 17 LEU HB2 1 1 1 270 1 1 17 LEU HB3 H -3.658 -0.834 -5.803 1.00 . A A . 17 LEU HB3 1 1 1 271 1 1 17 LEU HD11 H -6.580 -1.814 -4.334 1.00 . A A . 17 LEU HD11 1 1 1 272 1 1 17 LEU HD12 H -6.016 -2.371 -2.758 1.00 . A A . 17 LEU HD12 1 1 1 273 1 1 17 LEU HD13 H -6.306 -0.654 -3.034 1.00 . A A . 17 LEU HD13 1 1 1 274 1 1 17 LEU HD21 H -3.994 -2.957 -5.311 1.00 . A A . 17 LEU HD21 1 1 1 275 1 1 17 LEU HD22 H -2.851 -2.740 -3.987 1.00 . A A . 17 LEU HD22 1 1 1 276 1 1 17 LEU HD23 H -4.402 -3.525 -3.693 1.00 . A A . 17 LEU HD23 1 1 1 277 1 1 17 LEU HG H -3.963 -0.959 -3.126 1.00 . A A . 17 LEU HG 1 1 1 278 1 1 17 LEU N N -2.883 1.145 -4.193 1.00 . A A . 17 LEU N 1 1 1 279 1 1 17 LEU O O -5.105 1.694 -2.739 1.00 . A A . 17 LEU O 1 1 1 280 1 1 18 ALA C C -7.118 3.557 -2.932 1.00 . A A . 18 ALA C 1 1 1 281 1 1 18 ALA CA C -7.563 2.376 -3.797 1.00 . A A . 18 ALA CA 1 1 1 282 1 1 18 ALA CB C -8.191 1.278 -2.947 1.00 . A A . 18 ALA CB 1 1 1 283 1 1 18 ALA H H -6.522 1.701 -5.513 1.00 . A A . 18 ALA H 1 1 1 284 1 1 18 ALA HA H -8.302 2.719 -4.507 1.00 . A A . 18 ALA HA 1 1 1 285 1 1 18 ALA HB1 H -8.238 0.364 -3.518 1.00 . A A . 18 ALA HB1 1 1 1 286 1 1 18 ALA HB2 H -7.591 1.120 -2.063 1.00 . A A . 18 ALA HB2 1 1 1 287 1 1 18 ALA HB3 H -9.188 1.574 -2.657 1.00 . A A . 18 ALA HB3 1 1 1 288 1 1 18 ALA N N -6.434 1.840 -4.547 1.00 . A A . 18 ALA N 1 1 1 289 1 1 18 ALA O O -6.208 4.297 -3.310 1.00 . A A . 18 ALA O 1 1 1 290 1 1 19 GLU C C -6.414 4.359 0.190 1.00 . A A . 19 GLU C 1 1 1 291 1 1 19 GLU CA C -7.398 4.827 -0.882 1.00 . A A . 19 GLU CA 1 1 1 292 1 1 19 GLU CB C -8.658 5.400 -0.227 1.00 . A A . 19 GLU CB 1 1 1 293 1 1 19 GLU CD C -9.328 7.606 -1.261 1.00 . A A . 19 GLU CD 1 1 1 294 1 1 19 GLU CG C -8.642 6.915 -0.099 1.00 . A A . 19 GLU CG 1 1 1 295 1 1 19 GLU H H -8.467 3.119 -1.520 1.00 . A A . 19 GLU H 1 1 1 296 1 1 19 GLU HA H -6.928 5.599 -1.472 1.00 . A A . 19 GLU HA 1 1 1 297 1 1 19 GLU HB2 H -9.516 5.120 -0.820 1.00 . A A . 19 GLU HB2 1 1 1 298 1 1 19 GLU HB3 H -8.761 4.978 0.761 1.00 . A A . 19 GLU HB3 1 1 1 299 1 1 19 GLU HG2 H -9.149 7.192 0.814 1.00 . A A . 19 GLU HG2 1 1 1 300 1 1 19 GLU HG3 H -7.615 7.250 -0.054 1.00 . A A . 19 GLU HG3 1 1 1 301 1 1 19 GLU N N -7.751 3.734 -1.777 1.00 . A A . 19 GLU N 1 1 1 302 1 1 19 GLU O O -6.692 4.458 1.385 1.00 . A A . 19 GLU O 1 1 1 303 1 1 19 GLU OE1 O -8.648 7.883 -2.272 1.00 . A A . 19 GLU OE1 1 1 1 304 1 1 19 GLU OE2 O -10.544 7.871 -1.161 1.00 . A A . 19 GLU OE2 1 1 1 305 1 1 20 CYS C C -2.889 3.974 0.320 1.00 . A A . 20 CYS C 1 1 1 306 1 1 20 CYS CA C -4.242 3.385 0.688 1.00 . A A . 20 CYS CA 1 1 1 307 1 1 20 CYS CB C -4.177 1.857 0.683 1.00 . A A . 20 CYS CB 1 1 1 308 1 1 20 CYS H H -5.079 3.803 -1.206 1.00 . A A . 20 CYS H 1 1 1 309 1 1 20 CYS HA H -4.514 3.724 1.676 1.00 . A A . 20 CYS HA 1 1 1 310 1 1 20 CYS HB2 H -4.575 1.490 -0.252 1.00 . A A . 20 CYS HB2 1 1 1 311 1 1 20 CYS HB3 H -3.147 1.546 0.776 1.00 . A A . 20 CYS HB3 1 1 1 312 1 1 20 CYS N N -5.258 3.854 -0.241 1.00 . A A . 20 CYS N 1 1 1 313 1 1 20 CYS O O -2.797 4.834 -0.555 1.00 . A A . 20 CYS O 1 1 1 314 1 1 20 CYS SG S -5.119 1.073 2.030 1.00 . A A . 20 CYS SG 1 1 1 315 1 1 21 VAL C C 0.509 2.895 0.561 1.00 . A A . 21 VAL C 1 1 1 316 1 1 21 VAL CA C -0.503 4.024 0.716 1.00 . A A . 21 VAL CA 1 1 1 317 1 1 21 VAL CB C -0.027 4.988 1.822 1.00 . A A . 21 VAL CB 1 1 1 318 1 1 21 VAL CG1 C -1.013 6.135 1.989 1.00 . A A . 21 VAL CG1 1 1 1 319 1 1 21 VAL CG2 C 0.166 4.249 3.138 1.00 . A A . 21 VAL CG2 1 1 1 320 1 1 21 VAL H H -1.965 2.836 1.681 1.00 . A A . 21 VAL H 1 1 1 321 1 1 21 VAL HA H -0.546 4.576 -0.212 1.00 . A A . 21 VAL HA 1 1 1 322 1 1 21 VAL HB H 0.925 5.406 1.522 1.00 . A A . 21 VAL HB 1 1 1 323 1 1 21 VAL HG11 H -1.600 6.239 1.088 1.00 . A A . 21 VAL HG11 1 1 1 324 1 1 21 VAL HG12 H -1.667 5.929 2.824 1.00 . A A . 21 VAL HG12 1 1 1 325 1 1 21 VAL HG13 H -0.471 7.051 2.174 1.00 . A A . 21 VAL HG13 1 1 1 326 1 1 21 VAL HG21 H -0.642 3.546 3.278 1.00 . A A . 21 VAL HG21 1 1 1 327 1 1 21 VAL HG22 H 1.106 3.717 3.118 1.00 . A A . 21 VAL HG22 1 1 1 328 1 1 21 VAL HG23 H 0.172 4.957 3.953 1.00 . A A . 21 VAL HG23 1 1 1 329 1 1 21 VAL N N -1.839 3.519 0.990 1.00 . A A . 21 VAL N 1 1 1 330 1 1 21 VAL O O 0.297 1.776 1.027 1.00 . A A . 21 VAL O 1 1 1 331 1 1 22 CYS C C 3.809 2.489 0.693 1.00 . A A . 22 CYS C 1 1 1 332 1 1 22 CYS CA C 2.698 2.269 -0.328 1.00 . A A . 22 CYS CA 1 1 1 333 1 1 22 CYS CB C 3.250 2.434 -1.752 1.00 . A A . 22 CYS CB 1 1 1 334 1 1 22 CYS H H 1.702 4.129 -0.424 1.00 . A A . 22 CYS H 1 1 1 335 1 1 22 CYS HA H 2.303 1.271 -0.211 1.00 . A A . 22 CYS HA 1 1 1 336 1 1 22 CYS HB2 H 3.228 3.475 -2.019 1.00 . A A . 22 CYS HB2 1 1 1 337 1 1 22 CYS HB3 H 4.269 2.088 -1.785 1.00 . A A . 22 CYS HB3 1 1 1 338 1 1 22 CYS N N 1.614 3.219 -0.093 1.00 . A A . 22 CYS N 1 1 1 339 1 1 22 CYS O O 4.191 3.627 0.971 1.00 . A A . 22 CYS O 1 1 1 340 1 1 22 CYS SG S 2.315 1.528 -3.024 1.00 . A A . 22 CYS SG 1 1 1 341 1 1 23 LEU C C 6.738 1.207 1.664 1.00 . A A . 23 LEU C 1 1 1 342 1 1 23 LEU CA C 5.367 1.491 2.269 1.00 . A A . 23 LEU CA 1 1 1 343 1 1 23 LEU CB C 5.085 0.521 3.417 1.00 . A A . 23 LEU CB 1 1 1 344 1 1 23 LEU CD1 C 3.261 -0.607 4.720 1.00 . A A . 23 LEU CD1 1 1 1 345 1 1 23 LEU CD2 C 3.774 1.805 5.125 1.00 . A A . 23 LEU CD2 1 1 1 346 1 1 23 LEU CG C 3.719 0.697 4.085 1.00 . A A . 23 LEU CG 1 1 1 347 1 1 23 LEU H H 3.963 0.522 1.014 1.00 . A A . 23 LEU H 1 1 1 348 1 1 23 LEU HA H 5.364 2.498 2.657 1.00 . A A . 23 LEU HA 1 1 1 349 1 1 23 LEU HB2 H 5.150 -0.488 3.034 1.00 . A A . 23 LEU HB2 1 1 1 350 1 1 23 LEU HB3 H 5.848 0.654 4.168 1.00 . A A . 23 LEU HB3 1 1 1 351 1 1 23 LEU HD11 H 3.521 -1.432 4.073 1.00 . A A . 23 LEU HD11 1 1 1 352 1 1 23 LEU HD12 H 3.745 -0.732 5.676 1.00 . A A . 23 LEU HD12 1 1 1 353 1 1 23 LEU HD13 H 2.190 -0.584 4.859 1.00 . A A . 23 LEU HD13 1 1 1 354 1 1 23 LEU HD21 H 4.071 2.729 4.650 1.00 . A A . 23 LEU HD21 1 1 1 355 1 1 23 LEU HD22 H 2.799 1.929 5.572 1.00 . A A . 23 LEU HD22 1 1 1 356 1 1 23 LEU HD23 H 4.491 1.547 5.890 1.00 . A A . 23 LEU HD23 1 1 1 357 1 1 23 LEU HG H 2.992 0.975 3.336 1.00 . A A . 23 LEU HG 1 1 1 358 1 1 23 LEU N N 4.314 1.402 1.264 1.00 . A A . 23 LEU N 1 1 1 359 1 1 23 LEU O O 6.880 0.362 0.780 1.00 . A A . 23 LEU O 1 1 1 360 1 1 24 GLU C C 9.609 0.350 1.801 1.00 . A A . 24 GLU C 1 1 1 361 1 1 24 GLU CA C 9.111 1.786 1.665 1.00 . A A . 24 GLU CA 1 1 1 362 1 1 24 GLU CB C 10.043 2.732 2.424 1.00 . A A . 24 GLU CB 1 1 1 363 1 1 24 GLU CD C 9.823 4.047 4.571 1.00 . A A . 24 GLU CD 1 1 1 364 1 1 24 GLU CG C 9.875 2.672 3.934 1.00 . A A . 24 GLU CG 1 1 1 365 1 1 24 GLU H H 7.555 2.593 2.849 1.00 . A A . 24 GLU H 1 1 1 366 1 1 24 GLU HA H 9.119 2.057 0.621 1.00 . A A . 24 GLU HA 1 1 1 367 1 1 24 GLU HB2 H 11.066 2.479 2.187 1.00 . A A . 24 GLU HB2 1 1 1 368 1 1 24 GLU HB3 H 9.848 3.745 2.102 1.00 . A A . 24 GLU HB3 1 1 1 369 1 1 24 GLU HG2 H 8.958 2.152 4.162 1.00 . A A . 24 GLU HG2 1 1 1 370 1 1 24 GLU HG3 H 10.709 2.129 4.354 1.00 . A A . 24 GLU HG3 1 1 1 371 1 1 24 GLU N N 7.742 1.933 2.150 1.00 . A A . 24 GLU N 1 1 1 372 1 1 24 GLU O O 10.195 -0.198 0.868 1.00 . A A . 24 GLU O 1 1 1 373 1 1 24 GLU OE1 O 8.717 4.621 4.652 1.00 . A A . 24 GLU OE1 1 1 1 374 1 1 24 GLU OE2 O 10.887 4.550 4.988 1.00 . A A . 24 GLU OE2 1 1 1 375 1 1 25 HIS C C 9.227 -2.573 2.150 1.00 . A A . 25 HIS C 1 1 1 376 1 1 25 HIS CA C 9.822 -1.632 3.192 1.00 . A A . 25 HIS CA 1 1 1 377 1 1 25 HIS CB C 9.459 -2.099 4.605 1.00 . A A . 25 HIS CB 1 1 1 378 1 1 25 HIS CD2 C 6.903 -2.534 4.643 1.00 . A A . 25 HIS CD2 1 1 1 379 1 1 25 HIS CE1 C 6.324 -0.915 6.003 1.00 . A A . 25 HIS CE1 1 1 1 380 1 1 25 HIS CG C 8.030 -1.867 4.984 1.00 . A A . 25 HIS CG 1 1 1 381 1 1 25 HIS H H 8.910 0.220 3.674 1.00 . A A . 25 HIS H 1 1 1 382 1 1 25 HIS HA H 10.896 -1.646 3.088 1.00 . A A . 25 HIS HA 1 1 1 383 1 1 25 HIS HB2 H 9.652 -3.159 4.684 1.00 . A A . 25 HIS HB2 1 1 1 384 1 1 25 HIS HB3 H 10.082 -1.575 5.317 1.00 . A A . 25 HIS HB3 1 1 1 385 1 1 25 HIS HD1 H 8.223 -0.197 6.253 1.00 . A A . 25 HIS HD1 1 1 1 386 1 1 25 HIS HD2 H 6.838 -3.388 3.984 1.00 . A A . 25 HIS HD2 1 1 1 387 1 1 25 HIS HE1 H 5.738 -0.250 6.619 1.00 . A A . 25 HIS HE1 1 1 1 388 1 1 25 HIS HE2 H 4.952 -2.292 5.373 1.00 . A A . 25 HIS HE2 1 1 1 389 1 1 25 HIS N N 9.379 -0.260 2.963 1.00 . A A . 25 HIS N 1 1 1 390 1 1 25 HIS ND1 N 7.633 -0.857 5.835 1.00 . A A . 25 HIS ND1 1 1 1 391 1 1 25 HIS NE2 N 5.856 -1.924 5.291 1.00 . A A . 25 HIS NE2 1 1 1 392 1 1 25 HIS O O 9.773 -3.643 1.883 1.00 . A A . 25 HIS O 1 1 1 393 1 1 26 GLY C C 6.152 -3.548 0.963 1.00 . A A . 26 GLY C 1 1 1 394 1 1 26 GLY CA C 7.482 -2.966 0.528 1.00 . A A . 26 GLY CA 1 1 1 395 1 1 26 GLY H H 7.731 -1.290 1.792 1.00 . A A . 26 GLY H 1 1 1 396 1 1 26 GLY HA2 H 8.147 -3.776 0.264 1.00 . A A . 26 GLY HA2 1 1 1 397 1 1 26 GLY HA3 H 7.322 -2.351 -0.343 1.00 . A A . 26 GLY HA3 1 1 1 398 1 1 26 GLY N N 8.116 -2.157 1.549 1.00 . A A . 26 GLY N 1 1 1 399 1 1 26 GLY O O 6.009 -4.765 1.061 1.00 . A A . 26 GLY O 1 1 1 400 1 1 27 TYR C C 2.843 -1.967 1.556 1.00 . A A . 27 TYR C 1 1 1 401 1 1 27 TYR CA C 3.843 -3.117 1.622 1.00 . A A . 27 TYR CA 1 1 1 402 1 1 27 TYR CB C 3.882 -3.683 3.043 1.00 . A A . 27 TYR CB 1 1 1 403 1 1 27 TYR CD1 C 3.922 -6.074 2.227 1.00 . A A . 27 TYR CD1 1 1 1 404 1 1 27 TYR CD2 C 5.277 -5.499 4.103 1.00 . A A . 27 TYR CD2 1 1 1 405 1 1 27 TYR CE1 C 4.368 -7.380 2.302 1.00 . A A . 27 TYR CE1 1 1 1 406 1 1 27 TYR CE2 C 5.728 -6.802 4.183 1.00 . A A . 27 TYR CE2 1 1 1 407 1 1 27 TYR CG C 4.369 -5.112 3.125 1.00 . A A . 27 TYR CG 1 1 1 408 1 1 27 TYR CZ C 5.270 -7.739 3.280 1.00 . A A . 27 TYR CZ 1 1 1 409 1 1 27 TYR H H 5.349 -1.720 1.099 1.00 . A A . 27 TYR H 1 1 1 410 1 1 27 TYR HA H 3.524 -3.895 0.943 1.00 . A A . 27 TYR HA 1 1 1 411 1 1 27 TYR HB2 H 4.540 -3.077 3.640 1.00 . A A . 27 TYR HB2 1 1 1 412 1 1 27 TYR HB3 H 2.888 -3.645 3.464 1.00 . A A . 27 TYR HB3 1 1 1 413 1 1 27 TYR HD1 H 3.217 -5.790 1.460 1.00 . A A . 27 TYR HD1 1 1 1 414 1 1 27 TYR HD2 H 5.634 -4.762 4.807 1.00 . A A . 27 TYR HD2 1 1 1 415 1 1 27 TYR HE1 H 4.010 -8.114 1.595 1.00 . A A . 27 TYR HE1 1 1 1 416 1 1 27 TYR HE2 H 6.434 -7.083 4.951 1.00 . A A . 27 TYR HE2 1 1 1 417 1 1 27 TYR HH H 6.569 -9.111 2.923 1.00 . A A . 27 TYR HH 1 1 1 418 1 1 27 TYR N N 5.174 -2.679 1.208 1.00 . A A . 27 TYR N 1 1 1 419 1 1 27 TYR O O 3.175 -0.823 1.870 1.00 . A A . 27 TYR O 1 1 1 420 1 1 27 TYR OH O 5.717 -9.039 3.358 1.00 . A A . 27 TYR OH 1 1 1 421 1 1 28 CYS C C -0.348 -1.313 2.265 1.00 . A A . 28 CYS C 1 1 1 422 1 1 28 CYS CA C 0.565 -1.269 1.042 1.00 . A A . 28 CYS CA 1 1 1 423 1 1 28 CYS CB C -0.266 -1.488 -0.227 1.00 . A A . 28 CYS CB 1 1 1 424 1 1 28 CYS H H 1.415 -3.206 0.909 1.00 . A A . 28 CYS H 1 1 1 425 1 1 28 CYS HA H 1.037 -0.299 0.992 1.00 . A A . 28 CYS HA 1 1 1 426 1 1 28 CYS HB2 H -0.023 -2.455 -0.642 1.00 . A A . 28 CYS HB2 1 1 1 427 1 1 28 CYS HB3 H -1.316 -1.466 0.028 1.00 . A A . 28 CYS HB3 1 1 1 428 1 1 28 CYS N N 1.616 -2.277 1.146 1.00 . A A . 28 CYS N 1 1 1 429 1 1 28 CYS O O -0.976 -2.333 2.547 1.00 . A A . 28 CYS O 1 1 1 430 1 1 28 CYS SG S 0.015 -0.246 -1.530 1.00 . A A . 28 CYS SG 1 1 1 431 1 1 29 GLY C C -2.549 0.608 3.922 1.00 . A A . 29 GLY C 1 1 1 432 1 1 29 GLY CA C -1.249 -0.130 4.171 1.00 . A A . 29 GLY CA 1 1 1 433 1 1 29 GLY H H 0.112 0.583 2.714 1.00 . A A . 29 GLY H 1 1 1 434 1 1 29 GLY HA2 H -0.704 0.377 4.953 1.00 . A A . 29 GLY HA2 1 1 1 435 1 1 29 GLY HA3 H -1.475 -1.134 4.497 1.00 . A A . 29 GLY HA3 1 1 1 436 1 1 29 GLY N N -0.413 -0.198 2.988 1.00 . A A . 29 GLY N 1 1 1 437 1 1 29 GLY O O -3.599 0.144 4.413 1.00 . A A . 29 GLY O 1 1 1 438 1 1 29 GLY OXT O -2.518 1.650 3.234 1.00 . A A . 29 GLY OXT 1 1 2 439 1 1 1 ARG C C -11.356 2.921 1.054 1.00 . A A . 1 ARG C 1 1 2 440 1 1 1 ARG CA C -12.417 3.818 0.425 1.00 . A A . 1 ARG CA 1 1 2 441 1 1 1 ARG CB C -12.033 5.290 0.591 1.00 . A A . 1 ARG CB 1 1 2 442 1 1 1 ARG CD C -12.990 7.527 -0.040 1.00 . A A . 1 ARG CD 1 1 2 443 1 1 1 ARG CG C -12.511 6.177 -0.548 1.00 . A A . 1 ARG CG 1 1 2 444 1 1 1 ARG CZ C -14.620 8.165 -1.776 1.00 . A A . 1 ARG CZ 1 1 2 445 1 1 1 ARG H1 H -13.970 2.591 0.986 1.00 . A A . 1 ARG H1 1 1 2 446 1 1 1 ARG H2 H -13.678 3.908 2.048 1.00 . A A . 1 ARG H2 1 1 2 447 1 1 1 ARG H3 H -14.440 4.175 0.533 1.00 . A A . 1 ARG H3 1 1 2 448 1 1 1 ARG HA H -12.494 3.588 -0.628 1.00 . A A . 1 ARG HA 1 1 2 449 1 1 1 ARG HB2 H -12.462 5.660 1.511 1.00 . A A . 1 ARG HB2 1 1 2 450 1 1 1 ARG HB3 H -10.958 5.365 0.650 1.00 . A A . 1 ARG HB3 1 1 2 451 1 1 1 ARG HD2 H -13.790 7.369 0.668 1.00 . A A . 1 ARG HD2 1 1 2 452 1 1 1 ARG HD3 H -12.168 8.025 0.453 1.00 . A A . 1 ARG HD3 1 1 2 453 1 1 1 ARG HE H -12.928 9.148 -1.378 1.00 . A A . 1 ARG HE 1 1 2 454 1 1 1 ARG HG2 H -11.695 6.332 -1.237 1.00 . A A . 1 ARG HG2 1 1 2 455 1 1 1 ARG HG3 H -13.326 5.684 -1.057 1.00 . A A . 1 ARG HG3 1 1 2 456 1 1 1 ARG HH11 H -15.116 6.507 -0.728 1.00 . A A . 1 ARG HH11 1 1 2 457 1 1 1 ARG HH12 H -16.246 6.978 -1.954 1.00 . A A . 1 ARG HH12 1 1 2 458 1 1 1 ARG HH21 H -14.413 9.768 -2.989 1.00 . A A . 1 ARG HH21 1 1 2 459 1 1 1 ARG HH22 H -15.846 8.827 -3.238 1.00 . A A . 1 ARG HH22 1 1 2 460 1 1 1 ARG N N -13.746 3.604 1.055 1.00 . A A . 1 ARG N 1 1 2 461 1 1 1 ARG NE N -13.478 8.378 -1.123 1.00 . A A . 1 ARG NE 1 1 2 462 1 1 1 ARG NH1 N -15.389 7.132 -1.460 1.00 . A A . 1 ARG NH1 1 1 2 463 1 1 1 ARG NH2 N -14.990 8.987 -2.747 1.00 . A A . 1 ARG NH2 1 1 2 464 1 1 1 ARG O O -10.314 3.395 1.506 1.00 . A A . 1 ARG O 1 1 2 465 1 1 2 VAL C C -10.076 -0.222 0.576 1.00 . A A . 2 VAL C 1 1 2 466 1 1 2 VAL CA C -10.701 0.655 1.658 1.00 . A A . 2 VAL CA 1 1 2 467 1 1 2 VAL CB C -11.399 -0.245 2.698 1.00 . A A . 2 VAL CB 1 1 2 468 1 1 2 VAL CG1 C -12.502 -1.066 2.046 1.00 . A A . 2 VAL CG1 1 1 2 469 1 1 2 VAL CG2 C -10.389 -1.147 3.392 1.00 . A A . 2 VAL CG2 1 1 2 470 1 1 2 VAL H H -12.478 1.302 0.708 1.00 . A A . 2 VAL H 1 1 2 471 1 1 2 VAL HA H -9.917 1.205 2.159 1.00 . A A . 2 VAL HA 1 1 2 472 1 1 2 VAL HB H -11.853 0.390 3.445 1.00 . A A . 2 VAL HB 1 1 2 473 1 1 2 VAL HG11 H -12.098 -1.603 1.200 1.00 . A A . 2 VAL HG11 1 1 2 474 1 1 2 VAL HG12 H -12.898 -1.771 2.763 1.00 . A A . 2 VAL HG12 1 1 2 475 1 1 2 VAL HG13 H -13.291 -0.410 1.713 1.00 . A A . 2 VAL HG13 1 1 2 476 1 1 2 VAL HG21 H -9.646 -1.472 2.679 1.00 . A A . 2 VAL HG21 1 1 2 477 1 1 2 VAL HG22 H -9.908 -0.601 4.189 1.00 . A A . 2 VAL HG22 1 1 2 478 1 1 2 VAL HG23 H -10.897 -2.009 3.801 1.00 . A A . 2 VAL HG23 1 1 2 479 1 1 2 VAL N N -11.630 1.619 1.083 1.00 . A A . 2 VAL N 1 1 2 480 1 1 2 VAL O O -10.749 -0.636 -0.367 1.00 . A A . 2 VAL O 1 1 2 481 1 1 3 CYS C C -7.926 -2.763 0.271 1.00 . A A . 3 CYS C 1 1 2 482 1 1 3 CYS CA C -8.069 -1.330 -0.244 1.00 . A A . 3 CYS CA 1 1 2 483 1 1 3 CYS CB C -6.688 -0.738 -0.537 1.00 . A A . 3 CYS CB 1 1 2 484 1 1 3 CYS H H -8.300 -0.143 1.494 1.00 . A A . 3 CYS H 1 1 2 485 1 1 3 CYS HA H -8.645 -1.342 -1.155 1.00 . A A . 3 CYS HA 1 1 2 486 1 1 3 CYS HB2 H -6.243 -1.274 -1.362 1.00 . A A . 3 CYS HB2 1 1 2 487 1 1 3 CYS HB3 H -6.801 0.300 -0.811 1.00 . A A . 3 CYS HB3 1 1 2 488 1 1 3 CYS N N -8.784 -0.501 0.721 1.00 . A A . 3 CYS N 1 1 2 489 1 1 3 CYS O O -7.505 -2.981 1.407 1.00 . A A . 3 CYS O 1 1 2 490 1 1 3 CYS SG S -5.523 -0.819 0.863 1.00 . A A . 3 CYS SG 1 1 2 491 1 1 4 PRO C C -6.905 -5.506 0.574 1.00 . A A . 4 PRO C 1 1 2 492 1 1 4 PRO CA C -8.189 -5.177 -0.180 1.00 . A A . 4 PRO CA 1 1 2 493 1 1 4 PRO CB C -8.210 -5.889 -1.529 1.00 . A A . 4 PRO CB 1 1 2 494 1 1 4 PRO CD C -8.794 -3.597 -1.934 1.00 . A A . 4 PRO CD 1 1 2 495 1 1 4 PRO CG C -9.040 -5.010 -2.400 1.00 . A A . 4 PRO CG 1 1 2 496 1 1 4 PRO HA H -9.041 -5.485 0.408 1.00 . A A . 4 PRO HA 1 1 2 497 1 1 4 PRO HB2 H -7.202 -5.984 -1.906 1.00 . A A . 4 PRO HB2 1 1 2 498 1 1 4 PRO HB3 H -8.653 -6.867 -1.417 1.00 . A A . 4 PRO HB3 1 1 2 499 1 1 4 PRO HD2 H -8.059 -3.117 -2.563 1.00 . A A . 4 PRO HD2 1 1 2 500 1 1 4 PRO HD3 H -9.716 -3.036 -1.934 1.00 . A A . 4 PRO HD3 1 1 2 501 1 1 4 PRO HG2 H -8.735 -5.123 -3.431 1.00 . A A . 4 PRO HG2 1 1 2 502 1 1 4 PRO HG3 H -10.084 -5.264 -2.289 1.00 . A A . 4 PRO HG3 1 1 2 503 1 1 4 PRO N N -8.279 -3.763 -0.559 1.00 . A A . 4 PRO N 1 1 2 504 1 1 4 PRO O O -5.863 -4.890 0.345 1.00 . A A . 4 PRO O 1 1 2 505 1 1 5 ARG C C -4.869 -7.718 1.403 1.00 . A A . 5 ARG C 1 1 2 506 1 1 5 ARG CA C -5.828 -6.894 2.255 1.00 . A A . 5 ARG CA 1 1 2 507 1 1 5 ARG CB C -6.272 -7.706 3.473 1.00 . A A . 5 ARG CB 1 1 2 508 1 1 5 ARG CD C -6.863 -10.126 3.817 1.00 . A A . 5 ARG CD 1 1 2 509 1 1 5 ARG CG C -7.249 -8.823 3.137 1.00 . A A . 5 ARG CG 1 1 2 510 1 1 5 ARG CZ C -8.987 -11.337 4.129 1.00 . A A . 5 ARG CZ 1 1 2 511 1 1 5 ARG H H -7.843 -6.937 1.608 1.00 . A A . 5 ARG H 1 1 2 512 1 1 5 ARG HA H -5.320 -6.003 2.591 1.00 . A A . 5 ARG HA 1 1 2 513 1 1 5 ARG HB2 H -5.401 -8.145 3.935 1.00 . A A . 5 ARG HB2 1 1 2 514 1 1 5 ARG HB3 H -6.748 -7.042 4.179 1.00 . A A . 5 ARG HB3 1 1 2 515 1 1 5 ARG HD2 H -5.883 -10.421 3.473 1.00 . A A . 5 ARG HD2 1 1 2 516 1 1 5 ARG HD3 H -6.835 -9.967 4.885 1.00 . A A . 5 ARG HD3 1 1 2 517 1 1 5 ARG HE H -7.557 -11.851 2.835 1.00 . A A . 5 ARG HE 1 1 2 518 1 1 5 ARG HG2 H -8.235 -8.536 3.467 1.00 . A A . 5 ARG HG2 1 1 2 519 1 1 5 ARG HG3 H -7.255 -8.972 2.067 1.00 . A A . 5 ARG HG3 1 1 2 520 1 1 5 ARG HH11 H -8.767 -9.714 5.316 1.00 . A A . 5 ARG HH11 1 1 2 521 1 1 5 ARG HH12 H -10.250 -10.583 5.515 1.00 . A A . 5 ARG HH12 1 1 2 522 1 1 5 ARG HH21 H -9.507 -12.995 3.098 1.00 . A A . 5 ARG HH21 1 1 2 523 1 1 5 ARG HH22 H -10.671 -12.446 4.257 1.00 . A A . 5 ARG HH22 1 1 2 524 1 1 5 ARG N N -6.986 -6.483 1.471 1.00 . A A . 5 ARG N 1 1 2 525 1 1 5 ARG NE N -7.810 -11.199 3.522 1.00 . A A . 5 ARG NE 1 1 2 526 1 1 5 ARG NH1 N -9.365 -10.474 5.064 1.00 . A A . 5 ARG NH1 1 1 2 527 1 1 5 ARG NH2 N -9.787 -12.342 3.801 1.00 . A A . 5 ARG NH2 1 1 2 528 1 1 5 ARG O O -4.856 -8.946 1.474 1.00 . A A . 5 ARG O 1 1 2 529 1 1 6 ILE C C -1.747 -7.008 -0.217 1.00 . A A . 6 ILE C 1 1 2 530 1 1 6 ILE CA C -3.107 -7.696 -0.274 1.00 . A A . 6 ILE CA 1 1 2 531 1 1 6 ILE CB C -3.597 -7.721 -1.734 1.00 . A A . 6 ILE CB 1 1 2 532 1 1 6 ILE CD1 C -5.723 -7.931 -3.119 1.00 . A A . 6 ILE CD1 1 1 2 533 1 1 6 ILE CG1 C -5.037 -8.230 -1.803 1.00 . A A . 6 ILE CG1 1 1 2 534 1 1 6 ILE CG2 C -2.681 -8.589 -2.585 1.00 . A A . 6 ILE CG2 1 1 2 535 1 1 6 ILE H H -4.129 -6.053 0.582 1.00 . A A . 6 ILE H 1 1 2 536 1 1 6 ILE HA H -2.999 -8.716 0.066 1.00 . A A . 6 ILE HA 1 1 2 537 1 1 6 ILE HB H -3.558 -6.715 -2.122 1.00 . A A . 6 ILE HB 1 1 2 538 1 1 6 ILE HD11 H -5.621 -6.879 -3.347 1.00 . A A . 6 ILE HD11 1 1 2 539 1 1 6 ILE HD12 H -5.267 -8.516 -3.904 1.00 . A A . 6 ILE HD12 1 1 2 540 1 1 6 ILE HD13 H -6.771 -8.183 -3.044 1.00 . A A . 6 ILE HD13 1 1 2 541 1 1 6 ILE HG12 H -5.042 -9.299 -1.663 1.00 . A A . 6 ILE HG12 1 1 2 542 1 1 6 ILE HG13 H -5.613 -7.765 -1.015 1.00 . A A . 6 ILE HG13 1 1 2 543 1 1 6 ILE HG21 H -1.682 -8.567 -2.177 1.00 . A A . 6 ILE HG21 1 1 2 544 1 1 6 ILE HG22 H -3.047 -9.605 -2.586 1.00 . A A . 6 ILE HG22 1 1 2 545 1 1 6 ILE HG23 H -2.665 -8.211 -3.597 1.00 . A A . 6 ILE HG23 1 1 2 546 1 1 6 ILE N N -4.069 -7.030 0.595 1.00 . A A . 6 ILE N 1 1 2 547 1 1 6 ILE O O -1.650 -5.788 -0.350 1.00 . A A . 6 ILE O 1 1 2 548 1 1 7 LEU C C 1.005 -6.488 -1.206 1.00 . A A . 7 LEU C 1 1 2 549 1 1 7 LEU CA C 0.659 -7.273 0.055 1.00 . A A . 7 LEU CA 1 1 2 550 1 1 7 LEU CB C 1.659 -8.413 0.249 1.00 . A A . 7 LEU CB 1 1 2 551 1 1 7 LEU CD1 C 2.500 -10.348 1.603 1.00 . A A . 7 LEU CD1 1 1 2 552 1 1 7 LEU CD2 C 1.526 -8.350 2.755 1.00 . A A . 7 LEU CD2 1 1 2 553 1 1 7 LEU CG C 1.460 -9.240 1.521 1.00 . A A . 7 LEU CG 1 1 2 554 1 1 7 LEU H H -0.842 -8.766 0.079 1.00 . A A . 7 LEU H 1 1 2 555 1 1 7 LEU HA H 0.711 -6.610 0.904 1.00 . A A . 7 LEU HA 1 1 2 556 1 1 7 LEU HB2 H 1.586 -9.075 -0.602 1.00 . A A . 7 LEU HB2 1 1 2 557 1 1 7 LEU HB3 H 2.652 -7.992 0.272 1.00 . A A . 7 LEU HB3 1 1 2 558 1 1 7 LEU HD11 H 3.423 -10.007 1.157 1.00 . A A . 7 LEU HD11 1 1 2 559 1 1 7 LEU HD12 H 2.673 -10.604 2.637 1.00 . A A . 7 LEU HD12 1 1 2 560 1 1 7 LEU HD13 H 2.143 -11.217 1.070 1.00 . A A . 7 LEU HD13 1 1 2 561 1 1 7 LEU HD21 H 1.710 -7.329 2.454 1.00 . A A . 7 LEU HD21 1 1 2 562 1 1 7 LEU HD22 H 0.587 -8.405 3.288 1.00 . A A . 7 LEU HD22 1 1 2 563 1 1 7 LEU HD23 H 2.325 -8.684 3.400 1.00 . A A . 7 LEU HD23 1 1 2 564 1 1 7 LEU HG H 0.484 -9.703 1.492 1.00 . A A . 7 LEU HG 1 1 2 565 1 1 7 LEU N N -0.699 -7.801 -0.019 1.00 . A A . 7 LEU N 1 1 2 566 1 1 7 LEU O O 0.647 -6.886 -2.314 1.00 . A A . 7 LEU O 1 1 2 567 1 1 8 LEU C C 3.285 -3.652 -1.800 1.00 . A A . 8 LEU C 1 1 2 568 1 1 8 LEU CA C 2.096 -4.534 -2.162 1.00 . A A . 8 LEU CA 1 1 2 569 1 1 8 LEU CB C 0.918 -3.668 -2.615 1.00 . A A . 8 LEU CB 1 1 2 570 1 1 8 LEU CD1 C -0.402 -4.379 -4.628 1.00 . A A . 8 LEU CD1 1 1 2 571 1 1 8 LEU CD2 C 0.564 -2.074 -4.522 1.00 . A A . 8 LEU CD2 1 1 2 572 1 1 8 LEU CG C 0.760 -3.532 -4.132 1.00 . A A . 8 LEU CG 1 1 2 573 1 1 8 LEU H H 1.964 -5.101 -0.123 1.00 . A A . 8 LEU H 1 1 2 574 1 1 8 LEU HA H 2.382 -5.189 -2.971 1.00 . A A . 8 LEU HA 1 1 2 575 1 1 8 LEU HB2 H 0.009 -4.096 -2.214 1.00 . A A . 8 LEU HB2 1 1 2 576 1 1 8 LEU HB3 H 1.044 -2.680 -2.198 1.00 . A A . 8 LEU HB3 1 1 2 577 1 1 8 LEU HD11 H -0.619 -5.152 -3.905 1.00 . A A . 8 LEU HD11 1 1 2 578 1 1 8 LEU HD12 H -1.273 -3.754 -4.759 1.00 . A A . 8 LEU HD12 1 1 2 579 1 1 8 LEU HD13 H -0.140 -4.833 -5.572 1.00 . A A . 8 LEU HD13 1 1 2 580 1 1 8 LEU HD21 H -0.092 -1.597 -3.809 1.00 . A A . 8 LEU HD21 1 1 2 581 1 1 8 LEU HD22 H 1.519 -1.571 -4.527 1.00 . A A . 8 LEU HD22 1 1 2 582 1 1 8 LEU HD23 H 0.123 -2.021 -5.507 1.00 . A A . 8 LEU HD23 1 1 2 583 1 1 8 LEU HG H 1.660 -3.889 -4.613 1.00 . A A . 8 LEU HG 1 1 2 584 1 1 8 LEU N N 1.704 -5.370 -1.032 1.00 . A A . 8 LEU N 1 1 2 585 1 1 8 LEU O O 3.175 -2.768 -0.952 1.00 . A A . 8 LEU O 1 1 2 586 1 1 9 GLU C C 5.848 -2.075 -3.270 1.00 . A A . 9 GLU C 1 1 2 587 1 1 9 GLU CA C 5.636 -3.137 -2.196 1.00 . A A . 9 GLU CA 1 1 2 588 1 1 9 GLU CB C 6.846 -4.071 -2.143 1.00 . A A . 9 GLU CB 1 1 2 589 1 1 9 GLU CD C 7.092 -6.331 -3.248 1.00 . A A . 9 GLU CD 1 1 2 590 1 1 9 GLU CG C 7.087 -4.827 -3.440 1.00 . A A . 9 GLU CG 1 1 2 591 1 1 9 GLU H H 4.440 -4.625 -3.111 1.00 . A A . 9 GLU H 1 1 2 592 1 1 9 GLU HA H 5.527 -2.648 -1.240 1.00 . A A . 9 GLU HA 1 1 2 593 1 1 9 GLU HB2 H 7.727 -3.488 -1.922 1.00 . A A . 9 GLU HB2 1 1 2 594 1 1 9 GLU HB3 H 6.695 -4.792 -1.353 1.00 . A A . 9 GLU HB3 1 1 2 595 1 1 9 GLU HG2 H 6.307 -4.572 -4.141 1.00 . A A . 9 GLU HG2 1 1 2 596 1 1 9 GLU HG3 H 8.043 -4.527 -3.842 1.00 . A A . 9 GLU HG3 1 1 2 597 1 1 9 GLU N N 4.420 -3.904 -2.448 1.00 . A A . 9 GLU N 1 1 2 598 1 1 9 GLU O O 5.806 -2.371 -4.464 1.00 . A A . 9 GLU O 1 1 2 599 1 1 9 GLU OE1 O 8.150 -6.879 -2.873 1.00 . A A . 9 GLU OE1 1 1 2 600 1 1 9 GLU OE2 O 6.037 -6.962 -3.474 1.00 . A A . 9 GLU OE2 1 1 2 601 1 1 10 CYS C C 7.081 1.392 -3.114 1.00 . A A . 10 CYS C 1 1 2 602 1 1 10 CYS CA C 6.281 0.267 -3.770 1.00 . A A . 10 CYS CA 1 1 2 603 1 1 10 CYS CB C 4.938 0.809 -4.277 1.00 . A A . 10 CYS CB 1 1 2 604 1 1 10 CYS H H 6.085 -0.659 -1.874 1.00 . A A . 10 CYS H 1 1 2 605 1 1 10 CYS HA H 6.844 -0.113 -4.610 1.00 . A A . 10 CYS HA 1 1 2 606 1 1 10 CYS HB2 H 4.873 1.863 -4.052 1.00 . A A . 10 CYS HB2 1 1 2 607 1 1 10 CYS HB3 H 4.886 0.672 -5.347 1.00 . A A . 10 CYS HB3 1 1 2 608 1 1 10 CYS N N 6.070 -0.836 -2.839 1.00 . A A . 10 CYS N 1 1 2 609 1 1 10 CYS O O 7.260 1.411 -1.897 1.00 . A A . 10 CYS O 1 1 2 610 1 1 10 CYS SG S 3.476 0.000 -3.544 1.00 . A A . 10 CYS SG 1 1 2 611 1 1 11 LYS C C 7.415 4.617 -3.057 1.00 . A A . 11 LYS C 1 1 2 612 1 1 11 LYS CA C 8.331 3.456 -3.435 1.00 . A A . 11 LYS CA 1 1 2 613 1 1 11 LYS CB C 9.342 3.912 -4.489 1.00 . A A . 11 LYS CB 1 1 2 614 1 1 11 LYS CD C 11.361 3.942 -2.992 1.00 . A A . 11 LYS CD 1 1 2 615 1 1 11 LYS CE C 12.829 4.290 -3.175 1.00 . A A . 11 LYS CE 1 1 2 616 1 1 11 LYS CG C 10.475 4.754 -3.924 1.00 . A A . 11 LYS CG 1 1 2 617 1 1 11 LYS H H 7.376 2.257 -4.893 1.00 . A A . 11 LYS H 1 1 2 618 1 1 11 LYS HA H 8.864 3.132 -2.554 1.00 . A A . 11 LYS HA 1 1 2 619 1 1 11 LYS HB2 H 9.771 3.040 -4.961 1.00 . A A . 11 LYS HB2 1 1 2 620 1 1 11 LYS HB3 H 8.827 4.497 -5.237 1.00 . A A . 11 LYS HB3 1 1 2 621 1 1 11 LYS HD2 H 11.076 4.147 -1.971 1.00 . A A . 11 LYS HD2 1 1 2 622 1 1 11 LYS HD3 H 11.220 2.891 -3.203 1.00 . A A . 11 LYS HD3 1 1 2 623 1 1 11 LYS HE2 H 13.427 3.555 -2.656 1.00 . A A . 11 LYS HE2 1 1 2 624 1 1 11 LYS HE3 H 13.063 4.265 -4.229 1.00 . A A . 11 LYS HE3 1 1 2 625 1 1 11 LYS HG2 H 11.075 5.127 -4.739 1.00 . A A . 11 LYS HG2 1 1 2 626 1 1 11 LYS HG3 H 10.054 5.583 -3.374 1.00 . A A . 11 LYS HG3 1 1 2 627 1 1 11 LYS HZ1 H 12.438 6.330 -2.951 1.00 . A A . 11 LYS HZ1 1 1 2 628 1 1 11 LYS HZ2 H 13.162 5.619 -1.598 1.00 . A A . 11 LYS HZ2 1 1 2 629 1 1 11 LYS HZ3 H 14.085 5.948 -2.978 1.00 . A A . 11 LYS HZ3 1 1 2 630 1 1 11 LYS N N 7.555 2.327 -3.933 1.00 . A A . 11 LYS N 1 1 2 631 1 1 11 LYS NZ N 13.151 5.641 -2.638 1.00 . A A . 11 LYS NZ 1 1 2 632 1 1 11 LYS O O 7.295 4.968 -1.883 1.00 . A A . 11 LYS O 1 1 2 633 1 1 12 LYS C C 4.514 5.812 -3.313 1.00 . A A . 12 LYS C 1 1 2 634 1 1 12 LYS CA C 5.855 6.318 -3.829 1.00 . A A . 12 LYS CA 1 1 2 635 1 1 12 LYS CB C 5.654 7.115 -5.120 1.00 . A A . 12 LYS CB 1 1 2 636 1 1 12 LYS CD C 5.046 9.399 -5.971 1.00 . A A . 12 LYS CD 1 1 2 637 1 1 12 LYS CE C 4.669 10.775 -5.444 1.00 . A A . 12 LYS CE 1 1 2 638 1 1 12 LYS CG C 4.730 8.311 -4.958 1.00 . A A . 12 LYS CG 1 1 2 639 1 1 12 LYS H H 6.899 4.874 -4.972 1.00 . A A . 12 LYS H 1 1 2 640 1 1 12 LYS HA H 6.298 6.961 -3.083 1.00 . A A . 12 LYS HA 1 1 2 641 1 1 12 LYS HB2 H 6.614 7.471 -5.462 1.00 . A A . 12 LYS HB2 1 1 2 642 1 1 12 LYS HB3 H 5.234 6.461 -5.870 1.00 . A A . 12 LYS HB3 1 1 2 643 1 1 12 LYS HD2 H 6.104 9.383 -6.183 1.00 . A A . 12 LYS HD2 1 1 2 644 1 1 12 LYS HD3 H 4.490 9.206 -6.877 1.00 . A A . 12 LYS HD3 1 1 2 645 1 1 12 LYS HE2 H 4.545 11.445 -6.282 1.00 . A A . 12 LYS HE2 1 1 2 646 1 1 12 LYS HE3 H 3.737 10.698 -4.905 1.00 . A A . 12 LYS HE3 1 1 2 647 1 1 12 LYS HG2 H 3.710 7.987 -5.097 1.00 . A A . 12 LYS HG2 1 1 2 648 1 1 12 LYS HG3 H 4.849 8.712 -3.961 1.00 . A A . 12 LYS HG3 1 1 2 649 1 1 12 LYS HZ1 H 6.639 11.313 -5.005 1.00 . A A . 12 LYS HZ1 1 1 2 650 1 1 12 LYS HZ2 H 5.480 12.306 -4.278 1.00 . A A . 12 LYS HZ2 1 1 2 651 1 1 12 LYS HZ3 H 5.768 10.755 -3.668 1.00 . A A . 12 LYS HZ3 1 1 2 652 1 1 12 LYS N N 6.766 5.203 -4.058 1.00 . A A . 12 LYS N 1 1 2 653 1 1 12 LYS NZ N 5.712 11.326 -4.535 1.00 . A A . 12 LYS NZ 1 1 2 654 1 1 12 LYS O O 3.914 4.910 -3.897 1.00 . A A . 12 LYS O 1 1 2 655 1 1 13 ASP C C 1.649 6.035 -2.625 1.00 . A A . 13 ASP C 1 1 2 656 1 1 13 ASP CA C 2.784 5.982 -1.612 1.00 . A A . 13 ASP CA 1 1 2 657 1 1 13 ASP CB C 2.450 6.851 -0.398 1.00 . A A . 13 ASP CB 1 1 2 658 1 1 13 ASP CG C 3.594 6.922 0.595 1.00 . A A . 13 ASP CG 1 1 2 659 1 1 13 ASP H H 4.577 7.094 -1.780 1.00 . A A . 13 ASP H 1 1 2 660 1 1 13 ASP HA H 2.898 4.966 -1.289 1.00 . A A . 13 ASP HA 1 1 2 661 1 1 13 ASP HB2 H 2.220 7.849 -0.726 1.00 . A A . 13 ASP HB2 1 1 2 662 1 1 13 ASP HB3 H 1.589 6.437 0.104 1.00 . A A . 13 ASP HB3 1 1 2 663 1 1 13 ASP N N 4.050 6.389 -2.208 1.00 . A A . 13 ASP N 1 1 2 664 1 1 13 ASP O O 0.739 5.204 -2.594 1.00 . A A . 13 ASP O 1 1 2 665 1 1 13 ASP OD1 O 4.734 7.200 0.168 1.00 . A A . 13 ASP OD1 1 1 2 666 1 1 13 ASP OD2 O 3.349 6.700 1.799 1.00 . A A . 13 ASP OD2 1 1 2 667 1 1 14 SER C C 0.491 5.867 -5.329 1.00 . A A . 14 SER C 1 1 2 668 1 1 14 SER CA C 0.693 7.168 -4.556 1.00 . A A . 14 SER CA 1 1 2 669 1 1 14 SER CB C 1.085 8.291 -5.518 1.00 . A A . 14 SER CB 1 1 2 670 1 1 14 SER H H 2.464 7.634 -3.497 1.00 . A A . 14 SER H 1 1 2 671 1 1 14 SER HA H -0.234 7.430 -4.069 1.00 . A A . 14 SER HA 1 1 2 672 1 1 14 SER HB2 H 1.738 7.895 -6.283 1.00 . A A . 14 SER HB2 1 1 2 673 1 1 14 SER HB3 H 0.194 8.694 -5.978 1.00 . A A . 14 SER HB3 1 1 2 674 1 1 14 SER N N 1.710 7.008 -3.524 1.00 . A A . 14 SER N 1 1 2 675 1 1 14 SER O O -0.616 5.558 -5.769 1.00 . A A . 14 SER O 1 1 2 676 1 1 14 SER OG O 1.759 9.334 -4.836 1.00 . A A . 14 SER OG 1 1 2 677 1 1 15 ASP C C 0.453 2.919 -5.684 1.00 . A A . 15 ASP C 1 1 2 678 1 1 15 ASP CA C 1.532 3.853 -6.230 1.00 . A A . 15 ASP CA 1 1 2 679 1 1 15 ASP CB C 2.896 3.164 -6.174 1.00 . A A . 15 ASP CB 1 1 2 680 1 1 15 ASP CG C 3.312 2.593 -7.515 1.00 . A A . 15 ASP CG 1 1 2 681 1 1 15 ASP H H 2.431 5.416 -5.127 1.00 . A A . 15 ASP H 1 1 2 682 1 1 15 ASP HA H 1.301 4.079 -7.261 1.00 . A A . 15 ASP HA 1 1 2 683 1 1 15 ASP HB2 H 3.642 3.880 -5.864 1.00 . A A . 15 ASP HB2 1 1 2 684 1 1 15 ASP HB3 H 2.858 2.358 -5.457 1.00 . A A . 15 ASP HB3 1 1 2 685 1 1 15 ASP N N 1.575 5.114 -5.501 1.00 . A A . 15 ASP N 1 1 2 686 1 1 15 ASP O O -0.150 2.152 -6.436 1.00 . A A . 15 ASP O 1 1 2 687 1 1 15 ASP OD1 O 2.871 3.132 -8.553 1.00 . A A . 15 ASP OD1 1 1 2 688 1 1 15 ASP OD2 O 4.077 1.607 -7.530 1.00 . A A . 15 ASP OD2 1 1 2 689 1 1 16 CYS C C -2.074 2.093 -4.499 1.00 . A A . 16 CYS C 1 1 2 690 1 1 16 CYS CA C -0.760 2.104 -3.731 1.00 . A A . 16 CYS CA 1 1 2 691 1 1 16 CYS CB C -1.011 2.533 -2.282 1.00 . A A . 16 CYS CB 1 1 2 692 1 1 16 CYS H H 0.755 3.586 -3.821 1.00 . A A . 16 CYS H 1 1 2 693 1 1 16 CYS HA H -0.360 1.101 -3.728 1.00 . A A . 16 CYS HA 1 1 2 694 1 1 16 CYS HB2 H -0.125 2.982 -1.894 1.00 . A A . 16 CYS HB2 1 1 2 695 1 1 16 CYS HB3 H -1.804 3.262 -2.260 1.00 . A A . 16 CYS HB3 1 1 2 696 1 1 16 CYS N N 0.230 2.967 -4.372 1.00 . A A . 16 CYS N 1 1 2 697 1 1 16 CYS O O -2.281 2.878 -5.424 1.00 . A A . 16 CYS O 1 1 2 698 1 1 16 CYS SG S -1.470 1.169 -1.159 1.00 . A A . 16 CYS SG 1 1 2 699 1 1 17 LEU C C -5.347 1.653 -3.856 1.00 . A A . 17 LEU C 1 1 2 700 1 1 17 LEU CA C -4.259 1.053 -4.734 1.00 . A A . 17 LEU CA 1 1 2 701 1 1 17 LEU CB C -4.563 -0.421 -5.010 1.00 . A A . 17 LEU CB 1 1 2 702 1 1 17 LEU CD1 C -6.079 -2.017 -3.802 1.00 . A A . 17 LEU CD1 1 1 2 703 1 1 17 LEU CD2 C -3.598 -2.282 -3.629 1.00 . A A . 17 LEU CD2 1 1 2 704 1 1 17 LEU CG C -4.744 -1.289 -3.761 1.00 . A A . 17 LEU CG 1 1 2 705 1 1 17 LEU H H -2.719 0.600 -3.354 1.00 . A A . 17 LEU H 1 1 2 706 1 1 17 LEU HA H -4.230 1.588 -5.671 1.00 . A A . 17 LEU HA 1 1 2 707 1 1 17 LEU HB2 H -5.469 -0.474 -5.598 1.00 . A A . 17 LEU HB2 1 1 2 708 1 1 17 LEU HB3 H -3.752 -0.831 -5.594 1.00 . A A . 17 LEU HB3 1 1 2 709 1 1 17 LEU HD11 H -6.149 -2.590 -4.715 1.00 . A A . 17 LEU HD11 1 1 2 710 1 1 17 LEU HD12 H -6.153 -2.682 -2.954 1.00 . A A . 17 LEU HD12 1 1 2 711 1 1 17 LEU HD13 H -6.883 -1.297 -3.766 1.00 . A A . 17 LEU HD13 1 1 2 712 1 1 17 LEU HD21 H -2.659 -1.769 -3.774 1.00 . A A . 17 LEU HD21 1 1 2 713 1 1 17 LEU HD22 H -3.618 -2.727 -2.646 1.00 . A A . 17 LEU HD22 1 1 2 714 1 1 17 LEU HD23 H -3.704 -3.055 -4.376 1.00 . A A . 17 LEU HD23 1 1 2 715 1 1 17 LEU HG H -4.739 -0.654 -2.886 1.00 . A A . 17 LEU HG 1 1 2 716 1 1 17 LEU N N -2.955 1.189 -4.099 1.00 . A A . 17 LEU N 1 1 2 717 1 1 17 LEU O O -5.182 1.772 -2.642 1.00 . A A . 17 LEU O 1 1 2 718 1 1 18 ALA C C -7.069 3.757 -2.831 1.00 . A A . 18 ALA C 1 1 2 719 1 1 18 ALA CA C -7.569 2.629 -3.735 1.00 . A A . 18 ALA CA 1 1 2 720 1 1 18 ALA CB C -8.285 1.556 -2.925 1.00 . A A . 18 ALA CB 1 1 2 721 1 1 18 ALA H H -6.537 1.921 -5.443 1.00 . A A . 18 ALA H 1 1 2 722 1 1 18 ALA HA H -8.268 3.036 -4.452 1.00 . A A . 18 ALA HA 1 1 2 723 1 1 18 ALA HB1 H -8.122 0.591 -3.382 1.00 . A A . 18 ALA HB1 1 1 2 724 1 1 18 ALA HB2 H -7.899 1.548 -1.917 1.00 . A A . 18 ALA HB2 1 1 2 725 1 1 18 ALA HB3 H -9.344 1.769 -2.904 1.00 . A A . 18 ALA HB3 1 1 2 726 1 1 18 ALA N N -6.461 2.036 -4.473 1.00 . A A . 18 ALA N 1 1 2 727 1 1 18 ALA O O -6.073 4.410 -3.142 1.00 . A A . 18 ALA O 1 1 2 728 1 1 19 GLU C C -6.376 4.497 0.255 1.00 . A A . 19 GLU C 1 1 2 729 1 1 19 GLU CA C -7.359 5.032 -0.785 1.00 . A A . 19 GLU CA 1 1 2 730 1 1 19 GLU CB C -8.591 5.620 -0.092 1.00 . A A . 19 GLU CB 1 1 2 731 1 1 19 GLU CD C -8.275 7.540 1.518 1.00 . A A . 19 GLU CD 1 1 2 732 1 1 19 GLU CG C -8.530 7.128 0.081 1.00 . A A . 19 GLU CG 1 1 2 733 1 1 19 GLU H H -8.540 3.436 -1.510 1.00 . A A . 19 GLU H 1 1 2 734 1 1 19 GLU HA H -6.872 5.811 -1.354 1.00 . A A . 19 GLU HA 1 1 2 735 1 1 19 GLU HB2 H -9.466 5.384 -0.680 1.00 . A A . 19 GLU HB2 1 1 2 736 1 1 19 GLU HB3 H -8.692 5.170 0.883 1.00 . A A . 19 GLU HB3 1 1 2 737 1 1 19 GLU HG2 H -7.732 7.517 -0.534 1.00 . A A . 19 GLU HG2 1 1 2 738 1 1 19 GLU HG3 H -9.470 7.554 -0.239 1.00 . A A . 19 GLU HG3 1 1 2 739 1 1 19 GLU N N -7.755 3.984 -1.716 1.00 . A A . 19 GLU N 1 1 2 740 1 1 19 GLU O O -6.627 4.572 1.457 1.00 . A A . 19 GLU O 1 1 2 741 1 1 19 GLU OE1 O -9.197 7.398 2.348 1.00 . A A . 19 GLU OE1 1 1 2 742 1 1 19 GLU OE2 O -7.154 8.006 1.813 1.00 . A A . 19 GLU OE2 1 1 2 743 1 1 20 CYS C C -2.872 4.006 0.328 1.00 . A A . 20 CYS C 1 1 2 744 1 1 20 CYS CA C -4.233 3.427 0.681 1.00 . A A . 20 CYS CA 1 1 2 745 1 1 20 CYS CB C -4.200 1.900 0.599 1.00 . A A . 20 CYS CB 1 1 2 746 1 1 20 CYS H H -5.089 3.931 -1.183 1.00 . A A . 20 CYS H 1 1 2 747 1 1 20 CYS HA H -4.488 3.722 1.688 1.00 . A A . 20 CYS HA 1 1 2 748 1 1 20 CYS HB2 H -4.326 1.599 -0.430 1.00 . A A . 20 CYS HB2 1 1 2 749 1 1 20 CYS HB3 H -3.243 1.547 0.958 1.00 . A A . 20 CYS HB3 1 1 2 750 1 1 20 CYS N N -5.248 3.962 -0.213 1.00 . A A . 20 CYS N 1 1 2 751 1 1 20 CYS O O -2.767 4.863 -0.550 1.00 . A A . 20 CYS O 1 1 2 752 1 1 20 CYS SG S -5.497 1.079 1.581 1.00 . A A . 20 CYS SG 1 1 2 753 1 1 21 VAL C C 0.518 2.915 0.597 1.00 . A A . 21 VAL C 1 1 2 754 1 1 21 VAL CA C -0.492 4.047 0.747 1.00 . A A . 21 VAL CA 1 1 2 755 1 1 21 VAL CB C -0.019 5.011 1.854 1.00 . A A . 21 VAL CB 1 1 2 756 1 1 21 VAL CG1 C -1.021 6.141 2.038 1.00 . A A . 21 VAL CG1 1 1 2 757 1 1 21 VAL CG2 C 0.198 4.268 3.166 1.00 . A A . 21 VAL CG2 1 1 2 758 1 1 21 VAL H H -1.968 2.868 1.702 1.00 . A A . 21 VAL H 1 1 2 759 1 1 21 VAL HA H -0.526 4.600 -0.182 1.00 . A A . 21 VAL HA 1 1 2 760 1 1 21 VAL HB H 0.922 5.445 1.548 1.00 . A A . 21 VAL HB 1 1 2 761 1 1 21 VAL HG11 H -2.024 5.755 1.925 1.00 . A A . 21 VAL HG11 1 1 2 762 1 1 21 VAL HG12 H -0.907 6.567 3.023 1.00 . A A . 21 VAL HG12 1 1 2 763 1 1 21 VAL HG13 H -0.844 6.903 1.292 1.00 . A A . 21 VAL HG13 1 1 2 764 1 1 21 VAL HG21 H 0.911 3.472 3.014 1.00 . A A . 21 VAL HG21 1 1 2 765 1 1 21 VAL HG22 H 0.575 4.953 3.909 1.00 . A A . 21 VAL HG22 1 1 2 766 1 1 21 VAL HG23 H -0.740 3.851 3.502 1.00 . A A . 21 VAL HG23 1 1 2 767 1 1 21 VAL N N -1.832 3.548 1.009 1.00 . A A . 21 VAL N 1 1 2 768 1 1 21 VAL O O 0.307 1.800 1.073 1.00 . A A . 21 VAL O 1 1 2 769 1 1 22 CYS C C 3.821 2.506 0.709 1.00 . A A . 22 CYS C 1 1 2 770 1 1 22 CYS CA C 2.702 2.283 -0.302 1.00 . A A . 22 CYS CA 1 1 2 771 1 1 22 CYS CB C 3.244 2.437 -1.731 1.00 . A A . 22 CYS CB 1 1 2 772 1 1 22 CYS H H 1.705 4.140 -0.404 1.00 . A A . 22 CYS H 1 1 2 773 1 1 22 CYS HA H 2.307 1.285 -0.177 1.00 . A A . 22 CYS HA 1 1 2 774 1 1 22 CYS HB2 H 3.236 3.479 -1.998 1.00 . A A . 22 CYS HB2 1 1 2 775 1 1 22 CYS HB3 H 4.258 2.077 -1.772 1.00 . A A . 22 CYS HB3 1 1 2 776 1 1 22 CYS N N 1.619 3.233 -0.066 1.00 . A A . 22 CYS N 1 1 2 777 1 1 22 CYS O O 4.204 3.644 0.982 1.00 . A A . 22 CYS O 1 1 2 778 1 1 22 CYS SG S 2.284 1.546 -2.995 1.00 . A A . 22 CYS SG 1 1 2 779 1 1 23 LEU C C 6.762 1.227 1.655 1.00 . A A . 23 LEU C 1 1 2 780 1 1 23 LEU CA C 5.396 1.511 2.271 1.00 . A A . 23 LEU CA 1 1 2 781 1 1 23 LEU CB C 5.127 0.541 3.422 1.00 . A A . 23 LEU CB 1 1 2 782 1 1 23 LEU CD1 C 3.276 -0.592 4.688 1.00 . A A . 23 LEU CD1 1 1 2 783 1 1 23 LEU CD2 C 3.891 1.776 5.220 1.00 . A A . 23 LEU CD2 1 1 2 784 1 1 23 LEU CG C 3.779 0.729 4.121 1.00 . A A . 23 LEU CG 1 1 2 785 1 1 23 LEU H H 3.982 0.538 1.030 1.00 . A A . 23 LEU H 1 1 2 786 1 1 23 LEU HA H 5.397 2.518 2.659 1.00 . A A . 23 LEU HA 1 1 2 787 1 1 23 LEU HB2 H 5.172 -0.467 3.034 1.00 . A A . 23 LEU HB2 1 1 2 788 1 1 23 LEU HB3 H 5.907 0.662 4.155 1.00 . A A . 23 LEU HB3 1 1 2 789 1 1 23 LEU HD11 H 3.997 -1.370 4.482 1.00 . A A . 23 LEU HD11 1 1 2 790 1 1 23 LEU HD12 H 3.142 -0.499 5.755 1.00 . A A . 23 LEU HD12 1 1 2 791 1 1 23 LEU HD13 H 2.333 -0.844 4.227 1.00 . A A . 23 LEU HD13 1 1 2 792 1 1 23 LEU HD21 H 4.236 2.708 4.795 1.00 . A A . 23 LEU HD21 1 1 2 793 1 1 23 LEU HD22 H 2.924 1.924 5.675 1.00 . A A . 23 LEU HD22 1 1 2 794 1 1 23 LEU HD23 H 4.594 1.440 5.967 1.00 . A A . 23 LEU HD23 1 1 2 795 1 1 23 LEU HG H 3.055 1.079 3.400 1.00 . A A . 23 LEU HG 1 1 2 796 1 1 23 LEU N N 4.334 1.420 1.277 1.00 . A A . 23 LEU N 1 1 2 797 1 1 23 LEU O O 6.894 0.389 0.762 1.00 . A A . 23 LEU O 1 1 2 798 1 1 24 GLU C C 9.617 0.345 1.765 1.00 . A A . 24 GLU C 1 1 2 799 1 1 24 GLU CA C 9.139 1.789 1.648 1.00 . A A . 24 GLU CA 1 1 2 800 1 1 24 GLU CB C 10.085 2.712 2.417 1.00 . A A . 24 GLU CB 1 1 2 801 1 1 24 GLU CD C 10.231 3.847 4.668 1.00 . A A . 24 GLU CD 1 1 2 802 1 1 24 GLU CG C 10.004 2.546 3.925 1.00 . A A . 24 GLU CG 1 1 2 803 1 1 24 GLU H H 7.597 2.596 2.849 1.00 . A A . 24 GLU H 1 1 2 804 1 1 24 GLU HA H 9.145 2.072 0.606 1.00 . A A . 24 GLU HA 1 1 2 805 1 1 24 GLU HB2 H 11.099 2.508 2.107 1.00 . A A . 24 GLU HB2 1 1 2 806 1 1 24 GLU HB3 H 9.843 3.737 2.176 1.00 . A A . 24 GLU HB3 1 1 2 807 1 1 24 GLU HG2 H 9.024 2.169 4.181 1.00 . A A . 24 GLU HG2 1 1 2 808 1 1 24 GLU HG3 H 10.755 1.834 4.237 1.00 . A A . 24 GLU HG3 1 1 2 809 1 1 24 GLU N N 7.774 1.942 2.141 1.00 . A A . 24 GLU N 1 1 2 810 1 1 24 GLU O O 10.154 -0.217 0.810 1.00 . A A . 24 GLU O 1 1 2 811 1 1 24 GLU OE1 O 9.286 4.661 4.741 1.00 . A A . 24 GLU OE1 1 1 2 812 1 1 24 GLU OE2 O 11.353 4.054 5.176 1.00 . A A . 24 GLU OE2 1 1 2 813 1 1 25 HIS C C 9.255 -2.555 2.101 1.00 . A A . 25 HIS C 1 1 2 814 1 1 25 HIS CA C 9.850 -1.636 3.160 1.00 . A A . 25 HIS CA 1 1 2 815 1 1 25 HIS CB C 9.465 -2.129 4.562 1.00 . A A . 25 HIS CB 1 1 2 816 1 1 25 HIS CD2 C 6.941 -1.873 5.115 1.00 . A A . 25 HIS CD2 1 1 2 817 1 1 25 HIS CE1 C 7.051 0.003 6.241 1.00 . A A . 25 HIS CE1 1 1 2 818 1 1 25 HIS CG C 8.239 -1.486 5.135 1.00 . A A . 25 HIS CG 1 1 2 819 1 1 25 HIS H H 8.994 0.240 3.663 1.00 . A A . 25 HIS H 1 1 2 820 1 1 25 HIS HA H 10.926 -1.662 3.066 1.00 . A A . 25 HIS HA 1 1 2 821 1 1 25 HIS HB2 H 9.287 -3.193 4.521 1.00 . A A . 25 HIS HB2 1 1 2 822 1 1 25 HIS HB3 H 10.286 -1.937 5.237 1.00 . A A . 25 HIS HB3 1 1 2 823 1 1 25 HIS HD1 H 9.073 0.226 6.035 1.00 . A A . 25 HIS HD1 1 1 2 824 1 1 25 HIS HD2 H 6.545 -2.760 4.640 1.00 . A A . 25 HIS HD2 1 1 2 825 1 1 25 HIS HE1 H 6.775 0.874 6.817 1.00 . A A . 25 HIS HE1 1 1 2 826 1 1 25 HIS HE2 H 5.286 -1.018 6.079 1.00 . A A . 25 HIS HE2 1 1 2 827 1 1 25 HIS N N 9.426 -0.254 2.938 1.00 . A A . 25 HIS N 1 1 2 828 1 1 25 HIS ND1 N 8.273 -0.306 5.847 1.00 . A A . 25 HIS ND1 1 1 2 829 1 1 25 HIS NE2 N 6.224 -0.931 5.811 1.00 . A A . 25 HIS NE2 1 1 2 830 1 1 25 HIS O O 9.814 -3.608 1.792 1.00 . A A . 25 HIS O 1 1 2 831 1 1 26 GLY C C 6.159 -3.516 0.947 1.00 . A A . 26 GLY C 1 1 2 832 1 1 26 GLY CA C 7.484 -2.930 0.506 1.00 . A A . 26 GLY CA 1 1 2 833 1 1 26 GLY H H 7.732 -1.290 1.815 1.00 . A A . 26 GLY H 1 1 2 834 1 1 26 GLY HA2 H 8.144 -3.736 0.221 1.00 . A A . 26 GLY HA2 1 1 2 835 1 1 26 GLY HA3 H 7.317 -2.298 -0.351 1.00 . A A . 26 GLY HA3 1 1 2 836 1 1 26 GLY N N 8.126 -2.142 1.537 1.00 . A A . 26 GLY N 1 1 2 837 1 1 26 GLY O O 6.013 -4.735 1.029 1.00 . A A . 26 GLY O 1 1 2 838 1 1 27 TYR C C 2.864 -1.936 1.607 1.00 . A A . 27 TYR C 1 1 2 839 1 1 27 TYR CA C 3.865 -3.089 1.649 1.00 . A A . 27 TYR CA 1 1 2 840 1 1 27 TYR CB C 3.925 -3.665 3.065 1.00 . A A . 27 TYR CB 1 1 2 841 1 1 27 TYR CD1 C 3.864 -6.088 2.354 1.00 . A A . 27 TYR CD1 1 1 2 842 1 1 27 TYR CD2 C 5.491 -5.427 3.966 1.00 . A A . 27 TYR CD2 1 1 2 843 1 1 27 TYR CE1 C 4.330 -7.388 2.411 1.00 . A A . 27 TYR CE1 1 1 2 844 1 1 27 TYR CE2 C 5.964 -6.724 4.028 1.00 . A A . 27 TYR CE2 1 1 2 845 1 1 27 TYR CG C 4.435 -5.087 3.130 1.00 . A A . 27 TYR CG 1 1 2 846 1 1 27 TYR CZ C 5.380 -7.700 3.248 1.00 . A A . 27 TYR CZ 1 1 2 847 1 1 27 TYR H H 5.366 -1.688 1.130 1.00 . A A . 27 TYR H 1 1 2 848 1 1 27 TYR HA H 3.536 -3.861 0.970 1.00 . A A . 27 TYR HA 1 1 2 849 1 1 27 TYR HB2 H 4.580 -3.054 3.662 1.00 . A A . 27 TYR HB2 1 1 2 850 1 1 27 TYR HB3 H 2.934 -3.647 3.496 1.00 . A A . 27 TYR HB3 1 1 2 851 1 1 27 TYR HD1 H 3.042 -5.840 1.699 1.00 . A A . 27 TYR HD1 1 1 2 852 1 1 27 TYR HD2 H 5.946 -4.660 4.575 1.00 . A A . 27 TYR HD2 1 1 2 853 1 1 27 TYR HE1 H 3.874 -8.152 1.801 1.00 . A A . 27 TYR HE1 1 1 2 854 1 1 27 TYR HE2 H 6.785 -6.968 4.683 1.00 . A A . 27 TYR HE2 1 1 2 855 1 1 27 TYR HH H 6.067 -9.214 4.214 1.00 . A A . 27 TYR HH 1 1 2 856 1 1 27 TYR N N 5.189 -2.648 1.222 1.00 . A A . 27 TYR N 1 1 2 857 1 1 27 TYR O O 3.202 -0.797 1.923 1.00 . A A . 27 TYR O 1 1 2 858 1 1 27 TYR OH O 5.847 -8.993 3.306 1.00 . A A . 27 TYR OH 1 1 2 859 1 1 28 CYS C C -0.314 -1.288 2.376 1.00 . A A . 28 CYS C 1 1 2 860 1 1 28 CYS CA C 0.578 -1.233 1.139 1.00 . A A . 28 CYS CA 1 1 2 861 1 1 28 CYS CB C -0.274 -1.439 -0.118 1.00 . A A . 28 CYS CB 1 1 2 862 1 1 28 CYS H H 1.423 -3.170 0.977 1.00 . A A . 28 CYS H 1 1 2 863 1 1 28 CYS HA H 1.050 -0.265 1.091 1.00 . A A . 28 CYS HA 1 1 2 864 1 1 28 CYS HB2 H -0.055 -2.411 -0.537 1.00 . A A . 28 CYS HB2 1 1 2 865 1 1 28 CYS HB3 H -1.320 -1.398 0.152 1.00 . A A . 28 CYS HB3 1 1 2 866 1 1 28 CYS N N 1.630 -2.243 1.217 1.00 . A A . 28 CYS N 1 1 2 867 1 1 28 CYS O O -0.903 -2.324 2.684 1.00 . A A . 28 CYS O 1 1 2 868 1 1 28 CYS SG S 0.008 -0.202 -1.426 1.00 . A A . 28 CYS SG 1 1 2 869 1 1 29 GLY C C -2.574 0.538 4.026 1.00 . A A . 29 GLY C 1 1 2 870 1 1 29 GLY CA C -1.226 -0.107 4.279 1.00 . A A . 29 GLY CA 1 1 2 871 1 1 29 GLY H H 0.087 0.629 2.788 1.00 . A A . 29 GLY H 1 1 2 872 1 1 29 GLY HA2 H -0.702 0.462 5.032 1.00 . A A . 29 GLY HA2 1 1 2 873 1 1 29 GLY HA3 H -1.382 -1.111 4.644 1.00 . A A . 29 GLY HA3 1 1 2 874 1 1 29 GLY N N -0.406 -0.166 3.082 1.00 . A A . 29 GLY N 1 1 2 875 1 1 29 GLY O O -3.370 -0.033 3.252 1.00 . A A . 29 GLY O 1 1 2 876 1 1 29 GLY OXT O -2.834 1.615 4.604 1.00 . A A . 29 GLY OXT 1 1 3 877 1 1 1 ARG C C -8.561 2.373 4.387 1.00 . A A . 1 ARG C 1 1 3 878 1 1 1 ARG CA C -7.844 3.624 4.887 1.00 . A A . 1 ARG CA 1 1 3 879 1 1 1 ARG CB C -6.532 3.241 5.578 1.00 . A A . 1 ARG CB 1 1 3 880 1 1 1 ARG CD C -4.036 3.434 5.350 1.00 . A A . 1 ARG CD 1 1 3 881 1 1 1 ARG CG C -5.370 4.154 5.223 1.00 . A A . 1 ARG CG 1 1 3 882 1 1 1 ARG CZ C -3.073 4.460 7.374 1.00 . A A . 1 ARG CZ 1 1 3 883 1 1 1 ARG H1 H -8.962 3.719 6.612 1.00 . A A . 1 ARG H1 1 1 3 884 1 1 1 ARG H2 H -8.115 5.159 6.229 1.00 . A A . 1 ARG H2 1 1 3 885 1 1 1 ARG H3 H -9.519 4.729 5.341 1.00 . A A . 1 ARG H3 1 1 3 886 1 1 1 ARG HA H -7.629 4.265 4.047 1.00 . A A . 1 ARG HA 1 1 3 887 1 1 1 ARG HB2 H -6.678 3.280 6.648 1.00 . A A . 1 ARG HB2 1 1 3 888 1 1 1 ARG HB3 H -6.269 2.233 5.296 1.00 . A A . 1 ARG HB3 1 1 3 889 1 1 1 ARG HD2 H -4.188 2.512 5.890 1.00 . A A . 1 ARG HD2 1 1 3 890 1 1 1 ARG HD3 H -3.664 3.214 4.361 1.00 . A A . 1 ARG HD3 1 1 3 891 1 1 1 ARG HE H -2.322 4.638 5.533 1.00 . A A . 1 ARG HE 1 1 3 892 1 1 1 ARG HG2 H -5.488 4.491 4.204 1.00 . A A . 1 ARG HG2 1 1 3 893 1 1 1 ARG HG3 H -5.376 5.004 5.889 1.00 . A A . 1 ARG HG3 1 1 3 894 1 1 1 ARG HH11 H -4.749 3.375 7.701 1.00 . A A . 1 ARG HH11 1 1 3 895 1 1 1 ARG HH12 H -4.052 4.106 9.107 1.00 . A A . 1 ARG HH12 1 1 3 896 1 1 1 ARG HH21 H -1.404 5.600 7.381 1.00 . A A . 1 ARG HH21 1 1 3 897 1 1 1 ARG HH22 H -2.152 5.369 8.926 1.00 . A A . 1 ARG HH22 1 1 3 898 1 1 1 ARG N N -8.685 4.375 5.854 1.00 . A A . 1 ARG N 1 1 3 899 1 1 1 ARG NE N -3.046 4.239 6.061 1.00 . A A . 1 ARG NE 1 1 3 900 1 1 1 ARG NH1 N -4.037 3.937 8.121 1.00 . A A . 1 ARG NH1 1 1 3 901 1 1 1 ARG NH2 N -2.133 5.205 7.940 1.00 . A A . 1 ARG NH2 1 1 3 902 1 1 1 ARG O O -8.415 1.292 4.957 1.00 . A A . 1 ARG O 1 1 3 903 1 1 2 VAL C C -9.341 0.832 1.539 1.00 . A A . 2 VAL C 1 1 3 904 1 1 2 VAL CA C -10.076 1.414 2.743 1.00 . A A . 2 VAL CA 1 1 3 905 1 1 2 VAL CB C -11.496 1.842 2.315 1.00 . A A . 2 VAL CB 1 1 3 906 1 1 2 VAL CG1 C -11.434 2.918 1.240 1.00 . A A . 2 VAL CG1 1 1 3 907 1 1 2 VAL CG2 C -12.296 0.640 1.833 1.00 . A A . 2 VAL CG2 1 1 3 908 1 1 2 VAL H H -9.413 3.416 2.910 1.00 . A A . 2 VAL H 1 1 3 909 1 1 2 VAL HA H -10.168 0.648 3.499 1.00 . A A . 2 VAL HA 1 1 3 910 1 1 2 VAL HB H -11.998 2.257 3.176 1.00 . A A . 2 VAL HB 1 1 3 911 1 1 2 VAL HG11 H -10.443 3.345 1.213 1.00 . A A . 2 VAL HG11 1 1 3 912 1 1 2 VAL HG12 H -11.663 2.480 0.279 1.00 . A A . 2 VAL HG12 1 1 3 913 1 1 2 VAL HG13 H -12.154 3.691 1.464 1.00 . A A . 2 VAL HG13 1 1 3 914 1 1 2 VAL HG21 H -12.367 -0.087 2.628 1.00 . A A . 2 VAL HG21 1 1 3 915 1 1 2 VAL HG22 H -13.287 0.960 1.547 1.00 . A A . 2 VAL HG22 1 1 3 916 1 1 2 VAL HG23 H -11.802 0.197 0.982 1.00 . A A . 2 VAL HG23 1 1 3 917 1 1 2 VAL N N -9.337 2.529 3.320 1.00 . A A . 2 VAL N 1 1 3 918 1 1 2 VAL O O -9.235 1.474 0.494 1.00 . A A . 2 VAL O 1 1 3 919 1 1 3 CYS C C -7.966 -2.550 0.902 1.00 . A A . 3 CYS C 1 1 3 920 1 1 3 CYS CA C -8.109 -1.054 0.618 1.00 . A A . 3 CYS CA 1 1 3 921 1 1 3 CYS CB C -6.728 -0.418 0.434 1.00 . A A . 3 CYS CB 1 1 3 922 1 1 3 CYS H H -8.952 -0.848 2.550 1.00 . A A . 3 CYS H 1 1 3 923 1 1 3 CYS HA H -8.678 -0.925 -0.290 1.00 . A A . 3 CYS HA 1 1 3 924 1 1 3 CYS HB2 H -6.305 -0.761 -0.498 1.00 . A A . 3 CYS HB2 1 1 3 925 1 1 3 CYS HB3 H -6.837 0.656 0.398 1.00 . A A . 3 CYS HB3 1 1 3 926 1 1 3 CYS N N -8.834 -0.387 1.693 1.00 . A A . 3 CYS N 1 1 3 927 1 1 3 CYS O O -7.546 -2.943 1.991 1.00 . A A . 3 CYS O 1 1 3 928 1 1 3 CYS SG S -5.536 -0.810 1.758 1.00 . A A . 3 CYS SG 1 1 3 929 1 1 4 PRO C C -6.894 -5.297 0.717 1.00 . A A . 4 PRO C 1 1 3 930 1 1 4 PRO CA C -8.212 -4.865 0.082 1.00 . A A . 4 PRO CA 1 1 3 931 1 1 4 PRO CB C -8.302 -5.372 -1.354 1.00 . A A . 4 PRO CB 1 1 3 932 1 1 4 PRO CD C -8.818 -3.035 -1.411 1.00 . A A . 4 PRO CD 1 1 3 933 1 1 4 PRO CG C -9.141 -4.360 -2.054 1.00 . A A . 4 PRO CG 1 1 3 934 1 1 4 PRO HA H -9.036 -5.258 0.659 1.00 . A A . 4 PRO HA 1 1 3 935 1 1 4 PRO HB2 H -7.311 -5.430 -1.781 1.00 . A A . 4 PRO HB2 1 1 3 936 1 1 4 PRO HB3 H -8.764 -6.347 -1.368 1.00 . A A . 4 PRO HB3 1 1 3 937 1 1 4 PRO HD2 H -8.061 -2.516 -1.979 1.00 . A A . 4 PRO HD2 1 1 3 938 1 1 4 PRO HD3 H -9.710 -2.431 -1.327 1.00 . A A . 4 PRO HD3 1 1 3 939 1 1 4 PRO HG2 H -8.891 -4.337 -3.104 1.00 . A A . 4 PRO HG2 1 1 3 940 1 1 4 PRO HG3 H -10.186 -4.595 -1.921 1.00 . A A . 4 PRO HG3 1 1 3 941 1 1 4 PRO N N -8.310 -3.410 -0.075 1.00 . A A . 4 PRO N 1 1 3 942 1 1 4 PRO O O -5.842 -4.723 0.437 1.00 . A A . 4 PRO O 1 1 3 943 1 1 5 ARG C C -4.883 -7.581 1.258 1.00 . A A . 5 ARG C 1 1 3 944 1 1 5 ARG CA C -5.767 -6.820 2.239 1.00 . A A . 5 ARG CA 1 1 3 945 1 1 5 ARG CB C -6.158 -7.730 3.404 1.00 . A A . 5 ARG CB 1 1 3 946 1 1 5 ARG CD C -7.756 -7.822 5.341 1.00 . A A . 5 ARG CD 1 1 3 947 1 1 5 ARG CG C -6.731 -6.982 4.596 1.00 . A A . 5 ARG CG 1 1 3 948 1 1 5 ARG CZ C -9.930 -6.836 4.732 1.00 . A A . 5 ARG CZ 1 1 3 949 1 1 5 ARG H H -7.825 -6.732 1.753 1.00 . A A . 5 ARG H 1 1 3 950 1 1 5 ARG HA H -5.216 -5.974 2.623 1.00 . A A . 5 ARG HA 1 1 3 951 1 1 5 ARG HB2 H -6.899 -8.437 3.061 1.00 . A A . 5 ARG HB2 1 1 3 952 1 1 5 ARG HB3 H -5.283 -8.271 3.733 1.00 . A A . 5 ARG HB3 1 1 3 953 1 1 5 ARG HD2 H -7.389 -8.836 5.409 1.00 . A A . 5 ARG HD2 1 1 3 954 1 1 5 ARG HD3 H -7.882 -7.416 6.333 1.00 . A A . 5 ARG HD3 1 1 3 955 1 1 5 ARG HE H -9.275 -8.622 4.128 1.00 . A A . 5 ARG HE 1 1 3 956 1 1 5 ARG HG2 H -5.927 -6.731 5.272 1.00 . A A . 5 ARG HG2 1 1 3 957 1 1 5 ARG HG3 H -7.206 -6.077 4.246 1.00 . A A . 5 ARG HG3 1 1 3 958 1 1 5 ARG HH11 H -8.792 -5.678 5.940 1.00 . A A . 5 ARG HH11 1 1 3 959 1 1 5 ARG HH12 H -10.325 -5.005 5.495 1.00 . A A . 5 ARG HH12 1 1 3 960 1 1 5 ARG HH21 H -11.291 -7.739 3.543 1.00 . A A . 5 ARG HH21 1 1 3 961 1 1 5 ARG HH22 H -11.744 -6.176 4.135 1.00 . A A . 5 ARG HH22 1 1 3 962 1 1 5 ARG N N -6.958 -6.313 1.570 1.00 . A A . 5 ARG N 1 1 3 963 1 1 5 ARG NE N -9.050 -7.832 4.663 1.00 . A A . 5 ARG NE 1 1 3 964 1 1 5 ARG NH1 N -9.660 -5.751 5.448 1.00 . A A . 5 ARG NH1 1 1 3 965 1 1 5 ARG NH2 N -11.082 -6.924 4.083 1.00 . A A . 5 ARG NH2 1 1 3 966 1 1 5 ARG O O -4.897 -8.811 1.218 1.00 . A A . 5 ARG O 1 1 3 967 1 1 6 ILE C C -1.830 -6.833 -0.437 1.00 . A A . 6 ILE C 1 1 3 968 1 1 6 ILE CA C -3.226 -7.441 -0.515 1.00 . A A . 6 ILE CA 1 1 3 969 1 1 6 ILE CB C -3.770 -7.268 -1.946 1.00 . A A . 6 ILE CB 1 1 3 970 1 1 6 ILE CD1 C -5.968 -7.167 -3.227 1.00 . A A . 6 ILE CD1 1 1 3 971 1 1 6 ILE CG1 C -5.238 -7.694 -2.011 1.00 . A A . 6 ILE CG1 1 1 3 972 1 1 6 ILE CG2 C -2.934 -8.069 -2.932 1.00 . A A . 6 ILE CG2 1 1 3 973 1 1 6 ILE H H -4.152 -5.864 0.545 1.00 . A A . 6 ILE H 1 1 3 974 1 1 6 ILE HA H -3.161 -8.498 -0.303 1.00 . A A . 6 ILE HA 1 1 3 975 1 1 6 ILE HB H -3.694 -6.224 -2.212 1.00 . A A . 6 ILE HB 1 1 3 976 1 1 6 ILE HD11 H -5.455 -7.487 -4.122 1.00 . A A . 6 ILE HD11 1 1 3 977 1 1 6 ILE HD12 H -6.978 -7.550 -3.234 1.00 . A A . 6 ILE HD12 1 1 3 978 1 1 6 ILE HD13 H -5.992 -6.088 -3.192 1.00 . A A . 6 ILE HD13 1 1 3 979 1 1 6 ILE HG12 H -5.292 -8.772 -2.034 1.00 . A A . 6 ILE HG12 1 1 3 980 1 1 6 ILE HG13 H -5.751 -7.331 -1.132 1.00 . A A . 6 ILE HG13 1 1 3 981 1 1 6 ILE HG21 H -1.958 -8.252 -2.511 1.00 . A A . 6 ILE HG21 1 1 3 982 1 1 6 ILE HG22 H -3.422 -9.011 -3.135 1.00 . A A . 6 ILE HG22 1 1 3 983 1 1 6 ILE HG23 H -2.832 -7.512 -3.852 1.00 . A A . 6 ILE HG23 1 1 3 984 1 1 6 ILE N N -4.116 -6.839 0.467 1.00 . A A . 6 ILE N 1 1 3 985 1 1 6 ILE O O -1.662 -5.621 -0.574 1.00 . A A . 6 ILE O 1 1 3 986 1 1 7 LEU C C 0.979 -6.509 -1.391 1.00 . A A . 7 LEU C 1 1 3 987 1 1 7 LEU CA C 0.550 -7.232 -0.118 1.00 . A A . 7 LEU CA 1 1 3 988 1 1 7 LEU CB C 1.477 -8.421 0.141 1.00 . A A . 7 LEU CB 1 1 3 989 1 1 7 LEU CD1 C 1.927 -10.529 1.421 1.00 . A A . 7 LEU CD1 1 1 3 990 1 1 7 LEU CD2 C 1.576 -8.374 2.646 1.00 . A A . 7 LEU CD2 1 1 3 991 1 1 7 LEU CG C 1.189 -9.198 1.426 1.00 . A A . 7 LEU CG 1 1 3 992 1 1 7 LEU H H -1.032 -8.637 -0.115 1.00 . A A . 7 LEU H 1 1 3 993 1 1 7 LEU HA H 0.619 -6.546 0.712 1.00 . A A . 7 LEU HA 1 1 3 994 1 1 7 LEU HB2 H 1.396 -9.102 -0.694 1.00 . A A . 7 LEU HB2 1 1 3 995 1 1 7 LEU HB3 H 2.492 -8.055 0.189 1.00 . A A . 7 LEU HB3 1 1 3 996 1 1 7 LEU HD11 H 2.790 -10.459 0.775 1.00 . A A . 7 LEU HD11 1 1 3 997 1 1 7 LEU HD12 H 2.246 -10.768 2.424 1.00 . A A . 7 LEU HD12 1 1 3 998 1 1 7 LEU HD13 H 1.269 -11.304 1.058 1.00 . A A . 7 LEU HD13 1 1 3 999 1 1 7 LEU HD21 H 1.708 -7.343 2.356 1.00 . A A . 7 LEU HD21 1 1 3 1000 1 1 7 LEU HD22 H 0.797 -8.444 3.390 1.00 . A A . 7 LEU HD22 1 1 3 1001 1 1 7 LEU HD23 H 2.501 -8.753 3.057 1.00 . A A . 7 LEU HD23 1 1 3 1002 1 1 7 LEU HG H 0.130 -9.405 1.484 1.00 . A A . 7 LEU HG 1 1 3 1003 1 1 7 LEU N N -0.833 -7.683 -0.215 1.00 . A A . 7 LEU N 1 1 3 1004 1 1 7 LEU O O 0.631 -6.923 -2.497 1.00 . A A . 7 LEU O 1 1 3 1005 1 1 8 LEU C C 3.346 -3.726 -1.958 1.00 . A A . 8 LEU C 1 1 3 1006 1 1 8 LEU CA C 2.210 -4.655 -2.369 1.00 . A A . 8 LEU CA 1 1 3 1007 1 1 8 LEU CB C 1.064 -3.842 -2.973 1.00 . A A . 8 LEU CB 1 1 3 1008 1 1 8 LEU CD1 C 0.014 -4.429 -5.177 1.00 . A A . 8 LEU CD1 1 1 3 1009 1 1 8 LEU CD2 C 1.064 -2.183 -4.858 1.00 . A A . 8 LEU CD2 1 1 3 1010 1 1 8 LEU CG C 1.132 -3.658 -4.493 1.00 . A A . 8 LEU CG 1 1 3 1011 1 1 8 LEU H H 1.985 -5.147 -0.321 1.00 . A A . 8 LEU H 1 1 3 1012 1 1 8 LEU HA H 2.577 -5.349 -3.110 1.00 . A A . 8 LEU HA 1 1 3 1013 1 1 8 LEU HB2 H 0.135 -4.335 -2.730 1.00 . A A . 8 LEU HB2 1 1 3 1014 1 1 8 LEU HB3 H 1.064 -2.865 -2.514 1.00 . A A . 8 LEU HB3 1 1 3 1015 1 1 8 LEU HD11 H -0.123 -5.380 -4.683 1.00 . A A . 8 LEU HD11 1 1 3 1016 1 1 8 LEU HD12 H -0.903 -3.859 -5.120 1.00 . A A . 8 LEU HD12 1 1 3 1017 1 1 8 LEU HD13 H 0.271 -4.595 -6.212 1.00 . A A . 8 LEU HD13 1 1 3 1018 1 1 8 LEU HD21 H 1.392 -1.588 -4.017 1.00 . A A . 8 LEU HD21 1 1 3 1019 1 1 8 LEU HD22 H 1.705 -1.991 -5.706 1.00 . A A . 8 LEU HD22 1 1 3 1020 1 1 8 LEU HD23 H 0.047 -1.920 -5.109 1.00 . A A . 8 LEU HD23 1 1 3 1021 1 1 8 LEU HG H 2.073 -4.049 -4.853 1.00 . A A . 8 LEU HG 1 1 3 1022 1 1 8 LEU N N 1.736 -5.429 -1.228 1.00 . A A . 8 LEU N 1 1 3 1023 1 1 8 LEU O O 3.167 -2.853 -1.111 1.00 . A A . 8 LEU O 1 1 3 1024 1 1 9 GLU C C 5.890 -2.026 -3.308 1.00 . A A . 9 GLU C 1 1 3 1025 1 1 9 GLU CA C 5.685 -3.110 -2.257 1.00 . A A . 9 GLU CA 1 1 3 1026 1 1 9 GLU CB C 6.935 -3.991 -2.169 1.00 . A A . 9 GLU CB 1 1 3 1027 1 1 9 GLU CD C 6.586 -6.231 -3.281 1.00 . A A . 9 GLU CD 1 1 3 1028 1 1 9 GLU CG C 7.170 -4.838 -3.408 1.00 . A A . 9 GLU CG 1 1 3 1029 1 1 9 GLU H H 4.592 -4.641 -3.228 1.00 . A A . 9 GLU H 1 1 3 1030 1 1 9 GLU HA H 5.520 -2.639 -1.301 1.00 . A A . 9 GLU HA 1 1 3 1031 1 1 9 GLU HB2 H 7.796 -3.358 -2.023 1.00 . A A . 9 GLU HB2 1 1 3 1032 1 1 9 GLU HB3 H 6.836 -4.651 -1.320 1.00 . A A . 9 GLU HB3 1 1 3 1033 1 1 9 GLU HG2 H 6.713 -4.350 -4.256 1.00 . A A . 9 GLU HG2 1 1 3 1034 1 1 9 GLU HG3 H 8.234 -4.924 -3.574 1.00 . A A . 9 GLU HG3 1 1 3 1035 1 1 9 GLU N N 4.515 -3.926 -2.562 1.00 . A A . 9 GLU N 1 1 3 1036 1 1 9 GLU O O 5.853 -2.295 -4.509 1.00 . A A . 9 GLU O 1 1 3 1037 1 1 9 GLU OE1 O 6.819 -6.879 -2.238 1.00 . A A . 9 GLU OE1 1 1 3 1038 1 1 9 GLU OE2 O 5.896 -6.674 -4.223 1.00 . A A . 9 GLU OE2 1 1 3 1039 1 1 10 CYS C C 7.094 1.441 -3.063 1.00 . A A . 10 CYS C 1 1 3 1040 1 1 10 CYS CA C 6.300 0.333 -3.749 1.00 . A A . 10 CYS CA 1 1 3 1041 1 1 10 CYS CB C 4.950 0.880 -4.233 1.00 . A A . 10 CYS CB 1 1 3 1042 1 1 10 CYS H H 6.107 -0.643 -1.879 1.00 . A A . 10 CYS H 1 1 3 1043 1 1 10 CYS HA H 6.861 -0.021 -4.600 1.00 . A A . 10 CYS HA 1 1 3 1044 1 1 10 CYS HB2 H 4.882 1.927 -3.982 1.00 . A A . 10 CYS HB2 1 1 3 1045 1 1 10 CYS HB3 H 4.894 0.771 -5.307 1.00 . A A . 10 CYS HB3 1 1 3 1046 1 1 10 CYS N N 6.097 -0.796 -2.847 1.00 . A A . 10 CYS N 1 1 3 1047 1 1 10 CYS O O 7.198 1.479 -1.837 1.00 . A A . 10 CYS O 1 1 3 1048 1 1 10 CYS SG S 3.496 0.046 -3.515 1.00 . A A . 10 CYS SG 1 1 3 1049 1 1 11 LYS C C 7.521 4.616 -2.946 1.00 . A A . 11 LYS C 1 1 3 1050 1 1 11 LYS CA C 8.432 3.457 -3.338 1.00 . A A . 11 LYS CA 1 1 3 1051 1 1 11 LYS CB C 9.461 3.920 -4.373 1.00 . A A . 11 LYS CB 1 1 3 1052 1 1 11 LYS CD C 11.809 4.819 -4.329 1.00 . A A . 11 LYS CD 1 1 3 1053 1 1 11 LYS CE C 13.166 4.335 -4.813 1.00 . A A . 11 LYS CE 1 1 3 1054 1 1 11 LYS CG C 10.900 3.657 -3.959 1.00 . A A . 11 LYS CG 1 1 3 1055 1 1 11 LYS H H 7.530 2.261 -4.834 1.00 . A A . 11 LYS H 1 1 3 1056 1 1 11 LYS HA H 8.952 3.109 -2.457 1.00 . A A . 11 LYS HA 1 1 3 1057 1 1 11 LYS HB2 H 9.276 3.404 -5.303 1.00 . A A . 11 LYS HB2 1 1 3 1058 1 1 11 LYS HB3 H 9.344 4.983 -4.533 1.00 . A A . 11 LYS HB3 1 1 3 1059 1 1 11 LYS HD2 H 11.341 5.392 -5.116 1.00 . A A . 11 LYS HD2 1 1 3 1060 1 1 11 LYS HD3 H 11.948 5.445 -3.459 1.00 . A A . 11 LYS HD3 1 1 3 1061 1 1 11 LYS HE2 H 13.649 3.798 -4.010 1.00 . A A . 11 LYS HE2 1 1 3 1062 1 1 11 LYS HE3 H 13.019 3.671 -5.652 1.00 . A A . 11 LYS HE3 1 1 3 1063 1 1 11 LYS HG2 H 10.937 3.511 -2.890 1.00 . A A . 11 LYS HG2 1 1 3 1064 1 1 11 LYS HG3 H 11.251 2.765 -4.458 1.00 . A A . 11 LYS HG3 1 1 3 1065 1 1 11 LYS HZ1 H 13.802 6.321 -4.695 1.00 . A A . 11 LYS HZ1 1 1 3 1066 1 1 11 LYS HZ2 H 15.039 5.227 -5.063 1.00 . A A . 11 LYS HZ2 1 1 3 1067 1 1 11 LYS HZ3 H 13.912 5.659 -6.247 1.00 . A A . 11 LYS HZ3 1 1 3 1068 1 1 11 LYS N N 7.651 2.344 -3.865 1.00 . A A . 11 LYS N 1 1 3 1069 1 1 11 LYS NZ N 14.041 5.464 -5.234 1.00 . A A . 11 LYS NZ 1 1 3 1070 1 1 11 LYS O O 7.437 4.984 -1.774 1.00 . A A . 11 LYS O 1 1 3 1071 1 1 12 LYS C C 4.568 5.781 -3.206 1.00 . A A . 12 LYS C 1 1 3 1072 1 1 12 LYS CA C 5.921 6.293 -3.692 1.00 . A A . 12 LYS CA 1 1 3 1073 1 1 12 LYS CB C 5.742 7.119 -4.967 1.00 . A A . 12 LYS CB 1 1 3 1074 1 1 12 LYS CD C 5.372 9.512 -5.638 1.00 . A A . 12 LYS CD 1 1 3 1075 1 1 12 LYS CE C 4.407 10.687 -5.599 1.00 . A A . 12 LYS CE 1 1 3 1076 1 1 12 LYS CG C 4.886 8.361 -4.774 1.00 . A A . 12 LYS CG 1 1 3 1077 1 1 12 LYS H H 6.939 4.840 -4.845 1.00 . A A . 12 LYS H 1 1 3 1078 1 1 12 LYS HA H 6.353 6.919 -2.924 1.00 . A A . 12 LYS HA 1 1 3 1079 1 1 12 LYS HB2 H 6.714 7.430 -5.321 1.00 . A A . 12 LYS HB2 1 1 3 1080 1 1 12 LYS HB3 H 5.274 6.500 -5.720 1.00 . A A . 12 LYS HB3 1 1 3 1081 1 1 12 LYS HD2 H 6.336 9.840 -5.276 1.00 . A A . 12 LYS HD2 1 1 3 1082 1 1 12 LYS HD3 H 5.467 9.170 -6.658 1.00 . A A . 12 LYS HD3 1 1 3 1083 1 1 12 LYS HE2 H 3.467 10.377 -6.032 1.00 . A A . 12 LYS HE2 1 1 3 1084 1 1 12 LYS HE3 H 4.252 10.974 -4.569 1.00 . A A . 12 LYS HE3 1 1 3 1085 1 1 12 LYS HG2 H 3.866 8.128 -5.043 1.00 . A A . 12 LYS HG2 1 1 3 1086 1 1 12 LYS HG3 H 4.928 8.657 -3.736 1.00 . A A . 12 LYS HG3 1 1 3 1087 1 1 12 LYS HZ1 H 5.211 11.568 -7.314 1.00 . A A . 12 LYS HZ1 1 1 3 1088 1 1 12 LYS HZ2 H 4.189 12.589 -6.434 1.00 . A A . 12 LYS HZ2 1 1 3 1089 1 1 12 LYS HZ3 H 5.751 12.263 -5.870 1.00 . A A . 12 LYS HZ3 1 1 3 1090 1 1 12 LYS N N 6.833 5.181 -3.933 1.00 . A A . 12 LYS N 1 1 3 1091 1 1 12 LYS NZ N 4.926 11.858 -6.357 1.00 . A A . 12 LYS NZ 1 1 3 1092 1 1 12 LYS O O 4.000 4.860 -3.792 1.00 . A A . 12 LYS O 1 1 3 1093 1 1 13 ASP C C 1.676 6.014 -2.610 1.00 . A A . 13 ASP C 1 1 3 1094 1 1 13 ASP CA C 2.782 5.967 -1.566 1.00 . A A . 13 ASP CA 1 1 3 1095 1 1 13 ASP CB C 2.412 6.841 -0.366 1.00 . A A . 13 ASP CB 1 1 3 1096 1 1 13 ASP CG C 3.527 6.924 0.659 1.00 . A A . 13 ASP CG 1 1 3 1097 1 1 13 ASP H H 4.565 7.097 -1.702 1.00 . A A . 13 ASP H 1 1 3 1098 1 1 13 ASP HA H 2.888 4.952 -1.236 1.00 . A A . 13 ASP HA 1 1 3 1099 1 1 13 ASP HB2 H 2.187 7.838 -0.707 1.00 . A A . 13 ASP HB2 1 1 3 1100 1 1 13 ASP HB3 H 1.539 6.428 0.114 1.00 . A A . 13 ASP HB3 1 1 3 1101 1 1 13 ASP N N 4.064 6.375 -2.130 1.00 . A A . 13 ASP N 1 1 3 1102 1 1 13 ASP O O 0.768 5.182 -2.601 1.00 . A A . 13 ASP O 1 1 3 1103 1 1 13 ASP OD1 O 4.615 6.366 0.401 1.00 . A A . 13 ASP OD1 1 1 3 1104 1 1 13 ASP OD2 O 3.313 7.548 1.720 1.00 . A A . 13 ASP OD2 1 1 3 1105 1 1 14 SER C C 0.622 5.843 -5.363 1.00 . A A . 14 SER C 1 1 3 1106 1 1 14 SER CA C 0.775 7.138 -4.571 1.00 . A A . 14 SER CA 1 1 3 1107 1 1 14 SER CB C 1.174 8.278 -5.509 1.00 . A A . 14 SER CB 1 1 3 1108 1 1 14 SER H H 2.514 7.610 -3.465 1.00 . A A . 14 SER H 1 1 3 1109 1 1 14 SER HA H -0.171 7.377 -4.110 1.00 . A A . 14 SER HA 1 1 3 1110 1 1 14 SER HB2 H 0.302 8.625 -6.045 1.00 . A A . 14 SER HB2 1 1 3 1111 1 1 14 SER HB3 H 1.586 9.092 -4.929 1.00 . A A . 14 SER HB3 1 1 3 1112 1 1 14 SER N N 1.763 6.984 -3.511 1.00 . A A . 14 SER N 1 1 3 1113 1 1 14 SER O O -0.465 5.519 -5.840 1.00 . A A . 14 SER O 1 1 3 1114 1 1 14 SER OG O 2.145 7.851 -6.449 1.00 . A A . 14 SER OG 1 1 3 1115 1 1 15 ASP C C 0.615 2.922 -5.778 1.00 . A A . 15 ASP C 1 1 3 1116 1 1 15 ASP CA C 1.726 3.857 -6.250 1.00 . A A . 15 ASP CA 1 1 3 1117 1 1 15 ASP CB C 3.082 3.162 -6.115 1.00 . A A . 15 ASP CB 1 1 3 1118 1 1 15 ASP CG C 3.547 2.545 -7.418 1.00 . A A . 15 ASP CG 1 1 3 1119 1 1 15 ASP H H 2.564 5.425 -5.104 1.00 . A A . 15 ASP H 1 1 3 1120 1 1 15 ASP HA H 1.559 4.092 -7.290 1.00 . A A . 15 ASP HA 1 1 3 1121 1 1 15 ASP HB2 H 3.820 3.884 -5.797 1.00 . A A . 15 ASP HB2 1 1 3 1122 1 1 15 ASP HB3 H 3.007 2.380 -5.373 1.00 . A A . 15 ASP HB3 1 1 3 1123 1 1 15 ASP N N 1.725 5.113 -5.507 1.00 . A A . 15 ASP N 1 1 3 1124 1 1 15 ASP O O 0.051 2.170 -6.572 1.00 . A A . 15 ASP O 1 1 3 1125 1 1 15 ASP OD1 O 3.769 3.301 -8.387 1.00 . A A . 15 ASP OD1 1 1 3 1126 1 1 15 ASP OD2 O 3.689 1.305 -7.471 1.00 . A A . 15 ASP OD2 1 1 3 1127 1 1 16 CYS C C -2.001 2.167 -4.730 1.00 . A A . 16 CYS C 1 1 3 1128 1 1 16 CYS CA C -0.717 2.097 -3.914 1.00 . A A . 16 CYS CA 1 1 3 1129 1 1 16 CYS CB C -0.996 2.467 -2.453 1.00 . A A . 16 CYS CB 1 1 3 1130 1 1 16 CYS H H 0.807 3.571 -3.895 1.00 . A A . 16 CYS H 1 1 3 1131 1 1 16 CYS HA H -0.347 1.083 -3.950 1.00 . A A . 16 CYS HA 1 1 3 1132 1 1 16 CYS HB2 H -0.107 2.872 -2.022 1.00 . A A . 16 CYS HB2 1 1 3 1133 1 1 16 CYS HB3 H -1.769 3.214 -2.415 1.00 . A A . 16 CYS HB3 1 1 3 1134 1 1 16 CYS N N 0.316 2.960 -4.483 1.00 . A A . 16 CYS N 1 1 3 1135 1 1 16 CYS O O -2.122 2.966 -5.658 1.00 . A A . 16 CYS O 1 1 3 1136 1 1 16 CYS SG S -1.517 1.064 -1.405 1.00 . A A . 16 CYS SG 1 1 3 1137 1 1 17 LEU C C -5.377 1.635 -4.145 1.00 . A A . 17 LEU C 1 1 3 1138 1 1 17 LEU CA C -4.231 1.261 -5.076 1.00 . A A . 17 LEU CA 1 1 3 1139 1 1 17 LEU CB C -4.463 -0.138 -5.649 1.00 . A A . 17 LEU CB 1 1 3 1140 1 1 17 LEU CD1 C -5.566 -2.237 -4.824 1.00 . A A . 17 LEU CD1 1 1 3 1141 1 1 17 LEU CD2 C -3.077 -2.013 -4.723 1.00 . A A . 17 LEU CD2 1 1 3 1142 1 1 17 LEU CG C -4.404 -1.274 -4.625 1.00 . A A . 17 LEU CG 1 1 3 1143 1 1 17 LEU H H -2.785 0.705 -3.631 1.00 . A A . 17 LEU H 1 1 3 1144 1 1 17 LEU HA H -4.196 1.972 -5.888 1.00 . A A . 17 LEU HA 1 1 3 1145 1 1 17 LEU HB2 H -5.435 -0.152 -6.120 1.00 . A A . 17 LEU HB2 1 1 3 1146 1 1 17 LEU HB3 H -3.714 -0.323 -6.404 1.00 . A A . 17 LEU HB3 1 1 3 1147 1 1 17 LEU HD11 H -6.429 -1.691 -5.176 1.00 . A A . 17 LEU HD11 1 1 3 1148 1 1 17 LEU HD12 H -5.292 -2.986 -5.551 1.00 . A A . 17 LEU HD12 1 1 3 1149 1 1 17 LEU HD13 H -5.801 -2.715 -3.885 1.00 . A A . 17 LEU HD13 1 1 3 1150 1 1 17 LEU HD21 H -2.929 -2.354 -5.736 1.00 . A A . 17 LEU HD21 1 1 3 1151 1 1 17 LEU HD22 H -2.273 -1.345 -4.447 1.00 . A A . 17 LEU HD22 1 1 3 1152 1 1 17 LEU HD23 H -3.087 -2.861 -4.055 1.00 . A A . 17 LEU HD23 1 1 3 1153 1 1 17 LEU HG H -4.484 -0.858 -3.632 1.00 . A A . 17 LEU HG 1 1 3 1154 1 1 17 LEU N N -2.952 1.316 -4.378 1.00 . A A . 17 LEU N 1 1 3 1155 1 1 17 LEU O O -5.184 1.795 -2.940 1.00 . A A . 17 LEU O 1 1 3 1156 1 1 18 ALA C C -7.482 3.385 -3.092 1.00 . A A . 18 ALA C 1 1 3 1157 1 1 18 ALA CA C -7.749 2.130 -3.932 1.00 . A A . 18 ALA CA 1 1 3 1158 1 1 18 ALA CB C -8.173 0.952 -3.063 1.00 . A A . 18 ALA CB 1 1 3 1159 1 1 18 ALA H H -6.663 1.635 -5.678 1.00 . A A . 18 ALA H 1 1 3 1160 1 1 18 ALA HA H -8.552 2.342 -4.625 1.00 . A A . 18 ALA HA 1 1 3 1161 1 1 18 ALA HB1 H -8.338 0.087 -3.685 1.00 . A A . 18 ALA HB1 1 1 3 1162 1 1 18 ALA HB2 H -9.087 1.200 -2.542 1.00 . A A . 18 ALA HB2 1 1 3 1163 1 1 18 ALA HB3 H -7.397 0.737 -2.343 1.00 . A A . 18 ALA HB3 1 1 3 1164 1 1 18 ALA N N -6.572 1.774 -4.712 1.00 . A A . 18 ALA N 1 1 3 1165 1 1 18 ALA O O -7.092 4.420 -3.631 1.00 . A A . 18 ALA O 1 1 3 1166 1 1 19 GLU C C -6.469 4.072 0.207 1.00 . A A . 19 GLU C 1 1 3 1167 1 1 19 GLU CA C -7.458 4.433 -0.898 1.00 . A A . 19 GLU CA 1 1 3 1168 1 1 19 GLU CB C -8.781 4.905 -0.289 1.00 . A A . 19 GLU CB 1 1 3 1169 1 1 19 GLU CD C -9.583 6.850 1.108 1.00 . A A . 19 GLU CD 1 1 3 1170 1 1 19 GLU CG C -8.891 6.416 -0.170 1.00 . A A . 19 GLU CG 1 1 3 1171 1 1 19 GLU H H -7.995 2.451 -1.393 1.00 . A A . 19 GLU H 1 1 3 1172 1 1 19 GLU HA H -7.040 5.233 -1.491 1.00 . A A . 19 GLU HA 1 1 3 1173 1 1 19 GLU HB2 H -9.594 4.553 -0.908 1.00 . A A . 19 GLU HB2 1 1 3 1174 1 1 19 GLU HB3 H -8.881 4.479 0.698 1.00 . A A . 19 GLU HB3 1 1 3 1175 1 1 19 GLU HG2 H -7.899 6.839 -0.186 1.00 . A A . 19 GLU HG2 1 1 3 1176 1 1 19 GLU HG3 H -9.455 6.790 -1.013 1.00 . A A . 19 GLU HG3 1 1 3 1177 1 1 19 GLU N N -7.687 3.296 -1.779 1.00 . A A . 19 GLU N 1 1 3 1178 1 1 19 GLU O O -6.774 4.206 1.393 1.00 . A A . 19 GLU O 1 1 3 1179 1 1 19 GLU OE1 O -9.425 6.156 2.134 1.00 . A A . 19 GLU OE1 1 1 3 1180 1 1 19 GLU OE2 O -10.282 7.885 1.081 1.00 . A A . 19 GLU OE2 1 1 3 1181 1 1 20 CYS C C -2.922 3.868 0.386 1.00 . A A . 20 CYS C 1 1 3 1182 1 1 20 CYS CA C -4.255 3.248 0.778 1.00 . A A . 20 CYS CA 1 1 3 1183 1 1 20 CYS CB C -4.127 1.726 0.866 1.00 . A A . 20 CYS CB 1 1 3 1184 1 1 20 CYS H H -5.084 3.535 -1.144 1.00 . A A . 20 CYS H 1 1 3 1185 1 1 20 CYS HA H -4.548 3.634 1.742 1.00 . A A . 20 CYS HA 1 1 3 1186 1 1 20 CYS HB2 H -4.617 1.280 0.012 1.00 . A A . 20 CYS HB2 1 1 3 1187 1 1 20 CYS HB3 H -3.081 1.456 0.855 1.00 . A A . 20 CYS HB3 1 1 3 1188 1 1 20 CYS N N -5.281 3.618 -0.185 1.00 . A A . 20 CYS N 1 1 3 1189 1 1 20 CYS O O -2.860 4.699 -0.521 1.00 . A A . 20 CYS O 1 1 3 1190 1 1 20 CYS SG S -4.871 1.009 2.366 1.00 . A A . 20 CYS SG 1 1 3 1191 1 1 21 VAL C C 0.497 2.894 0.633 1.00 . A A . 21 VAL C 1 1 3 1192 1 1 21 VAL CA C -0.540 4.002 0.774 1.00 . A A . 21 VAL CA 1 1 3 1193 1 1 21 VAL CB C -0.080 4.999 1.858 1.00 . A A . 21 VAL CB 1 1 3 1194 1 1 21 VAL CG1 C -1.090 6.126 2.007 1.00 . A A . 21 VAL CG1 1 1 3 1195 1 1 21 VAL CG2 C 0.137 4.290 3.187 1.00 . A A . 21 VAL CG2 1 1 3 1196 1 1 21 VAL H H -1.964 2.806 1.782 1.00 . A A . 21 VAL H 1 1 3 1197 1 1 21 VAL HA H -0.604 4.535 -0.164 1.00 . A A . 21 VAL HA 1 1 3 1198 1 1 21 VAL HB H 0.861 5.431 1.544 1.00 . A A . 21 VAL HB 1 1 3 1199 1 1 21 VAL HG11 H -2.085 5.710 2.077 1.00 . A A . 21 VAL HG11 1 1 3 1200 1 1 21 VAL HG12 H -0.873 6.688 2.903 1.00 . A A . 21 VAL HG12 1 1 3 1201 1 1 21 VAL HG13 H -1.032 6.779 1.149 1.00 . A A . 21 VAL HG13 1 1 3 1202 1 1 21 VAL HG21 H -0.478 3.404 3.227 1.00 . A A . 21 VAL HG21 1 1 3 1203 1 1 21 VAL HG22 H 1.176 4.012 3.282 1.00 . A A . 21 VAL HG22 1 1 3 1204 1 1 21 VAL HG23 H -0.133 4.953 3.996 1.00 . A A . 21 VAL HG23 1 1 3 1205 1 1 21 VAL N N -1.859 3.469 1.067 1.00 . A A . 21 VAL N 1 1 3 1206 1 1 21 VAL O O 0.304 1.776 1.107 1.00 . A A . 21 VAL O 1 1 3 1207 1 1 22 CYS C C 3.803 2.538 0.784 1.00 . A A . 22 CYS C 1 1 3 1208 1 1 22 CYS CA C 2.697 2.297 -0.239 1.00 . A A . 22 CYS CA 1 1 3 1209 1 1 22 CYS CB C 3.252 2.450 -1.662 1.00 . A A . 22 CYS CB 1 1 3 1210 1 1 22 CYS H H 1.671 4.141 -0.359 1.00 . A A . 22 CYS H 1 1 3 1211 1 1 22 CYS HA H 2.314 1.295 -0.113 1.00 . A A . 22 CYS HA 1 1 3 1212 1 1 22 CYS HB2 H 3.258 3.492 -1.927 1.00 . A A . 22 CYS HB2 1 1 3 1213 1 1 22 CYS HB3 H 4.262 2.078 -1.695 1.00 . A A . 22 CYS HB3 1 1 3 1214 1 1 22 CYS N N 1.597 3.233 -0.019 1.00 . A A . 22 CYS N 1 1 3 1215 1 1 22 CYS O O 4.180 3.681 1.045 1.00 . A A . 22 CYS O 1 1 3 1216 1 1 22 CYS SG S 2.293 1.571 -2.935 1.00 . A A . 22 CYS SG 1 1 3 1217 1 1 23 LEU C C 6.727 1.265 1.789 1.00 . A A . 23 LEU C 1 1 3 1218 1 1 23 LEU CA C 5.354 1.560 2.382 1.00 . A A . 23 LEU CA 1 1 3 1219 1 1 23 LEU CB C 5.063 0.598 3.536 1.00 . A A . 23 LEU CB 1 1 3 1220 1 1 23 LEU CD1 C 3.229 -0.751 4.596 1.00 . A A . 23 LEU CD1 1 1 3 1221 1 1 23 LEU CD2 C 3.430 1.694 5.090 1.00 . A A . 23 LEU CD2 1 1 3 1222 1 1 23 LEU CG C 3.617 0.611 4.038 1.00 . A A . 23 LEU CG 1 1 3 1223 1 1 23 LEU H H 3.955 0.576 1.134 1.00 . A A . 23 LEU H 1 1 3 1224 1 1 23 LEU HA H 5.350 2.570 2.762 1.00 . A A . 23 LEU HA 1 1 3 1225 1 1 23 LEU HB2 H 5.303 -0.405 3.211 1.00 . A A . 23 LEU HB2 1 1 3 1226 1 1 23 LEU HB3 H 5.709 0.856 4.361 1.00 . A A . 23 LEU HB3 1 1 3 1227 1 1 23 LEU HD11 H 4.090 -1.402 4.592 1.00 . A A . 23 LEU HD11 1 1 3 1228 1 1 23 LEU HD12 H 2.868 -0.639 5.607 1.00 . A A . 23 LEU HD12 1 1 3 1229 1 1 23 LEU HD13 H 2.451 -1.182 3.983 1.00 . A A . 23 LEU HD13 1 1 3 1230 1 1 23 LEU HD21 H 3.965 2.584 4.790 1.00 . A A . 23 LEU HD21 1 1 3 1231 1 1 23 LEU HD22 H 2.379 1.923 5.189 1.00 . A A . 23 LEU HD22 1 1 3 1232 1 1 23 LEU HD23 H 3.813 1.346 6.038 1.00 . A A . 23 LEU HD23 1 1 3 1233 1 1 23 LEU HG H 2.959 0.831 3.210 1.00 . A A . 23 LEU HG 1 1 3 1234 1 1 23 LEU N N 4.306 1.459 1.373 1.00 . A A . 23 LEU N 1 1 3 1235 1 1 23 LEU O O 6.866 0.427 0.897 1.00 . A A . 23 LEU O 1 1 3 1236 1 1 24 GLU C C 9.568 0.352 1.926 1.00 . A A . 24 GLU C 1 1 3 1237 1 1 24 GLU CA C 9.109 1.803 1.820 1.00 . A A . 24 GLU CA 1 1 3 1238 1 1 24 GLU CB C 10.056 2.707 2.615 1.00 . A A . 24 GLU CB 1 1 3 1239 1 1 24 GLU CD C 10.787 3.520 4.891 1.00 . A A . 24 GLU CD 1 1 3 1240 1 1 24 GLU CG C 9.980 2.496 4.118 1.00 . A A . 24 GLU CG 1 1 3 1241 1 1 24 GLU H H 7.556 2.623 2.999 1.00 . A A . 24 GLU H 1 1 3 1242 1 1 24 GLU HA H 9.137 2.100 0.782 1.00 . A A . 24 GLU HA 1 1 3 1243 1 1 24 GLU HB2 H 11.071 2.513 2.296 1.00 . A A . 24 GLU HB2 1 1 3 1244 1 1 24 GLU HB3 H 9.813 3.737 2.405 1.00 . A A . 24 GLU HB3 1 1 3 1245 1 1 24 GLU HG2 H 8.948 2.565 4.427 1.00 . A A . 24 GLU HG2 1 1 3 1246 1 1 24 GLU HG3 H 10.358 1.511 4.350 1.00 . A A . 24 GLU HG3 1 1 3 1247 1 1 24 GLU N N 7.739 1.970 2.293 1.00 . A A . 24 GLU N 1 1 3 1248 1 1 24 GLU O O 10.122 -0.202 0.978 1.00 . A A . 24 GLU O 1 1 3 1249 1 1 24 GLU OE1 O 11.701 4.129 4.296 1.00 . A A . 24 GLU OE1 1 1 3 1250 1 1 24 GLU OE2 O 10.506 3.713 6.093 1.00 . A A . 24 GLU OE2 1 1 3 1251 1 1 25 HIS C C 9.182 -2.544 2.192 1.00 . A A . 25 HIS C 1 1 3 1252 1 1 25 HIS CA C 9.738 -1.653 3.297 1.00 . A A . 25 HIS CA 1 1 3 1253 1 1 25 HIS CB C 9.286 -2.174 4.670 1.00 . A A . 25 HIS CB 1 1 3 1254 1 1 25 HIS CD2 C 6.772 -1.800 5.202 1.00 . A A . 25 HIS CD2 1 1 3 1255 1 1 25 HIS CE1 C 6.963 0.054 6.355 1.00 . A A . 25 HIS CE1 1 1 3 1256 1 1 25 HIS CG C 8.087 -1.478 5.240 1.00 . A A . 25 HIS CG 1 1 3 1257 1 1 25 HIS H H 8.894 0.226 3.805 1.00 . A A . 25 HIS H 1 1 3 1258 1 1 25 HIS HA H 10.816 -1.690 3.250 1.00 . A A . 25 HIS HA 1 1 3 1259 1 1 25 HIS HB2 H 9.044 -3.222 4.583 1.00 . A A . 25 HIS HB2 1 1 3 1260 1 1 25 HIS HB3 H 10.100 -2.059 5.371 1.00 . A A . 25 HIS HB3 1 1 3 1261 1 1 25 HIS HD1 H 8.997 0.177 6.174 1.00 . A A . 25 HIS HD1 1 1 3 1262 1 1 25 HIS HD2 H 6.336 -2.658 4.710 1.00 . A A . 25 HIS HD2 1 1 3 1263 1 1 25 HIS HE1 H 6.725 0.930 6.941 1.00 . A A . 25 HIS HE1 1 1 3 1264 1 1 25 HIS HE2 H 5.153 -0.880 6.168 1.00 . A A . 25 HIS HE2 1 1 3 1265 1 1 25 HIS N N 9.338 -0.263 3.085 1.00 . A A . 25 HIS N 1 1 3 1266 1 1 25 HIS ND1 N 8.173 -0.311 5.968 1.00 . A A . 25 HIS ND1 1 1 3 1267 1 1 25 HIS NE2 N 6.095 -0.831 5.902 1.00 . A A . 25 HIS NE2 1 1 3 1268 1 1 25 HIS O O 9.755 -3.585 1.871 1.00 . A A . 25 HIS O 1 1 3 1269 1 1 26 GLY C C 6.129 -3.477 0.905 1.00 . A A . 26 GLY C 1 1 3 1270 1 1 26 GLY CA C 7.468 -2.875 0.529 1.00 . A A . 26 GLY CA 1 1 3 1271 1 1 26 GLY H H 7.666 -1.274 1.893 1.00 . A A . 26 GLY H 1 1 3 1272 1 1 26 GLY HA2 H 8.140 -3.671 0.244 1.00 . A A . 26 GLY HA2 1 1 3 1273 1 1 26 GLY HA3 H 7.328 -2.218 -0.314 1.00 . A A . 26 GLY HA3 1 1 3 1274 1 1 26 GLY N N 8.072 -2.117 1.604 1.00 . A A . 26 GLY N 1 1 3 1275 1 1 26 GLY O O 5.989 -4.698 0.968 1.00 . A A . 26 GLY O 1 1 3 1276 1 1 27 TYR C C 2.786 -1.942 1.403 1.00 . A A . 27 TYR C 1 1 3 1277 1 1 27 TYR CA C 3.800 -3.079 1.505 1.00 . A A . 27 TYR CA 1 1 3 1278 1 1 27 TYR CB C 3.792 -3.652 2.923 1.00 . A A . 27 TYR CB 1 1 3 1279 1 1 27 TYR CD1 C 3.887 -6.036 2.097 1.00 . A A . 27 TYR CD1 1 1 3 1280 1 1 27 TYR CD2 C 5.189 -5.454 4.007 1.00 . A A . 27 TYR CD2 1 1 3 1281 1 1 27 TYR CE1 C 4.350 -7.337 2.173 1.00 . A A . 27 TYR CE1 1 1 3 1282 1 1 27 TYR CE2 C 5.655 -6.751 4.090 1.00 . A A . 27 TYR CE2 1 1 3 1283 1 1 27 TYR CG C 4.298 -5.075 3.010 1.00 . A A . 27 TYR CG 1 1 3 1284 1 1 27 TYR CZ C 5.234 -7.690 3.171 1.00 . A A . 27 TYR CZ 1 1 3 1285 1 1 27 TYR H H 5.310 -1.659 1.069 1.00 . A A . 27 TYR H 1 1 3 1286 1 1 27 TYR HA H 3.519 -3.858 0.811 1.00 . A A . 27 TYR HA 1 1 3 1287 1 1 27 TYR HB2 H 4.418 -3.041 3.550 1.00 . A A . 27 TYR HB2 1 1 3 1288 1 1 27 TYR HB3 H 2.782 -3.634 3.304 1.00 . A A . 27 TYR HB3 1 1 3 1289 1 1 27 TYR HD1 H 3.195 -5.758 1.315 1.00 . A A . 27 TYR HD1 1 1 3 1290 1 1 27 TYR HD2 H 5.517 -4.718 4.726 1.00 . A A . 27 TYR HD2 1 1 3 1291 1 1 27 TYR HE1 H 4.019 -8.070 1.454 1.00 . A A . 27 TYR HE1 1 1 3 1292 1 1 27 TYR HE2 H 6.347 -7.027 4.872 1.00 . A A . 27 TYR HE2 1 1 3 1293 1 1 27 TYR HH H 5.376 -9.389 4.059 1.00 . A A . 27 TYR HH 1 1 3 1294 1 1 27 TYR N N 5.138 -2.621 1.144 1.00 . A A . 27 TYR N 1 1 3 1295 1 1 27 TYR O O 3.105 -0.787 1.682 1.00 . A A . 27 TYR O 1 1 3 1296 1 1 27 TYR OH O 5.696 -8.982 3.250 1.00 . A A . 27 TYR OH 1 1 3 1297 1 1 28 CYS C C -0.410 -1.309 2.094 1.00 . A A . 28 CYS C 1 1 3 1298 1 1 28 CYS CA C 0.499 -1.288 0.869 1.00 . A A . 28 CYS CA 1 1 3 1299 1 1 28 CYS CB C -0.329 -1.558 -0.391 1.00 . A A . 28 CYS CB 1 1 3 1300 1 1 28 CYS H H 1.374 -3.217 0.794 1.00 . A A . 28 CYS H 1 1 3 1301 1 1 28 CYS HA H 0.959 -0.315 0.790 1.00 . A A . 28 CYS HA 1 1 3 1302 1 1 28 CYS HB2 H -0.067 -2.529 -0.783 1.00 . A A . 28 CYS HB2 1 1 3 1303 1 1 28 CYS HB3 H -1.379 -1.552 -0.132 1.00 . A A . 28 CYS HB3 1 1 3 1304 1 1 28 CYS N N 1.564 -2.280 1.005 1.00 . A A . 28 CYS N 1 1 3 1305 1 1 28 CYS O O -1.104 -2.293 2.349 1.00 . A A . 28 CYS O 1 1 3 1306 1 1 28 CYS SG S -0.083 -0.341 -1.726 1.00 . A A . 28 CYS SG 1 1 3 1307 1 1 29 GLY C C -1.812 1.253 4.241 1.00 . A A . 29 GLY C 1 1 3 1308 1 1 29 GLY CA C -1.226 -0.131 4.040 1.00 . A A . 29 GLY CA 1 1 3 1309 1 1 29 GLY H H 0.174 0.538 2.598 1.00 . A A . 29 GLY H 1 1 3 1310 1 1 29 GLY HA2 H -0.626 -0.382 4.900 1.00 . A A . 29 GLY HA2 1 1 3 1311 1 1 29 GLY HA3 H -2.033 -0.843 3.955 1.00 . A A . 29 GLY HA3 1 1 3 1312 1 1 29 GLY N N -0.400 -0.216 2.850 1.00 . A A . 29 GLY N 1 1 3 1313 1 1 29 GLY O O -1.928 1.684 5.407 1.00 . A A . 29 GLY O 1 1 3 1314 1 1 29 GLY OXT O -2.156 1.905 3.232 1.00 . A A . 29 GLY OXT 1 1 4 1315 1 1 1 ARG C C -8.253 1.887 4.510 1.00 . A A . 1 ARG C 1 1 4 1316 1 1 1 ARG CA C -7.499 3.012 5.211 1.00 . A A . 1 ARG CA 1 1 4 1317 1 1 1 ARG CB C -8.452 3.814 6.100 1.00 . A A . 1 ARG CB 1 1 4 1318 1 1 1 ARG CD C -8.177 4.579 8.481 1.00 . A A . 1 ARG CD 1 1 4 1319 1 1 1 ARG CG C -8.418 3.392 7.561 1.00 . A A . 1 ARG CG 1 1 4 1320 1 1 1 ARG CZ C -10.358 4.883 9.588 1.00 . A A . 1 ARG CZ 1 1 4 1321 1 1 1 ARG H1 H -7.601 4.165 3.511 1.00 . A A . 1 ARG H1 1 1 4 1322 1 1 1 ARG H2 H -6.578 4.790 4.738 1.00 . A A . 1 ARG H2 1 1 4 1323 1 1 1 ARG H3 H -6.068 3.450 3.800 1.00 . A A . 1 ARG H3 1 1 4 1324 1 1 1 ARG HA H -6.717 2.586 5.821 1.00 . A A . 1 ARG HA 1 1 4 1325 1 1 1 ARG HB2 H -8.186 4.859 6.041 1.00 . A A . 1 ARG HB2 1 1 4 1326 1 1 1 ARG HB3 H -9.460 3.686 5.734 1.00 . A A . 1 ARG HB3 1 1 4 1327 1 1 1 ARG HD2 H -7.765 4.219 9.413 1.00 . A A . 1 ARG HD2 1 1 4 1328 1 1 1 ARG HD3 H -7.470 5.245 8.009 1.00 . A A . 1 ARG HD3 1 1 4 1329 1 1 1 ARG HE H -9.535 6.174 8.307 1.00 . A A . 1 ARG HE 1 1 4 1330 1 1 1 ARG HG2 H -9.364 2.940 7.817 1.00 . A A . 1 ARG HG2 1 1 4 1331 1 1 1 ARG HG3 H -7.624 2.673 7.699 1.00 . A A . 1 ARG HG3 1 1 4 1332 1 1 1 ARG HH11 H -9.403 3.168 10.075 1.00 . A A . 1 ARG HH11 1 1 4 1333 1 1 1 ARG HH12 H -10.938 3.406 10.840 1.00 . A A . 1 ARG HH12 1 1 4 1334 1 1 1 ARG HH21 H -11.554 6.488 9.313 1.00 . A A . 1 ARG HH21 1 1 4 1335 1 1 1 ARG HH22 H -12.160 5.290 10.407 1.00 . A A . 1 ARG HH22 1 1 4 1336 1 1 1 ARG N N -6.880 3.938 4.226 1.00 . A A . 1 ARG N 1 1 4 1337 1 1 1 ARG NE N -9.409 5.314 8.760 1.00 . A A . 1 ARG NE 1 1 4 1338 1 1 1 ARG NH1 N -10.221 3.724 10.219 1.00 . A A . 1 ARG NH1 1 1 4 1339 1 1 1 ARG NH2 N -11.446 5.614 9.785 1.00 . A A . 1 ARG NH2 1 1 4 1340 1 1 1 ARG O O -7.985 0.708 4.743 1.00 . A A . 1 ARG O 1 1 4 1341 1 1 2 VAL C C -9.235 0.767 1.696 1.00 . A A . 2 VAL C 1 1 4 1342 1 1 2 VAL CA C -9.991 1.279 2.918 1.00 . A A . 2 VAL CA 1 1 4 1343 1 1 2 VAL CB C -11.338 1.872 2.463 1.00 . A A . 2 VAL CB 1 1 4 1344 1 1 2 VAL CG1 C -12.282 2.022 3.646 1.00 . A A . 2 VAL CG1 1 1 4 1345 1 1 2 VAL CG2 C -11.128 3.207 1.764 1.00 . A A . 2 VAL CG2 1 1 4 1346 1 1 2 VAL H H -9.365 3.214 3.510 1.00 . A A . 2 VAL H 1 1 4 1347 1 1 2 VAL HA H -10.191 0.450 3.579 1.00 . A A . 2 VAL HA 1 1 4 1348 1 1 2 VAL HB H -11.789 1.188 1.757 1.00 . A A . 2 VAL HB 1 1 4 1349 1 1 2 VAL HG11 H -12.360 1.080 4.167 1.00 . A A . 2 VAL HG11 1 1 4 1350 1 1 2 VAL HG12 H -11.899 2.775 4.318 1.00 . A A . 2 VAL HG12 1 1 4 1351 1 1 2 VAL HG13 H -13.259 2.320 3.292 1.00 . A A . 2 VAL HG13 1 1 4 1352 1 1 2 VAL HG21 H -10.088 3.313 1.495 1.00 . A A . 2 VAL HG21 1 1 4 1353 1 1 2 VAL HG22 H -11.737 3.246 0.873 1.00 . A A . 2 VAL HG22 1 1 4 1354 1 1 2 VAL HG23 H -11.411 4.010 2.429 1.00 . A A . 2 VAL HG23 1 1 4 1355 1 1 2 VAL N N -9.198 2.259 3.652 1.00 . A A . 2 VAL N 1 1 4 1356 1 1 2 VAL O O -9.033 1.498 0.726 1.00 . A A . 2 VAL O 1 1 4 1357 1 1 3 CYS C C -7.886 -2.603 0.894 1.00 . A A . 3 CYS C 1 1 4 1358 1 1 3 CYS CA C -8.088 -1.108 0.649 1.00 . A A . 3 CYS CA 1 1 4 1359 1 1 3 CYS CB C -6.732 -0.419 0.462 1.00 . A A . 3 CYS CB 1 1 4 1360 1 1 3 CYS H H -9.014 -1.027 2.551 1.00 . A A . 3 CYS H 1 1 4 1361 1 1 3 CYS HA H -8.673 -0.976 -0.249 1.00 . A A . 3 CYS HA 1 1 4 1362 1 1 3 CYS HB2 H -6.295 -0.750 -0.468 1.00 . A A . 3 CYS HB2 1 1 4 1363 1 1 3 CYS HB3 H -6.885 0.651 0.419 1.00 . A A . 3 CYS HB3 1 1 4 1364 1 1 3 CYS N N -8.821 -0.495 1.750 1.00 . A A . 3 CYS N 1 1 4 1365 1 1 3 CYS O O -7.439 -3.005 1.968 1.00 . A A . 3 CYS O 1 1 4 1366 1 1 3 CYS SG S -5.528 -0.755 1.789 1.00 . A A . 3 CYS SG 1 1 4 1367 1 1 4 PRO C C -6.722 -5.301 0.636 1.00 . A A . 4 PRO C 1 1 4 1368 1 1 4 PRO CA C -8.061 -4.905 0.024 1.00 . A A . 4 PRO CA 1 1 4 1369 1 1 4 PRO CB C -8.149 -5.383 -1.424 1.00 . A A . 4 PRO CB 1 1 4 1370 1 1 4 PRO CD C -8.754 -3.065 -1.419 1.00 . A A . 4 PRO CD 1 1 4 1371 1 1 4 PRO CG C -9.030 -4.386 -2.091 1.00 . A A . 4 PRO CG 1 1 4 1372 1 1 4 PRO HA H -8.864 -5.342 0.601 1.00 . A A . 4 PRO HA 1 1 4 1373 1 1 4 PRO HB2 H -7.161 -5.396 -1.861 1.00 . A A . 4 PRO HB2 1 1 4 1374 1 1 4 PRO HB3 H -8.577 -6.373 -1.454 1.00 . A A . 4 PRO HB3 1 1 4 1375 1 1 4 PRO HD2 H -8.025 -2.502 -1.983 1.00 . A A . 4 PRO HD2 1 1 4 1376 1 1 4 PRO HD3 H -9.667 -2.500 -1.310 1.00 . A A . 4 PRO HD3 1 1 4 1377 1 1 4 PRO HG2 H -8.790 -4.329 -3.142 1.00 . A A . 4 PRO HG2 1 1 4 1378 1 1 4 PRO HG3 H -10.066 -4.664 -1.956 1.00 . A A . 4 PRO HG3 1 1 4 1379 1 1 4 PRO N N -8.214 -3.452 -0.099 1.00 . A A . 4 PRO N 1 1 4 1380 1 1 4 PRO O O -5.665 -4.879 0.167 1.00 . A A . 4 PRO O 1 1 4 1381 1 1 5 ARG C C -4.723 -7.440 1.438 1.00 . A A . 5 ARG C 1 1 4 1382 1 1 5 ARG CA C -5.562 -6.563 2.360 1.00 . A A . 5 ARG CA 1 1 4 1383 1 1 5 ARG CB C -5.915 -7.333 3.634 1.00 . A A . 5 ARG CB 1 1 4 1384 1 1 5 ARG CD C -8.181 -8.157 4.350 1.00 . A A . 5 ARG CD 1 1 4 1385 1 1 5 ARG CG C -6.992 -8.386 3.430 1.00 . A A . 5 ARG CG 1 1 4 1386 1 1 5 ARG CZ C -9.731 -9.551 5.664 1.00 . A A . 5 ARG CZ 1 1 4 1387 1 1 5 ARG H H -7.645 -6.416 2.017 1.00 . A A . 5 ARG H 1 1 4 1388 1 1 5 ARG HA H -4.987 -5.688 2.627 1.00 . A A . 5 ARG HA 1 1 4 1389 1 1 5 ARG HB2 H -5.026 -7.824 4.002 1.00 . A A . 5 ARG HB2 1 1 4 1390 1 1 5 ARG HB3 H -6.262 -6.631 4.380 1.00 . A A . 5 ARG HB3 1 1 4 1391 1 1 5 ARG HD2 H -7.826 -7.735 5.278 1.00 . A A . 5 ARG HD2 1 1 4 1392 1 1 5 ARG HD3 H -8.859 -7.462 3.875 1.00 . A A . 5 ARG HD3 1 1 4 1393 1 1 5 ARG HE H -8.753 -10.154 4.032 1.00 . A A . 5 ARG HE 1 1 4 1394 1 1 5 ARG HG2 H -7.331 -8.347 2.405 1.00 . A A . 5 ARG HG2 1 1 4 1395 1 1 5 ARG HG3 H -6.573 -9.360 3.636 1.00 . A A . 5 ARG HG3 1 1 4 1396 1 1 5 ARG HH11 H -9.495 -7.670 6.369 1.00 . A A . 5 ARG HH11 1 1 4 1397 1 1 5 ARG HH12 H -10.580 -8.670 7.274 1.00 . A A . 5 ARG HH12 1 1 4 1398 1 1 5 ARG HH21 H -10.180 -11.471 5.223 1.00 . A A . 5 ARG HH21 1 1 4 1399 1 1 5 ARG HH22 H -10.968 -10.829 6.624 1.00 . A A . 5 ARG HH22 1 1 4 1400 1 1 5 ARG N N -6.774 -6.113 1.687 1.00 . A A . 5 ARG N 1 1 4 1401 1 1 5 ARG NE N -8.899 -9.397 4.637 1.00 . A A . 5 ARG NE 1 1 4 1402 1 1 5 ARG NH1 N -9.953 -8.547 6.504 1.00 . A A . 5 ARG NH1 1 1 4 1403 1 1 5 ARG NH2 N -10.343 -10.712 5.852 1.00 . A A . 5 ARG NH2 1 1 4 1404 1 1 5 ARG O O -4.750 -8.667 1.536 1.00 . A A . 5 ARG O 1 1 4 1405 1 1 6 ILE C C -1.709 -6.963 -0.388 1.00 . A A . 6 ILE C 1 1 4 1406 1 1 6 ILE CA C -3.127 -7.520 -0.398 1.00 . A A . 6 ILE CA 1 1 4 1407 1 1 6 ILE CB C -3.686 -7.444 -1.832 1.00 . A A . 6 ILE CB 1 1 4 1408 1 1 6 ILE CD1 C -5.462 -9.187 -1.299 1.00 . A A . 6 ILE CD1 1 1 4 1409 1 1 6 ILE CG1 C -5.172 -7.806 -1.844 1.00 . A A . 6 ILE CG1 1 1 4 1410 1 1 6 ILE CG2 C -2.902 -8.366 -2.754 1.00 . A A . 6 ILE CG2 1 1 4 1411 1 1 6 ILE H H -4.000 -5.822 0.514 1.00 . A A . 6 ILE H 1 1 4 1412 1 1 6 ILE HA H -3.099 -8.556 -0.098 1.00 . A A . 6 ILE HA 1 1 4 1413 1 1 6 ILE HB H -3.566 -6.433 -2.189 1.00 . A A . 6 ILE HB 1 1 4 1414 1 1 6 ILE HD11 H -4.535 -9.671 -1.033 1.00 . A A . 6 ILE HD11 1 1 4 1415 1 1 6 ILE HD12 H -6.090 -9.105 -0.424 1.00 . A A . 6 ILE HD12 1 1 4 1416 1 1 6 ILE HD13 H -5.969 -9.772 -2.053 1.00 . A A . 6 ILE HD13 1 1 4 1417 1 1 6 ILE HG12 H -5.715 -7.092 -1.243 1.00 . A A . 6 ILE HG12 1 1 4 1418 1 1 6 ILE HG13 H -5.537 -7.765 -2.859 1.00 . A A . 6 ILE HG13 1 1 4 1419 1 1 6 ILE HG21 H -2.494 -9.186 -2.181 1.00 . A A . 6 ILE HG21 1 1 4 1420 1 1 6 ILE HG22 H -3.559 -8.754 -3.519 1.00 . A A . 6 ILE HG22 1 1 4 1421 1 1 6 ILE HG23 H -2.098 -7.814 -3.216 1.00 . A A . 6 ILE HG23 1 1 4 1422 1 1 6 ILE N N -3.977 -6.801 0.543 1.00 . A A . 6 ILE N 1 1 4 1423 1 1 6 ILE O O -1.507 -5.750 -0.440 1.00 . A A . 6 ILE O 1 1 4 1424 1 1 7 LEU C C 1.020 -6.625 -1.533 1.00 . A A . 7 LEU C 1 1 4 1425 1 1 7 LEU CA C 0.674 -7.454 -0.301 1.00 . A A . 7 LEU CA 1 1 4 1426 1 1 7 LEU CB C 1.578 -8.686 -0.235 1.00 . A A . 7 LEU CB 1 1 4 1427 1 1 7 LEU CD1 C 2.224 -10.832 0.882 1.00 . A A . 7 LEU CD1 1 1 4 1428 1 1 7 LEU CD2 C 1.644 -8.831 2.268 1.00 . A A . 7 LEU CD2 1 1 4 1429 1 1 7 LEU CG C 1.355 -9.588 0.979 1.00 . A A . 7 LEU CG 1 1 4 1430 1 1 7 LEU H H -0.951 -8.809 -0.279 1.00 . A A . 7 LEU H 1 1 4 1431 1 1 7 LEU HA H 0.836 -6.852 0.581 1.00 . A A . 7 LEU HA 1 1 4 1432 1 1 7 LEU HB2 H 1.417 -9.272 -1.128 1.00 . A A . 7 LEU HB2 1 1 4 1433 1 1 7 LEU HB3 H 2.604 -8.353 -0.224 1.00 . A A . 7 LEU HB3 1 1 4 1434 1 1 7 LEU HD11 H 2.182 -11.224 -0.123 1.00 . A A . 7 LEU HD11 1 1 4 1435 1 1 7 LEU HD12 H 3.244 -10.579 1.127 1.00 . A A . 7 LEU HD12 1 1 4 1436 1 1 7 LEU HD13 H 1.862 -11.579 1.574 1.00 . A A . 7 LEU HD13 1 1 4 1437 1 1 7 LEU HD21 H 1.780 -7.782 2.047 1.00 . A A . 7 LEU HD21 1 1 4 1438 1 1 7 LEU HD22 H 0.814 -8.950 2.948 1.00 . A A . 7 LEU HD22 1 1 4 1439 1 1 7 LEU HD23 H 2.542 -9.221 2.723 1.00 . A A . 7 LEU HD23 1 1 4 1440 1 1 7 LEU HG H 0.322 -9.904 1.000 1.00 . A A . 7 LEU HG 1 1 4 1441 1 1 7 LEU N N -0.728 -7.857 -0.319 1.00 . A A . 7 LEU N 1 1 4 1442 1 1 7 LEU O O 0.633 -6.967 -2.650 1.00 . A A . 7 LEU O 1 1 4 1443 1 1 8 LEU C C 3.282 -3.738 -1.997 1.00 . A A . 8 LEU C 1 1 4 1444 1 1 8 LEU CA C 2.149 -4.664 -2.422 1.00 . A A . 8 LEU CA 1 1 4 1445 1 1 8 LEU CB C 0.951 -3.841 -2.908 1.00 . A A . 8 LEU CB 1 1 4 1446 1 1 8 LEU CD1 C -0.648 -3.705 -4.834 1.00 . A A . 8 LEU CD1 1 1 4 1447 1 1 8 LEU CD2 C 1.537 -2.491 -4.936 1.00 . A A . 8 LEU CD2 1 1 4 1448 1 1 8 LEU CG C 0.817 -3.732 -4.428 1.00 . A A . 8 LEU CG 1 1 4 1449 1 1 8 LEU H H 2.034 -5.313 -0.408 1.00 . A A . 8 LEU H 1 1 4 1450 1 1 8 LEU HA H 2.495 -5.290 -3.230 1.00 . A A . 8 LEU HA 1 1 4 1451 1 1 8 LEU HB2 H 0.051 -4.293 -2.519 1.00 . A A . 8 LEU HB2 1 1 4 1452 1 1 8 LEU HB3 H 1.037 -2.845 -2.504 1.00 . A A . 8 LEU HB3 1 1 4 1453 1 1 8 LEU HD11 H -1.210 -4.371 -4.197 1.00 . A A . 8 LEU HD11 1 1 4 1454 1 1 8 LEU HD12 H -1.032 -2.700 -4.732 1.00 . A A . 8 LEU HD12 1 1 4 1455 1 1 8 LEU HD13 H -0.743 -4.023 -5.861 1.00 . A A . 8 LEU HD13 1 1 4 1456 1 1 8 LEU HD21 H 2.375 -2.273 -4.293 1.00 . A A . 8 LEU HD21 1 1 4 1457 1 1 8 LEU HD22 H 1.890 -2.667 -5.941 1.00 . A A . 8 LEU HD22 1 1 4 1458 1 1 8 LEU HD23 H 0.854 -1.654 -4.936 1.00 . A A . 8 LEU HD23 1 1 4 1459 1 1 8 LEU HG H 1.274 -4.596 -4.886 1.00 . A A . 8 LEU HG 1 1 4 1460 1 1 8 LEU N N 1.751 -5.536 -1.323 1.00 . A A . 8 LEU N 1 1 4 1461 1 1 8 LEU O O 3.097 -2.864 -1.150 1.00 . A A . 8 LEU O 1 1 4 1462 1 1 9 GLU C C 5.846 -2.043 -3.319 1.00 . A A . 9 GLU C 1 1 4 1463 1 1 9 GLU CA C 5.629 -3.129 -2.272 1.00 . A A . 9 GLU CA 1 1 4 1464 1 1 9 GLU CB C 6.873 -4.015 -2.178 1.00 . A A . 9 GLU CB 1 1 4 1465 1 1 9 GLU CD C 8.136 -5.903 -3.284 1.00 . A A . 9 GLU CD 1 1 4 1466 1 1 9 GLU CG C 7.235 -4.699 -3.486 1.00 . A A . 9 GLU CG 1 1 4 1467 1 1 9 GLU H H 4.537 -4.655 -3.254 1.00 . A A . 9 GLU H 1 1 4 1468 1 1 9 GLU HA H 5.458 -2.661 -1.315 1.00 . A A . 9 GLU HA 1 1 4 1469 1 1 9 GLU HB2 H 7.712 -3.407 -1.873 1.00 . A A . 9 GLU HB2 1 1 4 1470 1 1 9 GLU HB3 H 6.703 -4.778 -1.433 1.00 . A A . 9 GLU HB3 1 1 4 1471 1 1 9 GLU HG2 H 6.327 -5.026 -3.971 1.00 . A A . 9 GLU HG2 1 1 4 1472 1 1 9 GLU HG3 H 7.745 -3.989 -4.120 1.00 . A A . 9 GLU HG3 1 1 4 1473 1 1 9 GLU N N 4.457 -3.940 -2.589 1.00 . A A . 9 GLU N 1 1 4 1474 1 1 9 GLU O O 5.816 -2.311 -4.520 1.00 . A A . 9 GLU O 1 1 4 1475 1 1 9 GLU OE1 O 9.303 -5.711 -2.886 1.00 . A A . 9 GLU OE1 1 1 4 1476 1 1 9 GLU OE2 O 7.672 -7.037 -3.526 1.00 . A A . 9 GLU OE2 1 1 4 1477 1 1 10 CYS C C 7.068 1.416 -3.060 1.00 . A A . 10 CYS C 1 1 4 1478 1 1 10 CYS CA C 6.275 0.313 -3.753 1.00 . A A . 10 CYS CA 1 1 4 1479 1 1 10 CYS CB C 4.932 0.867 -4.248 1.00 . A A . 10 CYS CB 1 1 4 1480 1 1 10 CYS H H 6.064 -0.664 -1.885 1.00 . A A . 10 CYS H 1 1 4 1481 1 1 10 CYS HA H 6.841 -0.043 -4.600 1.00 . A A . 10 CYS HA 1 1 4 1482 1 1 10 CYS HB2 H 4.872 1.917 -4.004 1.00 . A A . 10 CYS HB2 1 1 4 1483 1 1 10 CYS HB3 H 4.880 0.751 -5.321 1.00 . A A . 10 CYS HB3 1 1 4 1484 1 1 10 CYS N N 6.059 -0.816 -2.855 1.00 . A A . 10 CYS N 1 1 4 1485 1 1 10 CYS O O 7.176 1.442 -1.834 1.00 . A A . 10 CYS O 1 1 4 1486 1 1 10 CYS SG S 3.467 0.050 -3.531 1.00 . A A . 10 CYS SG 1 1 4 1487 1 1 11 LYS C C 7.490 4.601 -2.936 1.00 . A A . 11 LYS C 1 1 4 1488 1 1 11 LYS CA C 8.401 3.438 -3.317 1.00 . A A . 11 LYS CA 1 1 4 1489 1 1 11 LYS CB C 9.443 3.898 -4.341 1.00 . A A . 11 LYS CB 1 1 4 1490 1 1 11 LYS CD C 11.096 2.047 -3.946 1.00 . A A . 11 LYS CD 1 1 4 1491 1 1 11 LYS CE C 12.235 1.658 -3.017 1.00 . A A . 11 LYS CE 1 1 4 1492 1 1 11 LYS CG C 10.870 3.550 -3.951 1.00 . A A . 11 LYS CG 1 1 4 1493 1 1 11 LYS H H 7.497 2.256 -4.823 1.00 . A A . 11 LYS H 1 1 4 1494 1 1 11 LYS HA H 8.908 3.088 -2.431 1.00 . A A . 11 LYS HA 1 1 4 1495 1 1 11 LYS HB2 H 9.228 3.432 -5.291 1.00 . A A . 11 LYS HB2 1 1 4 1496 1 1 11 LYS HB3 H 9.375 4.970 -4.452 1.00 . A A . 11 LYS HB3 1 1 4 1497 1 1 11 LYS HD2 H 10.192 1.559 -3.614 1.00 . A A . 11 LYS HD2 1 1 4 1498 1 1 11 LYS HD3 H 11.335 1.726 -4.949 1.00 . A A . 11 LYS HD3 1 1 4 1499 1 1 11 LYS HE2 H 12.334 0.583 -3.020 1.00 . A A . 11 LYS HE2 1 1 4 1500 1 1 11 LYS HE3 H 13.149 2.104 -3.384 1.00 . A A . 11 LYS HE3 1 1 4 1501 1 1 11 LYS HG2 H 11.548 4.003 -4.660 1.00 . A A . 11 LYS HG2 1 1 4 1502 1 1 11 LYS HG3 H 11.068 3.940 -2.962 1.00 . A A . 11 LYS HG3 1 1 4 1503 1 1 11 LYS HZ1 H 10.995 1.998 -1.372 1.00 . A A . 11 LYS HZ1 1 1 4 1504 1 1 11 LYS HZ2 H 12.578 1.565 -0.959 1.00 . A A . 11 LYS HZ2 1 1 4 1505 1 1 11 LYS HZ3 H 12.248 3.123 -1.529 1.00 . A A . 11 LYS HZ3 1 1 4 1506 1 1 11 LYS N N 7.620 2.329 -3.855 1.00 . A A . 11 LYS N 1 1 4 1507 1 1 11 LYS NZ N 11.997 2.119 -1.622 1.00 . A A . 11 LYS NZ 1 1 4 1508 1 1 11 LYS O O 7.391 4.967 -1.765 1.00 . A A . 11 LYS O 1 1 4 1509 1 1 12 LYS C C 4.559 5.790 -3.216 1.00 . A A . 12 LYS C 1 1 4 1510 1 1 12 LYS CA C 5.914 6.291 -3.701 1.00 . A A . 12 LYS CA 1 1 4 1511 1 1 12 LYS CB C 5.740 7.108 -4.982 1.00 . A A . 12 LYS CB 1 1 4 1512 1 1 12 LYS CD C 5.738 9.623 -4.938 1.00 . A A . 12 LYS CD 1 1 4 1513 1 1 12 LYS CE C 6.684 9.803 -3.760 1.00 . A A . 12 LYS CE 1 1 4 1514 1 1 12 LYS CG C 4.900 8.362 -4.795 1.00 . A A . 12 LYS CG 1 1 4 1515 1 1 12 LYS H H 6.940 4.835 -4.843 1.00 . A A . 12 LYS H 1 1 4 1516 1 1 12 LYS HA H 6.348 6.921 -2.938 1.00 . A A . 12 LYS HA 1 1 4 1517 1 1 12 LYS HB2 H 6.715 7.401 -5.344 1.00 . A A . 12 LYS HB2 1 1 4 1518 1 1 12 LYS HB3 H 5.262 6.489 -5.727 1.00 . A A . 12 LYS HB3 1 1 4 1519 1 1 12 LYS HD2 H 6.317 9.558 -5.845 1.00 . A A . 12 LYS HD2 1 1 4 1520 1 1 12 LYS HD3 H 5.078 10.476 -4.991 1.00 . A A . 12 LYS HD3 1 1 4 1521 1 1 12 LYS HE2 H 6.409 10.701 -3.227 1.00 . A A . 12 LYS HE2 1 1 4 1522 1 1 12 LYS HE3 H 6.588 8.952 -3.103 1.00 . A A . 12 LYS HE3 1 1 4 1523 1 1 12 LYS HG2 H 4.120 8.374 -5.541 1.00 . A A . 12 LYS HG2 1 1 4 1524 1 1 12 LYS HG3 H 4.459 8.342 -3.809 1.00 . A A . 12 LYS HG3 1 1 4 1525 1 1 12 LYS HZ1 H 8.256 9.355 -5.061 1.00 . A A . 12 LYS HZ1 1 1 4 1526 1 1 12 LYS HZ2 H 8.332 10.913 -4.404 1.00 . A A . 12 LYS HZ2 1 1 4 1527 1 1 12 LYS HZ3 H 8.737 9.573 -3.454 1.00 . A A . 12 LYS HZ3 1 1 4 1528 1 1 12 LYS N N 6.822 5.174 -3.932 1.00 . A A . 12 LYS N 1 1 4 1529 1 1 12 LYS NZ N 8.102 9.919 -4.200 1.00 . A A . 12 LYS NZ 1 1 4 1530 1 1 12 LYS O O 3.977 4.879 -3.805 1.00 . A A . 12 LYS O 1 1 4 1531 1 1 13 ASP C C 1.673 6.043 -2.614 1.00 . A A . 13 ASP C 1 1 4 1532 1 1 13 ASP CA C 2.777 5.983 -1.569 1.00 . A A . 13 ASP CA 1 1 4 1533 1 1 13 ASP CB C 2.415 6.857 -0.367 1.00 . A A . 13 ASP CB 1 1 4 1534 1 1 13 ASP CG C 3.532 6.928 0.658 1.00 . A A . 13 ASP CG 1 1 4 1535 1 1 13 ASP H H 4.573 7.096 -1.701 1.00 . A A . 13 ASP H 1 1 4 1536 1 1 13 ASP HA H 2.875 4.967 -1.242 1.00 . A A . 13 ASP HA 1 1 4 1537 1 1 13 ASP HB2 H 2.199 7.856 -0.705 1.00 . A A . 13 ASP HB2 1 1 4 1538 1 1 13 ASP HB3 H 1.539 6.450 0.112 1.00 . A A . 13 ASP HB3 1 1 4 1539 1 1 13 ASP N N 4.062 6.382 -2.133 1.00 . A A . 13 ASP N 1 1 4 1540 1 1 13 ASP O O 0.758 5.220 -2.610 1.00 . A A . 13 ASP O 1 1 4 1541 1 1 13 ASP OD1 O 4.613 6.358 0.401 1.00 . A A . 13 ASP OD1 1 1 4 1542 1 1 13 ASP OD2 O 3.324 7.556 1.718 1.00 . A A . 13 ASP OD2 1 1 4 1543 1 1 14 SER C C 0.621 5.891 -5.368 1.00 . A A . 14 SER C 1 1 4 1544 1 1 14 SER CA C 0.788 7.183 -4.573 1.00 . A A . 14 SER CA 1 1 4 1545 1 1 14 SER CB C 1.203 8.325 -5.505 1.00 . A A . 14 SER CB 1 1 4 1546 1 1 14 SER H H 2.529 7.635 -3.461 1.00 . A A . 14 SER H 1 1 4 1547 1 1 14 SER HA H -0.157 7.433 -4.114 1.00 . A A . 14 SER HA 1 1 4 1548 1 1 14 SER HB2 H 2.180 8.682 -5.220 1.00 . A A . 14 SER HB2 1 1 4 1549 1 1 14 SER HB3 H 1.235 7.964 -6.523 1.00 . A A . 14 SER HB3 1 1 4 1550 1 1 14 SER N N 1.771 7.016 -3.511 1.00 . A A . 14 SER N 1 1 4 1551 1 1 14 SER O O -0.469 5.580 -5.848 1.00 . A A . 14 SER O 1 1 4 1552 1 1 14 SER OG O 0.285 9.403 -5.432 1.00 . A A . 14 SER OG 1 1 4 1553 1 1 15 ASP C C 0.591 2.963 -5.781 1.00 . A A . 15 ASP C 1 1 4 1554 1 1 15 ASP CA C 1.704 3.893 -6.257 1.00 . A A . 15 ASP CA 1 1 4 1555 1 1 15 ASP CB C 3.057 3.190 -6.132 1.00 . A A . 15 ASP CB 1 1 4 1556 1 1 15 ASP CG C 3.514 2.579 -7.443 1.00 . A A . 15 ASP CG 1 1 4 1557 1 1 15 ASP H H 2.558 5.450 -5.105 1.00 . A A . 15 ASP H 1 1 4 1558 1 1 15 ASP HA H 1.532 4.132 -7.295 1.00 . A A . 15 ASP HA 1 1 4 1559 1 1 15 ASP HB2 H 3.800 3.906 -5.813 1.00 . A A . 15 ASP HB2 1 1 4 1560 1 1 15 ASP HB3 H 2.982 2.404 -5.396 1.00 . A A . 15 ASP HB3 1 1 4 1561 1 1 15 ASP N N 1.716 5.147 -5.511 1.00 . A A . 15 ASP N 1 1 4 1562 1 1 15 ASP O O 0.018 2.214 -6.573 1.00 . A A . 15 ASP O 1 1 4 1563 1 1 15 ASP OD1 O 3.342 3.231 -8.493 1.00 . A A . 15 ASP OD1 1 1 4 1564 1 1 15 ASP OD2 O 4.042 1.448 -7.417 1.00 . A A . 15 ASP OD2 1 1 4 1565 1 1 16 CYS C C -2.018 2.198 -4.728 1.00 . A A . 16 CYS C 1 1 4 1566 1 1 16 CYS CA C -0.736 2.138 -3.909 1.00 . A A . 16 CYS CA 1 1 4 1567 1 1 16 CYS CB C -1.019 2.518 -2.451 1.00 . A A . 16 CYS CB 1 1 4 1568 1 1 16 CYS H H 0.796 3.604 -3.896 1.00 . A A . 16 CYS H 1 1 4 1569 1 1 16 CYS HA H -0.363 1.125 -3.936 1.00 . A A . 16 CYS HA 1 1 4 1570 1 1 16 CYS HB2 H -0.131 2.925 -2.020 1.00 . A A . 16 CYS HB2 1 1 4 1571 1 1 16 CYS HB3 H -1.791 3.266 -2.422 1.00 . A A . 16 CYS HB3 1 1 4 1572 1 1 16 CYS N N 0.298 2.998 -4.483 1.00 . A A . 16 CYS N 1 1 4 1573 1 1 16 CYS O O -2.145 2.997 -5.655 1.00 . A A . 16 CYS O 1 1 4 1574 1 1 16 CYS SG S -1.544 1.122 -1.398 1.00 . A A . 16 CYS SG 1 1 4 1575 1 1 17 LEU C C -5.389 1.663 -4.161 1.00 . A A . 17 LEU C 1 1 4 1576 1 1 17 LEU CA C -4.238 1.272 -5.079 1.00 . A A . 17 LEU CA 1 1 4 1577 1 1 17 LEU CB C -4.468 -0.137 -5.630 1.00 . A A . 17 LEU CB 1 1 4 1578 1 1 17 LEU CD1 C -5.958 -1.497 -4.141 1.00 . A A . 17 LEU CD1 1 1 4 1579 1 1 17 LEU CD2 C -3.892 -2.521 -5.109 1.00 . A A . 17 LEU CD2 1 1 4 1580 1 1 17 LEU CG C -4.523 -1.244 -4.574 1.00 . A A . 17 LEU CG 1 1 4 1581 1 1 17 LEU H H -2.789 0.726 -3.632 1.00 . A A . 17 LEU H 1 1 4 1582 1 1 17 LEU HA H -4.200 1.967 -5.904 1.00 . A A . 17 LEU HA 1 1 4 1583 1 1 17 LEU HB2 H -5.402 -0.140 -6.173 1.00 . A A . 17 LEU HB2 1 1 4 1584 1 1 17 LEU HB3 H -3.669 -0.366 -6.319 1.00 . A A . 17 LEU HB3 1 1 4 1585 1 1 17 LEU HD11 H -6.623 -1.322 -4.973 1.00 . A A . 17 LEU HD11 1 1 4 1586 1 1 17 LEU HD12 H -6.058 -2.520 -3.808 1.00 . A A . 17 LEU HD12 1 1 4 1587 1 1 17 LEU HD13 H -6.213 -0.829 -3.331 1.00 . A A . 17 LEU HD13 1 1 4 1588 1 1 17 LEU HD21 H -3.177 -2.274 -5.880 1.00 . A A . 17 LEU HD21 1 1 4 1589 1 1 17 LEU HD22 H -3.391 -3.040 -4.305 1.00 . A A . 17 LEU HD22 1 1 4 1590 1 1 17 LEU HD23 H -4.662 -3.156 -5.523 1.00 . A A . 17 LEU HD23 1 1 4 1591 1 1 17 LEU HG H -3.962 -0.931 -3.706 1.00 . A A . 17 LEU HG 1 1 4 1592 1 1 17 LEU N N -2.961 1.337 -4.379 1.00 . A A . 17 LEU N 1 1 4 1593 1 1 17 LEU O O -5.206 1.822 -2.954 1.00 . A A . 17 LEU O 1 1 4 1594 1 1 18 ALA C C -7.484 3.454 -3.145 1.00 . A A . 18 ALA C 1 1 4 1595 1 1 18 ALA CA C -7.756 2.194 -3.975 1.00 . A A . 18 ALA CA 1 1 4 1596 1 1 18 ALA CB C -8.198 1.028 -3.098 1.00 . A A . 18 ALA CB 1 1 4 1597 1 1 18 ALA H H -6.657 1.680 -5.707 1.00 . A A . 18 ALA H 1 1 4 1598 1 1 18 ALA HA H -8.551 2.407 -4.676 1.00 . A A . 18 ALA HA 1 1 4 1599 1 1 18 ALA HB1 H -8.332 0.149 -3.710 1.00 . A A . 18 ALA HB1 1 1 4 1600 1 1 18 ALA HB2 H -9.131 1.276 -2.614 1.00 . A A . 18 ALA HB2 1 1 4 1601 1 1 18 ALA HB3 H -7.444 0.835 -2.349 1.00 . A A . 18 ALA HB3 1 1 4 1602 1 1 18 ALA N N -6.575 1.820 -4.741 1.00 . A A . 18 ALA N 1 1 4 1603 1 1 18 ALA O O -7.078 4.480 -3.689 1.00 . A A . 18 ALA O 1 1 4 1604 1 1 19 GLU C C -6.490 4.161 0.155 1.00 . A A . 19 GLU C 1 1 4 1605 1 1 19 GLU CA C -7.470 4.522 -0.958 1.00 . A A . 19 GLU CA 1 1 4 1606 1 1 19 GLU CB C -8.792 5.010 -0.362 1.00 . A A . 19 GLU CB 1 1 4 1607 1 1 19 GLU CD C -10.355 6.988 -0.202 1.00 . A A . 19 GLU CD 1 1 4 1608 1 1 19 GLU CG C -8.916 6.524 -0.313 1.00 . A A . 19 GLU CG 1 1 4 1609 1 1 19 GLU H H -8.023 2.542 -1.442 1.00 . A A . 19 GLU H 1 1 4 1610 1 1 19 GLU HA H -7.042 5.313 -1.556 1.00 . A A . 19 GLU HA 1 1 4 1611 1 1 19 GLU HB2 H -9.607 4.623 -0.955 1.00 . A A . 19 GLU HB2 1 1 4 1612 1 1 19 GLU HB3 H -8.881 4.631 0.646 1.00 . A A . 19 GLU HB3 1 1 4 1613 1 1 19 GLU HG2 H -8.369 6.891 0.542 1.00 . A A . 19 GLU HG2 1 1 4 1614 1 1 19 GLU HG3 H -8.490 6.937 -1.216 1.00 . A A . 19 GLU HG3 1 1 4 1615 1 1 19 GLU N N -7.703 3.380 -1.832 1.00 . A A . 19 GLU N 1 1 4 1616 1 1 19 GLU O O -6.795 4.313 1.338 1.00 . A A . 19 GLU O 1 1 4 1617 1 1 19 GLU OE1 O -11.252 6.260 -0.679 1.00 . A A . 19 GLU OE1 1 1 4 1618 1 1 19 GLU OE2 O -10.587 8.077 0.363 1.00 . A A . 19 GLU OE2 1 1 4 1619 1 1 20 CYS C C -2.950 3.921 0.350 1.00 . A A . 20 CYS C 1 1 4 1620 1 1 20 CYS CA C -4.290 3.314 0.740 1.00 . A A . 20 CYS CA 1 1 4 1621 1 1 20 CYS CB C -4.176 1.791 0.836 1.00 . A A . 20 CYS CB 1 1 4 1622 1 1 20 CYS H H -5.110 3.590 -1.186 1.00 . A A . 20 CYS H 1 1 4 1623 1 1 20 CYS HA H -4.584 3.708 1.702 1.00 . A A . 20 CYS HA 1 1 4 1624 1 1 20 CYS HB2 H -4.686 1.346 -0.005 1.00 . A A . 20 CYS HB2 1 1 4 1625 1 1 20 CYS HB3 H -3.133 1.509 0.809 1.00 . A A . 20 CYS HB3 1 1 4 1626 1 1 20 CYS N N -5.307 3.686 -0.228 1.00 . A A . 20 CYS N 1 1 4 1627 1 1 20 CYS O O -2.881 4.757 -0.550 1.00 . A A . 20 CYS O 1 1 4 1628 1 1 20 CYS SG S -4.901 1.091 2.354 1.00 . A A . 20 CYS SG 1 1 4 1629 1 1 21 VAL C C 0.462 2.906 0.596 1.00 . A A . 21 VAL C 1 1 4 1630 1 1 21 VAL CA C -0.566 4.023 0.730 1.00 . A A . 21 VAL CA 1 1 4 1631 1 1 21 VAL CB C -0.097 5.019 1.810 1.00 . A A . 21 VAL CB 1 1 4 1632 1 1 21 VAL CG1 C -1.074 6.178 1.925 1.00 . A A . 21 VAL CG1 1 1 4 1633 1 1 21 VAL CG2 C 0.073 4.322 3.153 1.00 . A A . 21 VAL CG2 1 1 4 1634 1 1 21 VAL H H -2.000 2.835 1.735 1.00 . A A . 21 VAL H 1 1 4 1635 1 1 21 VAL HA H -0.623 4.553 -0.210 1.00 . A A . 21 VAL HA 1 1 4 1636 1 1 21 VAL HB H 0.864 5.419 1.511 1.00 . A A . 21 VAL HB 1 1 4 1637 1 1 21 VAL HG11 H -1.644 6.261 1.012 1.00 . A A . 21 VAL HG11 1 1 4 1638 1 1 21 VAL HG12 H -1.746 6.002 2.753 1.00 . A A . 21 VAL HG12 1 1 4 1639 1 1 21 VAL HG13 H -0.529 7.094 2.094 1.00 . A A . 21 VAL HG13 1 1 4 1640 1 1 21 VAL HG21 H 0.663 3.427 3.021 1.00 . A A . 21 VAL HG21 1 1 4 1641 1 1 21 VAL HG22 H 0.573 4.985 3.842 1.00 . A A . 21 VAL HG22 1 1 4 1642 1 1 21 VAL HG23 H -0.898 4.058 3.545 1.00 . A A . 21 VAL HG23 1 1 4 1643 1 1 21 VAL N N -1.890 3.503 1.025 1.00 . A A . 21 VAL N 1 1 4 1644 1 1 21 VAL O O 0.255 1.787 1.063 1.00 . A A . 21 VAL O 1 1 4 1645 1 1 22 CYS C C 3.761 2.528 0.774 1.00 . A A . 22 CYS C 1 1 4 1646 1 1 22 CYS CA C 2.665 2.296 -0.261 1.00 . A A . 22 CYS CA 1 1 4 1647 1 1 22 CYS CB C 3.233 2.455 -1.678 1.00 . A A . 22 CYS CB 1 1 4 1648 1 1 22 CYS H H 1.654 4.147 -0.381 1.00 . A A . 22 CYS H 1 1 4 1649 1 1 22 CYS HA H 2.275 1.297 -0.143 1.00 . A A . 22 CYS HA 1 1 4 1650 1 1 22 CYS HB2 H 3.247 3.499 -1.937 1.00 . A A . 22 CYS HB2 1 1 4 1651 1 1 22 CYS HB3 H 4.241 2.078 -1.707 1.00 . A A . 22 CYS HB3 1 1 4 1652 1 1 22 CYS N N 1.570 3.238 -0.045 1.00 . A A . 22 CYS N 1 1 4 1653 1 1 22 CYS O O 4.148 3.666 1.039 1.00 . A A . 22 CYS O 1 1 4 1654 1 1 22 CYS SG S 2.279 1.590 -2.963 1.00 . A A . 22 CYS SG 1 1 4 1655 1 1 23 LEU C C 6.662 1.231 1.826 1.00 . A A . 23 LEU C 1 1 4 1656 1 1 23 LEU CA C 5.280 1.539 2.396 1.00 . A A . 23 LEU CA 1 1 4 1657 1 1 23 LEU CB C 4.960 0.593 3.552 1.00 . A A . 23 LEU CB 1 1 4 1658 1 1 23 LEU CD1 C 3.085 -0.702 4.604 1.00 . A A . 23 LEU CD1 1 1 4 1659 1 1 23 LEU CD2 C 3.333 1.740 5.078 1.00 . A A . 23 LEU CD2 1 1 4 1660 1 1 23 LEU CG C 3.509 0.644 4.038 1.00 . A A . 23 LEU CG 1 1 4 1661 1 1 23 LEU H H 3.888 0.564 1.132 1.00 . A A . 23 LEU H 1 1 4 1662 1 1 23 LEU HA H 5.281 2.553 2.768 1.00 . A A . 23 LEU HA 1 1 4 1663 1 1 23 LEU HB2 H 5.180 -0.417 3.238 1.00 . A A . 23 LEU HB2 1 1 4 1664 1 1 23 LEU HB3 H 5.602 0.843 4.383 1.00 . A A . 23 LEU HB3 1 1 4 1665 1 1 23 LEU HD11 H 3.422 -1.490 3.949 1.00 . A A . 23 LEU HD11 1 1 4 1666 1 1 23 LEU HD12 H 3.520 -0.835 5.583 1.00 . A A . 23 LEU HD12 1 1 4 1667 1 1 23 LEU HD13 H 2.008 -0.736 4.682 1.00 . A A . 23 LEU HD13 1 1 4 1668 1 1 23 LEU HD21 H 3.889 2.615 4.776 1.00 . A A . 23 LEU HD21 1 1 4 1669 1 1 23 LEU HD22 H 2.285 1.990 5.162 1.00 . A A . 23 LEU HD22 1 1 4 1670 1 1 23 LEU HD23 H 3.699 1.392 6.032 1.00 . A A . 23 LEU HD23 1 1 4 1671 1 1 23 LEU HG H 2.865 0.870 3.201 1.00 . A A . 23 LEU HG 1 1 4 1672 1 1 23 LEU N N 4.246 1.444 1.373 1.00 . A A . 23 LEU N 1 1 4 1673 1 1 23 LEU O O 6.810 0.387 0.941 1.00 . A A . 23 LEU O 1 1 4 1674 1 1 24 GLU C C 9.513 0.322 2.006 1.00 . A A . 24 GLU C 1 1 4 1675 1 1 24 GLU CA C 9.046 1.771 1.893 1.00 . A A . 24 GLU CA 1 1 4 1676 1 1 24 GLU CB C 9.974 2.678 2.700 1.00 . A A . 24 GLU CB 1 1 4 1677 1 1 24 GLU CD C 9.748 3.921 4.889 1.00 . A A . 24 GLU CD 1 1 4 1678 1 1 24 GLU CG C 9.776 2.569 4.204 1.00 . A A . 24 GLU CG 1 1 4 1679 1 1 24 GLU H H 7.472 2.598 3.037 1.00 . A A . 24 GLU H 1 1 4 1680 1 1 24 GLU HA H 9.091 2.066 0.855 1.00 . A A . 24 GLU HA 1 1 4 1681 1 1 24 GLU HB2 H 10.998 2.420 2.475 1.00 . A A . 24 GLU HB2 1 1 4 1682 1 1 24 GLU HB3 H 9.799 3.703 2.410 1.00 . A A . 24 GLU HB3 1 1 4 1683 1 1 24 GLU HG2 H 8.839 2.067 4.396 1.00 . A A . 24 GLU HG2 1 1 4 1684 1 1 24 GLU HG3 H 10.585 1.987 4.620 1.00 . A A . 24 GLU HG3 1 1 4 1685 1 1 24 GLU N N 7.666 1.937 2.341 1.00 . A A . 24 GLU N 1 1 4 1686 1 1 24 GLU O O 10.122 -0.211 1.080 1.00 . A A . 24 GLU O 1 1 4 1687 1 1 24 GLU OE1 O 10.688 4.715 4.674 1.00 . A A . 24 GLU OE1 1 1 4 1688 1 1 24 GLU OE2 O 8.786 4.187 5.640 1.00 . A A . 24 GLU OE2 1 1 4 1689 1 1 25 HIS C C 9.101 -2.597 2.250 1.00 . A A . 25 HIS C 1 1 4 1690 1 1 25 HIS CA C 9.648 -1.697 3.351 1.00 . A A . 25 HIS CA 1 1 4 1691 1 1 25 HIS CB C 9.205 -2.203 4.727 1.00 . A A . 25 HIS CB 1 1 4 1692 1 1 25 HIS CD2 C 6.657 -2.677 4.640 1.00 . A A . 25 HIS CD2 1 1 4 1693 1 1 25 HIS CE1 C 5.984 -1.037 5.928 1.00 . A A . 25 HIS CE1 1 1 4 1694 1 1 25 HIS CG C 7.755 -1.984 5.024 1.00 . A A . 25 HIS CG 1 1 4 1695 1 1 25 HIS H H 8.752 0.157 3.851 1.00 . A A . 25 HIS H 1 1 4 1696 1 1 25 HIS HA H 10.727 -1.723 3.304 1.00 . A A . 25 HIS HA 1 1 4 1697 1 1 25 HIS HB2 H 9.396 -3.263 4.789 1.00 . A A . 25 HIS HB2 1 1 4 1698 1 1 25 HIS HB3 H 9.780 -1.697 5.489 1.00 . A A . 25 HIS HB3 1 1 4 1699 1 1 25 HIS HD1 H 7.856 -0.282 6.261 1.00 . A A . 25 HIS HD1 1 1 4 1700 1 1 25 HIS HD2 H 6.641 -3.546 3.997 1.00 . A A . 25 HIS HD2 1 1 4 1701 1 1 25 HIS HE1 H 5.355 -0.366 6.495 1.00 . A A . 25 HIS HE1 1 1 4 1702 1 1 25 HIS HE2 H 4.672 -2.461 5.276 1.00 . A A . 25 HIS HE2 1 1 4 1703 1 1 25 HIS N N 9.237 -0.313 3.142 1.00 . A A . 25 HIS N 1 1 4 1704 1 1 25 HIS ND1 N 7.299 -0.962 5.828 1.00 . A A . 25 HIS ND1 1 1 4 1705 1 1 25 HIS NE2 N 5.568 -2.069 5.216 1.00 . A A . 25 HIS NE2 1 1 4 1706 1 1 25 HIS O O 9.659 -3.656 1.965 1.00 . A A . 25 HIS O 1 1 4 1707 1 1 26 GLY C C 6.085 -3.529 0.898 1.00 . A A . 26 GLY C 1 1 4 1708 1 1 26 GLY CA C 7.429 -2.926 0.541 1.00 . A A . 26 GLY CA 1 1 4 1709 1 1 26 GLY H H 7.622 -1.300 1.878 1.00 . A A . 26 GLY H 1 1 4 1710 1 1 26 GLY HA2 H 8.108 -3.721 0.270 1.00 . A A . 26 GLY HA2 1 1 4 1711 1 1 26 GLY HA3 H 7.301 -2.274 -0.308 1.00 . A A . 26 GLY HA3 1 1 4 1712 1 1 26 GLY N N 8.017 -2.158 1.619 1.00 . A A . 26 GLY N 1 1 4 1713 1 1 26 GLY O O 5.946 -4.750 0.955 1.00 . A A . 26 GLY O 1 1 4 1714 1 1 27 TYR C C 2.747 -1.973 1.390 1.00 . A A . 27 TYR C 1 1 4 1715 1 1 27 TYR CA C 3.745 -3.127 1.461 1.00 . A A . 27 TYR CA 1 1 4 1716 1 1 27 TYR CB C 3.720 -3.745 2.862 1.00 . A A . 27 TYR CB 1 1 4 1717 1 1 27 TYR CD1 C 3.808 -6.101 1.953 1.00 . A A . 27 TYR CD1 1 1 4 1718 1 1 27 TYR CD2 C 5.056 -5.606 3.923 1.00 . A A . 27 TYR CD2 1 1 4 1719 1 1 27 TYR CE1 C 4.249 -7.409 1.997 1.00 . A A . 27 TYR CE1 1 1 4 1720 1 1 27 TYR CE2 C 5.502 -6.913 3.973 1.00 . A A . 27 TYR CE2 1 1 4 1721 1 1 27 TYR CG C 4.203 -5.178 2.913 1.00 . A A . 27 TYR CG 1 1 4 1722 1 1 27 TYR CZ C 5.095 -7.811 3.009 1.00 . A A . 27 TYR CZ 1 1 4 1723 1 1 27 TYR H H 5.266 -1.711 1.049 1.00 . A A . 27 TYR H 1 1 4 1724 1 1 27 TYR HA H 3.459 -3.880 0.743 1.00 . A A . 27 TYR HA 1 1 4 1725 1 1 27 TYR HB2 H 4.351 -3.164 3.510 1.00 . A A . 27 TYR HB2 1 1 4 1726 1 1 27 TYR HB3 H 2.707 -3.721 3.239 1.00 . A A . 27 TYR HB3 1 1 4 1727 1 1 27 TYR HD1 H 3.145 -5.784 1.162 1.00 . A A . 27 TYR HD1 1 1 4 1728 1 1 27 TYR HD2 H 5.372 -4.901 4.677 1.00 . A A . 27 TYR HD2 1 1 4 1729 1 1 27 TYR HE1 H 3.930 -8.112 1.243 1.00 . A A . 27 TYR HE1 1 1 4 1730 1 1 27 TYR HE2 H 6.164 -7.227 4.766 1.00 . A A . 27 TYR HE2 1 1 4 1731 1 1 27 TYR HH H 6.060 -9.302 2.275 1.00 . A A . 27 TYR HH 1 1 4 1732 1 1 27 TYR N N 5.091 -2.672 1.122 1.00 . A A . 27 TYR N 1 1 4 1733 1 1 27 TYR O O 3.085 -0.829 1.690 1.00 . A A . 27 TYR O 1 1 4 1734 1 1 27 TYR OH O 5.536 -9.113 3.056 1.00 . A A . 27 TYR OH 1 1 4 1735 1 1 28 CYS C C -0.433 -1.300 2.119 1.00 . A A . 28 CYS C 1 1 4 1736 1 1 28 CYS CA C 0.467 -1.273 0.887 1.00 . A A . 28 CYS CA 1 1 4 1737 1 1 28 CYS CB C -0.376 -1.504 -0.371 1.00 . A A . 28 CYS CB 1 1 4 1738 1 1 28 CYS H H 1.311 -3.214 0.767 1.00 . A A . 28 CYS H 1 1 4 1739 1 1 28 CYS HA H 0.943 -0.307 0.822 1.00 . A A . 28 CYS HA 1 1 4 1740 1 1 28 CYS HB2 H -0.144 -2.477 -0.776 1.00 . A A . 28 CYS HB2 1 1 4 1741 1 1 28 CYS HB3 H -1.423 -1.471 -0.106 1.00 . A A . 28 CYS HB3 1 1 4 1742 1 1 28 CYS N N 1.516 -2.285 0.994 1.00 . A A . 28 CYS N 1 1 4 1743 1 1 28 CYS O O -1.101 -2.298 2.391 1.00 . A A . 28 CYS O 1 1 4 1744 1 1 28 CYS SG S -0.102 -0.280 -1.694 1.00 . A A . 28 CYS SG 1 1 4 1745 1 1 29 GLY C C -1.447 1.311 4.536 1.00 . A A . 29 GLY C 1 1 4 1746 1 1 29 GLY CA C -1.267 -0.114 4.052 1.00 . A A . 29 GLY CA 1 1 4 1747 1 1 29 GLY H H 0.106 0.567 2.593 1.00 . A A . 29 GLY H 1 1 4 1748 1 1 29 GLY HA2 H -0.802 -0.692 4.838 1.00 . A A . 29 GLY HA2 1 1 4 1749 1 1 29 GLY HA3 H -2.238 -0.535 3.838 1.00 . A A . 29 GLY HA3 1 1 4 1750 1 1 29 GLY N N -0.446 -0.197 2.859 1.00 . A A . 29 GLY N 1 1 4 1751 1 1 29 GLY O O -2.035 2.122 3.788 1.00 . A A . 29 GLY O 1 1 4 1752 1 1 29 GLY OXT O -1.002 1.617 5.662 1.00 . A A . 29 GLY OXT 1 1 5 1753 1 1 1 ARG C C -8.192 1.286 4.243 1.00 . A A . 1 ARG C 1 1 5 1754 1 1 1 ARG CA C -7.332 2.052 5.245 1.00 . A A . 1 ARG CA 1 1 5 1755 1 1 1 ARG CB C -6.752 3.312 4.595 1.00 . A A . 1 ARG CB 1 1 5 1756 1 1 1 ARG CD C -6.589 4.834 6.588 1.00 . A A . 1 ARG CD 1 1 5 1757 1 1 1 ARG CG C -7.238 4.603 5.232 1.00 . A A . 1 ARG CG 1 1 5 1758 1 1 1 ARG CZ C -5.660 6.719 7.876 1.00 . A A . 1 ARG CZ 1 1 5 1759 1 1 1 ARG H1 H -6.582 0.264 5.931 1.00 . A A . 1 ARG H1 1 1 5 1760 1 1 1 ARG H2 H -5.483 1.188 4.995 1.00 . A A . 1 ARG H2 1 1 5 1761 1 1 1 ARG H3 H -5.842 1.657 6.607 1.00 . A A . 1 ARG H3 1 1 5 1762 1 1 1 ARG HA H -7.944 2.337 6.088 1.00 . A A . 1 ARG HA 1 1 5 1763 1 1 1 ARG HB2 H -5.675 3.280 4.675 1.00 . A A . 1 ARG HB2 1 1 5 1764 1 1 1 ARG HB3 H -7.026 3.327 3.551 1.00 . A A . 1 ARG HB3 1 1 5 1765 1 1 1 ARG HD2 H -7.223 4.413 7.353 1.00 . A A . 1 ARG HD2 1 1 5 1766 1 1 1 ARG HD3 H -5.630 4.337 6.603 1.00 . A A . 1 ARG HD3 1 1 5 1767 1 1 1 ARG HE H -6.823 6.897 6.265 1.00 . A A . 1 ARG HE 1 1 5 1768 1 1 1 ARG HG2 H -6.993 5.429 4.582 1.00 . A A . 1 ARG HG2 1 1 5 1769 1 1 1 ARG HG3 H -8.310 4.549 5.362 1.00 . A A . 1 ARG HG3 1 1 5 1770 1 1 1 ARG HH11 H -5.151 4.892 8.579 1.00 . A A . 1 ARG HH11 1 1 5 1771 1 1 1 ARG HH12 H -4.512 6.234 9.468 1.00 . A A . 1 ARG HH12 1 1 5 1772 1 1 1 ARG HH21 H -5.983 8.664 7.431 1.00 . A A . 1 ARG HH21 1 1 5 1773 1 1 1 ARG HH22 H -4.985 8.375 8.816 1.00 . A A . 1 ARG HH22 1 1 5 1774 1 1 1 ARG N N -6.208 1.215 5.739 1.00 . A A . 1 ARG N 1 1 5 1775 1 1 1 ARG NE N -6.390 6.255 6.864 1.00 . A A . 1 ARG NE 1 1 5 1776 1 1 1 ARG NH1 N -5.058 5.879 8.710 1.00 . A A . 1 ARG NH1 1 1 5 1777 1 1 1 ARG NH2 N -5.532 8.026 8.055 1.00 . A A . 1 ARG NH2 1 1 5 1778 1 1 1 ARG O O -8.089 0.064 4.129 1.00 . A A . 1 ARG O 1 1 5 1779 1 1 2 VAL C C -9.119 0.843 1.355 1.00 . A A . 2 VAL C 1 1 5 1780 1 1 2 VAL CA C -9.917 1.399 2.530 1.00 . A A . 2 VAL CA 1 1 5 1781 1 1 2 VAL CB C -10.955 2.406 1.999 1.00 . A A . 2 VAL CB 1 1 5 1782 1 1 2 VAL CG1 C -11.983 1.703 1.125 1.00 . A A . 2 VAL CG1 1 1 5 1783 1 1 2 VAL CG2 C -11.632 3.133 3.152 1.00 . A A . 2 VAL CG2 1 1 5 1784 1 1 2 VAL H H -9.077 2.980 3.658 1.00 . A A . 2 VAL H 1 1 5 1785 1 1 2 VAL HA H -10.446 0.588 3.009 1.00 . A A . 2 VAL HA 1 1 5 1786 1 1 2 VAL HB H -10.440 3.137 1.393 1.00 . A A . 2 VAL HB 1 1 5 1787 1 1 2 VAL HG11 H -11.485 0.984 0.492 1.00 . A A . 2 VAL HG11 1 1 5 1788 1 1 2 VAL HG12 H -12.701 1.196 1.751 1.00 . A A . 2 VAL HG12 1 1 5 1789 1 1 2 VAL HG13 H -12.492 2.432 0.512 1.00 . A A . 2 VAL HG13 1 1 5 1790 1 1 2 VAL HG21 H -11.592 2.517 4.039 1.00 . A A . 2 VAL HG21 1 1 5 1791 1 1 2 VAL HG22 H -11.122 4.066 3.338 1.00 . A A . 2 VAL HG22 1 1 5 1792 1 1 2 VAL HG23 H -12.662 3.330 2.897 1.00 . A A . 2 VAL HG23 1 1 5 1793 1 1 2 VAL N N -9.040 2.011 3.521 1.00 . A A . 2 VAL N 1 1 5 1794 1 1 2 VAL O O -8.841 1.554 0.388 1.00 . A A . 2 VAL O 1 1 5 1795 1 1 3 CYS C C -7.888 -2.590 0.645 1.00 . A A . 3 CYS C 1 1 5 1796 1 1 3 CYS CA C -7.988 -1.085 0.390 1.00 . A A . 3 CYS CA 1 1 5 1797 1 1 3 CYS CB C -6.588 -0.473 0.290 1.00 . A A . 3 CYS CB 1 1 5 1798 1 1 3 CYS H H -9.007 -0.946 2.240 1.00 . A A . 3 CYS H 1 1 5 1799 1 1 3 CYS HA H -8.509 -0.922 -0.541 1.00 . A A . 3 CYS HA 1 1 5 1800 1 1 3 CYS HB2 H -6.101 -0.854 -0.596 1.00 . A A . 3 CYS HB2 1 1 5 1801 1 1 3 CYS HB3 H -6.679 0.601 0.209 1.00 . A A . 3 CYS HB3 1 1 5 1802 1 1 3 CYS N N -8.755 -0.432 1.445 1.00 . A A . 3 CYS N 1 1 5 1803 1 1 3 CYS O O -7.534 -3.014 1.744 1.00 . A A . 3 CYS O 1 1 5 1804 1 1 3 CYS SG S -5.507 -0.834 1.712 1.00 . A A . 3 CYS SG 1 1 5 1805 1 1 4 PRO C C -6.887 -5.356 0.482 1.00 . A A . 4 PRO C 1 1 5 1806 1 1 4 PRO CA C -8.142 -4.879 -0.241 1.00 . A A . 4 PRO CA 1 1 5 1807 1 1 4 PRO CB C -8.132 -5.346 -1.694 1.00 . A A . 4 PRO CB 1 1 5 1808 1 1 4 PRO CD C -8.633 -3.004 -1.719 1.00 . A A . 4 PRO CD 1 1 5 1809 1 1 4 PRO CG C -8.911 -4.308 -2.422 1.00 . A A . 4 PRO CG 1 1 5 1810 1 1 4 PRO HA H -9.016 -5.268 0.259 1.00 . A A . 4 PRO HA 1 1 5 1811 1 1 4 PRO HB2 H -7.113 -5.403 -2.050 1.00 . A A . 4 PRO HB2 1 1 5 1812 1 1 4 PRO HB3 H -8.600 -6.316 -1.767 1.00 . A A . 4 PRO HB3 1 1 5 1813 1 1 4 PRO HD2 H -7.847 -2.464 -2.225 1.00 . A A . 4 PRO HD2 1 1 5 1814 1 1 4 PRO HD3 H -9.530 -2.405 -1.667 1.00 . A A . 4 PRO HD3 1 1 5 1815 1 1 4 PRO HG2 H -8.582 -4.256 -3.450 1.00 . A A . 4 PRO HG2 1 1 5 1816 1 1 4 PRO HG3 H -9.965 -4.540 -2.376 1.00 . A A . 4 PRO HG3 1 1 5 1817 1 1 4 PRO N N -8.200 -3.419 -0.369 1.00 . A A . 4 PRO N 1 1 5 1818 1 1 4 PRO O O -5.797 -4.824 0.273 1.00 . A A . 4 PRO O 1 1 5 1819 1 1 5 ARG C C -4.996 -7.700 1.177 1.00 . A A . 5 ARG C 1 1 5 1820 1 1 5 ARG CA C -5.928 -6.910 2.089 1.00 . A A . 5 ARG CA 1 1 5 1821 1 1 5 ARG CB C -6.436 -7.806 3.219 1.00 . A A . 5 ARG CB 1 1 5 1822 1 1 5 ARG CD C -7.850 -7.960 5.293 1.00 . A A . 5 ARG CD 1 1 5 1823 1 1 5 ARG CG C -7.593 -7.202 4.000 1.00 . A A . 5 ARG CG 1 1 5 1824 1 1 5 ARG CZ C -9.760 -8.534 6.738 1.00 . A A . 5 ARG CZ 1 1 5 1825 1 1 5 ARG H H -7.942 -6.746 1.460 1.00 . A A . 5 ARG H 1 1 5 1826 1 1 5 ARG HA H -5.380 -6.083 2.515 1.00 . A A . 5 ARG HA 1 1 5 1827 1 1 5 ARG HB2 H -6.766 -8.745 2.799 1.00 . A A . 5 ARG HB2 1 1 5 1828 1 1 5 ARG HB3 H -5.626 -7.993 3.907 1.00 . A A . 5 ARG HB3 1 1 5 1829 1 1 5 ARG HD2 H -7.435 -8.953 5.200 1.00 . A A . 5 ARG HD2 1 1 5 1830 1 1 5 ARG HD3 H -7.360 -7.441 6.103 1.00 . A A . 5 ARG HD3 1 1 5 1831 1 1 5 ARG HE H -9.905 -7.779 4.897 1.00 . A A . 5 ARG HE 1 1 5 1832 1 1 5 ARG HG2 H -7.357 -6.175 4.238 1.00 . A A . 5 ARG HG2 1 1 5 1833 1 1 5 ARG HG3 H -8.484 -7.237 3.389 1.00 . A A . 5 ARG HG3 1 1 5 1834 1 1 5 ARG HH11 H -7.949 -8.890 7.564 1.00 . A A . 5 ARG HH11 1 1 5 1835 1 1 5 ARG HH12 H -9.309 -9.286 8.560 1.00 . A A . 5 ARG HH12 1 1 5 1836 1 1 5 ARG HH21 H -11.695 -8.298 6.204 1.00 . A A . 5 ARG HH21 1 1 5 1837 1 1 5 ARG HH22 H -11.437 -8.949 7.788 1.00 . A A . 5 ARG HH22 1 1 5 1838 1 1 5 ARG N N -7.049 -6.363 1.335 1.00 . A A . 5 ARG N 1 1 5 1839 1 1 5 ARG NE N -9.276 -8.068 5.589 1.00 . A A . 5 ARG NE 1 1 5 1840 1 1 5 ARG NH1 N -8.938 -8.937 7.699 1.00 . A A . 5 ARG NH1 1 1 5 1841 1 1 5 ARG NH2 N -11.071 -8.599 6.926 1.00 . A A . 5 ARG NH2 1 1 5 1842 1 1 5 ARG O O -5.047 -8.930 1.134 1.00 . A A . 5 ARG O 1 1 5 1843 1 1 6 ILE C C -1.826 -6.954 -0.373 1.00 . A A . 6 ILE C 1 1 5 1844 1 1 6 ILE CA C -3.197 -7.617 -0.461 1.00 . A A . 6 ILE CA 1 1 5 1845 1 1 6 ILE CB C -3.694 -7.556 -1.918 1.00 . A A . 6 ILE CB 1 1 5 1846 1 1 6 ILE CD1 C -5.708 -7.993 -3.410 1.00 . A A . 6 ILE CD1 1 1 5 1847 1 1 6 ILE CG1 C -5.144 -8.033 -2.007 1.00 . A A . 6 ILE CG1 1 1 5 1848 1 1 6 ILE CG2 C -2.798 -8.395 -2.818 1.00 . A A . 6 ILE CG2 1 1 5 1849 1 1 6 ILE H H -4.153 -6.009 0.528 1.00 . A A . 6 ILE H 1 1 5 1850 1 1 6 ILE HA H -3.104 -8.656 -0.177 1.00 . A A . 6 ILE HA 1 1 5 1851 1 1 6 ILE HB H -3.638 -6.532 -2.251 1.00 . A A . 6 ILE HB 1 1 5 1852 1 1 6 ILE HD11 H -5.443 -7.057 -3.879 1.00 . A A . 6 ILE HD11 1 1 5 1853 1 1 6 ILE HD12 H -5.303 -8.812 -3.986 1.00 . A A . 6 ILE HD12 1 1 5 1854 1 1 6 ILE HD13 H -6.784 -8.082 -3.368 1.00 . A A . 6 ILE HD13 1 1 5 1855 1 1 6 ILE HG12 H -5.203 -9.053 -1.656 1.00 . A A . 6 ILE HG12 1 1 5 1856 1 1 6 ILE HG13 H -5.762 -7.405 -1.382 1.00 . A A . 6 ILE HG13 1 1 5 1857 1 1 6 ILE HG21 H -1.831 -8.514 -2.352 1.00 . A A . 6 ILE HG21 1 1 5 1858 1 1 6 ILE HG22 H -3.247 -9.365 -2.969 1.00 . A A . 6 ILE HG22 1 1 5 1859 1 1 6 ILE HG23 H -2.681 -7.900 -3.771 1.00 . A A . 6 ILE HG23 1 1 5 1860 1 1 6 ILE N N -4.144 -6.985 0.450 1.00 . A A . 6 ILE N 1 1 5 1861 1 1 6 ILE O O -1.696 -5.747 -0.581 1.00 . A A . 6 ILE O 1 1 5 1862 1 1 7 LEU C C 0.991 -6.555 -1.244 1.00 . A A . 7 LEU C 1 1 5 1863 1 1 7 LEU CA C 0.556 -7.240 0.048 1.00 . A A . 7 LEU CA 1 1 5 1864 1 1 7 LEU CB C 1.521 -8.379 0.383 1.00 . A A . 7 LEU CB 1 1 5 1865 1 1 7 LEU CD1 C 2.184 -10.282 1.873 1.00 . A A . 7 LEU CD1 1 1 5 1866 1 1 7 LEU CD2 C 1.288 -8.169 2.873 1.00 . A A . 7 LEU CD2 1 1 5 1867 1 1 7 LEU CG C 1.219 -9.121 1.686 1.00 . A A . 7 LEU CG 1 1 5 1868 1 1 7 LEU H H -0.975 -8.704 0.087 1.00 . A A . 7 LEU H 1 1 5 1869 1 1 7 LEU HA H 0.573 -6.517 0.849 1.00 . A A . 7 LEU HA 1 1 5 1870 1 1 7 LEU HB2 H 1.499 -9.092 -0.428 1.00 . A A . 7 LEU HB2 1 1 5 1871 1 1 7 LEU HB3 H 2.518 -7.968 0.453 1.00 . A A . 7 LEU HB3 1 1 5 1872 1 1 7 LEU HD11 H 2.593 -10.568 0.915 1.00 . A A . 7 LEU HD11 1 1 5 1873 1 1 7 LEU HD12 H 2.986 -9.982 2.531 1.00 . A A . 7 LEU HD12 1 1 5 1874 1 1 7 LEU HD13 H 1.658 -11.121 2.304 1.00 . A A . 7 LEU HD13 1 1 5 1875 1 1 7 LEU HD21 H 1.435 -7.160 2.518 1.00 . A A . 7 LEU HD21 1 1 5 1876 1 1 7 LEU HD22 H 0.366 -8.223 3.431 1.00 . A A . 7 LEU HD22 1 1 5 1877 1 1 7 LEU HD23 H 2.112 -8.448 3.512 1.00 . A A . 7 LEU HD23 1 1 5 1878 1 1 7 LEU HG H 0.217 -9.525 1.638 1.00 . A A . 7 LEU HG 1 1 5 1879 1 1 7 LEU N N -0.807 -7.750 -0.067 1.00 . A A . 7 LEU N 1 1 5 1880 1 1 7 LEU O O 0.690 -7.028 -2.339 1.00 . A A . 7 LEU O 1 1 5 1881 1 1 8 LEU C C 3.308 -3.752 -1.884 1.00 . A A . 8 LEU C 1 1 5 1882 1 1 8 LEU CA C 2.177 -4.697 -2.271 1.00 . A A . 8 LEU CA 1 1 5 1883 1 1 8 LEU CB C 1.027 -3.910 -2.903 1.00 . A A . 8 LEU CB 1 1 5 1884 1 1 8 LEU CD1 C -0.290 -4.477 -4.966 1.00 . A A . 8 LEU CD1 1 1 5 1885 1 1 8 LEU CD2 C 1.228 -2.490 -4.964 1.00 . A A . 8 LEU CD2 1 1 5 1886 1 1 8 LEU CG C 1.014 -3.901 -4.435 1.00 . A A . 8 LEU CG 1 1 5 1887 1 1 8 LEU H H 1.915 -5.111 -0.208 1.00 . A A . 8 LEU H 1 1 5 1888 1 1 8 LEU HA H 2.551 -5.411 -2.989 1.00 . A A . 8 LEU HA 1 1 5 1889 1 1 8 LEU HB2 H 0.096 -4.336 -2.557 1.00 . A A . 8 LEU HB2 1 1 5 1890 1 1 8 LEU HB3 H 1.086 -2.888 -2.559 1.00 . A A . 8 LEU HB3 1 1 5 1891 1 1 8 LEU HD11 H -1.122 -3.994 -4.476 1.00 . A A . 8 LEU HD11 1 1 5 1892 1 1 8 LEU HD12 H -0.351 -4.310 -6.030 1.00 . A A . 8 LEU HD12 1 1 5 1893 1 1 8 LEU HD13 H -0.322 -5.538 -4.766 1.00 . A A . 8 LEU HD13 1 1 5 1894 1 1 8 LEU HD21 H 0.850 -1.776 -4.248 1.00 . A A . 8 LEU HD21 1 1 5 1895 1 1 8 LEU HD22 H 2.283 -2.319 -5.119 1.00 . A A . 8 LEU HD22 1 1 5 1896 1 1 8 LEU HD23 H 0.703 -2.373 -5.901 1.00 . A A . 8 LEU HD23 1 1 5 1897 1 1 8 LEU HG H 1.823 -4.519 -4.798 1.00 . A A . 8 LEU HG 1 1 5 1898 1 1 8 LEU N N 1.703 -5.441 -1.109 1.00 . A A . 8 LEU N 1 1 5 1899 1 1 8 LEU O O 3.128 -2.864 -1.052 1.00 . A A . 8 LEU O 1 1 5 1900 1 1 9 GLU C C 5.834 -2.055 -3.276 1.00 . A A . 9 GLU C 1 1 5 1901 1 1 9 GLU CA C 5.642 -3.123 -2.206 1.00 . A A . 9 GLU CA 1 1 5 1902 1 1 9 GLU CB C 6.896 -3.994 -2.112 1.00 . A A . 9 GLU CB 1 1 5 1903 1 1 9 GLU CD C 8.519 -5.500 -3.330 1.00 . A A . 9 GLU CD 1 1 5 1904 1 1 9 GLU CG C 7.181 -4.786 -3.377 1.00 . A A . 9 GLU CG 1 1 5 1905 1 1 9 GLU H H 4.555 -4.681 -3.142 1.00 . A A . 9 GLU H 1 1 5 1906 1 1 9 GLU HA H 5.480 -2.639 -1.254 1.00 . A A . 9 GLU HA 1 1 5 1907 1 1 9 GLU HB2 H 7.747 -3.359 -1.911 1.00 . A A . 9 GLU HB2 1 1 5 1908 1 1 9 GLU HB3 H 6.778 -4.691 -1.295 1.00 . A A . 9 GLU HB3 1 1 5 1909 1 1 9 GLU HG2 H 6.403 -5.523 -3.509 1.00 . A A . 9 GLU HG2 1 1 5 1910 1 1 9 GLU HG3 H 7.181 -4.110 -4.219 1.00 . A A . 9 GLU HG3 1 1 5 1911 1 1 9 GLU N N 4.475 -3.953 -2.490 1.00 . A A . 9 GLU N 1 1 5 1912 1 1 9 GLU O O 5.783 -2.343 -4.471 1.00 . A A . 9 GLU O 1 1 5 1913 1 1 9 GLU OE1 O 9.552 -4.813 -3.191 1.00 . A A . 9 GLU OE1 1 1 5 1914 1 1 9 GLU OE2 O 8.532 -6.744 -3.431 1.00 . A A . 9 GLU OE2 1 1 5 1915 1 1 10 CYS C C 7.036 1.422 -3.098 1.00 . A A . 10 CYS C 1 1 5 1916 1 1 10 CYS CA C 6.245 0.296 -3.759 1.00 . A A . 10 CYS CA 1 1 5 1917 1 1 10 CYS CB C 4.894 0.828 -4.254 1.00 . A A . 10 CYS CB 1 1 5 1918 1 1 10 CYS H H 6.074 -0.649 -1.870 1.00 . A A . 10 CYS H 1 1 5 1919 1 1 10 CYS HA H 6.807 -0.071 -4.604 1.00 . A A . 10 CYS HA 1 1 5 1920 1 1 10 CYS HB2 H 4.826 1.883 -4.030 1.00 . A A . 10 CYS HB2 1 1 5 1921 1 1 10 CYS HB3 H 4.833 0.691 -5.323 1.00 . A A . 10 CYS HB3 1 1 5 1922 1 1 10 CYS N N 6.051 -0.818 -2.836 1.00 . A A . 10 CYS N 1 1 5 1923 1 1 10 CYS O O 7.126 1.495 -1.872 1.00 . A A . 10 CYS O 1 1 5 1924 1 1 10 CYS SG S 3.441 0.014 -3.508 1.00 . A A . 10 CYS SG 1 1 5 1925 1 1 11 LYS C C 7.473 4.586 -3.028 1.00 . A A . 11 LYS C 1 1 5 1926 1 1 11 LYS CA C 8.385 3.425 -3.416 1.00 . A A . 11 LYS CA 1 1 5 1927 1 1 11 LYS CB C 9.397 3.883 -4.472 1.00 . A A . 11 LYS CB 1 1 5 1928 1 1 11 LYS CD C 11.542 2.601 -4.798 1.00 . A A . 11 LYS CD 1 1 5 1929 1 1 11 LYS CE C 12.762 3.111 -5.551 1.00 . A A . 11 LYS CE 1 1 5 1930 1 1 11 LYS CG C 10.845 3.721 -4.036 1.00 . A A . 11 LYS CG 1 1 5 1931 1 1 11 LYS H H 7.495 2.189 -4.887 1.00 . A A . 11 LYS H 1 1 5 1932 1 1 11 LYS HA H 8.919 3.093 -2.538 1.00 . A A . 11 LYS HA 1 1 5 1933 1 1 11 LYS HB2 H 9.245 3.305 -5.372 1.00 . A A . 11 LYS HB2 1 1 5 1934 1 1 11 LYS HB3 H 9.226 4.926 -4.693 1.00 . A A . 11 LYS HB3 1 1 5 1935 1 1 11 LYS HD2 H 11.857 1.843 -4.097 1.00 . A A . 11 LYS HD2 1 1 5 1936 1 1 11 LYS HD3 H 10.848 2.172 -5.506 1.00 . A A . 11 LYS HD3 1 1 5 1937 1 1 11 LYS HE2 H 13.234 2.279 -6.052 1.00 . A A . 11 LYS HE2 1 1 5 1938 1 1 11 LYS HE3 H 12.439 3.836 -6.284 1.00 . A A . 11 LYS HE3 1 1 5 1939 1 1 11 LYS HG2 H 11.370 4.647 -4.218 1.00 . A A . 11 LYS HG2 1 1 5 1940 1 1 11 LYS HG3 H 10.869 3.493 -2.981 1.00 . A A . 11 LYS HG3 1 1 5 1941 1 1 11 LYS HZ1 H 13.567 3.469 -3.655 1.00 . A A . 11 LYS HZ1 1 1 5 1942 1 1 11 LYS HZ2 H 14.716 3.459 -4.896 1.00 . A A . 11 LYS HZ2 1 1 5 1943 1 1 11 LYS HZ3 H 13.685 4.787 -4.711 1.00 . A A . 11 LYS HZ3 1 1 5 1944 1 1 11 LYS N N 7.605 2.299 -3.919 1.00 . A A . 11 LYS N 1 1 5 1945 1 1 11 LYS NZ N 13.751 3.751 -4.640 1.00 . A A . 11 LYS NZ 1 1 5 1946 1 1 11 LYS O O 7.364 4.937 -1.854 1.00 . A A . 11 LYS O 1 1 5 1947 1 1 12 LYS C C 4.560 5.786 -3.279 1.00 . A A . 12 LYS C 1 1 5 1948 1 1 12 LYS CA C 5.906 6.288 -3.790 1.00 . A A . 12 LYS CA 1 1 5 1949 1 1 12 LYS CB C 5.715 7.090 -5.079 1.00 . A A . 12 LYS CB 1 1 5 1950 1 1 12 LYS CD C 4.958 9.260 -6.096 1.00 . A A . 12 LYS CD 1 1 5 1951 1 1 12 LYS CE C 6.386 9.748 -6.277 1.00 . A A . 12 LYS CE 1 1 5 1952 1 1 12 LYS CG C 4.834 8.317 -4.909 1.00 . A A . 12 LYS CG 1 1 5 1953 1 1 12 LYS H H 6.942 4.843 -4.939 1.00 . A A . 12 LYS H 1 1 5 1954 1 1 12 LYS HA H 6.349 6.926 -3.040 1.00 . A A . 12 LYS HA 1 1 5 1955 1 1 12 LYS HB2 H 6.681 7.414 -5.434 1.00 . A A . 12 LYS HB2 1 1 5 1956 1 1 12 LYS HB3 H 5.263 6.450 -5.823 1.00 . A A . 12 LYS HB3 1 1 5 1957 1 1 12 LYS HD2 H 4.650 8.739 -6.991 1.00 . A A . 12 LYS HD2 1 1 5 1958 1 1 12 LYS HD3 H 4.314 10.112 -5.934 1.00 . A A . 12 LYS HD3 1 1 5 1959 1 1 12 LYS HE2 H 6.386 10.827 -6.290 1.00 . A A . 12 LYS HE2 1 1 5 1960 1 1 12 LYS HE3 H 6.982 9.399 -5.446 1.00 . A A . 12 LYS HE3 1 1 5 1961 1 1 12 LYS HG2 H 3.806 8.000 -4.822 1.00 . A A . 12 LYS HG2 1 1 5 1962 1 1 12 LYS HG3 H 5.130 8.840 -4.012 1.00 . A A . 12 LYS HG3 1 1 5 1963 1 1 12 LYS HZ1 H 6.810 8.231 -7.651 1.00 . A A . 12 LYS HZ1 1 1 5 1964 1 1 12 LYS HZ2 H 6.568 9.748 -8.358 1.00 . A A . 12 LYS HZ2 1 1 5 1965 1 1 12 LYS HZ3 H 8.014 9.414 -7.544 1.00 . A A . 12 LYS HZ3 1 1 5 1966 1 1 12 LYS N N 6.816 5.171 -4.024 1.00 . A A . 12 LYS N 1 1 5 1967 1 1 12 LYS NZ N 6.987 9.251 -7.547 1.00 . A A . 12 LYS NZ 1 1 5 1968 1 1 12 LYS O O 3.973 4.869 -3.854 1.00 . A A . 12 LYS O 1 1 5 1969 1 1 13 ASP C C 1.683 6.015 -2.636 1.00 . A A . 13 ASP C 1 1 5 1970 1 1 13 ASP CA C 2.802 5.977 -1.605 1.00 . A A . 13 ASP CA 1 1 5 1971 1 1 13 ASP CB C 2.449 6.864 -0.410 1.00 . A A . 13 ASP CB 1 1 5 1972 1 1 13 ASP CG C 3.579 6.959 0.597 1.00 . A A . 13 ASP CG 1 1 5 1973 1 1 13 ASP H H 4.592 7.099 -1.771 1.00 . A A . 13 ASP H 1 1 5 1974 1 1 13 ASP HA H 2.913 4.966 -1.267 1.00 . A A . 13 ASP HA 1 1 5 1975 1 1 13 ASP HB2 H 2.218 7.857 -0.758 1.00 . A A . 13 ASP HB2 1 1 5 1976 1 1 13 ASP HB3 H 1.584 6.455 0.087 1.00 . A A . 13 ASP HB3 1 1 5 1977 1 1 13 ASP N N 4.077 6.381 -2.192 1.00 . A A . 13 ASP N 1 1 5 1978 1 1 13 ASP O O 0.808 5.149 -2.645 1.00 . A A . 13 ASP O 1 1 5 1979 1 1 13 ASP OD1 O 4.727 7.219 0.178 1.00 . A A . 13 ASP OD1 1 1 5 1980 1 1 13 ASP OD2 O 3.317 6.771 1.804 1.00 . A A . 13 ASP OD2 1 1 5 1981 1 1 14 SER C C 0.566 5.862 -5.345 1.00 . A A . 14 SER C 1 1 5 1982 1 1 14 SER CA C 0.721 7.160 -4.556 1.00 . A A . 14 SER CA 1 1 5 1983 1 1 14 SER CB C 1.100 8.303 -5.500 1.00 . A A . 14 SER CB 1 1 5 1984 1 1 14 SER H H 2.452 7.666 -3.451 1.00 . A A . 14 SER H 1 1 5 1985 1 1 14 SER HA H -0.222 7.393 -4.083 1.00 . A A . 14 SER HA 1 1 5 1986 1 1 14 SER HB2 H 2.110 8.156 -5.853 1.00 . A A . 14 SER HB2 1 1 5 1987 1 1 14 SER HB3 H 0.423 8.310 -6.342 1.00 . A A . 14 SER HB3 1 1 5 1988 1 1 14 SER N N 1.724 7.013 -3.509 1.00 . A A . 14 SER N 1 1 5 1989 1 1 14 SER O O -0.526 5.530 -5.806 1.00 . A A . 14 SER O 1 1 5 1990 1 1 14 SER OG O 1.025 9.555 -4.841 1.00 . A A . 14 SER OG 1 1 5 1991 1 1 15 ASP C C 0.570 2.944 -5.760 1.00 . A A . 15 ASP C 1 1 5 1992 1 1 15 ASP CA C 1.672 3.882 -6.246 1.00 . A A . 15 ASP CA 1 1 5 1993 1 1 15 ASP CB C 3.032 3.195 -6.122 1.00 . A A . 15 ASP CB 1 1 5 1994 1 1 15 ASP CG C 3.453 2.512 -7.409 1.00 . A A . 15 ASP CG 1 1 5 1995 1 1 15 ASP H H 2.513 5.459 -5.111 1.00 . A A . 15 ASP H 1 1 5 1996 1 1 15 ASP HA H 1.493 4.115 -7.283 1.00 . A A . 15 ASP HA 1 1 5 1997 1 1 15 ASP HB2 H 3.780 3.931 -5.867 1.00 . A A . 15 ASP HB2 1 1 5 1998 1 1 15 ASP HB3 H 2.984 2.451 -5.340 1.00 . A A . 15 ASP HB3 1 1 5 1999 1 1 15 ASP N N 1.672 5.139 -5.503 1.00 . A A . 15 ASP N 1 1 5 2000 1 1 15 ASP O O 0.000 2.187 -6.546 1.00 . A A . 15 ASP O 1 1 5 2001 1 1 15 ASP OD1 O 2.571 2.230 -8.246 1.00 . A A . 15 ASP OD1 1 1 5 2002 1 1 15 ASP OD2 O 4.664 2.261 -7.579 1.00 . A A . 15 ASP OD2 1 1 5 2003 1 1 16 CYS C C -2.031 2.181 -4.678 1.00 . A A . 16 CYS C 1 1 5 2004 1 1 16 CYS CA C -0.737 2.115 -3.879 1.00 . A A . 16 CYS CA 1 1 5 2005 1 1 16 CYS CB C -0.998 2.487 -2.415 1.00 . A A . 16 CYS CB 1 1 5 2006 1 1 16 CYS H H 0.781 3.595 -3.879 1.00 . A A . 16 CYS H 1 1 5 2007 1 1 16 CYS HA H -0.364 1.103 -3.918 1.00 . A A . 16 CYS HA 1 1 5 2008 1 1 16 CYS HB2 H -0.101 2.885 -1.992 1.00 . A A . 16 CYS HB2 1 1 5 2009 1 1 16 CYS HB3 H -1.764 3.244 -2.370 1.00 . A A . 16 CYS HB3 1 1 5 2010 1 1 16 CYS N N 0.285 2.981 -4.461 1.00 . A A . 16 CYS N 1 1 5 2011 1 1 16 CYS O O -2.163 2.975 -5.610 1.00 . A A . 16 CYS O 1 1 5 2012 1 1 16 CYS SG S -1.522 1.092 -1.360 1.00 . A A . 16 CYS SG 1 1 5 2013 1 1 17 LEU C C -5.400 1.659 -4.051 1.00 . A A . 17 LEU C 1 1 5 2014 1 1 17 LEU CA C -4.265 1.278 -4.994 1.00 . A A . 17 LEU CA 1 1 5 2015 1 1 17 LEU CB C -4.505 -0.122 -5.563 1.00 . A A . 17 LEU CB 1 1 5 2016 1 1 17 LEU CD1 C -5.496 -2.394 -5.186 1.00 . A A . 17 LEU CD1 1 1 5 2017 1 1 17 LEU CD2 C -3.546 -1.641 -3.815 1.00 . A A . 17 LEU CD2 1 1 5 2018 1 1 17 LEU CG C -4.816 -1.204 -4.527 1.00 . A A . 17 LEU CG 1 1 5 2019 1 1 17 LEU H H -2.804 0.725 -3.563 1.00 . A A . 17 LEU H 1 1 5 2020 1 1 17 LEU HA H -4.238 1.988 -5.807 1.00 . A A . 17 LEU HA 1 1 5 2021 1 1 17 LEU HB2 H -5.332 -0.069 -6.256 1.00 . A A . 17 LEU HB2 1 1 5 2022 1 1 17 LEU HB3 H -3.622 -0.422 -6.107 1.00 . A A . 17 LEU HB3 1 1 5 2023 1 1 17 LEU HD11 H -6.255 -2.042 -5.869 1.00 . A A . 17 LEU HD11 1 1 5 2024 1 1 17 LEU HD12 H -4.763 -2.972 -5.729 1.00 . A A . 17 LEU HD12 1 1 5 2025 1 1 17 LEU HD13 H -5.953 -3.013 -4.428 1.00 . A A . 17 LEU HD13 1 1 5 2026 1 1 17 LEU HD21 H -2.695 -1.471 -4.459 1.00 . A A . 17 LEU HD21 1 1 5 2027 1 1 17 LEU HD22 H -3.429 -1.071 -2.905 1.00 . A A . 17 LEU HD22 1 1 5 2028 1 1 17 LEU HD23 H -3.610 -2.692 -3.574 1.00 . A A . 17 LEU HD23 1 1 5 2029 1 1 17 LEU HG H -5.493 -0.802 -3.788 1.00 . A A . 17 LEU HG 1 1 5 2030 1 1 17 LEU N N -2.978 1.332 -4.311 1.00 . A A . 17 LEU N 1 1 5 2031 1 1 17 LEU O O -5.190 1.836 -2.851 1.00 . A A . 17 LEU O 1 1 5 2032 1 1 18 ALA C C -7.492 3.394 -2.968 1.00 . A A . 18 ALA C 1 1 5 2033 1 1 18 ALA CA C -7.771 2.141 -3.807 1.00 . A A . 18 ALA CA 1 1 5 2034 1 1 18 ALA CB C -8.186 0.962 -2.935 1.00 . A A . 18 ALA CB 1 1 5 2035 1 1 18 ALA H H -6.709 1.627 -5.564 1.00 . A A . 18 ALA H 1 1 5 2036 1 1 18 ALA HA H -8.581 2.355 -4.489 1.00 . A A . 18 ALA HA 1 1 5 2037 1 1 18 ALA HB1 H -8.368 0.100 -3.558 1.00 . A A . 18 ALA HB1 1 1 5 2038 1 1 18 ALA HB2 H -9.088 1.213 -2.397 1.00 . A A . 18 ALA HB2 1 1 5 2039 1 1 18 ALA HB3 H -7.398 0.740 -2.232 1.00 . A A . 18 ALA HB3 1 1 5 2040 1 1 18 ALA N N -6.604 1.782 -4.602 1.00 . A A . 18 ALA N 1 1 5 2041 1 1 18 ALA O O -7.105 4.429 -3.510 1.00 . A A . 18 ALA O 1 1 5 2042 1 1 19 GLU C C -6.434 4.072 0.318 1.00 . A A . 19 GLU C 1 1 5 2043 1 1 19 GLU CA C -7.438 4.436 -0.772 1.00 . A A . 19 GLU CA 1 1 5 2044 1 1 19 GLU CB C -8.751 4.907 -0.140 1.00 . A A . 19 GLU CB 1 1 5 2045 1 1 19 GLU CD C -10.086 6.997 -0.631 1.00 . A A . 19 GLU CD 1 1 5 2046 1 1 19 GLU CG C -8.844 6.417 0.015 1.00 . A A . 19 GLU CG 1 1 5 2047 1 1 19 GLU H H -7.986 2.457 -1.266 1.00 . A A . 19 GLU H 1 1 5 2048 1 1 19 GLU HA H -7.029 5.238 -1.368 1.00 . A A . 19 GLU HA 1 1 5 2049 1 1 19 GLU HB2 H -9.573 4.579 -0.759 1.00 . A A . 19 GLU HB2 1 1 5 2050 1 1 19 GLU HB3 H -8.848 4.459 0.837 1.00 . A A . 19 GLU HB3 1 1 5 2051 1 1 19 GLU HG2 H -8.860 6.657 1.068 1.00 . A A . 19 GLU HG2 1 1 5 2052 1 1 19 GLU HG3 H -7.974 6.867 -0.442 1.00 . A A . 19 GLU HG3 1 1 5 2053 1 1 19 GLU N N -7.681 3.303 -1.653 1.00 . A A . 19 GLU N 1 1 5 2054 1 1 19 GLU O O -6.723 4.196 1.509 1.00 . A A . 19 GLU O 1 1 5 2055 1 1 19 GLU OE1 O -10.584 6.396 -1.606 1.00 . A A . 19 GLU OE1 1 1 5 2056 1 1 19 GLU OE2 O -10.563 8.052 -0.162 1.00 . A A . 19 GLU OE2 1 1 5 2057 1 1 20 CYS C C -2.881 3.871 0.430 1.00 . A A . 20 CYS C 1 1 5 2058 1 1 20 CYS CA C -4.206 3.257 0.849 1.00 . A A . 20 CYS CA 1 1 5 2059 1 1 20 CYS CB C -4.083 1.734 0.937 1.00 . A A . 20 CYS CB 1 1 5 2060 1 1 20 CYS H H -5.065 3.556 -1.057 1.00 . A A . 20 CYS H 1 1 5 2061 1 1 20 CYS HA H -4.482 3.645 1.819 1.00 . A A . 20 CYS HA 1 1 5 2062 1 1 20 CYS HB2 H -4.503 1.295 0.044 1.00 . A A . 20 CYS HB2 1 1 5 2063 1 1 20 CYS HB3 H -3.038 1.467 1.005 1.00 . A A . 20 CYS HB3 1 1 5 2064 1 1 20 CYS N N -5.249 3.629 -0.094 1.00 . A A . 20 CYS N 1 1 5 2065 1 1 20 CYS O O -2.829 4.673 -0.502 1.00 . A A . 20 CYS O 1 1 5 2066 1 1 20 CYS SG S -4.939 1.001 2.369 1.00 . A A . 20 CYS SG 1 1 5 2067 1 1 21 VAL C C 0.538 2.921 0.647 1.00 . A A . 21 VAL C 1 1 5 2068 1 1 21 VAL CA C -0.496 4.031 0.795 1.00 . A A . 21 VAL CA 1 1 5 2069 1 1 21 VAL CB C -0.015 5.037 1.861 1.00 . A A . 21 VAL CB 1 1 5 2070 1 1 21 VAL CG1 C -1.021 6.167 2.017 1.00 . A A . 21 VAL CG1 1 1 5 2071 1 1 21 VAL CG2 C 0.225 4.340 3.193 1.00 . A A . 21 VAL CG2 1 1 5 2072 1 1 21 VAL H H -1.905 2.857 1.851 1.00 . A A . 21 VAL H 1 1 5 2073 1 1 21 VAL HA H -0.575 4.555 -0.146 1.00 . A A . 21 VAL HA 1 1 5 2074 1 1 21 VAL HB H 0.921 5.464 1.526 1.00 . A A . 21 VAL HB 1 1 5 2075 1 1 21 VAL HG11 H -2.010 5.754 2.147 1.00 . A A . 21 VAL HG11 1 1 5 2076 1 1 21 VAL HG12 H -0.763 6.761 2.882 1.00 . A A . 21 VAL HG12 1 1 5 2077 1 1 21 VAL HG13 H -1.004 6.788 1.135 1.00 . A A . 21 VAL HG13 1 1 5 2078 1 1 21 VAL HG21 H 0.911 3.519 3.051 1.00 . A A . 21 VAL HG21 1 1 5 2079 1 1 21 VAL HG22 H 0.646 5.044 3.897 1.00 . A A . 21 VAL HG22 1 1 5 2080 1 1 21 VAL HG23 H -0.712 3.964 3.577 1.00 . A A . 21 VAL HG23 1 1 5 2081 1 1 21 VAL N N -1.810 3.499 1.116 1.00 . A A . 21 VAL N 1 1 5 2082 1 1 21 VAL O O 0.357 1.808 1.138 1.00 . A A . 21 VAL O 1 1 5 2083 1 1 22 CYS C C 3.846 2.573 0.735 1.00 . A A . 22 CYS C 1 1 5 2084 1 1 22 CYS CA C 2.721 2.317 -0.263 1.00 . A A . 22 CYS CA 1 1 5 2085 1 1 22 CYS CB C 3.243 2.455 -1.700 1.00 . A A . 22 CYS CB 1 1 5 2086 1 1 22 CYS H H 1.691 4.158 -0.384 1.00 . A A . 22 CYS H 1 1 5 2087 1 1 22 CYS HA H 2.342 1.317 -0.116 1.00 . A A . 22 CYS HA 1 1 5 2088 1 1 22 CYS HB2 H 3.239 3.494 -1.978 1.00 . A A . 22 CYS HB2 1 1 5 2089 1 1 22 CYS HB3 H 4.253 2.085 -1.751 1.00 . A A . 22 CYS HB3 1 1 5 2090 1 1 22 CYS N N 1.625 3.253 -0.031 1.00 . A A . 22 CYS N 1 1 5 2091 1 1 22 CYS O O 4.245 3.717 0.953 1.00 . A A . 22 CYS O 1 1 5 2092 1 1 22 CYS SG S 2.257 1.556 -2.937 1.00 . A A . 22 CYS SG 1 1 5 2093 1 1 23 LEU C C 6.765 1.286 1.747 1.00 . A A . 23 LEU C 1 1 5 2094 1 1 23 LEU CA C 5.402 1.622 2.345 1.00 . A A . 23 LEU CA 1 1 5 2095 1 1 23 LEU CB C 5.110 0.705 3.533 1.00 . A A . 23 LEU CB 1 1 5 2096 1 1 23 LEU CD1 C 3.277 -0.616 4.631 1.00 . A A . 23 LEU CD1 1 1 5 2097 1 1 23 LEU CD2 C 3.454 1.849 5.027 1.00 . A A . 23 LEU CD2 1 1 5 2098 1 1 23 LEU CG C 3.659 0.726 4.021 1.00 . A A . 23 LEU CG 1 1 5 2099 1 1 23 LEU H H 3.970 0.621 1.149 1.00 . A A . 23 LEU H 1 1 5 2100 1 1 23 LEU HA H 5.419 2.644 2.691 1.00 . A A . 23 LEU HA 1 1 5 2101 1 1 23 LEU HB2 H 5.360 -0.308 3.250 1.00 . A A . 23 LEU HB2 1 1 5 2102 1 1 23 LEU HB3 H 5.746 1.001 4.352 1.00 . A A . 23 LEU HB3 1 1 5 2103 1 1 23 LEU HD11 H 4.141 -1.263 4.650 1.00 . A A . 23 LEU HD11 1 1 5 2104 1 1 23 LEU HD12 H 2.917 -0.467 5.638 1.00 . A A . 23 LEU HD12 1 1 5 2105 1 1 23 LEU HD13 H 2.501 -1.073 4.036 1.00 . A A . 23 LEU HD13 1 1 5 2106 1 1 23 LEU HD21 H 4.142 1.726 5.850 1.00 . A A . 23 LEU HD21 1 1 5 2107 1 1 23 LEU HD22 H 3.634 2.799 4.546 1.00 . A A . 23 LEU HD22 1 1 5 2108 1 1 23 LEU HD23 H 2.440 1.819 5.399 1.00 . A A . 23 LEU HD23 1 1 5 2109 1 1 23 LEU HG H 3.006 0.906 3.180 1.00 . A A . 23 LEU HG 1 1 5 2110 1 1 23 LEU N N 4.339 1.506 1.354 1.00 . A A . 23 LEU N 1 1 5 2111 1 1 23 LEU O O 6.879 0.423 0.875 1.00 . A A . 23 LEU O 1 1 5 2112 1 1 24 GLU C C 9.591 0.324 1.899 1.00 . A A . 24 GLU C 1 1 5 2113 1 1 24 GLU CA C 9.157 1.778 1.748 1.00 . A A . 24 GLU CA 1 1 5 2114 1 1 24 GLU CB C 10.123 2.689 2.508 1.00 . A A . 24 GLU CB 1 1 5 2115 1 1 24 GLU CD C 10.941 3.511 4.751 1.00 . A A . 24 GLU CD 1 1 5 2116 1 1 24 GLU CG C 10.063 2.518 4.016 1.00 . A A . 24 GLU CG 1 1 5 2117 1 1 24 GLU H H 7.628 2.656 2.917 1.00 . A A . 24 GLU H 1 1 5 2118 1 1 24 GLU HA H 9.181 2.040 0.701 1.00 . A A . 24 GLU HA 1 1 5 2119 1 1 24 GLU HB2 H 11.131 2.474 2.183 1.00 . A A . 24 GLU HB2 1 1 5 2120 1 1 24 GLU HB3 H 9.890 3.717 2.273 1.00 . A A . 24 GLU HB3 1 1 5 2121 1 1 24 GLU HG2 H 9.042 2.656 4.340 1.00 . A A . 24 GLU HG2 1 1 5 2122 1 1 24 GLU HG3 H 10.387 1.518 4.265 1.00 . A A . 24 GLU HG3 1 1 5 2123 1 1 24 GLU N N 7.792 1.982 2.225 1.00 . A A . 24 GLU N 1 1 5 2124 1 1 24 GLU O O 10.142 -0.266 0.969 1.00 . A A . 24 GLU O 1 1 5 2125 1 1 24 GLU OE1 O 10.800 4.727 4.503 1.00 . A A . 24 GLU OE1 1 1 5 2126 1 1 24 GLU OE2 O 11.772 3.072 5.575 1.00 . A A . 24 GLU OE2 1 1 5 2127 1 1 25 HIS C C 9.154 -2.557 2.248 1.00 . A A . 25 HIS C 1 1 5 2128 1 1 25 HIS CA C 9.720 -1.643 3.327 1.00 . A A . 25 HIS CA 1 1 5 2129 1 1 25 HIS CB C 9.256 -2.117 4.714 1.00 . A A . 25 HIS CB 1 1 5 2130 1 1 25 HIS CD2 C 6.761 -1.655 5.263 1.00 . A A . 25 HIS CD2 1 1 5 2131 1 1 25 HIS CE1 C 7.017 0.233 6.347 1.00 . A A . 25 HIS CE1 1 1 5 2132 1 1 25 HIS CG C 8.084 -1.368 5.274 1.00 . A A . 25 HIS CG 1 1 5 2133 1 1 25 HIS H H 8.903 0.263 3.775 1.00 . A A . 25 HIS H 1 1 5 2134 1 1 25 HIS HA H 10.798 -1.698 3.285 1.00 . A A . 25 HIS HA 1 1 5 2135 1 1 25 HIS HB2 H 8.979 -3.157 4.654 1.00 . A A . 25 HIS HB2 1 1 5 2136 1 1 25 HIS HB3 H 10.077 -2.014 5.410 1.00 . A A . 25 HIS HB3 1 1 5 2137 1 1 25 HIS HD1 H 9.051 0.294 6.137 1.00 . A A . 25 HIS HD1 1 1 5 2138 1 1 25 HIS HD2 H 6.296 -2.517 4.806 1.00 . A A . 25 HIS HD2 1 1 5 2139 1 1 25 HIS HE1 H 6.811 1.134 6.905 1.00 . A A . 25 HIS HE1 1 1 5 2140 1 1 25 HIS HE2 H 5.181 -0.658 6.218 1.00 . A A . 25 HIS HE2 1 1 5 2141 1 1 25 HIS N N 9.344 -0.254 3.073 1.00 . A A . 25 HIS N 1 1 5 2142 1 1 25 HIS ND1 N 8.210 -0.179 5.960 1.00 . A A . 25 HIS ND1 1 1 5 2143 1 1 25 HIS NE2 N 6.119 -0.644 5.938 1.00 . A A . 25 HIS NE2 1 1 5 2144 1 1 25 HIS O O 9.709 -3.619 1.964 1.00 . A A . 25 HIS O 1 1 5 2145 1 1 26 GLY C C 6.100 -3.480 0.966 1.00 . A A . 26 GLY C 1 1 5 2146 1 1 26 GLY CA C 7.447 -2.905 0.579 1.00 . A A . 26 GLY CA 1 1 5 2147 1 1 26 GLY H H 7.668 -1.265 1.893 1.00 . A A . 26 GLY H 1 1 5 2148 1 1 26 GLY HA2 H 8.111 -3.717 0.317 1.00 . A A . 26 GLY HA2 1 1 5 2149 1 1 26 GLY HA3 H 7.320 -2.269 -0.282 1.00 . A A . 26 GLY HA3 1 1 5 2150 1 1 26 GLY N N 8.058 -2.126 1.635 1.00 . A A . 26 GLY N 1 1 5 2151 1 1 26 GLY O O 5.941 -4.697 1.046 1.00 . A A . 26 GLY O 1 1 5 2152 1 1 27 TYR C C 2.779 -1.894 1.432 1.00 . A A . 27 TYR C 1 1 5 2153 1 1 27 TYR CA C 3.780 -3.039 1.565 1.00 . A A . 27 TYR CA 1 1 5 2154 1 1 27 TYR CB C 3.765 -3.573 2.998 1.00 . A A . 27 TYR CB 1 1 5 2155 1 1 27 TYR CD1 C 3.672 -6.043 2.479 1.00 . A A . 27 TYR CD1 1 1 5 2156 1 1 27 TYR CD2 C 5.409 -5.258 3.910 1.00 . A A . 27 TYR CD2 1 1 5 2157 1 1 27 TYR CE1 C 4.151 -7.333 2.599 1.00 . A A . 27 TYR CE1 1 1 5 2158 1 1 27 TYR CE2 C 5.894 -6.545 4.035 1.00 . A A . 27 TYR CE2 1 1 5 2159 1 1 27 TYR CG C 4.291 -4.984 3.131 1.00 . A A . 27 TYR CG 1 1 5 2160 1 1 27 TYR CZ C 5.263 -7.579 3.377 1.00 . A A . 27 TYR CZ 1 1 5 2161 1 1 27 TYR H H 5.311 -1.646 1.107 1.00 . A A . 27 TYR H 1 1 5 2162 1 1 27 TYR HA H 3.493 -3.834 0.893 1.00 . A A . 27 TYR HA 1 1 5 2163 1 1 27 TYR HB2 H 4.375 -2.935 3.615 1.00 . A A . 27 TYR HB2 1 1 5 2164 1 1 27 TYR HB3 H 2.750 -3.559 3.368 1.00 . A A . 27 TYR HB3 1 1 5 2165 1 1 27 TYR HD1 H 2.802 -5.847 1.870 1.00 . A A . 27 TYR HD1 1 1 5 2166 1 1 27 TYR HD2 H 5.902 -4.446 4.424 1.00 . A A . 27 TYR HD2 1 1 5 2167 1 1 27 TYR HE1 H 3.656 -8.143 2.084 1.00 . A A . 27 TYR HE1 1 1 5 2168 1 1 27 TYR HE2 H 6.765 -6.737 4.644 1.00 . A A . 27 TYR HE2 1 1 5 2169 1 1 27 TYR HH H 6.043 -9.009 4.399 1.00 . A A . 27 TYR HH 1 1 5 2170 1 1 27 TYR N N 5.124 -2.605 1.195 1.00 . A A . 27 TYR N 1 1 5 2171 1 1 27 TYR O O 3.110 -0.734 1.672 1.00 . A A . 27 TYR O 1 1 5 2172 1 1 27 TYR OH O 5.743 -8.863 3.498 1.00 . A A . 27 TYR OH 1 1 5 2173 1 1 28 CYS C C -0.411 -1.207 2.115 1.00 . A A . 28 CYS C 1 1 5 2174 1 1 28 CYS CA C 0.495 -1.236 0.888 1.00 . A A . 28 CYS CA 1 1 5 2175 1 1 28 CYS CB C -0.342 -1.539 -0.360 1.00 . A A . 28 CYS CB 1 1 5 2176 1 1 28 CYS H H 1.350 -3.175 0.873 1.00 . A A . 28 CYS H 1 1 5 2177 1 1 28 CYS HA H 0.963 -0.271 0.775 1.00 . A A . 28 CYS HA 1 1 5 2178 1 1 28 CYS HB2 H -0.070 -2.513 -0.738 1.00 . A A . 28 CYS HB2 1 1 5 2179 1 1 28 CYS HB3 H -1.388 -1.545 -0.091 1.00 . A A . 28 CYS HB3 1 1 5 2180 1 1 28 CYS N N 1.550 -2.233 1.051 1.00 . A A . 28 CYS N 1 1 5 2181 1 1 28 CYS O O -1.133 -2.165 2.390 1.00 . A A . 28 CYS O 1 1 5 2182 1 1 28 CYS SG S -0.126 -0.342 -1.717 1.00 . A A . 28 CYS SG 1 1 5 2183 1 1 29 GLY C C -1.451 1.483 4.402 1.00 . A A . 29 GLY C 1 1 5 2184 1 1 29 GLY CA C -1.189 0.035 4.039 1.00 . A A . 29 GLY CA 1 1 5 2185 1 1 29 GLY H H 0.226 0.632 2.581 1.00 . A A . 29 GLY H 1 1 5 2186 1 1 29 GLY HA2 H -0.686 -0.447 4.866 1.00 . A A . 29 GLY HA2 1 1 5 2187 1 1 29 GLY HA3 H -2.134 -0.459 3.868 1.00 . A A . 29 GLY HA3 1 1 5 2188 1 1 29 GLY N N -0.368 -0.100 2.850 1.00 . A A . 29 GLY N 1 1 5 2189 1 1 29 GLY O O -2.129 2.178 3.616 1.00 . A A . 29 GLY O 1 1 5 2190 1 1 29 GLY OXT O -0.981 1.921 5.473 1.00 . A A . 29 GLY OXT 1 1 6 2191 1 1 1 ARG C C -11.009 3.162 1.269 1.00 . A A . 1 ARG C 1 1 6 2192 1 1 1 ARG CA C -11.876 4.200 0.564 1.00 . A A . 1 ARG CA 1 1 6 2193 1 1 1 ARG CB C -11.729 5.562 1.246 1.00 . A A . 1 ARG CB 1 1 6 2194 1 1 1 ARG CD C -13.326 6.439 2.986 1.00 . A A . 1 ARG CD 1 1 6 2195 1 1 1 ARG CG C -12.121 5.551 2.716 1.00 . A A . 1 ARG CG 1 1 6 2196 1 1 1 ARG CZ C -12.414 8.409 4.151 1.00 . A A . 1 ARG CZ 1 1 6 2197 1 1 1 ARG H1 H -13.532 3.480 1.549 1.00 . A A . 1 ARG H1 1 1 6 2198 1 1 1 ARG H2 H -13.872 4.650 0.344 1.00 . A A . 1 ARG H2 1 1 6 2199 1 1 1 ARG H3 H -13.443 3.051 -0.110 1.00 . A A . 1 ARG H3 1 1 6 2200 1 1 1 ARG HA H -11.560 4.283 -0.465 1.00 . A A . 1 ARG HA 1 1 6 2201 1 1 1 ARG HB2 H -10.700 5.878 1.173 1.00 . A A . 1 ARG HB2 1 1 6 2202 1 1 1 ARG HB3 H -12.354 6.278 0.733 1.00 . A A . 1 ARG HB3 1 1 6 2203 1 1 1 ARG HD2 H -13.497 7.067 2.124 1.00 . A A . 1 ARG HD2 1 1 6 2204 1 1 1 ARG HD3 H -14.190 5.810 3.148 1.00 . A A . 1 ARG HD3 1 1 6 2205 1 1 1 ARG HE H -13.556 7.007 4.997 1.00 . A A . 1 ARG HE 1 1 6 2206 1 1 1 ARG HG2 H -12.360 4.539 3.007 1.00 . A A . 1 ARG HG2 1 1 6 2207 1 1 1 ARG HG3 H -11.286 5.907 3.303 1.00 . A A . 1 ARG HG3 1 1 6 2208 1 1 1 ARG HH11 H -11.917 8.287 2.193 1.00 . A A . 1 ARG HH11 1 1 6 2209 1 1 1 ARG HH12 H -11.287 9.664 3.035 1.00 . A A . 1 ARG HH12 1 1 6 2210 1 1 1 ARG HH21 H -12.727 8.815 6.106 1.00 . A A . 1 ARG HH21 1 1 6 2211 1 1 1 ARG HH22 H -11.746 9.964 5.257 1.00 . A A . 1 ARG HH22 1 1 6 2212 1 1 1 ARG N N -13.310 3.810 0.589 1.00 . A A . 1 ARG N 1 1 6 2213 1 1 1 ARG NE N -13.131 7.288 4.159 1.00 . A A . 1 ARG NE 1 1 6 2214 1 1 1 ARG NH1 N -11.824 8.820 3.035 1.00 . A A . 1 ARG NH1 1 1 6 2215 1 1 1 ARG NH2 N -12.285 9.121 5.263 1.00 . A A . 1 ARG NH2 1 1 6 2216 1 1 1 ARG O O -10.035 3.504 1.940 1.00 . A A . 1 ARG O 1 1 6 2217 1 1 2 VAL C C -9.875 -0.015 0.688 1.00 . A A . 2 VAL C 1 1 6 2218 1 1 2 VAL CA C -10.627 0.804 1.734 1.00 . A A . 2 VAL CA 1 1 6 2219 1 1 2 VAL CB C -11.560 -0.127 2.535 1.00 . A A . 2 VAL CB 1 1 6 2220 1 1 2 VAL CG1 C -12.582 -0.785 1.618 1.00 . A A . 2 VAL CG1 1 1 6 2221 1 1 2 VAL CG2 C -10.753 -1.175 3.287 1.00 . A A . 2 VAL CG2 1 1 6 2222 1 1 2 VAL H H -12.157 1.684 0.566 1.00 . A A . 2 VAL H 1 1 6 2223 1 1 2 VAL HA H -9.912 1.237 2.419 1.00 . A A . 2 VAL HA 1 1 6 2224 1 1 2 VAL HB H -12.094 0.471 3.258 1.00 . A A . 2 VAL HB 1 1 6 2225 1 1 2 VAL HG11 H -12.624 -0.249 0.680 1.00 . A A . 2 VAL HG11 1 1 6 2226 1 1 2 VAL HG12 H -12.293 -1.810 1.434 1.00 . A A . 2 VAL HG12 1 1 6 2227 1 1 2 VAL HG13 H -13.554 -0.764 2.088 1.00 . A A . 2 VAL HG13 1 1 6 2228 1 1 2 VAL HG21 H -10.082 -1.672 2.602 1.00 . A A . 2 VAL HG21 1 1 6 2229 1 1 2 VAL HG22 H -10.182 -0.696 4.068 1.00 . A A . 2 VAL HG22 1 1 6 2230 1 1 2 VAL HG23 H -11.424 -1.900 3.724 1.00 . A A . 2 VAL HG23 1 1 6 2231 1 1 2 VAL N N -11.371 1.893 1.113 1.00 . A A . 2 VAL N 1 1 6 2232 1 1 2 VAL O O -10.405 -0.306 -0.384 1.00 . A A . 2 VAL O 1 1 6 2233 1 1 3 CYS C C -7.799 -2.642 0.512 1.00 . A A . 3 CYS C 1 1 6 2234 1 1 3 CYS CA C -7.817 -1.170 0.097 1.00 . A A . 3 CYS CA 1 1 6 2235 1 1 3 CYS CB C -6.388 -0.618 0.059 1.00 . A A . 3 CYS CB 1 1 6 2236 1 1 3 CYS H H -8.272 -0.121 1.878 1.00 . A A . 3 CYS H 1 1 6 2237 1 1 3 CYS HA H -8.249 -1.088 -0.889 1.00 . A A . 3 CYS HA 1 1 6 2238 1 1 3 CYS HB2 H -5.845 -1.104 -0.738 1.00 . A A . 3 CYS HB2 1 1 6 2239 1 1 3 CYS HB3 H -6.427 0.443 -0.135 1.00 . A A . 3 CYS HB3 1 1 6 2240 1 1 3 CYS N N -8.639 -0.384 1.009 1.00 . A A . 3 CYS N 1 1 6 2241 1 1 3 CYS O O -7.554 -2.960 1.675 1.00 . A A . 3 CYS O 1 1 6 2242 1 1 3 CYS SG S -5.446 -0.867 1.600 1.00 . A A . 3 CYS SG 1 1 6 2243 1 1 4 PRO C C -6.866 -5.447 0.667 1.00 . A A . 4 PRO C 1 1 6 2244 1 1 4 PRO CA C -8.071 -5.001 -0.155 1.00 . A A . 4 PRO CA 1 1 6 2245 1 1 4 PRO CB C -8.025 -5.625 -1.548 1.00 . A A . 4 PRO CB 1 1 6 2246 1 1 4 PRO CD C -8.363 -3.276 -1.852 1.00 . A A . 4 PRO CD 1 1 6 2247 1 1 4 PRO CG C -8.699 -4.628 -2.425 1.00 . A A . 4 PRO CG 1 1 6 2248 1 1 4 PRO HA H -8.979 -5.301 0.347 1.00 . A A . 4 PRO HA 1 1 6 2249 1 1 4 PRO HB2 H -6.996 -5.782 -1.842 1.00 . A A . 4 PRO HB2 1 1 6 2250 1 1 4 PRO HB3 H -8.552 -6.567 -1.542 1.00 . A A . 4 PRO HB3 1 1 6 2251 1 1 4 PRO HD2 H -7.502 -2.858 -2.353 1.00 . A A . 4 PRO HD2 1 1 6 2252 1 1 4 PRO HD3 H -9.209 -2.611 -1.937 1.00 . A A . 4 PRO HD3 1 1 6 2253 1 1 4 PRO HG2 H -8.321 -4.712 -3.433 1.00 . A A . 4 PRO HG2 1 1 6 2254 1 1 4 PRO HG3 H -9.766 -4.787 -2.409 1.00 . A A . 4 PRO HG3 1 1 6 2255 1 1 4 PRO N N -8.060 -3.562 -0.435 1.00 . A A . 4 PRO N 1 1 6 2256 1 1 4 PRO O O -5.821 -4.796 0.658 1.00 . A A . 4 PRO O 1 1 6 2257 1 1 5 ARG C C -4.966 -7.907 1.353 1.00 . A A . 5 ARG C 1 1 6 2258 1 1 5 ARG CA C -5.941 -7.094 2.199 1.00 . A A . 5 ARG CA 1 1 6 2259 1 1 5 ARG CB C -6.511 -7.966 3.319 1.00 . A A . 5 ARG CB 1 1 6 2260 1 1 5 ARG CD C -8.284 -7.676 5.083 1.00 . A A . 5 ARG CD 1 1 6 2261 1 1 5 ARG CG C -6.954 -7.176 4.541 1.00 . A A . 5 ARG CG 1 1 6 2262 1 1 5 ARG CZ C -7.780 -9.745 6.327 1.00 . A A . 5 ARG CZ 1 1 6 2263 1 1 5 ARG H H -7.874 -7.037 1.340 1.00 . A A . 5 ARG H 1 1 6 2264 1 1 5 ARG HA H -5.413 -6.260 2.635 1.00 . A A . 5 ARG HA 1 1 6 2265 1 1 5 ARG HB2 H -7.365 -8.508 2.938 1.00 . A A . 5 ARG HB2 1 1 6 2266 1 1 5 ARG HB3 H -5.756 -8.673 3.629 1.00 . A A . 5 ARG HB3 1 1 6 2267 1 1 5 ARG HD2 H -8.914 -6.825 5.294 1.00 . A A . 5 ARG HD2 1 1 6 2268 1 1 5 ARG HD3 H -8.756 -8.294 4.333 1.00 . A A . 5 ARG HD3 1 1 6 2269 1 1 5 ARG HE H -8.265 -7.998 7.160 1.00 . A A . 5 ARG HE 1 1 6 2270 1 1 5 ARG HG2 H -6.204 -7.272 5.311 1.00 . A A . 5 ARG HG2 1 1 6 2271 1 1 5 ARG HG3 H -7.056 -6.136 4.266 1.00 . A A . 5 ARG HG3 1 1 6 2272 1 1 5 ARG HH11 H -7.667 -9.933 4.315 1.00 . A A . 5 ARG HH11 1 1 6 2273 1 1 5 ARG HH12 H -7.319 -11.371 5.217 1.00 . A A . 5 ARG HH12 1 1 6 2274 1 1 5 ARG HH21 H -7.807 -9.887 8.342 1.00 . A A . 5 ARG HH21 1 1 6 2275 1 1 5 ARG HH22 H -7.398 -11.345 7.500 1.00 . A A . 5 ARG HH22 1 1 6 2276 1 1 5 ARG N N -7.019 -6.561 1.374 1.00 . A A . 5 ARG N 1 1 6 2277 1 1 5 ARG NE N -8.117 -8.457 6.307 1.00 . A A . 5 ARG NE 1 1 6 2278 1 1 5 ARG NH1 N -7.572 -10.403 5.193 1.00 . A A . 5 ARG NH1 1 1 6 2279 1 1 5 ARG NH2 N -7.651 -10.377 7.485 1.00 . A A . 5 ARG NH2 1 1 6 2280 1 1 5 ARG O O -5.020 -9.137 1.333 1.00 . A A . 5 ARG O 1 1 6 2281 1 1 6 ILE C C -1.747 -7.142 -0.140 1.00 . A A . 6 ILE C 1 1 6 2282 1 1 6 ILE CA C -3.089 -7.866 -0.195 1.00 . A A . 6 ILE CA 1 1 6 2283 1 1 6 ILE CB C -3.562 -7.932 -1.659 1.00 . A A . 6 ILE CB 1 1 6 2284 1 1 6 ILE CD1 C -5.586 -8.418 -3.123 1.00 . A A . 6 ILE CD1 1 1 6 2285 1 1 6 ILE CG1 C -4.991 -8.473 -1.733 1.00 . A A . 6 ILE CG1 1 1 6 2286 1 1 6 ILE CG2 C -2.619 -8.797 -2.482 1.00 . A A . 6 ILE CG2 1 1 6 2287 1 1 6 ILE H H -4.085 -6.232 0.710 1.00 . A A . 6 ILE H 1 1 6 2288 1 1 6 ILE HA H -2.957 -8.876 0.166 1.00 . A A . 6 ILE HA 1 1 6 2289 1 1 6 ILE HB H -3.541 -6.933 -2.066 1.00 . A A . 6 ILE HB 1 1 6 2290 1 1 6 ILE HD11 H -4.901 -8.867 -3.826 1.00 . A A . 6 ILE HD11 1 1 6 2291 1 1 6 ILE HD12 H -6.521 -8.959 -3.136 1.00 . A A . 6 ILE HD12 1 1 6 2292 1 1 6 ILE HD13 H -5.763 -7.389 -3.399 1.00 . A A . 6 ILE HD13 1 1 6 2293 1 1 6 ILE HG12 H -4.996 -9.504 -1.411 1.00 . A A . 6 ILE HG12 1 1 6 2294 1 1 6 ILE HG13 H -5.623 -7.892 -1.077 1.00 . A A . 6 ILE HG13 1 1 6 2295 1 1 6 ILE HG21 H -2.120 -9.503 -1.834 1.00 . A A . 6 ILE HG21 1 1 6 2296 1 1 6 ILE HG22 H -3.182 -9.333 -3.231 1.00 . A A . 6 ILE HG22 1 1 6 2297 1 1 6 ILE HG23 H -1.884 -8.169 -2.964 1.00 . A A . 6 ILE HG23 1 1 6 2298 1 1 6 ILE N N -4.076 -7.210 0.654 1.00 . A A . 6 ILE N 1 1 6 2299 1 1 6 ILE O O -1.687 -5.917 -0.245 1.00 . A A . 6 ILE O 1 1 6 2300 1 1 7 LEU C C 1.012 -6.602 -1.193 1.00 . A A . 7 LEU C 1 1 6 2301 1 1 7 LEU CA C 0.667 -7.344 0.094 1.00 . A A . 7 LEU CA 1 1 6 2302 1 1 7 LEU CB C 1.694 -8.449 0.347 1.00 . A A . 7 LEU CB 1 1 6 2303 1 1 7 LEU CD1 C 2.649 -10.200 1.867 1.00 . A A . 7 LEU CD1 1 1 6 2304 1 1 7 LEU CD2 C 1.374 -8.275 2.830 1.00 . A A . 7 LEU CD2 1 1 6 2305 1 1 7 LEU CG C 1.500 -9.228 1.650 1.00 . A A . 7 LEU CG 1 1 6 2306 1 1 7 LEU H H -0.789 -8.880 0.102 1.00 . A A . 7 LEU H 1 1 6 2307 1 1 7 LEU HA H 0.693 -6.646 0.917 1.00 . A A . 7 LEU HA 1 1 6 2308 1 1 7 LEU HB2 H 1.648 -9.148 -0.476 1.00 . A A . 7 LEU HB2 1 1 6 2309 1 1 7 LEU HB3 H 2.675 -8.002 0.364 1.00 . A A . 7 LEU HB3 1 1 6 2310 1 1 7 LEU HD11 H 3.127 -10.409 0.920 1.00 . A A . 7 LEU HD11 1 1 6 2311 1 1 7 LEU HD12 H 3.368 -9.763 2.543 1.00 . A A . 7 LEU HD12 1 1 6 2312 1 1 7 LEU HD13 H 2.270 -11.119 2.289 1.00 . A A . 7 LEU HD13 1 1 6 2313 1 1 7 LEU HD21 H 1.725 -7.295 2.541 1.00 . A A . 7 LEU HD21 1 1 6 2314 1 1 7 LEU HD22 H 0.338 -8.210 3.131 1.00 . A A . 7 LEU HD22 1 1 6 2315 1 1 7 LEU HD23 H 1.966 -8.640 3.655 1.00 . A A . 7 LEU HD23 1 1 6 2316 1 1 7 LEU HG H 0.587 -9.803 1.584 1.00 . A A . 7 LEU HG 1 1 6 2317 1 1 7 LEU N N -0.675 -7.910 0.026 1.00 . A A . 7 LEU N 1 1 6 2318 1 1 7 LEU O O 0.681 -7.055 -2.289 1.00 . A A . 7 LEU O 1 1 6 2319 1 1 8 LEU C C 3.225 -3.730 -1.860 1.00 . A A . 8 LEU C 1 1 6 2320 1 1 8 LEU CA C 2.068 -4.660 -2.211 1.00 . A A . 8 LEU CA 1 1 6 2321 1 1 8 LEU CB C 0.874 -3.848 -2.719 1.00 . A A . 8 LEU CB 1 1 6 2322 1 1 8 LEU CD1 C -0.417 -5.031 -4.514 1.00 . A A . 8 LEU CD1 1 1 6 2323 1 1 8 LEU CD2 C 0.148 -2.609 -4.774 1.00 . A A . 8 LEU CD2 1 1 6 2324 1 1 8 LEU CG C 0.612 -3.949 -4.223 1.00 . A A . 8 LEU CG 1 1 6 2325 1 1 8 LEU H H 1.920 -5.149 -0.154 1.00 . A A . 8 LEU H 1 1 6 2326 1 1 8 LEU HA H 2.389 -5.337 -2.989 1.00 . A A . 8 LEU HA 1 1 6 2327 1 1 8 LEU HB2 H -0.010 -4.186 -2.196 1.00 . A A . 8 LEU HB2 1 1 6 2328 1 1 8 LEU HB3 H 1.039 -2.809 -2.473 1.00 . A A . 8 LEU HB3 1 1 6 2329 1 1 8 LEU HD11 H -0.449 -5.729 -3.691 1.00 . A A . 8 LEU HD11 1 1 6 2330 1 1 8 LEU HD12 H -1.390 -4.577 -4.639 1.00 . A A . 8 LEU HD12 1 1 6 2331 1 1 8 LEU HD13 H -0.145 -5.553 -5.419 1.00 . A A . 8 LEU HD13 1 1 6 2332 1 1 8 LEU HD21 H -0.324 -2.040 -3.987 1.00 . A A . 8 LEU HD21 1 1 6 2333 1 1 8 LEU HD22 H 0.998 -2.062 -5.153 1.00 . A A . 8 LEU HD22 1 1 6 2334 1 1 8 LEU HD23 H -0.559 -2.774 -5.574 1.00 . A A . 8 LEU HD23 1 1 6 2335 1 1 8 LEU HG H 1.530 -4.219 -4.724 1.00 . A A . 8 LEU HG 1 1 6 2336 1 1 8 LEU N N 1.681 -5.461 -1.055 1.00 . A A . 8 LEU N 1 1 6 2337 1 1 8 LEU O O 3.077 -2.829 -1.037 1.00 . A A . 8 LEU O 1 1 6 2338 1 1 9 GLU C C 5.748 -2.085 -3.316 1.00 . A A . 9 GLU C 1 1 6 2339 1 1 9 GLU CA C 5.561 -3.141 -2.232 1.00 . A A . 9 GLU CA 1 1 6 2340 1 1 9 GLU CB C 6.804 -4.028 -2.153 1.00 . A A . 9 GLU CB 1 1 6 2341 1 1 9 GLU CD C 8.337 -4.531 -4.100 1.00 . A A . 9 GLU CD 1 1 6 2342 1 1 9 GLU CG C 7.035 -4.867 -3.401 1.00 . A A . 9 GLU CG 1 1 6 2343 1 1 9 GLU H H 4.433 -4.693 -3.130 1.00 . A A . 9 GLU H 1 1 6 2344 1 1 9 GLU HA H 5.423 -2.645 -1.283 1.00 . A A . 9 GLU HA 1 1 6 2345 1 1 9 GLU HB2 H 7.671 -3.401 -2.001 1.00 . A A . 9 GLU HB2 1 1 6 2346 1 1 9 GLU HB3 H 6.702 -4.696 -1.311 1.00 . A A . 9 GLU HB3 1 1 6 2347 1 1 9 GLU HG2 H 7.054 -5.909 -3.120 1.00 . A A . 9 GLU HG2 1 1 6 2348 1 1 9 GLU HG3 H 6.219 -4.696 -4.088 1.00 . A A . 9 GLU HG3 1 1 6 2349 1 1 9 GLU N N 4.376 -3.957 -2.486 1.00 . A A . 9 GLU N 1 1 6 2350 1 1 9 GLU O O 5.687 -2.386 -4.508 1.00 . A A . 9 GLU O 1 1 6 2351 1 1 9 GLU OE1 O 8.771 -3.362 -4.018 1.00 . A A . 9 GLU OE1 1 1 6 2352 1 1 9 GLU OE2 O 8.925 -5.436 -4.729 1.00 . A A . 9 GLU OE2 1 1 6 2353 1 1 10 CYS C C 7.036 1.351 -3.211 1.00 . A A . 10 CYS C 1 1 6 2354 1 1 10 CYS CA C 6.161 0.261 -3.826 1.00 . A A . 10 CYS CA 1 1 6 2355 1 1 10 CYS CB C 4.806 0.850 -4.242 1.00 . A A . 10 CYS CB 1 1 6 2356 1 1 10 CYS H H 6.000 -0.665 -1.928 1.00 . A A . 10 CYS H 1 1 6 2357 1 1 10 CYS HA H 6.657 -0.129 -4.702 1.00 . A A . 10 CYS HA 1 1 6 2358 1 1 10 CYS HB2 H 4.784 1.899 -3.987 1.00 . A A . 10 CYS HB2 1 1 6 2359 1 1 10 CYS HB3 H 4.691 0.744 -5.310 1.00 . A A . 10 CYS HB3 1 1 6 2360 1 1 10 CYS N N 5.971 -0.844 -2.891 1.00 . A A . 10 CYS N 1 1 6 2361 1 1 10 CYS O O 7.228 1.395 -1.996 1.00 . A A . 10 CYS O 1 1 6 2362 1 1 10 CYS SG S 3.366 0.060 -3.448 1.00 . A A . 10 CYS SG 1 1 6 2363 1 1 11 LYS C C 7.572 4.499 -3.117 1.00 . A A . 11 LYS C 1 1 6 2364 1 1 11 LYS CA C 8.414 3.323 -3.599 1.00 . A A . 11 LYS CA 1 1 6 2365 1 1 11 LYS CB C 9.349 3.778 -4.721 1.00 . A A . 11 LYS CB 1 1 6 2366 1 1 11 LYS CD C 11.491 3.407 -5.980 1.00 . A A . 11 LYS CD 1 1 6 2367 1 1 11 LYS CE C 12.734 2.541 -6.112 1.00 . A A . 11 LYS CE 1 1 6 2368 1 1 11 LYS CG C 10.531 2.849 -4.942 1.00 . A A . 11 LYS CG 1 1 6 2369 1 1 11 LYS H H 7.370 2.145 -5.017 1.00 . A A . 11 LYS H 1 1 6 2370 1 1 11 LYS HA H 9.006 2.956 -2.774 1.00 . A A . 11 LYS HA 1 1 6 2371 1 1 11 LYS HB2 H 8.787 3.837 -5.641 1.00 . A A . 11 LYS HB2 1 1 6 2372 1 1 11 LYS HB3 H 9.730 4.760 -4.480 1.00 . A A . 11 LYS HB3 1 1 6 2373 1 1 11 LYS HD2 H 10.991 3.449 -6.936 1.00 . A A . 11 LYS HD2 1 1 6 2374 1 1 11 LYS HD3 H 11.788 4.403 -5.683 1.00 . A A . 11 LYS HD3 1 1 6 2375 1 1 11 LYS HE2 H 13.121 2.337 -5.125 1.00 . A A . 11 LYS HE2 1 1 6 2376 1 1 11 LYS HE3 H 12.459 1.611 -6.589 1.00 . A A . 11 LYS HE3 1 1 6 2377 1 1 11 LYS HG2 H 11.059 2.725 -4.009 1.00 . A A . 11 LYS HG2 1 1 6 2378 1 1 11 LYS HG3 H 10.165 1.892 -5.283 1.00 . A A . 11 LYS HG3 1 1 6 2379 1 1 11 LYS HZ1 H 13.368 3.904 -7.561 1.00 . A A . 11 LYS HZ1 1 1 6 2380 1 1 11 LYS HZ2 H 14.468 3.691 -6.295 1.00 . A A . 11 LYS HZ2 1 1 6 2381 1 1 11 LYS HZ3 H 14.307 2.500 -7.486 1.00 . A A . 11 LYS HZ3 1 1 6 2382 1 1 11 LYS N N 7.562 2.231 -4.059 1.00 . A A . 11 LYS N 1 1 6 2383 1 1 11 LYS NZ N 13.793 3.205 -6.920 1.00 . A A . 11 LYS NZ 1 1 6 2384 1 1 11 LYS O O 7.629 4.879 -1.947 1.00 . A A . 11 LYS O 1 1 6 2385 1 1 12 LYS C C 4.587 5.716 -3.156 1.00 . A A . 12 LYS C 1 1 6 2386 1 1 12 LYS CA C 5.927 6.201 -3.693 1.00 . A A . 12 LYS CA 1 1 6 2387 1 1 12 LYS CB C 5.706 7.080 -4.926 1.00 . A A . 12 LYS CB 1 1 6 2388 1 1 12 LYS CD C 5.765 9.570 -4.600 1.00 . A A . 12 LYS CD 1 1 6 2389 1 1 12 LYS CE C 4.933 10.840 -4.501 1.00 . A A . 12 LYS CE 1 1 6 2390 1 1 12 LYS CG C 4.889 8.330 -4.643 1.00 . A A . 12 LYS CG 1 1 6 2391 1 1 12 LYS H H 6.783 4.720 -4.941 1.00 . A A . 12 LYS H 1 1 6 2392 1 1 12 LYS HA H 6.421 6.782 -2.930 1.00 . A A . 12 LYS HA 1 1 6 2393 1 1 12 LYS HB2 H 6.667 7.383 -5.315 1.00 . A A . 12 LYS HB2 1 1 6 2394 1 1 12 LYS HB3 H 5.190 6.501 -5.677 1.00 . A A . 12 LYS HB3 1 1 6 2395 1 1 12 LYS HD2 H 6.414 9.510 -3.740 1.00 . A A . 12 LYS HD2 1 1 6 2396 1 1 12 LYS HD3 H 6.360 9.609 -5.500 1.00 . A A . 12 LYS HD3 1 1 6 2397 1 1 12 LYS HE2 H 5.596 11.676 -4.339 1.00 . A A . 12 LYS HE2 1 1 6 2398 1 1 12 LYS HE3 H 4.400 10.979 -5.431 1.00 . A A . 12 LYS HE3 1 1 6 2399 1 1 12 LYS HG2 H 4.151 8.450 -5.421 1.00 . A A . 12 LYS HG2 1 1 6 2400 1 1 12 LYS HG3 H 4.394 8.216 -3.689 1.00 . A A . 12 LYS HG3 1 1 6 2401 1 1 12 LYS HZ1 H 4.261 10.084 -2.673 1.00 . A A . 12 LYS HZ1 1 1 6 2402 1 1 12 LYS HZ2 H 3.868 11.709 -2.929 1.00 . A A . 12 LYS HZ2 1 1 6 2403 1 1 12 LYS HZ3 H 3.017 10.493 -3.744 1.00 . A A . 12 LYS HZ3 1 1 6 2404 1 1 12 LYS N N 6.786 5.070 -4.025 1.00 . A A . 12 LYS N 1 1 6 2405 1 1 12 LYS NZ N 3.952 10.777 -3.384 1.00 . A A . 12 LYS NZ 1 1 6 2406 1 1 12 LYS O O 4.009 4.761 -3.678 1.00 . A A . 12 LYS O 1 1 6 2407 1 1 13 ASP C C 1.695 6.066 -2.527 1.00 . A A . 13 ASP C 1 1 6 2408 1 1 13 ASP CA C 2.824 5.989 -1.509 1.00 . A A . 13 ASP CA 1 1 6 2409 1 1 13 ASP CB C 2.505 6.865 -0.296 1.00 . A A . 13 ASP CB 1 1 6 2410 1 1 13 ASP CG C 3.652 6.920 0.696 1.00 . A A . 13 ASP CG 1 1 6 2411 1 1 13 ASP H H 4.599 7.119 -1.731 1.00 . A A . 13 ASP H 1 1 6 2412 1 1 13 ASP HA H 2.916 4.970 -1.187 1.00 . A A . 13 ASP HA 1 1 6 2413 1 1 13 ASP HB2 H 2.291 7.868 -0.625 1.00 . A A . 13 ASP HB2 1 1 6 2414 1 1 13 ASP HB3 H 1.639 6.467 0.207 1.00 . A A . 13 ASP HB3 1 1 6 2415 1 1 13 ASP N N 4.095 6.370 -2.109 1.00 . A A . 13 ASP N 1 1 6 2416 1 1 13 ASP O O 0.780 5.242 -2.516 1.00 . A A . 13 ASP O 1 1 6 2417 1 1 13 ASP OD1 O 4.793 7.193 0.269 1.00 . A A . 13 ASP OD1 1 1 6 2418 1 1 13 ASP OD2 O 3.407 6.689 1.899 1.00 . A A . 13 ASP OD2 1 1 6 2419 1 1 14 SER C C 0.607 5.948 -5.263 1.00 . A A . 14 SER C 1 1 6 2420 1 1 14 SER CA C 0.767 7.229 -4.451 1.00 . A A . 14 SER CA 1 1 6 2421 1 1 14 SER CB C 1.148 8.388 -5.374 1.00 . A A . 14 SER CB 1 1 6 2422 1 1 14 SER H H 2.533 7.668 -3.374 1.00 . A A . 14 SER H 1 1 6 2423 1 1 14 SER HA H -0.172 7.455 -3.968 1.00 . A A . 14 SER HA 1 1 6 2424 1 1 14 SER HB2 H 2.196 8.319 -5.622 1.00 . A A . 14 SER HB2 1 1 6 2425 1 1 14 SER HB3 H 0.560 8.334 -6.278 1.00 . A A . 14 SER HB3 1 1 6 2426 1 1 14 SER N N 1.773 7.050 -3.412 1.00 . A A . 14 SER N 1 1 6 2427 1 1 14 SER O O -0.486 5.625 -5.728 1.00 . A A . 14 SER O 1 1 6 2428 1 1 14 SER OG O 0.910 9.637 -4.749 1.00 . A A . 14 SER OG 1 1 6 2429 1 1 15 ASP C C 0.598 3.042 -5.743 1.00 . A A . 15 ASP C 1 1 6 2430 1 1 15 ASP CA C 1.712 3.982 -6.197 1.00 . A A . 15 ASP CA 1 1 6 2431 1 1 15 ASP CB C 3.066 3.282 -6.065 1.00 . A A . 15 ASP CB 1 1 6 2432 1 1 15 ASP CG C 3.485 2.588 -7.345 1.00 . A A . 15 ASP CG 1 1 6 2433 1 1 15 ASP H H 2.556 5.539 -5.037 1.00 . A A . 15 ASP H 1 1 6 2434 1 1 15 ASP HA H 1.551 4.233 -7.234 1.00 . A A . 15 ASP HA 1 1 6 2435 1 1 15 ASP HB2 H 3.818 4.013 -5.810 1.00 . A A . 15 ASP HB2 1 1 6 2436 1 1 15 ASP HB3 H 3.007 2.544 -5.278 1.00 . A A . 15 ASP HB3 1 1 6 2437 1 1 15 ASP N N 1.713 5.226 -5.435 1.00 . A A . 15 ASP N 1 1 6 2438 1 1 15 ASP O O 0.032 2.303 -6.549 1.00 . A A . 15 ASP O 1 1 6 2439 1 1 15 ASP OD1 O 3.577 3.270 -8.387 1.00 . A A . 15 ASP OD1 1 1 6 2440 1 1 15 ASP OD2 O 3.721 1.361 -7.306 1.00 . A A . 15 ASP OD2 1 1 6 2441 1 1 16 CYS C C -2.026 2.283 -4.696 1.00 . A A . 16 CYS C 1 1 6 2442 1 1 16 CYS CA C -0.737 2.191 -3.891 1.00 . A A . 16 CYS CA 1 1 6 2443 1 1 16 CYS CB C -1.004 2.532 -2.420 1.00 . A A . 16 CYS CB 1 1 6 2444 1 1 16 CYS H H 0.790 3.660 -3.849 1.00 . A A . 16 CYS H 1 1 6 2445 1 1 16 CYS HA H -0.372 1.176 -3.949 1.00 . A A . 16 CYS HA 1 1 6 2446 1 1 16 CYS HB2 H -0.101 2.894 -1.979 1.00 . A A . 16 CYS HB2 1 1 6 2447 1 1 16 CYS HB3 H -1.752 3.305 -2.364 1.00 . A A . 16 CYS HB3 1 1 6 2448 1 1 16 CYS N N 0.298 3.060 -4.446 1.00 . A A . 16 CYS N 1 1 6 2449 1 1 16 CYS O O -2.155 3.114 -5.597 1.00 . A A . 16 CYS O 1 1 6 2450 1 1 16 CYS SG S -1.573 1.123 -1.406 1.00 . A A . 16 CYS SG 1 1 6 2451 1 1 17 LEU C C -5.390 1.753 -4.114 1.00 . A A . 17 LEU C 1 1 6 2452 1 1 17 LEU CA C -4.254 1.381 -5.057 1.00 . A A . 17 LEU CA 1 1 6 2453 1 1 17 LEU CB C -4.500 -0.011 -5.643 1.00 . A A . 17 LEU CB 1 1 6 2454 1 1 17 LEU CD1 C -6.050 -1.321 -4.170 1.00 . A A . 17 LEU CD1 1 1 6 2455 1 1 17 LEU CD2 C -4.051 -2.434 -5.182 1.00 . A A . 17 LEU CD2 1 1 6 2456 1 1 17 LEU CG C -4.606 -1.137 -4.614 1.00 . A A . 17 LEU CG 1 1 6 2457 1 1 17 LEU H H -2.795 0.783 -3.643 1.00 . A A . 17 LEU H 1 1 6 2458 1 1 17 LEU HA H -4.219 2.099 -5.862 1.00 . A A . 17 LEU HA 1 1 6 2459 1 1 17 LEU HB2 H -5.419 0.018 -6.211 1.00 . A A . 17 LEU HB2 1 1 6 2460 1 1 17 LEU HB3 H -3.689 -0.244 -6.316 1.00 . A A . 17 LEU HB3 1 1 6 2461 1 1 17 LEU HD11 H -6.606 -0.418 -4.370 1.00 . A A . 17 LEU HD11 1 1 6 2462 1 1 17 LEU HD12 H -6.490 -2.144 -4.714 1.00 . A A . 17 LEU HD12 1 1 6 2463 1 1 17 LEU HD13 H -6.077 -1.534 -3.111 1.00 . A A . 17 LEU HD13 1 1 6 2464 1 1 17 LEU HD21 H -4.152 -2.428 -6.258 1.00 . A A . 17 LEU HD21 1 1 6 2465 1 1 17 LEU HD22 H -3.007 -2.525 -4.921 1.00 . A A . 17 LEU HD22 1 1 6 2466 1 1 17 LEU HD23 H -4.599 -3.270 -4.775 1.00 . A A . 17 LEU HD23 1 1 6 2467 1 1 17 LEU HG H -4.022 -0.876 -3.743 1.00 . A A . 17 LEU HG 1 1 6 2468 1 1 17 LEU N N -2.969 1.417 -4.368 1.00 . A A . 17 LEU N 1 1 6 2469 1 1 17 LEU O O -5.189 1.884 -2.907 1.00 . A A . 17 LEU O 1 1 6 2470 1 1 18 ALA C C -7.464 3.522 -3.022 1.00 . A A . 18 ALA C 1 1 6 2471 1 1 18 ALA CA C -7.751 2.284 -3.879 1.00 . A A . 18 ALA CA 1 1 6 2472 1 1 18 ALA CB C -8.183 1.099 -3.024 1.00 . A A . 18 ALA CB 1 1 6 2473 1 1 18 ALA H H -6.681 1.807 -5.640 1.00 . A A . 18 ALA H 1 1 6 2474 1 1 18 ALA HA H -8.556 2.516 -4.562 1.00 . A A . 18 ALA HA 1 1 6 2475 1 1 18 ALA HB1 H -8.368 0.246 -3.659 1.00 . A A . 18 ALA HB1 1 1 6 2476 1 1 18 ALA HB2 H -9.085 1.352 -2.488 1.00 . A A . 18 ALA HB2 1 1 6 2477 1 1 18 ALA HB3 H -7.401 0.860 -2.318 1.00 . A A . 18 ALA HB3 1 1 6 2478 1 1 18 ALA N N -6.584 1.925 -4.673 1.00 . A A . 18 ALA N 1 1 6 2479 1 1 18 ALA O O -7.063 4.562 -3.549 1.00 . A A . 18 ALA O 1 1 6 2480 1 1 19 GLU C C -6.425 4.144 0.284 1.00 . A A . 19 GLU C 1 1 6 2481 1 1 19 GLU CA C -7.413 4.538 -0.814 1.00 . A A . 19 GLU CA 1 1 6 2482 1 1 19 GLU CB C -8.729 5.027 -0.200 1.00 . A A . 19 GLU CB 1 1 6 2483 1 1 19 GLU CD C -8.927 7.522 0.148 1.00 . A A . 19 GLU CD 1 1 6 2484 1 1 19 GLU CG C -9.209 6.351 -0.772 1.00 . A A . 19 GLU CG 1 1 6 2485 1 1 19 GLU H H -7.979 2.571 -1.334 1.00 . A A . 19 GLU H 1 1 6 2486 1 1 19 GLU HA H -6.980 5.337 -1.397 1.00 . A A . 19 GLU HA 1 1 6 2487 1 1 19 GLU HB2 H -9.492 4.285 -0.376 1.00 . A A . 19 GLU HB2 1 1 6 2488 1 1 19 GLU HB3 H -8.597 5.148 0.866 1.00 . A A . 19 GLU HB3 1 1 6 2489 1 1 19 GLU HG2 H -8.709 6.523 -1.713 1.00 . A A . 19 GLU HG2 1 1 6 2490 1 1 19 GLU HG3 H -10.275 6.290 -0.938 1.00 . A A . 19 GLU HG3 1 1 6 2491 1 1 19 GLU N N -7.662 3.417 -1.709 1.00 . A A . 19 GLU N 1 1 6 2492 1 1 19 GLU O O -6.727 4.248 1.473 1.00 . A A . 19 GLU O 1 1 6 2493 1 1 19 GLU OE1 O -7.906 7.481 0.866 1.00 . A A . 19 GLU OE1 1 1 6 2494 1 1 19 GLU OE2 O -9.727 8.481 0.150 1.00 . A A . 19 GLU OE2 1 1 6 2495 1 1 20 CYS C C -2.874 3.889 0.426 1.00 . A A . 20 CYS C 1 1 6 2496 1 1 20 CYS CA C -4.214 3.291 0.825 1.00 . A A . 20 CYS CA 1 1 6 2497 1 1 20 CYS CB C -4.115 1.766 0.891 1.00 . A A . 20 CYS CB 1 1 6 2498 1 1 20 CYS H H -5.050 3.635 -1.085 1.00 . A A . 20 CYS H 1 1 6 2499 1 1 20 CYS HA H -4.491 3.671 1.797 1.00 . A A . 20 CYS HA 1 1 6 2500 1 1 20 CYS HB2 H -4.480 1.349 -0.036 1.00 . A A . 20 CYS HB2 1 1 6 2501 1 1 20 CYS HB3 H -3.080 1.485 1.022 1.00 . A A . 20 CYS HB3 1 1 6 2502 1 1 20 CYS N N -5.242 3.693 -0.123 1.00 . A A . 20 CYS N 1 1 6 2503 1 1 20 CYS O O -2.785 4.630 -0.553 1.00 . A A . 20 CYS O 1 1 6 2504 1 1 20 CYS SG S -5.072 1.019 2.250 1.00 . A A . 20 CYS SG 1 1 6 2505 1 1 21 VAL C C 0.515 2.975 0.732 1.00 . A A . 21 VAL C 1 1 6 2506 1 1 21 VAL CA C -0.509 4.093 0.887 1.00 . A A . 21 VAL CA 1 1 6 2507 1 1 21 VAL CB C -0.031 5.079 1.973 1.00 . A A . 21 VAL CB 1 1 6 2508 1 1 21 VAL CG1 C -1.035 6.209 2.143 1.00 . A A . 21 VAL CG1 1 1 6 2509 1 1 21 VAL CG2 C 0.200 4.361 3.296 1.00 . A A . 21 VAL CG2 1 1 6 2510 1 1 21 VAL H H -1.958 2.978 1.952 1.00 . A A . 21 VAL H 1 1 6 2511 1 1 21 VAL HA H -0.570 4.632 -0.048 1.00 . A A . 21 VAL HA 1 1 6 2512 1 1 21 VAL HB H 0.908 5.511 1.651 1.00 . A A . 21 VAL HB 1 1 6 2513 1 1 21 VAL HG11 H -1.639 6.291 1.251 1.00 . A A . 21 VAL HG11 1 1 6 2514 1 1 21 VAL HG12 H -1.672 6.001 2.990 1.00 . A A . 21 VAL HG12 1 1 6 2515 1 1 21 VAL HG13 H -0.508 7.137 2.307 1.00 . A A . 21 VAL HG13 1 1 6 2516 1 1 21 VAL HG21 H 0.875 3.532 3.141 1.00 . A A . 21 VAL HG21 1 1 6 2517 1 1 21 VAL HG22 H 0.631 5.048 4.008 1.00 . A A . 21 VAL HG22 1 1 6 2518 1 1 21 VAL HG23 H -0.742 3.992 3.674 1.00 . A A . 21 VAL HG23 1 1 6 2519 1 1 21 VAL N N -1.834 3.572 1.182 1.00 . A A . 21 VAL N 1 1 6 2520 1 1 21 VAL O O 0.322 1.859 1.214 1.00 . A A . 21 VAL O 1 1 6 2521 1 1 22 CYS C C 3.822 2.590 0.810 1.00 . A A . 22 CYS C 1 1 6 2522 1 1 22 CYS CA C 2.691 2.354 -0.185 1.00 . A A . 22 CYS CA 1 1 6 2523 1 1 22 CYS CB C 3.214 2.494 -1.623 1.00 . A A . 22 CYS CB 1 1 6 2524 1 1 22 CYS H H 1.680 4.206 -0.291 1.00 . A A . 22 CYS H 1 1 6 2525 1 1 22 CYS HA H 2.303 1.356 -0.044 1.00 . A A . 22 CYS HA 1 1 6 2526 1 1 22 CYS HB2 H 3.227 3.534 -1.893 1.00 . A A . 22 CYS HB2 1 1 6 2527 1 1 22 CYS HB3 H 4.217 2.108 -1.680 1.00 . A A . 22 CYS HB3 1 1 6 2528 1 1 22 CYS N N 1.605 3.300 0.055 1.00 . A A . 22 CYS N 1 1 6 2529 1 1 22 CYS O O 4.219 3.729 1.054 1.00 . A A . 22 CYS O 1 1 6 2530 1 1 22 CYS SG S 2.211 1.621 -2.867 1.00 . A A . 22 CYS SG 1 1 6 2531 1 1 23 LEU C C 6.753 1.285 1.752 1.00 . A A . 23 LEU C 1 1 6 2532 1 1 23 LEU CA C 5.398 1.602 2.378 1.00 . A A . 23 LEU CA 1 1 6 2533 1 1 23 LEU CB C 5.121 0.651 3.542 1.00 . A A . 23 LEU CB 1 1 6 2534 1 1 23 LEU CD1 C 3.300 -0.692 4.632 1.00 . A A . 23 LEU CD1 1 1 6 2535 1 1 23 LEU CD2 C 3.501 1.758 5.102 1.00 . A A . 23 LEU CD2 1 1 6 2536 1 1 23 LEU CG C 3.680 0.666 4.058 1.00 . A A . 23 LEU CG 1 1 6 2537 1 1 23 LEU H H 3.961 0.629 1.168 1.00 . A A . 23 LEU H 1 1 6 2538 1 1 23 LEU HA H 5.416 2.615 2.750 1.00 . A A . 23 LEU HA 1 1 6 2539 1 1 23 LEU HB2 H 5.360 -0.354 3.225 1.00 . A A . 23 LEU HB2 1 1 6 2540 1 1 23 LEU HB3 H 5.774 0.918 4.359 1.00 . A A . 23 LEU HB3 1 1 6 2541 1 1 23 LEU HD11 H 4.195 -1.269 4.812 1.00 . A A . 23 LEU HD11 1 1 6 2542 1 1 23 LEU HD12 H 2.766 -0.555 5.560 1.00 . A A . 23 LEU HD12 1 1 6 2543 1 1 23 LEU HD13 H 2.670 -1.216 3.928 1.00 . A A . 23 LEU HD13 1 1 6 2544 1 1 23 LEU HD21 H 3.828 2.703 4.694 1.00 . A A . 23 LEU HD21 1 1 6 2545 1 1 23 LEU HD22 H 2.458 1.825 5.377 1.00 . A A . 23 LEU HD22 1 1 6 2546 1 1 23 LEU HD23 H 4.090 1.520 5.975 1.00 . A A . 23 LEU HD23 1 1 6 2547 1 1 23 LEU HG H 3.013 0.877 3.235 1.00 . A A . 23 LEU HG 1 1 6 2548 1 1 23 LEU N N 4.326 1.509 1.394 1.00 . A A . 23 LEU N 1 1 6 2549 1 1 23 LEU O O 6.862 0.424 0.879 1.00 . A A . 23 LEU O 1 1 6 2550 1 1 24 GLU C C 9.579 0.353 1.809 1.00 . A A . 24 GLU C 1 1 6 2551 1 1 24 GLU CA C 9.137 1.810 1.701 1.00 . A A . 24 GLU CA 1 1 6 2552 1 1 24 GLU CB C 10.115 2.705 2.464 1.00 . A A . 24 GLU CB 1 1 6 2553 1 1 24 GLU CD C 10.752 3.625 4.728 1.00 . A A . 24 GLU CD 1 1 6 2554 1 1 24 GLU CG C 10.076 2.501 3.970 1.00 . A A . 24 GLU CG 1 1 6 2555 1 1 24 GLU H H 7.623 2.669 2.902 1.00 . A A . 24 GLU H 1 1 6 2556 1 1 24 GLU HA H 9.142 2.097 0.659 1.00 . A A . 24 GLU HA 1 1 6 2557 1 1 24 GLU HB2 H 11.117 2.500 2.120 1.00 . A A . 24 GLU HB2 1 1 6 2558 1 1 24 GLU HB3 H 9.876 3.738 2.257 1.00 . A A . 24 GLU HB3 1 1 6 2559 1 1 24 GLU HG2 H 9.046 2.441 4.286 1.00 . A A . 24 GLU HG2 1 1 6 2560 1 1 24 GLU HG3 H 10.578 1.574 4.207 1.00 . A A . 24 GLU HG3 1 1 6 2561 1 1 24 GLU N N 7.782 1.997 2.207 1.00 . A A . 24 GLU N 1 1 6 2562 1 1 24 GLU O O 10.112 -0.214 0.855 1.00 . A A . 24 GLU O 1 1 6 2563 1 1 24 GLU OE1 O 11.982 3.786 4.581 1.00 . A A . 24 GLU OE1 1 1 6 2564 1 1 24 GLU OE2 O 10.052 4.345 5.470 1.00 . A A . 24 GLU OE2 1 1 6 2565 1 1 25 HIS C C 9.135 -2.542 2.121 1.00 . A A . 25 HIS C 1 1 6 2566 1 1 25 HIS CA C 9.741 -1.645 3.193 1.00 . A A . 25 HIS CA 1 1 6 2567 1 1 25 HIS CB C 9.329 -2.137 4.591 1.00 . A A . 25 HIS CB 1 1 6 2568 1 1 25 HIS CD2 C 6.861 -1.685 5.259 1.00 . A A . 25 HIS CD2 1 1 6 2569 1 1 25 HIS CE1 C 7.159 0.206 6.326 1.00 . A A . 25 HIS CE1 1 1 6 2570 1 1 25 HIS CG C 8.182 -1.392 5.206 1.00 . A A . 25 HIS CG 1 1 6 2571 1 1 25 HIS H H 8.930 0.251 3.696 1.00 . A A . 25 HIS H 1 1 6 2572 1 1 25 HIS HA H 10.817 -1.699 3.110 1.00 . A A . 25 HIS HA 1 1 6 2573 1 1 25 HIS HB2 H 9.045 -3.176 4.524 1.00 . A A . 25 HIS HB2 1 1 6 2574 1 1 25 HIS HB3 H 10.176 -2.048 5.255 1.00 . A A . 25 HIS HB3 1 1 6 2575 1 1 25 HIS HD1 H 9.180 0.276 6.018 1.00 . A A . 25 HIS HD1 1 1 6 2576 1 1 25 HIS HD2 H 6.379 -2.552 4.830 1.00 . A A . 25 HIS HD2 1 1 6 2577 1 1 25 HIS HE1 H 6.975 1.109 6.889 1.00 . A A . 25 HIS HE1 1 1 6 2578 1 1 25 HIS HE2 H 5.323 -0.693 6.286 1.00 . A A . 25 HIS HE2 1 1 6 2579 1 1 25 HIS N N 9.357 -0.250 2.975 1.00 . A A . 25 HIS N 1 1 6 2580 1 1 25 HIS ND1 N 8.335 -0.201 5.882 1.00 . A A . 25 HIS ND1 1 1 6 2581 1 1 25 HIS NE2 N 6.247 -0.676 5.962 1.00 . A A . 25 HIS NE2 1 1 6 2582 1 1 25 HIS O O 9.684 -3.593 1.793 1.00 . A A . 25 HIS O 1 1 6 2583 1 1 26 GLY C C 6.015 -3.441 0.954 1.00 . A A . 26 GLY C 1 1 6 2584 1 1 26 GLY CA C 7.356 -2.877 0.527 1.00 . A A . 26 GLY CA 1 1 6 2585 1 1 26 GLY H H 7.621 -1.259 1.860 1.00 . A A . 26 GLY H 1 1 6 2586 1 1 26 GLY HA2 H 8.002 -3.693 0.239 1.00 . A A . 26 GLY HA2 1 1 6 2587 1 1 26 GLY HA3 H 7.206 -2.235 -0.326 1.00 . A A . 26 GLY HA3 1 1 6 2588 1 1 26 GLY N N 8.007 -2.111 1.567 1.00 . A A . 26 GLY N 1 1 6 2589 1 1 26 GLY O O 5.862 -4.655 1.084 1.00 . A A . 26 GLY O 1 1 6 2590 1 1 27 TYR C C 2.698 -1.843 1.417 1.00 . A A . 27 TYR C 1 1 6 2591 1 1 27 TYR CA C 3.703 -2.982 1.571 1.00 . A A . 27 TYR CA 1 1 6 2592 1 1 27 TYR CB C 3.714 -3.467 3.022 1.00 . A A . 27 TYR CB 1 1 6 2593 1 1 27 TYR CD1 C 3.786 -5.907 2.375 1.00 . A A . 27 TYR CD1 1 1 6 2594 1 1 27 TYR CD2 C 5.169 -5.178 4.173 1.00 . A A . 27 TYR CD2 1 1 6 2595 1 1 27 TYR CE1 C 4.258 -7.197 2.530 1.00 . A A . 27 TYR CE1 1 1 6 2596 1 1 27 TYR CE2 C 5.646 -6.464 4.335 1.00 . A A . 27 TYR CE2 1 1 6 2597 1 1 27 TYR CG C 4.231 -4.877 3.193 1.00 . A A . 27 TYR CG 1 1 6 2598 1 1 27 TYR CZ C 5.189 -7.470 3.509 1.00 . A A . 27 TYR CZ 1 1 6 2599 1 1 27 TYR H H 5.223 -1.605 1.036 1.00 . A A . 27 TYR H 1 1 6 2600 1 1 27 TYR HA H 3.404 -3.799 0.931 1.00 . A A . 27 TYR HA 1 1 6 2601 1 1 27 TYR HB2 H 4.342 -2.814 3.601 1.00 . A A . 27 TYR HB2 1 1 6 2602 1 1 27 TYR HB3 H 2.707 -3.432 3.412 1.00 . A A . 27 TYR HB3 1 1 6 2603 1 1 27 TYR HD1 H 3.058 -5.690 1.607 1.00 . A A . 27 TYR HD1 1 1 6 2604 1 1 27 TYR HD2 H 5.525 -4.388 4.819 1.00 . A A . 27 TYR HD2 1 1 6 2605 1 1 27 TYR HE1 H 3.900 -7.983 1.884 1.00 . A A . 27 TYR HE1 1 1 6 2606 1 1 27 TYR HE2 H 6.375 -6.678 5.102 1.00 . A A . 27 TYR HE2 1 1 6 2607 1 1 27 TYR HH H 5.034 -9.263 4.184 1.00 . A A . 27 TYR HH 1 1 6 2608 1 1 27 TYR N N 5.040 -2.560 1.164 1.00 . A A . 27 TYR N 1 1 6 2609 1 1 27 TYR O O 3.026 -0.680 1.646 1.00 . A A . 27 TYR O 1 1 6 2610 1 1 27 TYR OH O 5.661 -8.752 3.667 1.00 . A A . 27 TYR OH 1 1 6 2611 1 1 28 CYS C C -0.494 -1.154 2.074 1.00 . A A . 28 CYS C 1 1 6 2612 1 1 28 CYS CA C 0.418 -1.194 0.852 1.00 . A A . 28 CYS CA 1 1 6 2613 1 1 28 CYS CB C -0.411 -1.512 -0.398 1.00 . A A . 28 CYS CB 1 1 6 2614 1 1 28 CYS H H 1.277 -3.132 0.864 1.00 . A A . 28 CYS H 1 1 6 2615 1 1 28 CYS HA H 0.885 -0.229 0.730 1.00 . A A . 28 CYS HA 1 1 6 2616 1 1 28 CYS HB2 H -0.132 -2.488 -0.765 1.00 . A A . 28 CYS HB2 1 1 6 2617 1 1 28 CYS HB3 H -1.459 -1.520 -0.135 1.00 . A A . 28 CYS HB3 1 1 6 2618 1 1 28 CYS N N 1.474 -2.188 1.032 1.00 . A A . 28 CYS N 1 1 6 2619 1 1 28 CYS O O -1.277 -2.074 2.307 1.00 . A A . 28 CYS O 1 1 6 2620 1 1 28 CYS SG S -0.193 -0.327 -1.766 1.00 . A A . 28 CYS SG 1 1 6 2621 1 1 29 GLY C C -1.632 1.487 4.289 1.00 . A A . 29 GLY C 1 1 6 2622 1 1 29 GLY CA C -1.203 0.054 4.043 1.00 . A A . 29 GLY CA 1 1 6 2623 1 1 29 GLY H H 0.259 0.618 2.618 1.00 . A A . 29 GLY H 1 1 6 2624 1 1 29 GLY HA2 H -0.638 -0.292 4.896 1.00 . A A . 29 GLY HA2 1 1 6 2625 1 1 29 GLY HA3 H -2.083 -0.561 3.933 1.00 . A A . 29 GLY HA3 1 1 6 2626 1 1 29 GLY N N -0.384 -0.083 2.853 1.00 . A A . 29 GLY N 1 1 6 2627 1 1 29 GLY O O -0.925 2.200 5.029 1.00 . A A . 29 GLY O 1 1 6 2628 1 1 29 GLY OXT O -2.678 1.895 3.740 1.00 . A A . 29 GLY OXT 1 1 7 2629 1 1 1 ARG C C -11.346 2.952 0.850 1.00 . A A . 1 ARG C 1 1 7 2630 1 1 1 ARG CA C -12.399 3.833 0.183 1.00 . A A . 1 ARG CA 1 1 7 2631 1 1 1 ARG CB C -12.116 5.307 0.478 1.00 . A A . 1 ARG CB 1 1 7 2632 1 1 1 ARG CD C -11.218 6.729 2.344 1.00 . A A . 1 ARG CD 1 1 7 2633 1 1 1 ARG CG C -12.230 5.666 1.950 1.00 . A A . 1 ARG CG 1 1 7 2634 1 1 1 ARG CZ C -9.940 7.385 4.346 1.00 . A A . 1 ARG CZ 1 1 7 2635 1 1 1 ARG H1 H -13.710 3.394 1.707 1.00 . A A . 1 ARG H1 1 1 7 2636 1 1 1 ARG H2 H -14.392 4.288 0.410 1.00 . A A . 1 ARG H2 1 1 7 2637 1 1 1 ARG H3 H -14.059 2.618 0.217 1.00 . A A . 1 ARG H3 1 1 7 2638 1 1 1 ARG HA H -12.369 3.670 -0.884 1.00 . A A . 1 ARG HA 1 1 7 2639 1 1 1 ARG HB2 H -11.115 5.542 0.148 1.00 . A A . 1 ARG HB2 1 1 7 2640 1 1 1 ARG HB3 H -12.820 5.913 -0.074 1.00 . A A . 1 ARG HB3 1 1 7 2641 1 1 1 ARG HD2 H -10.299 6.548 1.809 1.00 . A A . 1 ARG HD2 1 1 7 2642 1 1 1 ARG HD3 H -11.609 7.699 2.070 1.00 . A A . 1 ARG HD3 1 1 7 2643 1 1 1 ARG HE H -11.534 6.184 4.350 1.00 . A A . 1 ARG HE 1 1 7 2644 1 1 1 ARG HG2 H -13.224 6.040 2.144 1.00 . A A . 1 ARG HG2 1 1 7 2645 1 1 1 ARG HG3 H -12.056 4.779 2.542 1.00 . A A . 1 ARG HG3 1 1 7 2646 1 1 1 ARG HH11 H -9.248 8.171 2.616 1.00 . A A . 1 ARG HH11 1 1 7 2647 1 1 1 ARG HH12 H -8.367 8.617 4.039 1.00 . A A . 1 ARG HH12 1 1 7 2648 1 1 1 ARG HH21 H -10.375 6.769 6.222 1.00 . A A . 1 ARG HH21 1 1 7 2649 1 1 1 ARG HH22 H -9.006 7.820 6.086 1.00 . A A . 1 ARG HH22 1 1 7 2650 1 1 1 ARG N N -13.763 3.503 0.674 1.00 . A A . 1 ARG N 1 1 7 2651 1 1 1 ARG NE N -10.941 6.717 3.779 1.00 . A A . 1 ARG NE 1 1 7 2652 1 1 1 ARG NH1 N -9.118 8.118 3.606 1.00 . A A . 1 ARG NH1 1 1 7 2653 1 1 1 ARG NH2 N -9.759 7.319 5.659 1.00 . A A . 1 ARG NH2 1 1 7 2654 1 1 1 ARG O O -10.227 3.394 1.110 1.00 . A A . 1 ARG O 1 1 7 2655 1 1 2 VAL C C -10.136 -0.143 0.721 1.00 . A A . 2 VAL C 1 1 7 2656 1 1 2 VAL CA C -10.798 0.760 1.755 1.00 . A A . 2 VAL CA 1 1 7 2657 1 1 2 VAL CB C -11.525 -0.116 2.794 1.00 . A A . 2 VAL CB 1 1 7 2658 1 1 2 VAL CG1 C -10.525 -0.941 3.589 1.00 . A A . 2 VAL CG1 1 1 7 2659 1 1 2 VAL CG2 C -12.373 0.745 3.718 1.00 . A A . 2 VAL CG2 1 1 7 2660 1 1 2 VAL H H -12.617 1.409 0.888 1.00 . A A . 2 VAL H 1 1 7 2661 1 1 2 VAL HA H -10.034 1.328 2.266 1.00 . A A . 2 VAL HA 1 1 7 2662 1 1 2 VAL HB H -12.180 -0.794 2.268 1.00 . A A . 2 VAL HB 1 1 7 2663 1 1 2 VAL HG11 H -9.789 -0.285 4.031 1.00 . A A . 2 VAL HG11 1 1 7 2664 1 1 2 VAL HG12 H -11.043 -1.479 4.369 1.00 . A A . 2 VAL HG12 1 1 7 2665 1 1 2 VAL HG13 H -10.034 -1.643 2.932 1.00 . A A . 2 VAL HG13 1 1 7 2666 1 1 2 VAL HG21 H -11.855 1.670 3.925 1.00 . A A . 2 VAL HG21 1 1 7 2667 1 1 2 VAL HG22 H -13.318 0.960 3.243 1.00 . A A . 2 VAL HG22 1 1 7 2668 1 1 2 VAL HG23 H -12.546 0.215 4.643 1.00 . A A . 2 VAL HG23 1 1 7 2669 1 1 2 VAL N N -11.711 1.703 1.121 1.00 . A A . 2 VAL N 1 1 7 2670 1 1 2 VAL O O -10.777 -0.584 -0.233 1.00 . A A . 2 VAL O 1 1 7 2671 1 1 3 CYS C C -7.969 -2.682 0.547 1.00 . A A . 3 CYS C 1 1 7 2672 1 1 3 CYS CA C -8.101 -1.261 -0.006 1.00 . A A . 3 CYS CA 1 1 7 2673 1 1 3 CYS CB C -6.712 -0.669 -0.268 1.00 . A A . 3 CYS CB 1 1 7 2674 1 1 3 CYS H H -8.391 -0.030 1.691 1.00 . A A . 3 CYS H 1 1 7 2675 1 1 3 CYS HA H -8.646 -1.297 -0.936 1.00 . A A . 3 CYS HA 1 1 7 2676 1 1 3 CYS HB2 H -6.259 -1.190 -1.097 1.00 . A A . 3 CYS HB2 1 1 7 2677 1 1 3 CYS HB3 H -6.819 0.376 -0.522 1.00 . A A . 3 CYS HB3 1 1 7 2678 1 1 3 CYS N N -8.848 -0.412 0.914 1.00 . A A . 3 CYS N 1 1 7 2679 1 1 3 CYS O O -7.574 -2.871 1.698 1.00 . A A . 3 CYS O 1 1 7 2680 1 1 3 CYS SG S -5.567 -0.782 1.147 1.00 . A A . 3 CYS SG 1 1 7 2681 1 1 4 PRO C C -6.893 -5.422 0.856 1.00 . A A . 4 PRO C 1 1 7 2682 1 1 4 PRO CA C -8.209 -5.105 0.153 1.00 . A A . 4 PRO CA 1 1 7 2683 1 1 4 PRO CB C -8.301 -5.867 -1.167 1.00 . A A . 4 PRO CB 1 1 7 2684 1 1 4 PRO CD C -8.776 -3.575 -1.659 1.00 . A A . 4 PRO CD 1 1 7 2685 1 1 4 PRO CG C -9.119 -4.989 -2.047 1.00 . A A . 4 PRO CG 1 1 7 2686 1 1 4 PRO HA H -9.034 -5.382 0.792 1.00 . A A . 4 PRO HA 1 1 7 2687 1 1 4 PRO HB2 H -7.309 -6.019 -1.569 1.00 . A A . 4 PRO HB2 1 1 7 2688 1 1 4 PRO HB3 H -8.778 -6.820 -1.004 1.00 . A A . 4 PRO HB3 1 1 7 2689 1 1 4 PRO HD2 H -7.998 -3.187 -2.299 1.00 . A A . 4 PRO HD2 1 1 7 2690 1 1 4 PRO HD3 H -9.653 -2.947 -1.706 1.00 . A A . 4 PRO HD3 1 1 7 2691 1 1 4 PRO HG2 H -8.865 -5.166 -3.081 1.00 . A A . 4 PRO HG2 1 1 7 2692 1 1 4 PRO HG3 H -10.169 -5.178 -1.880 1.00 . A A . 4 PRO HG3 1 1 7 2693 1 1 4 PRO N N -8.297 -3.703 -0.267 1.00 . A A . 4 PRO N 1 1 7 2694 1 1 4 PRO O O -5.896 -4.725 0.671 1.00 . A A . 4 PRO O 1 1 7 2695 1 1 5 ARG C C -4.779 -7.702 1.482 1.00 . A A . 5 ARG C 1 1 7 2696 1 1 5 ARG CA C -5.700 -6.887 2.383 1.00 . A A . 5 ARG CA 1 1 7 2697 1 1 5 ARG CB C -6.077 -7.704 3.621 1.00 . A A . 5 ARG CB 1 1 7 2698 1 1 5 ARG CD C -5.679 -6.470 5.774 1.00 . A A . 5 ARG CD 1 1 7 2699 1 1 5 ARG CG C -5.134 -7.498 4.796 1.00 . A A . 5 ARG CG 1 1 7 2700 1 1 5 ARG CZ C -3.619 -5.905 7.001 1.00 . A A . 5 ARG CZ 1 1 7 2701 1 1 5 ARG H H -7.721 -7.000 1.766 1.00 . A A . 5 ARG H 1 1 7 2702 1 1 5 ARG HA H -5.181 -5.993 2.695 1.00 . A A . 5 ARG HA 1 1 7 2703 1 1 5 ARG HB2 H -7.072 -7.425 3.932 1.00 . A A . 5 ARG HB2 1 1 7 2704 1 1 5 ARG HB3 H -6.070 -8.753 3.361 1.00 . A A . 5 ARG HB3 1 1 7 2705 1 1 5 ARG HD2 H -6.460 -5.905 5.287 1.00 . A A . 5 ARG HD2 1 1 7 2706 1 1 5 ARG HD3 H -6.090 -6.987 6.629 1.00 . A A . 5 ARG HD3 1 1 7 2707 1 1 5 ARG HE H -4.714 -4.611 5.949 1.00 . A A . 5 ARG HE 1 1 7 2708 1 1 5 ARG HG2 H -5.006 -8.437 5.311 1.00 . A A . 5 ARG HG2 1 1 7 2709 1 1 5 ARG HG3 H -4.180 -7.156 4.423 1.00 . A A . 5 ARG HG3 1 1 7 2710 1 1 5 ARG HH11 H -4.164 -7.849 7.129 1.00 . A A . 5 ARG HH11 1 1 7 2711 1 1 5 ARG HH12 H -2.718 -7.426 7.983 1.00 . A A . 5 ARG HH12 1 1 7 2712 1 1 5 ARG HH21 H -2.812 -4.053 7.071 1.00 . A A . 5 ARG HH21 1 1 7 2713 1 1 5 ARG HH22 H -1.951 -5.272 7.951 1.00 . A A . 5 ARG HH22 1 1 7 2714 1 1 5 ARG N N -6.896 -6.480 1.660 1.00 . A A . 5 ARG N 1 1 7 2715 1 1 5 ARG NE N -4.643 -5.547 6.232 1.00 . A A . 5 ARG NE 1 1 7 2716 1 1 5 ARG NH1 N -3.490 -7.163 7.404 1.00 . A A . 5 ARG NH1 1 1 7 2717 1 1 5 ARG NH2 N -2.720 -5.002 7.372 1.00 . A A . 5 ARG NH2 1 1 7 2718 1 1 5 ARG O O -4.750 -8.931 1.553 1.00 . A A . 5 ARG O 1 1 7 2719 1 1 6 ILE C C -1.727 -7.004 -0.235 1.00 . A A . 6 ILE C 1 1 7 2720 1 1 6 ILE CA C -3.103 -7.661 -0.282 1.00 . A A . 6 ILE CA 1 1 7 2721 1 1 6 ILE CB C -3.626 -7.626 -1.729 1.00 . A A . 6 ILE CB 1 1 7 2722 1 1 6 ILE CD1 C -5.288 -9.515 -1.344 1.00 . A A . 6 ILE CD1 1 1 7 2723 1 1 6 ILE CG1 C -5.087 -8.080 -1.780 1.00 . A A . 6 ILE CG1 1 1 7 2724 1 1 6 ILE CG2 C -2.762 -8.498 -2.628 1.00 . A A . 6 ILE CG2 1 1 7 2725 1 1 6 ILE H H -4.097 -6.030 0.627 1.00 . A A . 6 ILE H 1 1 7 2726 1 1 6 ILE HA H -3.008 -8.695 0.021 1.00 . A A . 6 ILE HA 1 1 7 2727 1 1 6 ILE HB H -3.562 -6.610 -2.087 1.00 . A A . 6 ILE HB 1 1 7 2728 1 1 6 ILE HD11 H -4.611 -9.745 -0.535 1.00 . A A . 6 ILE HD11 1 1 7 2729 1 1 6 ILE HD12 H -6.306 -9.650 -1.010 1.00 . A A . 6 ILE HD12 1 1 7 2730 1 1 6 ILE HD13 H -5.092 -10.175 -2.177 1.00 . A A . 6 ILE HD13 1 1 7 2731 1 1 6 ILE HG12 H -5.675 -7.451 -1.128 1.00 . A A . 6 ILE HG12 1 1 7 2732 1 1 6 ILE HG13 H -5.451 -7.985 -2.791 1.00 . A A . 6 ILE HG13 1 1 7 2733 1 1 6 ILE HG21 H -1.793 -8.636 -2.171 1.00 . A A . 6 ILE HG21 1 1 7 2734 1 1 6 ILE HG22 H -3.237 -9.458 -2.762 1.00 . A A . 6 ILE HG22 1 1 7 2735 1 1 6 ILE HG23 H -2.643 -8.018 -3.588 1.00 . A A . 6 ILE HG23 1 1 7 2736 1 1 6 ILE N N -4.027 -7.007 0.636 1.00 . A A . 6 ILE N 1 1 7 2737 1 1 6 ILE O O -1.611 -5.780 -0.287 1.00 . A A . 6 ILE O 1 1 7 2738 1 1 7 LEU C C 1.013 -6.514 -1.333 1.00 . A A . 7 LEU C 1 1 7 2739 1 1 7 LEU CA C 0.681 -7.327 -0.086 1.00 . A A . 7 LEU CA 1 1 7 2740 1 1 7 LEU CB C 1.664 -8.492 0.052 1.00 . A A . 7 LEU CB 1 1 7 2741 1 1 7 LEU CD1 C 2.581 -10.397 1.398 1.00 . A A . 7 LEU CD1 1 1 7 2742 1 1 7 LEU CD2 C 1.437 -8.492 2.551 1.00 . A A . 7 LEU CD2 1 1 7 2743 1 1 7 LEU CG C 1.474 -9.357 1.299 1.00 . A A . 7 LEU CG 1 1 7 2744 1 1 7 LEU H H -0.846 -8.793 -0.101 1.00 . A A . 7 LEU H 1 1 7 2745 1 1 7 LEU HA H 0.769 -6.689 0.780 1.00 . A A . 7 LEU HA 1 1 7 2746 1 1 7 LEU HB2 H 1.564 -9.124 -0.819 1.00 . A A . 7 LEU HB2 1 1 7 2747 1 1 7 LEU HB3 H 2.665 -8.089 0.069 1.00 . A A . 7 LEU HB3 1 1 7 2748 1 1 7 LEU HD11 H 3.473 -10.022 0.919 1.00 . A A . 7 LEU HD11 1 1 7 2749 1 1 7 LEU HD12 H 2.790 -10.602 2.438 1.00 . A A . 7 LEU HD12 1 1 7 2750 1 1 7 LEU HD13 H 2.265 -11.307 0.910 1.00 . A A . 7 LEU HD13 1 1 7 2751 1 1 7 LEU HD21 H 1.829 -7.512 2.323 1.00 . A A . 7 LEU HD21 1 1 7 2752 1 1 7 LEU HD22 H 0.416 -8.400 2.893 1.00 . A A . 7 LEU HD22 1 1 7 2753 1 1 7 LEU HD23 H 2.036 -8.949 3.325 1.00 . A A . 7 LEU HD23 1 1 7 2754 1 1 7 LEU HG H 0.532 -9.881 1.224 1.00 . A A . 7 LEU HG 1 1 7 2755 1 1 7 LEU N N -0.688 -7.827 -0.138 1.00 . A A . 7 LEU N 1 1 7 2756 1 1 7 LEU O O 0.621 -6.876 -2.443 1.00 . A A . 7 LEU O 1 1 7 2757 1 1 8 LEU C C 3.295 -3.663 -1.875 1.00 . A A . 8 LEU C 1 1 7 2758 1 1 8 LEU CA C 2.121 -4.556 -2.259 1.00 . A A . 8 LEU CA 1 1 7 2759 1 1 8 LEU CB C 0.932 -3.700 -2.704 1.00 . A A . 8 LEU CB 1 1 7 2760 1 1 8 LEU CD1 C -0.575 -4.127 -4.667 1.00 . A A . 8 LEU CD1 1 1 7 2761 1 1 8 LEU CD2 C 0.901 -2.109 -4.647 1.00 . A A . 8 LEU CD2 1 1 7 2762 1 1 8 LEU CG C 0.766 -3.564 -4.221 1.00 . A A . 8 LEU CG 1 1 7 2763 1 1 8 LEU H H 2.024 -5.178 -0.236 1.00 . A A . 8 LEU H 1 1 7 2764 1 1 8 LEU HA H 2.421 -5.192 -3.079 1.00 . A A . 8 LEU HA 1 1 7 2765 1 1 8 LEU HB2 H 0.031 -4.137 -2.299 1.00 . A A . 8 LEU HB2 1 1 7 2766 1 1 8 LEU HB3 H 1.051 -2.711 -2.286 1.00 . A A . 8 LEU HB3 1 1 7 2767 1 1 8 LEU HD11 H -0.795 -5.021 -4.103 1.00 . A A . 8 LEU HD11 1 1 7 2768 1 1 8 LEU HD12 H -1.349 -3.393 -4.494 1.00 . A A . 8 LEU HD12 1 1 7 2769 1 1 8 LEU HD13 H -0.533 -4.365 -5.719 1.00 . A A . 8 LEU HD13 1 1 7 2770 1 1 8 LEU HD21 H 0.521 -1.468 -3.865 1.00 . A A . 8 LEU HD21 1 1 7 2771 1 1 8 LEU HD22 H 1.942 -1.881 -4.824 1.00 . A A . 8 LEU HD22 1 1 7 2772 1 1 8 LEU HD23 H 0.338 -1.945 -5.553 1.00 . A A . 8 LEU HD23 1 1 7 2773 1 1 8 LEU HG H 1.544 -4.129 -4.713 1.00 . A A . 8 LEU HG 1 1 7 2774 1 1 8 LEU N N 1.738 -5.416 -1.145 1.00 . A A . 8 LEU N 1 1 7 2775 1 1 8 LEU O O 3.164 -2.789 -1.020 1.00 . A A . 8 LEU O 1 1 7 2776 1 1 9 GLU C C 5.856 -2.038 -3.291 1.00 . A A . 9 GLU C 1 1 7 2777 1 1 9 GLU CA C 5.644 -3.118 -2.236 1.00 . A A . 9 GLU CA 1 1 7 2778 1 1 9 GLU CB C 6.864 -4.040 -2.185 1.00 . A A . 9 GLU CB 1 1 7 2779 1 1 9 GLU CD C 8.309 -4.219 -4.249 1.00 . A A . 9 GLU CD 1 1 7 2780 1 1 9 GLU CG C 7.124 -4.778 -3.488 1.00 . A A . 9 GLU CG 1 1 7 2781 1 1 9 GLU H H 4.477 -4.611 -3.180 1.00 . A A . 9 GLU H 1 1 7 2782 1 1 9 GLU HA H 5.520 -2.645 -1.274 1.00 . A A . 9 GLU HA 1 1 7 2783 1 1 9 GLU HB2 H 7.738 -3.449 -1.950 1.00 . A A . 9 GLU HB2 1 1 7 2784 1 1 9 GLU HB3 H 6.716 -4.771 -1.404 1.00 . A A . 9 GLU HB3 1 1 7 2785 1 1 9 GLU HG2 H 7.316 -5.818 -3.266 1.00 . A A . 9 GLU HG2 1 1 7 2786 1 1 9 GLU HG3 H 6.245 -4.701 -4.112 1.00 . A A . 9 GLU HG3 1 1 7 2787 1 1 9 GLU N N 4.441 -3.895 -2.511 1.00 . A A . 9 GLU N 1 1 7 2788 1 1 9 GLU O O 5.825 -2.316 -4.491 1.00 . A A . 9 GLU O 1 1 7 2789 1 1 9 GLU OE1 O 9.258 -3.733 -3.598 1.00 . A A . 9 GLU OE1 1 1 7 2790 1 1 9 GLU OE2 O 8.290 -4.266 -5.497 1.00 . A A . 9 GLU OE2 1 1 7 2791 1 1 10 CYS C C 7.071 1.430 -3.073 1.00 . A A . 10 CYS C 1 1 7 2792 1 1 10 CYS CA C 6.279 0.314 -3.750 1.00 . A A . 10 CYS CA 1 1 7 2793 1 1 10 CYS CB C 4.936 0.859 -4.253 1.00 . A A . 10 CYS CB 1 1 7 2794 1 1 10 CYS H H 6.076 -0.644 -1.872 1.00 . A A . 10 CYS H 1 1 7 2795 1 1 10 CYS HA H 6.847 -0.050 -4.594 1.00 . A A . 10 CYS HA 1 1 7 2796 1 1 10 CYS HB2 H 4.872 1.912 -4.021 1.00 . A A . 10 CYS HB2 1 1 7 2797 1 1 10 CYS HB3 H 4.884 0.731 -5.324 1.00 . A A . 10 CYS HB3 1 1 7 2798 1 1 10 CYS N N 6.067 -0.806 -2.839 1.00 . A A . 10 CYS N 1 1 7 2799 1 1 10 CYS O O 7.220 1.445 -1.851 1.00 . A A . 10 CYS O 1 1 7 2800 1 1 10 CYS SG S 3.473 0.046 -3.527 1.00 . A A . 10 CYS SG 1 1 7 2801 1 1 11 LYS C C 7.430 4.647 -2.985 1.00 . A A . 11 LYS C 1 1 7 2802 1 1 11 LYS CA C 8.347 3.485 -3.355 1.00 . A A . 11 LYS CA 1 1 7 2803 1 1 11 LYS CB C 9.379 3.945 -4.387 1.00 . A A . 11 LYS CB 1 1 7 2804 1 1 11 LYS CD C 11.881 4.082 -4.586 1.00 . A A . 11 LYS CD 1 1 7 2805 1 1 11 LYS CE C 12.328 4.007 -6.037 1.00 . A A . 11 LYS CE 1 1 7 2806 1 1 11 LYS CG C 10.689 3.176 -4.322 1.00 . A A . 11 LYS CG 1 1 7 2807 1 1 11 LYS H H 7.419 2.297 -4.841 1.00 . A A . 11 LYS H 1 1 7 2808 1 1 11 LYS HA H 8.862 3.151 -2.468 1.00 . A A . 11 LYS HA 1 1 7 2809 1 1 11 LYS HB2 H 8.962 3.819 -5.377 1.00 . A A . 11 LYS HB2 1 1 7 2810 1 1 11 LYS HB3 H 9.591 4.991 -4.227 1.00 . A A . 11 LYS HB3 1 1 7 2811 1 1 11 LYS HD2 H 11.604 5.100 -4.358 1.00 . A A . 11 LYS HD2 1 1 7 2812 1 1 11 LYS HD3 H 12.699 3.778 -3.949 1.00 . A A . 11 LYS HD3 1 1 7 2813 1 1 11 LYS HE2 H 13.234 4.585 -6.151 1.00 . A A . 11 LYS HE2 1 1 7 2814 1 1 11 LYS HE3 H 12.528 2.974 -6.285 1.00 . A A . 11 LYS HE3 1 1 7 2815 1 1 11 LYS HG2 H 10.791 2.741 -3.340 1.00 . A A . 11 LYS HG2 1 1 7 2816 1 1 11 LYS HG3 H 10.673 2.392 -5.065 1.00 . A A . 11 LYS HG3 1 1 7 2817 1 1 11 LYS HZ1 H 10.664 5.194 -6.462 1.00 . A A . 11 LYS HZ1 1 1 7 2818 1 1 11 LYS HZ2 H 11.747 5.044 -7.753 1.00 . A A . 11 LYS HZ2 1 1 7 2819 1 1 11 LYS HZ3 H 10.725 3.757 -7.352 1.00 . A A . 11 LYS HZ3 1 1 7 2820 1 1 11 LYS N N 7.574 2.364 -3.875 1.00 . A A . 11 LYS N 1 1 7 2821 1 1 11 LYS NZ N 11.294 4.538 -6.966 1.00 . A A . 11 LYS NZ 1 1 7 2822 1 1 11 LYS O O 7.298 4.996 -1.811 1.00 . A A . 11 LYS O 1 1 7 2823 1 1 12 LYS C C 4.536 5.850 -3.264 1.00 . A A . 12 LYS C 1 1 7 2824 1 1 12 LYS CA C 5.882 6.353 -3.771 1.00 . A A . 12 LYS CA 1 1 7 2825 1 1 12 LYS CB C 5.690 7.148 -5.065 1.00 . A A . 12 LYS CB 1 1 7 2826 1 1 12 LYS CD C 5.039 9.398 -5.975 1.00 . A A . 12 LYS CD 1 1 7 2827 1 1 12 LYS CE C 4.727 8.875 -7.367 1.00 . A A . 12 LYS CE 1 1 7 2828 1 1 12 LYS CG C 4.767 8.346 -4.912 1.00 . A A . 12 LYS CG 1 1 7 2829 1 1 12 LYS H H 6.936 4.909 -4.904 1.00 . A A . 12 LYS H 1 1 7 2830 1 1 12 LYS HA H 6.319 6.997 -3.022 1.00 . A A . 12 LYS HA 1 1 7 2831 1 1 12 LYS HB2 H 6.653 7.502 -5.402 1.00 . A A . 12 LYS HB2 1 1 7 2832 1 1 12 LYS HB3 H 5.275 6.494 -5.817 1.00 . A A . 12 LYS HB3 1 1 7 2833 1 1 12 LYS HD2 H 4.422 10.261 -5.779 1.00 . A A . 12 LYS HD2 1 1 7 2834 1 1 12 LYS HD3 H 6.081 9.679 -5.930 1.00 . A A . 12 LYS HD3 1 1 7 2835 1 1 12 LYS HE2 H 4.983 7.828 -7.411 1.00 . A A . 12 LYS HE2 1 1 7 2836 1 1 12 LYS HE3 H 3.669 8.994 -7.554 1.00 . A A . 12 LYS HE3 1 1 7 2837 1 1 12 LYS HG2 H 3.744 8.014 -5.002 1.00 . A A . 12 LYS HG2 1 1 7 2838 1 1 12 LYS HG3 H 4.920 8.784 -3.936 1.00 . A A . 12 LYS HG3 1 1 7 2839 1 1 12 LYS HZ1 H 6.349 10.024 -8.010 1.00 . A A . 12 LYS HZ1 1 1 7 2840 1 1 12 LYS HZ2 H 5.764 8.951 -9.179 1.00 . A A . 12 LYS HZ2 1 1 7 2841 1 1 12 LYS HZ3 H 4.906 10.364 -8.823 1.00 . A A . 12 LYS HZ3 1 1 7 2842 1 1 12 LYS N N 6.793 5.236 -3.992 1.00 . A A . 12 LYS N 1 1 7 2843 1 1 12 LYS NZ N 5.490 9.604 -8.419 1.00 . A A . 12 LYS NZ 1 1 7 2844 1 1 12 LYS O O 3.934 4.957 -3.859 1.00 . A A . 12 LYS O 1 1 7 2845 1 1 13 ASP C C 1.673 6.061 -2.590 1.00 . A A . 13 ASP C 1 1 7 2846 1 1 13 ASP CA C 2.801 6.013 -1.566 1.00 . A A . 13 ASP CA 1 1 7 2847 1 1 13 ASP CB C 2.457 6.888 -0.359 1.00 . A A . 13 ASP CB 1 1 7 2848 1 1 13 ASP CG C 3.593 6.966 0.642 1.00 . A A . 13 ASP CG 1 1 7 2849 1 1 13 ASP H H 4.600 7.118 -1.720 1.00 . A A . 13 ASP H 1 1 7 2850 1 1 13 ASP HA H 2.913 4.999 -1.239 1.00 . A A . 13 ASP HA 1 1 7 2851 1 1 13 ASP HB2 H 2.227 7.884 -0.695 1.00 . A A . 13 ASP HB2 1 1 7 2852 1 1 13 ASP HB3 H 1.593 6.475 0.138 1.00 . A A . 13 ASP HB3 1 1 7 2853 1 1 13 ASP N N 4.072 6.418 -2.155 1.00 . A A . 13 ASP N 1 1 7 2854 1 1 13 ASP O O 0.764 5.231 -2.560 1.00 . A A . 13 ASP O 1 1 7 2855 1 1 13 ASP OD1 O 4.738 7.234 0.220 1.00 . A A . 13 ASP OD1 1 1 7 2856 1 1 13 ASP OD2 O 3.338 6.761 1.847 1.00 . A A . 13 ASP OD2 1 1 7 2857 1 1 14 SER C C 0.556 5.890 -5.322 1.00 . A A . 14 SER C 1 1 7 2858 1 1 14 SER CA C 0.736 7.185 -4.534 1.00 . A A . 14 SER CA 1 1 7 2859 1 1 14 SER CB C 1.125 8.321 -5.483 1.00 . A A . 14 SER CB 1 1 7 2860 1 1 14 SER H H 2.499 7.654 -3.463 1.00 . A A . 14 SER H 1 1 7 2861 1 1 14 SER HA H -0.199 7.433 -4.055 1.00 . A A . 14 SER HA 1 1 7 2862 1 1 14 SER HB2 H 1.868 7.965 -6.181 1.00 . A A . 14 SER HB2 1 1 7 2863 1 1 14 SER HB3 H 0.250 8.650 -6.024 1.00 . A A . 14 SER HB3 1 1 7 2864 1 1 14 SER N N 1.744 7.029 -3.493 1.00 . A A . 14 SER N 1 1 7 2865 1 1 14 SER O O -0.544 5.572 -5.774 1.00 . A A . 14 SER O 1 1 7 2866 1 1 14 SER OG O 1.661 9.422 -4.769 1.00 . A A . 14 SER OG 1 1 7 2867 1 1 15 ASP C C 0.531 2.959 -5.724 1.00 . A A . 15 ASP C 1 1 7 2868 1 1 15 ASP CA C 1.625 3.895 -6.233 1.00 . A A . 15 ASP CA 1 1 7 2869 1 1 15 ASP CB C 2.987 3.202 -6.145 1.00 . A A . 15 ASP CB 1 1 7 2870 1 1 15 ASP CG C 3.418 2.605 -7.470 1.00 . A A . 15 ASP CG 1 1 7 2871 1 1 15 ASP H H 2.499 5.459 -5.107 1.00 . A A . 15 ASP H 1 1 7 2872 1 1 15 ASP HA H 1.423 4.130 -7.267 1.00 . A A . 15 ASP HA 1 1 7 2873 1 1 15 ASP HB2 H 3.731 3.921 -5.836 1.00 . A A . 15 ASP HB2 1 1 7 2874 1 1 15 ASP HB3 H 2.934 2.409 -5.413 1.00 . A A . 15 ASP HB3 1 1 7 2875 1 1 15 ASP N N 1.650 5.151 -5.491 1.00 . A A . 15 ASP N 1 1 7 2876 1 1 15 ASP O O -0.055 2.202 -6.497 1.00 . A A . 15 ASP O 1 1 7 2877 1 1 15 ASP OD1 O 2.630 1.837 -8.060 1.00 . A A . 15 ASP OD1 1 1 7 2878 1 1 15 ASP OD2 O 4.545 2.906 -7.917 1.00 . A A . 15 ASP OD2 1 1 7 2879 1 1 16 CYS C C -2.039 2.164 -4.601 1.00 . A A . 16 CYS C 1 1 7 2880 1 1 16 CYS CA C -0.737 2.136 -3.811 1.00 . A A . 16 CYS CA 1 1 7 2881 1 1 16 CYS CB C -0.989 2.538 -2.354 1.00 . A A . 16 CYS CB 1 1 7 2882 1 1 16 CYS H H 0.783 3.614 -3.851 1.00 . A A . 16 CYS H 1 1 7 2883 1 1 16 CYS HA H -0.351 1.127 -3.829 1.00 . A A . 16 CYS HA 1 1 7 2884 1 1 16 CYS HB2 H -0.092 2.953 -1.949 1.00 . A A . 16 CYS HB2 1 1 7 2885 1 1 16 CYS HB3 H -1.763 3.284 -2.318 1.00 . A A . 16 CYS HB3 1 1 7 2886 1 1 16 CYS N N 0.274 3.000 -4.420 1.00 . A A . 16 CYS N 1 1 7 2887 1 1 16 CYS O O -2.199 2.945 -5.538 1.00 . A A . 16 CYS O 1 1 7 2888 1 1 16 CYS SG S -1.486 1.157 -1.266 1.00 . A A . 16 CYS SG 1 1 7 2889 1 1 17 LEU C C -5.373 1.748 -4.017 1.00 . A A . 17 LEU C 1 1 7 2890 1 1 17 LEU CA C -4.252 1.195 -4.889 1.00 . A A . 17 LEU CA 1 1 7 2891 1 1 17 LEU CB C -4.548 -0.260 -5.255 1.00 . A A . 17 LEU CB 1 1 7 2892 1 1 17 LEU CD1 C -5.758 -2.246 -4.310 1.00 . A A . 17 LEU CD1 1 1 7 2893 1 1 17 LEU CD2 C -3.333 -1.901 -3.801 1.00 . A A . 17 LEU CD2 1 1 7 2894 1 1 17 LEU CG C -4.665 -1.215 -4.065 1.00 . A A . 17 LEU CG 1 1 7 2895 1 1 17 LEU H H -2.762 0.698 -3.466 1.00 . A A . 17 LEU H 1 1 7 2896 1 1 17 LEU HA H -4.198 1.779 -5.795 1.00 . A A . 17 LEU HA 1 1 7 2897 1 1 17 LEU HB2 H -5.477 -0.289 -5.807 1.00 . A A . 17 LEU HB2 1 1 7 2898 1 1 17 LEU HB3 H -3.757 -0.616 -5.897 1.00 . A A . 17 LEU HB3 1 1 7 2899 1 1 17 LEU HD11 H -5.687 -2.608 -5.325 1.00 . A A . 17 LEU HD11 1 1 7 2900 1 1 17 LEU HD12 H -5.635 -3.070 -3.623 1.00 . A A . 17 LEU HD12 1 1 7 2901 1 1 17 LEU HD13 H -6.724 -1.790 -4.157 1.00 . A A . 17 LEU HD13 1 1 7 2902 1 1 17 LEU HD21 H -2.527 -1.214 -4.012 1.00 . A A . 17 LEU HD21 1 1 7 2903 1 1 17 LEU HD22 H -3.284 -2.206 -2.765 1.00 . A A . 17 LEU HD22 1 1 7 2904 1 1 17 LEU HD23 H -3.243 -2.769 -4.436 1.00 . A A . 17 LEU HD23 1 1 7 2905 1 1 17 LEU HG H -4.932 -0.650 -3.183 1.00 . A A . 17 LEU HG 1 1 7 2906 1 1 17 LEU N N -2.961 1.294 -4.217 1.00 . A A . 17 LEU N 1 1 7 2907 1 1 17 LEU O O -5.178 2.022 -2.834 1.00 . A A . 17 LEU O 1 1 7 2908 1 1 18 ALA C C -7.351 3.682 -3.103 1.00 . A A . 18 ALA C 1 1 7 2909 1 1 18 ALA CA C -7.714 2.423 -3.900 1.00 . A A . 18 ALA CA 1 1 7 2910 1 1 18 ALA CB C -8.296 1.339 -3.001 1.00 . A A . 18 ALA CB 1 1 7 2911 1 1 18 ALA H H -6.644 1.667 -5.561 1.00 . A A . 18 ALA H 1 1 7 2912 1 1 18 ALA HA H -8.463 2.684 -4.635 1.00 . A A . 18 ALA HA 1 1 7 2913 1 1 18 ALA HB1 H -8.518 0.462 -3.591 1.00 . A A . 18 ALA HB1 1 1 7 2914 1 1 18 ALA HB2 H -7.579 1.084 -2.234 1.00 . A A . 18 ALA HB2 1 1 7 2915 1 1 18 ALA HB3 H -9.202 1.702 -2.539 1.00 . A A . 18 ALA HB3 1 1 7 2916 1 1 18 ALA N N -6.553 1.906 -4.615 1.00 . A A . 18 ALA N 1 1 7 2917 1 1 18 ALA O O -6.826 4.643 -3.667 1.00 . A A . 18 ALA O 1 1 7 2918 1 1 19 GLU C C -6.343 4.424 0.156 1.00 . A A . 19 GLU C 1 1 7 2919 1 1 19 GLU CA C -7.308 4.824 -0.956 1.00 . A A . 19 GLU CA 1 1 7 2920 1 1 19 GLU CB C -8.593 5.415 -0.365 1.00 . A A . 19 GLU CB 1 1 7 2921 1 1 19 GLU CD C -8.148 7.898 -0.515 1.00 . A A . 19 GLU CD 1 1 7 2922 1 1 19 GLU CG C -8.997 6.738 -0.997 1.00 . A A . 19 GLU CG 1 1 7 2923 1 1 19 GLU H H -8.036 2.891 -1.393 1.00 . A A . 19 GLU H 1 1 7 2924 1 1 19 GLU HA H -6.832 5.569 -1.576 1.00 . A A . 19 GLU HA 1 1 7 2925 1 1 19 GLU HB2 H -9.399 4.711 -0.509 1.00 . A A . 19 GLU HB2 1 1 7 2926 1 1 19 GLU HB3 H -8.452 5.577 0.693 1.00 . A A . 19 GLU HB3 1 1 7 2927 1 1 19 GLU HG2 H -8.893 6.657 -2.069 1.00 . A A . 19 GLU HG2 1 1 7 2928 1 1 19 GLU HG3 H -10.029 6.938 -0.751 1.00 . A A . 19 GLU HG3 1 1 7 2929 1 1 19 GLU N N -7.622 3.678 -1.799 1.00 . A A . 19 GLU N 1 1 7 2930 1 1 19 GLU O O -6.607 4.650 1.338 1.00 . A A . 19 GLU O 1 1 7 2931 1 1 19 GLU OE1 O -7.881 7.972 0.702 1.00 . A A . 19 GLU OE1 1 1 7 2932 1 1 19 GLU OE2 O -7.749 8.731 -1.356 1.00 . A A . 19 GLU OE2 1 1 7 2933 1 1 20 CYS C C -2.854 3.974 0.346 1.00 . A A . 20 CYS C 1 1 7 2934 1 1 20 CYS CA C -4.212 3.404 0.728 1.00 . A A . 20 CYS CA 1 1 7 2935 1 1 20 CYS CB C -4.149 1.877 0.791 1.00 . A A . 20 CYS CB 1 1 7 2936 1 1 20 CYS H H -5.055 3.679 -1.187 1.00 . A A . 20 CYS H 1 1 7 2937 1 1 20 CYS HA H -4.492 3.787 1.698 1.00 . A A . 20 CYS HA 1 1 7 2938 1 1 20 CYS HB2 H -4.254 1.478 -0.206 1.00 . A A . 20 CYS HB2 1 1 7 2939 1 1 20 CYS HB3 H -3.191 1.579 1.193 1.00 . A A . 20 CYS HB3 1 1 7 2940 1 1 20 CYS N N -5.218 3.830 -0.231 1.00 . A A . 20 CYS N 1 1 7 2941 1 1 20 CYS O O -2.748 4.757 -0.596 1.00 . A A . 20 CYS O 1 1 7 2942 1 1 20 CYS SG S -5.445 1.125 1.828 1.00 . A A . 20 CYS SG 1 1 7 2943 1 1 21 VAL C C 0.522 2.945 0.633 1.00 . A A . 21 VAL C 1 1 7 2944 1 1 21 VAL CA C -0.481 4.083 0.794 1.00 . A A . 21 VAL CA 1 1 7 2945 1 1 21 VAL CB C 0.013 5.045 1.895 1.00 . A A . 21 VAL CB 1 1 7 2946 1 1 21 VAL CG1 C -0.972 6.188 2.082 1.00 . A A . 21 VAL CG1 1 1 7 2947 1 1 21 VAL CG2 C 0.230 4.302 3.207 1.00 . A A . 21 VAL CG2 1 1 7 2948 1 1 21 VAL H H -1.955 2.966 1.822 1.00 . A A . 21 VAL H 1 1 7 2949 1 1 21 VAL HA H -0.526 4.635 -0.133 1.00 . A A . 21 VAL HA 1 1 7 2950 1 1 21 VAL HB H 0.959 5.465 1.581 1.00 . A A . 21 VAL HB 1 1 7 2951 1 1 21 VAL HG11 H -1.450 6.410 1.140 1.00 . A A . 21 VAL HG11 1 1 7 2952 1 1 21 VAL HG12 H -1.721 5.904 2.807 1.00 . A A . 21 VAL HG12 1 1 7 2953 1 1 21 VAL HG13 H -0.445 7.064 2.433 1.00 . A A . 21 VAL HG13 1 1 7 2954 1 1 21 VAL HG21 H 0.919 3.487 3.047 1.00 . A A . 21 VAL HG21 1 1 7 2955 1 1 21 VAL HG22 H 0.638 4.981 3.941 1.00 . A A . 21 VAL HG22 1 1 7 2956 1 1 21 VAL HG23 H -0.714 3.914 3.560 1.00 . A A . 21 VAL HG23 1 1 7 2957 1 1 21 VAL N N -1.818 3.589 1.078 1.00 . A A . 21 VAL N 1 1 7 2958 1 1 21 VAL O O 0.300 1.825 1.093 1.00 . A A . 21 VAL O 1 1 7 2959 1 1 22 CYS C C 3.819 2.508 0.752 1.00 . A A . 22 CYS C 1 1 7 2960 1 1 22 CYS CA C 2.702 2.304 -0.266 1.00 . A A . 22 CYS CA 1 1 7 2961 1 1 22 CYS CB C 3.249 2.469 -1.692 1.00 . A A . 22 CYS CB 1 1 7 2962 1 1 22 CYS H H 1.722 4.174 -0.350 1.00 . A A . 22 CYS H 1 1 7 2963 1 1 22 CYS HA H 2.297 1.310 -0.152 1.00 . A A . 22 CYS HA 1 1 7 2964 1 1 22 CYS HB2 H 3.246 3.513 -1.952 1.00 . A A . 22 CYS HB2 1 1 7 2965 1 1 22 CYS HB3 H 4.261 2.103 -1.734 1.00 . A A . 22 CYS HB3 1 1 7 2966 1 1 22 CYS N N 1.627 3.263 -0.023 1.00 . A A . 22 CYS N 1 1 7 2967 1 1 22 CYS O O 4.208 3.640 1.042 1.00 . A A . 22 CYS O 1 1 7 2968 1 1 22 CYS SG S 2.287 1.591 -2.964 1.00 . A A . 22 CYS SG 1 1 7 2969 1 1 23 LEU C C 6.747 1.194 1.695 1.00 . A A . 23 LEU C 1 1 7 2970 1 1 23 LEU CA C 5.380 1.478 2.307 1.00 . A A . 23 LEU CA 1 1 7 2971 1 1 23 LEU CB C 5.098 0.488 3.439 1.00 . A A . 23 LEU CB 1 1 7 2972 1 1 23 LEU CD1 C 3.238 -0.709 4.626 1.00 . A A . 23 LEU CD1 1 1 7 2973 1 1 23 LEU CD2 C 3.771 1.667 5.209 1.00 . A A . 23 LEU CD2 1 1 7 2974 1 1 23 LEU CG C 3.723 0.632 4.094 1.00 . A A . 23 LEU CG 1 1 7 2975 1 1 23 LEU H H 3.964 0.535 1.046 1.00 . A A . 23 LEU H 1 1 7 2976 1 1 23 LEU HA H 5.384 2.478 2.714 1.00 . A A . 23 LEU HA 1 1 7 2977 1 1 23 LEU HB2 H 5.185 -0.513 3.042 1.00 . A A . 23 LEU HB2 1 1 7 2978 1 1 23 LEU HB3 H 5.850 0.623 4.200 1.00 . A A . 23 LEU HB3 1 1 7 2979 1 1 23 LEU HD11 H 4.045 -1.425 4.589 1.00 . A A . 23 LEU HD11 1 1 7 2980 1 1 23 LEU HD12 H 2.906 -0.593 5.648 1.00 . A A . 23 LEU HD12 1 1 7 2981 1 1 23 LEU HD13 H 2.418 -1.061 4.019 1.00 . A A . 23 LEU HD13 1 1 7 2982 1 1 23 LEU HD21 H 4.758 1.675 5.650 1.00 . A A . 23 LEU HD21 1 1 7 2983 1 1 23 LEU HD22 H 3.548 2.643 4.804 1.00 . A A . 23 LEU HD22 1 1 7 2984 1 1 23 LEU HD23 H 3.042 1.415 5.965 1.00 . A A . 23 LEU HD23 1 1 7 2985 1 1 23 LEU HG H 3.013 0.972 3.354 1.00 . A A . 23 LEU HG 1 1 7 2986 1 1 23 LEU N N 4.321 1.410 1.306 1.00 . A A . 23 LEU N 1 1 7 2987 1 1 23 LEU O O 6.878 0.364 0.795 1.00 . A A . 23 LEU O 1 1 7 2988 1 1 24 GLU C C 9.595 0.294 1.808 1.00 . A A . 24 GLU C 1 1 7 2989 1 1 24 GLU CA C 9.126 1.742 1.704 1.00 . A A . 24 GLU CA 1 1 7 2990 1 1 24 GLU CB C 10.075 2.652 2.486 1.00 . A A . 24 GLU CB 1 1 7 2991 1 1 24 GLU CD C 10.647 3.569 4.770 1.00 . A A . 24 GLU CD 1 1 7 2992 1 1 24 GLU CG C 10.039 2.420 3.989 1.00 . A A . 24 GLU CG 1 1 7 2993 1 1 24 GLU H H 7.584 2.545 2.907 1.00 . A A . 24 GLU H 1 1 7 2994 1 1 24 GLU HA H 9.140 2.036 0.665 1.00 . A A . 24 GLU HA 1 1 7 2995 1 1 24 GLU HB2 H 11.085 2.482 2.141 1.00 . A A . 24 GLU HB2 1 1 7 2996 1 1 24 GLU HB3 H 9.808 3.681 2.297 1.00 . A A . 24 GLU HB3 1 1 7 2997 1 1 24 GLU HG2 H 9.013 2.298 4.297 1.00 . A A . 24 GLU HG2 1 1 7 2998 1 1 24 GLU HG3 H 10.592 1.520 4.213 1.00 . A A . 24 GLU HG3 1 1 7 2999 1 1 24 GLU N N 7.760 1.899 2.193 1.00 . A A . 24 GLU N 1 1 7 3000 1 1 24 GLU O O 10.134 -0.260 0.850 1.00 . A A . 24 GLU O 1 1 7 3001 1 1 24 GLU OE1 O 9.980 4.619 4.896 1.00 . A A . 24 GLU OE1 1 1 7 3002 1 1 24 GLU OE2 O 11.787 3.420 5.257 1.00 . A A . 24 GLU OE2 1 1 7 3003 1 1 25 HIS C C 9.203 -2.607 2.109 1.00 . A A . 25 HIS C 1 1 7 3004 1 1 25 HIS CA C 9.800 -1.704 3.181 1.00 . A A . 25 HIS CA 1 1 7 3005 1 1 25 HIS CB C 9.404 -2.209 4.576 1.00 . A A . 25 HIS CB 1 1 7 3006 1 1 25 HIS CD2 C 6.884 -1.919 5.133 1.00 . A A . 25 HIS CD2 1 1 7 3007 1 1 25 HIS CE1 C 7.024 -0.056 6.279 1.00 . A A . 25 HIS CE1 1 1 7 3008 1 1 25 HIS CG C 8.188 -1.553 5.157 1.00 . A A . 25 HIS CG 1 1 7 3009 1 1 25 HIS H H 8.955 0.172 3.700 1.00 . A A . 25 HIS H 1 1 7 3010 1 1 25 HIS HA H 10.875 -1.739 3.093 1.00 . A A . 25 HIS HA 1 1 7 3011 1 1 25 HIS HB2 H 9.207 -3.269 4.521 1.00 . A A . 25 HIS HB2 1 1 7 3012 1 1 25 HIS HB3 H 10.227 -2.041 5.256 1.00 . A A . 25 HIS HB3 1 1 7 3013 1 1 25 HIS HD1 H 9.051 0.135 6.076 1.00 . A A . 25 HIS HD1 1 1 7 3014 1 1 25 HIS HD2 H 6.473 -2.794 4.648 1.00 . A A . 25 HIS HD2 1 1 7 3015 1 1 25 HIS HE1 H 6.762 0.812 6.866 1.00 . A A . 25 HIS HE1 1 1 7 3016 1 1 25 HIS HE2 H 5.242 -1.045 6.103 1.00 . A A . 25 HIS HE2 1 1 7 3017 1 1 25 HIS N N 9.389 -0.317 2.973 1.00 . A A . 25 HIS N 1 1 7 3018 1 1 25 HIS ND1 N 8.241 -0.382 5.882 1.00 . A A . 25 HIS ND1 1 1 7 3019 1 1 25 HIS NE2 N 6.182 -0.973 5.839 1.00 . A A . 25 HIS NE2 1 1 7 3020 1 1 25 HIS O O 9.755 -3.660 1.791 1.00 . A A . 25 HIS O 1 1 7 3021 1 1 26 GLY C C 6.106 -3.531 0.924 1.00 . A A . 26 GLY C 1 1 7 3022 1 1 26 GLY CA C 7.439 -2.946 0.499 1.00 . A A . 26 GLY CA 1 1 7 3023 1 1 26 GLY H H 7.693 -1.325 1.828 1.00 . A A . 26 GLY H 1 1 7 3024 1 1 26 GLY HA2 H 8.096 -3.753 0.206 1.00 . A A . 26 GLY HA2 1 1 7 3025 1 1 26 GLY HA3 H 7.280 -2.303 -0.352 1.00 . A A . 26 GLY HA3 1 1 7 3026 1 1 26 GLY N N 8.081 -2.177 1.542 1.00 . A A . 26 GLY N 1 1 7 3027 1 1 26 GLY O O 5.959 -4.749 1.009 1.00 . A A . 26 GLY O 1 1 7 3028 1 1 27 TYR C C 2.801 -1.948 1.524 1.00 . A A . 27 TYR C 1 1 7 3029 1 1 27 TYR CA C 3.801 -3.099 1.588 1.00 . A A . 27 TYR CA 1 1 7 3030 1 1 27 TYR CB C 3.838 -3.671 3.007 1.00 . A A . 27 TYR CB 1 1 7 3031 1 1 27 TYR CD1 C 3.867 -6.062 2.194 1.00 . A A . 27 TYR CD1 1 1 7 3032 1 1 27 TYR CD2 C 5.249 -5.485 4.050 1.00 . A A . 27 TYR CD2 1 1 7 3033 1 1 27 TYR CE1 C 4.315 -7.368 2.263 1.00 . A A . 27 TYR CE1 1 1 7 3034 1 1 27 TYR CE2 C 5.700 -6.789 4.125 1.00 . A A . 27 TYR CE2 1 1 7 3035 1 1 27 TYR CG C 4.326 -5.100 3.084 1.00 . A A . 27 TYR CG 1 1 7 3036 1 1 27 TYR CZ C 5.231 -7.726 3.230 1.00 . A A . 27 TYR CZ 1 1 7 3037 1 1 27 TYR H H 5.312 -1.701 1.085 1.00 . A A . 27 TYR H 1 1 7 3038 1 1 27 TYR HA H 3.484 -3.874 0.907 1.00 . A A . 27 TYR HA 1 1 7 3039 1 1 27 TYR HB2 H 4.495 -3.066 3.608 1.00 . A A . 27 TYR HB2 1 1 7 3040 1 1 27 TYR HB3 H 2.843 -3.635 3.427 1.00 . A A . 27 TYR HB3 1 1 7 3041 1 1 27 TYR HD1 H 3.151 -5.778 1.437 1.00 . A A . 27 TYR HD1 1 1 7 3042 1 1 27 TYR HD2 H 5.615 -4.749 4.750 1.00 . A A . 27 TYR HD2 1 1 7 3043 1 1 27 TYR HE1 H 3.947 -8.103 1.562 1.00 . A A . 27 TYR HE1 1 1 7 3044 1 1 27 TYR HE2 H 6.417 -7.069 4.882 1.00 . A A . 27 TYR HE2 1 1 7 3045 1 1 27 TYR HH H 4.947 -9.626 3.131 1.00 . A A . 27 TYR HH 1 1 7 3046 1 1 27 TYR N N 5.133 -2.661 1.178 1.00 . A A . 27 TYR N 1 1 7 3047 1 1 27 TYR O O 3.135 -0.806 1.838 1.00 . A A . 27 TYR O 1 1 7 3048 1 1 27 TYR OH O 5.678 -9.026 3.301 1.00 . A A . 27 TYR OH 1 1 7 3049 1 1 28 CYS C C -0.387 -1.294 2.245 1.00 . A A . 28 CYS C 1 1 7 3050 1 1 28 CYS CA C 0.521 -1.249 1.019 1.00 . A A . 28 CYS CA 1 1 7 3051 1 1 28 CYS CB C -0.316 -1.470 -0.247 1.00 . A A . 28 CYS CB 1 1 7 3052 1 1 28 CYS H H 1.371 -3.186 0.882 1.00 . A A . 28 CYS H 1 1 7 3053 1 1 28 CYS HA H 0.992 -0.280 0.966 1.00 . A A . 28 CYS HA 1 1 7 3054 1 1 28 CYS HB2 H -0.080 -2.440 -0.658 1.00 . A A . 28 CYS HB2 1 1 7 3055 1 1 28 CYS HB3 H -1.364 -1.441 0.012 1.00 . A A . 28 CYS HB3 1 1 7 3056 1 1 28 CYS N N 1.573 -2.258 1.119 1.00 . A A . 28 CYS N 1 1 7 3057 1 1 28 CYS O O -1.028 -2.308 2.519 1.00 . A A . 28 CYS O 1 1 7 3058 1 1 28 CYS SG S -0.034 -0.235 -1.557 1.00 . A A . 28 CYS SG 1 1 7 3059 1 1 29 GLY C C -2.552 0.648 3.932 1.00 . A A . 29 GLY C 1 1 7 3060 1 1 29 GLY CA C -1.267 -0.119 4.165 1.00 . A A . 29 GLY CA 1 1 7 3061 1 1 29 GLY H H 0.097 0.591 2.710 1.00 . A A . 29 GLY H 1 1 7 3062 1 1 29 GLY HA2 H -0.710 0.364 4.954 1.00 . A A . 29 GLY HA2 1 1 7 3063 1 1 29 GLY HA3 H -1.512 -1.125 4.477 1.00 . A A . 29 GLY HA3 1 1 7 3064 1 1 29 GLY N N -0.436 -0.186 2.978 1.00 . A A . 29 GLY N 1 1 7 3065 1 1 29 GLY O O -3.637 0.074 4.161 1.00 . A A . 29 GLY O 1 1 7 3066 1 1 29 GLY OXT O -2.475 1.825 3.519 1.00 . A A . 29 GLY OXT 1 1 8 3067 1 1 1 ARG C C -10.997 2.631 1.822 1.00 . A A . 1 ARG C 1 1 8 3068 1 1 1 ARG CA C -12.032 3.702 1.488 1.00 . A A . 1 ARG CA 1 1 8 3069 1 1 1 ARG CB C -12.779 4.126 2.753 1.00 . A A . 1 ARG CB 1 1 8 3070 1 1 1 ARG CD C -11.916 4.997 4.953 1.00 . A A . 1 ARG CD 1 1 8 3071 1 1 1 ARG CG C -12.133 5.297 3.478 1.00 . A A . 1 ARG CG 1 1 8 3072 1 1 1 ARG CZ C -10.021 4.798 6.517 1.00 . A A . 1 ARG CZ 1 1 8 3073 1 1 1 ARG H1 H -12.497 2.701 -0.248 1.00 . A A . 1 ARG H1 1 1 8 3074 1 1 1 ARG H2 H -13.673 2.563 0.994 1.00 . A A . 1 ARG H2 1 1 8 3075 1 1 1 ARG H3 H -13.526 4.026 0.112 1.00 . A A . 1 ARG H3 1 1 8 3076 1 1 1 ARG HA H -11.527 4.560 1.069 1.00 . A A . 1 ARG HA 1 1 8 3077 1 1 1 ARG HB2 H -13.787 4.408 2.485 1.00 . A A . 1 ARG HB2 1 1 8 3078 1 1 1 ARG HB3 H -12.819 3.287 3.431 1.00 . A A . 1 ARG HB3 1 1 8 3079 1 1 1 ARG HD2 H -12.314 5.815 5.536 1.00 . A A . 1 ARG HD2 1 1 8 3080 1 1 1 ARG HD3 H -12.440 4.088 5.204 1.00 . A A . 1 ARG HD3 1 1 8 3081 1 1 1 ARG HE H -9.872 4.746 4.527 1.00 . A A . 1 ARG HE 1 1 8 3082 1 1 1 ARG HG2 H -11.179 5.508 3.020 1.00 . A A . 1 ARG HG2 1 1 8 3083 1 1 1 ARG HG3 H -12.776 6.162 3.386 1.00 . A A . 1 ARG HG3 1 1 8 3084 1 1 1 ARG HH11 H -11.822 5.027 7.408 1.00 . A A . 1 ARG HH11 1 1 8 3085 1 1 1 ARG HH12 H -10.473 4.885 8.485 1.00 . A A . 1 ARG HH12 1 1 8 3086 1 1 1 ARG HH21 H -8.098 4.560 5.941 1.00 . A A . 1 ARG HH21 1 1 8 3087 1 1 1 ARG HH22 H -8.359 4.621 7.653 1.00 . A A . 1 ARG HH22 1 1 8 3088 1 1 1 ARG N N -13.021 3.204 0.498 1.00 . A A . 1 ARG N 1 1 8 3089 1 1 1 ARG NE N -10.499 4.834 5.275 1.00 . A A . 1 ARG NE 1 1 8 3090 1 1 1 ARG NH1 N -10.840 4.913 7.554 1.00 . A A . 1 ARG NH1 1 1 8 3091 1 1 1 ARG NH2 N -8.719 4.648 6.720 1.00 . A A . 1 ARG NH2 1 1 8 3092 1 1 1 ARG O O -9.816 2.776 1.512 1.00 . A A . 1 ARG O 1 1 8 3093 1 1 2 VAL C C -10.001 -0.236 1.593 1.00 . A A . 2 VAL C 1 1 8 3094 1 1 2 VAL CA C -10.567 0.459 2.828 1.00 . A A . 2 VAL CA 1 1 8 3095 1 1 2 VAL CB C -11.296 -0.580 3.699 1.00 . A A . 2 VAL CB 1 1 8 3096 1 1 2 VAL CG1 C -11.543 -0.028 5.095 1.00 . A A . 2 VAL CG1 1 1 8 3097 1 1 2 VAL CG2 C -12.602 -1.001 3.044 1.00 . A A . 2 VAL CG2 1 1 8 3098 1 1 2 VAL H H -12.405 1.494 2.673 1.00 . A A . 2 VAL H 1 1 8 3099 1 1 2 VAL HA H -9.750 0.871 3.402 1.00 . A A . 2 VAL HA 1 1 8 3100 1 1 2 VAL HB H -10.665 -1.452 3.788 1.00 . A A . 2 VAL HB 1 1 8 3101 1 1 2 VAL HG11 H -10.811 0.734 5.315 1.00 . A A . 2 VAL HG11 1 1 8 3102 1 1 2 VAL HG12 H -12.535 0.399 5.142 1.00 . A A . 2 VAL HG12 1 1 8 3103 1 1 2 VAL HG13 H -11.461 -0.826 5.817 1.00 . A A . 2 VAL HG13 1 1 8 3104 1 1 2 VAL HG21 H -12.558 -0.796 1.985 1.00 . A A . 2 VAL HG21 1 1 8 3105 1 1 2 VAL HG22 H -12.759 -2.059 3.200 1.00 . A A . 2 VAL HG22 1 1 8 3106 1 1 2 VAL HG23 H -13.420 -0.448 3.483 1.00 . A A . 2 VAL HG23 1 1 8 3107 1 1 2 VAL N N -11.452 1.554 2.453 1.00 . A A . 2 VAL N 1 1 8 3108 1 1 2 VAL O O -10.716 -0.472 0.620 1.00 . A A . 2 VAL O 1 1 8 3109 1 1 3 CYS C C -7.932 -2.730 0.786 1.00 . A A . 3 CYS C 1 1 8 3110 1 1 3 CYS CA C -8.053 -1.228 0.525 1.00 . A A . 3 CYS CA 1 1 8 3111 1 1 3 CYS CB C -6.669 -0.622 0.282 1.00 . A A . 3 CYS CB 1 1 8 3112 1 1 3 CYS H H -8.194 -0.346 2.443 1.00 . A A . 3 CYS H 1 1 8 3113 1 1 3 CYS HA H -8.661 -1.075 -0.354 1.00 . A A . 3 CYS HA 1 1 8 3114 1 1 3 CYS HB2 H -6.264 -1.024 -0.635 1.00 . A A . 3 CYS HB2 1 1 8 3115 1 1 3 CYS HB3 H -6.767 0.450 0.184 1.00 . A A . 3 CYS HB3 1 1 8 3116 1 1 3 CYS N N -8.712 -0.560 1.640 1.00 . A A . 3 CYS N 1 1 8 3117 1 1 3 CYS O O -7.477 -3.143 1.853 1.00 . A A . 3 CYS O 1 1 8 3118 1 1 3 CYS SG S -5.462 -0.950 1.607 1.00 . A A . 3 CYS SG 1 1 8 3119 1 1 4 PRO C C -6.990 -5.512 0.604 1.00 . A A . 4 PRO C 1 1 8 3120 1 1 4 PRO CA C -8.280 -5.028 -0.053 1.00 . A A . 4 PRO CA 1 1 8 3121 1 1 4 PRO CB C -8.346 -5.498 -1.503 1.00 . A A . 4 PRO CB 1 1 8 3122 1 1 4 PRO CD C -8.901 -3.164 -1.491 1.00 . A A . 4 PRO CD 1 1 8 3123 1 1 4 PRO CG C -9.185 -4.474 -2.184 1.00 . A A . 4 PRO CG 1 1 8 3124 1 1 4 PRO HA H -9.128 -5.414 0.492 1.00 . A A . 4 PRO HA 1 1 8 3125 1 1 4 PRO HB2 H -7.348 -5.534 -1.918 1.00 . A A . 4 PRO HB2 1 1 8 3126 1 1 4 PRO HB3 H -8.799 -6.476 -1.548 1.00 . A A . 4 PRO HB3 1 1 8 3127 1 1 4 PRO HD2 H -8.181 -2.589 -2.054 1.00 . A A . 4 PRO HD2 1 1 8 3128 1 1 4 PRO HD3 H -9.814 -2.601 -1.360 1.00 . A A . 4 PRO HD3 1 1 8 3129 1 1 4 PRO HG2 H -8.912 -4.412 -3.227 1.00 . A A . 4 PRO HG2 1 1 8 3130 1 1 4 PRO HG3 H -10.229 -4.730 -2.084 1.00 . A A . 4 PRO HG3 1 1 8 3131 1 1 4 PRO N N -8.341 -3.569 -0.184 1.00 . A A . 4 PRO N 1 1 8 3132 1 1 4 PRO O O -5.937 -4.894 0.457 1.00 . A A . 4 PRO O 1 1 8 3133 1 1 5 ARG C C -4.986 -7.850 0.992 1.00 . A A . 5 ARG C 1 1 8 3134 1 1 5 ARG CA C -5.923 -7.194 1.999 1.00 . A A . 5 ARG CA 1 1 8 3135 1 1 5 ARG CB C -6.366 -8.220 3.043 1.00 . A A . 5 ARG CB 1 1 8 3136 1 1 5 ARG CD C -5.732 -6.741 4.973 1.00 . A A . 5 ARG CD 1 1 8 3137 1 1 5 ARG CG C -6.823 -7.600 4.353 1.00 . A A . 5 ARG CG 1 1 8 3138 1 1 5 ARG CZ C -6.956 -4.662 5.476 1.00 . A A . 5 ARG CZ 1 1 8 3139 1 1 5 ARG H H -7.950 -7.074 1.402 1.00 . A A . 5 ARG H 1 1 8 3140 1 1 5 ARG HA H -5.399 -6.391 2.494 1.00 . A A . 5 ARG HA 1 1 8 3141 1 1 5 ARG HB2 H -7.185 -8.798 2.639 1.00 . A A . 5 ARG HB2 1 1 8 3142 1 1 5 ARG HB3 H -5.539 -8.883 3.253 1.00 . A A . 5 ARG HB3 1 1 8 3143 1 1 5 ARG HD2 H -5.668 -6.969 6.027 1.00 . A A . 5 ARG HD2 1 1 8 3144 1 1 5 ARG HD3 H -4.791 -6.974 4.497 1.00 . A A . 5 ARG HD3 1 1 8 3145 1 1 5 ARG HE H -5.445 -4.815 4.181 1.00 . A A . 5 ARG HE 1 1 8 3146 1 1 5 ARG HG2 H -7.689 -6.982 4.165 1.00 . A A . 5 ARG HG2 1 1 8 3147 1 1 5 ARG HG3 H -7.083 -8.389 5.042 1.00 . A A . 5 ARG HG3 1 1 8 3148 1 1 5 ARG HH11 H -7.601 -6.283 6.501 1.00 . A A . 5 ARG HH11 1 1 8 3149 1 1 5 ARG HH12 H -8.445 -4.809 6.836 1.00 . A A . 5 ARG HH12 1 1 8 3150 1 1 5 ARG HH21 H -6.556 -2.876 4.620 1.00 . A A . 5 ARG HH21 1 1 8 3151 1 1 5 ARG HH22 H -7.853 -2.875 5.768 1.00 . A A . 5 ARG HH22 1 1 8 3152 1 1 5 ARG N N -7.083 -6.626 1.325 1.00 . A A . 5 ARG N 1 1 8 3153 1 1 5 ARG NE N -6.003 -5.314 4.815 1.00 . A A . 5 ARG NE 1 1 8 3154 1 1 5 ARG NH1 N -7.731 -5.304 6.342 1.00 . A A . 5 ARG NH1 1 1 8 3155 1 1 5 ARG NH2 N -7.136 -3.365 5.271 1.00 . A A . 5 ARG NH2 1 1 8 3156 1 1 5 ARG O O -4.988 -9.070 0.830 1.00 . A A . 5 ARG O 1 1 8 3157 1 1 6 ILE C C -1.894 -6.837 -0.543 1.00 . A A . 6 ILE C 1 1 8 3158 1 1 6 ILE CA C -3.244 -7.530 -0.672 1.00 . A A . 6 ILE CA 1 1 8 3159 1 1 6 ILE CB C -3.778 -7.330 -2.103 1.00 . A A . 6 ILE CB 1 1 8 3160 1 1 6 ILE CD1 C -5.904 -7.450 -3.497 1.00 . A A . 6 ILE CD1 1 1 8 3161 1 1 6 ILE CG1 C -5.213 -7.845 -2.210 1.00 . A A . 6 ILE CG1 1 1 8 3162 1 1 6 ILE CG2 C -2.878 -8.035 -3.108 1.00 . A A . 6 ILE CG2 1 1 8 3163 1 1 6 ILE H H -4.234 -6.068 0.493 1.00 . A A . 6 ILE H 1 1 8 3164 1 1 6 ILE HA H -3.112 -8.589 -0.504 1.00 . A A . 6 ILE HA 1 1 8 3165 1 1 6 ILE HB H -3.764 -6.274 -2.324 1.00 . A A . 6 ILE HB 1 1 8 3166 1 1 6 ILE HD11 H -5.929 -6.373 -3.576 1.00 . A A . 6 ILE HD11 1 1 8 3167 1 1 6 ILE HD12 H -5.362 -7.861 -4.337 1.00 . A A . 6 ILE HD12 1 1 8 3168 1 1 6 ILE HD13 H -6.913 -7.834 -3.496 1.00 . A A . 6 ILE HD13 1 1 8 3169 1 1 6 ILE HG12 H -5.207 -8.924 -2.155 1.00 . A A . 6 ILE HG12 1 1 8 3170 1 1 6 ILE HG13 H -5.792 -7.451 -1.387 1.00 . A A . 6 ILE HG13 1 1 8 3171 1 1 6 ILE HG21 H -1.857 -7.711 -2.966 1.00 . A A . 6 ILE HG21 1 1 8 3172 1 1 6 ILE HG22 H -2.942 -9.103 -2.962 1.00 . A A . 6 ILE HG22 1 1 8 3173 1 1 6 ILE HG23 H -3.197 -7.790 -4.110 1.00 . A A . 6 ILE HG23 1 1 8 3174 1 1 6 ILE N N -4.187 -7.032 0.320 1.00 . A A . 6 ILE N 1 1 8 3175 1 1 6 ILE O O -1.744 -5.672 -0.911 1.00 . A A . 6 ILE O 1 1 8 3176 1 1 7 LEU C C 0.972 -6.459 -1.151 1.00 . A A . 7 LEU C 1 1 8 3177 1 1 7 LEU CA C 0.432 -7.020 0.162 1.00 . A A . 7 LEU CA 1 1 8 3178 1 1 7 LEU CB C 1.372 -8.102 0.693 1.00 . A A . 7 LEU CB 1 1 8 3179 1 1 7 LEU CD1 C 1.855 -9.884 2.391 1.00 . A A . 7 LEU CD1 1 1 8 3180 1 1 7 LEU CD2 C 1.106 -7.614 3.139 1.00 . A A . 7 LEU CD2 1 1 8 3181 1 1 7 LEU CG C 0.987 -8.679 2.057 1.00 . A A . 7 LEU CG 1 1 8 3182 1 1 7 LEU H H -1.092 -8.486 0.255 1.00 . A A . 7 LEU H 1 1 8 3183 1 1 7 LEU HA H 0.372 -6.219 0.884 1.00 . A A . 7 LEU HA 1 1 8 3184 1 1 7 LEU HB2 H 1.399 -8.910 -0.023 1.00 . A A . 7 LEU HB2 1 1 8 3185 1 1 7 LEU HB3 H 2.363 -7.681 0.772 1.00 . A A . 7 LEU HB3 1 1 8 3186 1 1 7 LEU HD11 H 2.762 -9.848 1.805 1.00 . A A . 7 LEU HD11 1 1 8 3187 1 1 7 LEU HD12 H 2.104 -9.868 3.441 1.00 . A A . 7 LEU HD12 1 1 8 3188 1 1 7 LEU HD13 H 1.315 -10.790 2.162 1.00 . A A . 7 LEU HD13 1 1 8 3189 1 1 7 LEU HD21 H 1.150 -6.637 2.680 1.00 . A A . 7 LEU HD21 1 1 8 3190 1 1 7 LEU HD22 H 0.247 -7.667 3.791 1.00 . A A . 7 LEU HD22 1 1 8 3191 1 1 7 LEU HD23 H 2.005 -7.782 3.713 1.00 . A A . 7 LEU HD23 1 1 8 3192 1 1 7 LEU HG H -0.041 -9.009 2.022 1.00 . A A . 7 LEU HG 1 1 8 3193 1 1 7 LEU N N -0.911 -7.562 -0.017 1.00 . A A . 7 LEU N 1 1 8 3194 1 1 7 LEU O O 0.771 -7.043 -2.214 1.00 . A A . 7 LEU O 1 1 8 3195 1 1 8 LEU C C 3.356 -3.746 -1.873 1.00 . A A . 8 LEU C 1 1 8 3196 1 1 8 LEU CA C 2.225 -4.692 -2.253 1.00 . A A . 8 LEU CA 1 1 8 3197 1 1 8 LEU CB C 1.141 -3.931 -3.019 1.00 . A A . 8 LEU CB 1 1 8 3198 1 1 8 LEU CD1 C 0.060 -3.816 -5.278 1.00 . A A . 8 LEU CD1 1 1 8 3199 1 1 8 LEU CD2 C 2.165 -2.539 -4.835 1.00 . A A . 8 LEU CD2 1 1 8 3200 1 1 8 LEU CG C 1.381 -3.806 -4.524 1.00 . A A . 8 LEU CG 1 1 8 3201 1 1 8 LEU H H 1.789 -4.904 -0.190 1.00 . A A . 8 LEU H 1 1 8 3202 1 1 8 LEU HA H 2.622 -5.470 -2.887 1.00 . A A . 8 LEU HA 1 1 8 3203 1 1 8 LEU HB2 H 0.200 -4.437 -2.865 1.00 . A A . 8 LEU HB2 1 1 8 3204 1 1 8 LEU HB3 H 1.068 -2.937 -2.605 1.00 . A A . 8 LEU HB3 1 1 8 3205 1 1 8 LEU HD11 H -0.727 -3.455 -4.632 1.00 . A A . 8 LEU HD11 1 1 8 3206 1 1 8 LEU HD12 H 0.136 -3.176 -6.146 1.00 . A A . 8 LEU HD12 1 1 8 3207 1 1 8 LEU HD13 H -0.167 -4.824 -5.593 1.00 . A A . 8 LEU HD13 1 1 8 3208 1 1 8 LEU HD21 H 3.110 -2.564 -4.312 1.00 . A A . 8 LEU HD21 1 1 8 3209 1 1 8 LEU HD22 H 2.343 -2.477 -5.898 1.00 . A A . 8 LEU HD22 1 1 8 3210 1 1 8 LEU HD23 H 1.598 -1.678 -4.514 1.00 . A A . 8 LEU HD23 1 1 8 3211 1 1 8 LEU HG H 1.963 -4.651 -4.861 1.00 . A A . 8 LEU HG 1 1 8 3212 1 1 8 LEU N N 1.659 -5.324 -1.068 1.00 . A A . 8 LEU N 1 1 8 3213 1 1 8 LEU O O 3.177 -2.853 -1.045 1.00 . A A . 8 LEU O 1 1 8 3214 1 1 9 GLU C C 5.875 -2.057 -3.277 1.00 . A A . 9 GLU C 1 1 8 3215 1 1 9 GLU CA C 5.687 -3.120 -2.202 1.00 . A A . 9 GLU CA 1 1 8 3216 1 1 9 GLU CB C 6.942 -3.989 -2.106 1.00 . A A . 9 GLU CB 1 1 8 3217 1 1 9 GLU CD C 6.669 -6.323 -3.031 1.00 . A A . 9 GLU CD 1 1 8 3218 1 1 9 GLU CG C 7.137 -4.907 -3.301 1.00 . A A . 9 GLU CG 1 1 8 3219 1 1 9 GLU H H 4.600 -4.681 -3.129 1.00 . A A . 9 GLU H 1 1 8 3220 1 1 9 GLU HA H 5.526 -2.630 -1.254 1.00 . A A . 9 GLU HA 1 1 8 3221 1 1 9 GLU HB2 H 7.806 -3.346 -2.029 1.00 . A A . 9 GLU HB2 1 1 8 3222 1 1 9 GLU HB3 H 6.877 -4.598 -1.218 1.00 . A A . 9 GLU HB3 1 1 8 3223 1 1 9 GLU HG2 H 6.578 -4.513 -4.137 1.00 . A A . 9 GLU HG2 1 1 8 3224 1 1 9 GLU HG3 H 8.188 -4.931 -3.552 1.00 . A A . 9 GLU HG3 1 1 8 3225 1 1 9 GLU N N 4.521 -3.949 -2.480 1.00 . A A . 9 GLU N 1 1 8 3226 1 1 9 GLU O O 5.825 -2.351 -4.472 1.00 . A A . 9 GLU O 1 1 8 3227 1 1 9 GLU OE1 O 7.247 -6.979 -2.140 1.00 . A A . 9 GLU OE1 1 1 8 3228 1 1 9 GLU OE2 O 5.725 -6.775 -3.712 1.00 . A A . 9 GLU OE2 1 1 8 3229 1 1 10 CYS C C 7.105 1.401 -3.128 1.00 . A A . 10 CYS C 1 1 8 3230 1 1 10 CYS CA C 6.274 0.293 -3.769 1.00 . A A . 10 CYS CA 1 1 8 3231 1 1 10 CYS CB C 4.918 0.851 -4.222 1.00 . A A . 10 CYS CB 1 1 8 3232 1 1 10 CYS H H 6.107 -0.646 -1.878 1.00 . A A . 10 CYS H 1 1 8 3233 1 1 10 CYS HA H 6.804 -0.082 -4.632 1.00 . A A . 10 CYS HA 1 1 8 3234 1 1 10 CYS HB2 H 4.864 1.899 -3.967 1.00 . A A . 10 CYS HB2 1 1 8 3235 1 1 10 CYS HB3 H 4.836 0.745 -5.293 1.00 . A A . 10 CYS HB3 1 1 8 3236 1 1 10 CYS N N 6.085 -0.818 -2.843 1.00 . A A . 10 CYS N 1 1 8 3237 1 1 10 CYS O O 7.241 1.461 -1.906 1.00 . A A . 10 CYS O 1 1 8 3238 1 1 10 CYS SG S 3.474 0.026 -3.471 1.00 . A A . 10 CYS SG 1 1 8 3239 1 1 11 LYS C C 7.596 4.564 -3.074 1.00 . A A . 11 LYS C 1 1 8 3240 1 1 11 LYS CA C 8.475 3.385 -3.477 1.00 . A A . 11 LYS CA 1 1 8 3241 1 1 11 LYS CB C 9.477 3.818 -4.550 1.00 . A A . 11 LYS CB 1 1 8 3242 1 1 11 LYS CD C 11.884 3.127 -4.803 1.00 . A A . 11 LYS CD 1 1 8 3243 1 1 11 LYS CE C 12.960 2.556 -3.894 1.00 . A A . 11 LYS CE 1 1 8 3244 1 1 11 LYS CG C 10.895 3.983 -4.027 1.00 . A A . 11 LYS CG 1 1 8 3245 1 1 11 LYS H H 7.513 2.177 -4.925 1.00 . A A . 11 LYS H 1 1 8 3246 1 1 11 LYS HA H 9.016 3.041 -2.608 1.00 . A A . 11 LYS HA 1 1 8 3247 1 1 11 LYS HB2 H 9.488 3.075 -5.334 1.00 . A A . 11 LYS HB2 1 1 8 3248 1 1 11 LYS HB3 H 9.157 4.762 -4.966 1.00 . A A . 11 LYS HB3 1 1 8 3249 1 1 11 LYS HD2 H 11.350 2.310 -5.268 1.00 . A A . 11 LYS HD2 1 1 8 3250 1 1 11 LYS HD3 H 12.351 3.734 -5.564 1.00 . A A . 11 LYS HD3 1 1 8 3251 1 1 11 LYS HE2 H 13.711 3.314 -3.726 1.00 . A A . 11 LYS HE2 1 1 8 3252 1 1 11 LYS HE3 H 12.510 2.282 -2.951 1.00 . A A . 11 LYS HE3 1 1 8 3253 1 1 11 LYS HG2 H 11.183 5.019 -4.119 1.00 . A A . 11 LYS HG2 1 1 8 3254 1 1 11 LYS HG3 H 10.920 3.693 -2.986 1.00 . A A . 11 LYS HG3 1 1 8 3255 1 1 11 LYS HZ1 H 12.889 0.662 -4.770 1.00 . A A . 11 LYS HZ1 1 1 8 3256 1 1 11 LYS HZ2 H 14.163 1.625 -5.326 1.00 . A A . 11 LYS HZ2 1 1 8 3257 1 1 11 LYS HZ3 H 14.246 0.913 -3.793 1.00 . A A . 11 LYS HZ3 1 1 8 3258 1 1 11 LYS N N 7.659 2.277 -3.961 1.00 . A A . 11 LYS N 1 1 8 3259 1 1 11 LYS NZ N 13.610 1.355 -4.488 1.00 . A A . 11 LYS NZ 1 1 8 3260 1 1 11 LYS O O 7.605 4.993 -1.919 1.00 . A A . 11 LYS O 1 1 8 3261 1 1 12 LYS C C 4.593 5.717 -3.263 1.00 . A A . 12 LYS C 1 1 8 3262 1 1 12 LYS CA C 5.942 6.206 -3.777 1.00 . A A . 12 LYS CA 1 1 8 3263 1 1 12 LYS CB C 5.749 7.029 -5.052 1.00 . A A . 12 LYS CB 1 1 8 3264 1 1 12 LYS CD C 5.593 9.539 -5.131 1.00 . A A . 12 LYS CD 1 1 8 3265 1 1 12 LYS CE C 6.459 9.940 -3.947 1.00 . A A . 12 LYS CE 1 1 8 3266 1 1 12 LYS CG C 4.849 8.240 -4.864 1.00 . A A . 12 LYS CG 1 1 8 3267 1 1 12 LYS H H 6.867 4.692 -4.930 1.00 . A A . 12 LYS H 1 1 8 3268 1 1 12 LYS HA H 6.400 6.828 -3.022 1.00 . A A . 12 LYS HA 1 1 8 3269 1 1 12 LYS HB2 H 6.715 7.372 -5.394 1.00 . A A . 12 LYS HB2 1 1 8 3270 1 1 12 LYS HB3 H 5.312 6.398 -5.812 1.00 . A A . 12 LYS HB3 1 1 8 3271 1 1 12 LYS HD2 H 6.224 9.409 -5.998 1.00 . A A . 12 LYS HD2 1 1 8 3272 1 1 12 LYS HD3 H 4.874 10.322 -5.321 1.00 . A A . 12 LYS HD3 1 1 8 3273 1 1 12 LYS HE2 H 5.934 10.689 -3.372 1.00 . A A . 12 LYS HE2 1 1 8 3274 1 1 12 LYS HE3 H 6.630 9.069 -3.331 1.00 . A A . 12 LYS HE3 1 1 8 3275 1 1 12 LYS HG2 H 4.017 8.168 -5.547 1.00 . A A . 12 LYS HG2 1 1 8 3276 1 1 12 LYS HG3 H 4.482 8.248 -3.847 1.00 . A A . 12 LYS HG3 1 1 8 3277 1 1 12 LYS HZ1 H 8.032 10.108 -5.310 1.00 . A A . 12 LYS HZ1 1 1 8 3278 1 1 12 LYS HZ2 H 7.717 11.529 -4.451 1.00 . A A . 12 LYS HZ2 1 1 8 3279 1 1 12 LYS HZ3 H 8.509 10.242 -3.692 1.00 . A A . 12 LYS HZ3 1 1 8 3280 1 1 12 LYS N N 6.834 5.080 -4.031 1.00 . A A . 12 LYS N 1 1 8 3281 1 1 12 LYS NZ N 7.771 10.494 -4.381 1.00 . A A . 12 LYS NZ 1 1 8 3282 1 1 12 LYS O O 4.018 4.774 -3.806 1.00 . A A . 12 LYS O 1 1 8 3283 1 1 13 ASP C C 1.701 6.002 -2.660 1.00 . A A . 13 ASP C 1 1 8 3284 1 1 13 ASP CA C 2.814 5.970 -1.623 1.00 . A A . 13 ASP CA 1 1 8 3285 1 1 13 ASP CB C 2.463 6.875 -0.440 1.00 . A A . 13 ASP CB 1 1 8 3286 1 1 13 ASP CG C 3.588 6.973 0.570 1.00 . A A . 13 ASP CG 1 1 8 3287 1 1 13 ASP H H 4.599 7.093 -1.813 1.00 . A A . 13 ASP H 1 1 8 3288 1 1 13 ASP HA H 2.914 4.962 -1.271 1.00 . A A . 13 ASP HA 1 1 8 3289 1 1 13 ASP HB2 H 2.241 7.865 -0.801 1.00 . A A . 13 ASP HB2 1 1 8 3290 1 1 13 ASP HB3 H 1.591 6.478 0.057 1.00 . A A . 13 ASP HB3 1 1 8 3291 1 1 13 ASP N N 4.094 6.355 -2.209 1.00 . A A . 13 ASP N 1 1 8 3292 1 1 13 ASP O O 0.786 5.179 -2.622 1.00 . A A . 13 ASP O 1 1 8 3293 1 1 13 ASP OD1 O 4.741 7.213 0.154 1.00 . A A . 13 ASP OD1 1 1 8 3294 1 1 13 ASP OD2 O 3.317 6.810 1.779 1.00 . A A . 13 ASP OD2 1 1 8 3295 1 1 14 SER C C 0.632 5.778 -5.407 1.00 . A A . 14 SER C 1 1 8 3296 1 1 14 SER CA C 0.798 7.089 -4.641 1.00 . A A . 14 SER CA 1 1 8 3297 1 1 14 SER CB C 1.198 8.212 -5.601 1.00 . A A . 14 SER CB 1 1 8 3298 1 1 14 SER H H 2.550 7.570 -3.559 1.00 . A A . 14 SER H 1 1 8 3299 1 1 14 SER HA H -0.144 7.341 -4.178 1.00 . A A . 14 SER HA 1 1 8 3300 1 1 14 SER HB2 H 2.075 8.712 -5.220 1.00 . A A . 14 SER HB2 1 1 8 3301 1 1 14 SER HB3 H 1.416 7.794 -6.573 1.00 . A A . 14 SER HB3 1 1 8 3302 1 1 14 SER N N 1.791 6.950 -3.584 1.00 . A A . 14 SER N 1 1 8 3303 1 1 14 SER O O -0.462 5.449 -5.867 1.00 . A A . 14 SER O 1 1 8 3304 1 1 14 SER OG O 0.154 9.161 -5.737 1.00 . A A . 14 SER OG 1 1 8 3305 1 1 15 ASP C C 0.592 2.858 -5.773 1.00 . A A . 15 ASP C 1 1 8 3306 1 1 15 ASP CA C 1.716 3.766 -6.263 1.00 . A A . 15 ASP CA 1 1 8 3307 1 1 15 ASP CB C 3.063 3.057 -6.109 1.00 . A A . 15 ASP CB 1 1 8 3308 1 1 15 ASP CG C 3.530 2.415 -7.401 1.00 . A A . 15 ASP CG 1 1 8 3309 1 1 15 ASP H H 2.574 5.354 -5.157 1.00 . A A . 15 ASP H 1 1 8 3310 1 1 15 ASP HA H 1.555 3.981 -7.308 1.00 . A A . 15 ASP HA 1 1 8 3311 1 1 15 ASP HB2 H 3.807 3.775 -5.797 1.00 . A A . 15 ASP HB2 1 1 8 3312 1 1 15 ASP HB3 H 2.975 2.287 -5.356 1.00 . A A . 15 ASP HB3 1 1 8 3313 1 1 15 ASP N N 1.730 5.038 -5.546 1.00 . A A . 15 ASP N 1 1 8 3314 1 1 15 ASP O O 0.015 2.098 -6.551 1.00 . A A . 15 ASP O 1 1 8 3315 1 1 15 ASP OD1 O 3.625 3.131 -8.420 1.00 . A A . 15 ASP OD1 1 1 8 3316 1 1 15 ASP OD2 O 3.799 1.196 -7.394 1.00 . A A . 15 ASP OD2 1 1 8 3317 1 1 16 CYS C C -2.046 2.193 -4.694 1.00 . A A . 16 CYS C 1 1 8 3318 1 1 16 CYS CA C -0.754 2.091 -3.893 1.00 . A A . 16 CYS CA 1 1 8 3319 1 1 16 CYS CB C -1.003 2.474 -2.429 1.00 . A A . 16 CYS CB 1 1 8 3320 1 1 16 CYS H H 0.793 3.541 -3.903 1.00 . A A . 16 CYS H 1 1 8 3321 1 1 16 CYS HA H -0.411 1.068 -3.931 1.00 . A A . 16 CYS HA 1 1 8 3322 1 1 16 CYS HB2 H -0.103 2.874 -2.016 1.00 . A A . 16 CYS HB2 1 1 8 3323 1 1 16 CYS HB3 H -1.767 3.230 -2.384 1.00 . A A . 16 CYS HB3 1 1 8 3324 1 1 16 CYS N N 0.293 2.926 -4.478 1.00 . A A . 16 CYS N 1 1 8 3325 1 1 16 CYS O O -2.146 2.975 -5.640 1.00 . A A . 16 CYS O 1 1 8 3326 1 1 16 CYS SG S -1.520 1.083 -1.364 1.00 . A A . 16 CYS SG 1 1 8 3327 1 1 17 LEU C C -5.443 1.764 -4.051 1.00 . A A . 17 LEU C 1 1 8 3328 1 1 17 LEU CA C -4.314 1.374 -4.997 1.00 . A A . 17 LEU CA 1 1 8 3329 1 1 17 LEU CB C -4.584 -0.012 -5.585 1.00 . A A . 17 LEU CB 1 1 8 3330 1 1 17 LEU CD1 C -6.060 -1.380 -4.090 1.00 . A A . 17 LEU CD1 1 1 8 3331 1 1 17 LEU CD2 C -4.056 -2.426 -5.159 1.00 . A A . 17 LEU CD2 1 1 8 3332 1 1 17 LEU CG C -4.634 -1.151 -4.564 1.00 . A A . 17 LEU CG 1 1 8 3333 1 1 17 LEU H H -2.877 0.788 -3.554 1.00 . A A . 17 LEU H 1 1 8 3334 1 1 17 LEU HA H -4.271 2.092 -5.801 1.00 . A A . 17 LEU HA 1 1 8 3335 1 1 17 LEU HB2 H -5.532 0.019 -6.105 1.00 . A A . 17 LEU HB2 1 1 8 3336 1 1 17 LEU HB3 H -3.807 -0.234 -6.301 1.00 . A A . 17 LEU HB3 1 1 8 3337 1 1 17 LEU HD11 H -6.641 -0.484 -4.250 1.00 . A A . 17 LEU HD11 1 1 8 3338 1 1 17 LEU HD12 H -6.497 -2.196 -4.647 1.00 . A A . 17 LEU HD12 1 1 8 3339 1 1 17 LEU HD13 H -6.055 -1.624 -3.039 1.00 . A A . 17 LEU HD13 1 1 8 3340 1 1 17 LEU HD21 H -3.383 -2.174 -5.965 1.00 . A A . 17 LEU HD21 1 1 8 3341 1 1 17 LEU HD22 H -3.517 -2.968 -4.396 1.00 . A A . 17 LEU HD22 1 1 8 3342 1 1 17 LEU HD23 H -4.858 -3.042 -5.539 1.00 . A A . 17 LEU HD23 1 1 8 3343 1 1 17 LEU HG H -4.037 -0.881 -3.705 1.00 . A A . 17 LEU HG 1 1 8 3344 1 1 17 LEU N N -3.026 1.389 -4.313 1.00 . A A . 17 LEU N 1 1 8 3345 1 1 17 LEU O O -5.249 1.851 -2.839 1.00 . A A . 17 LEU O 1 1 8 3346 1 1 18 ALA C C -7.457 3.590 -2.935 1.00 . A A . 18 ALA C 1 1 8 3347 1 1 18 ALA CA C -7.785 2.384 -3.823 1.00 . A A . 18 ALA CA 1 1 8 3348 1 1 18 ALA CB C -8.270 1.197 -3.002 1.00 . A A . 18 ALA CB 1 1 8 3349 1 1 18 ALA H H -6.715 1.916 -5.588 1.00 . A A . 18 ALA H 1 1 8 3350 1 1 18 ALA HA H -8.573 2.663 -4.508 1.00 . A A . 18 ALA HA 1 1 8 3351 1 1 18 ALA HB1 H -8.434 0.351 -3.654 1.00 . A A . 18 ALA HB1 1 1 8 3352 1 1 18 ALA HB2 H -9.194 1.455 -2.507 1.00 . A A . 18 ALA HB2 1 1 8 3353 1 1 18 ALA HB3 H -7.525 0.942 -2.263 1.00 . A A . 18 ALA HB3 1 1 8 3354 1 1 18 ALA N N -6.624 2.001 -4.616 1.00 . A A . 18 ALA N 1 1 8 3355 1 1 18 ALA O O -7.009 4.623 -3.433 1.00 . A A . 18 ALA O 1 1 8 3356 1 1 19 GLU C C -6.361 4.114 0.344 1.00 . A A . 19 GLU C 1 1 8 3357 1 1 19 GLU CA C -7.384 4.549 -0.702 1.00 . A A . 19 GLU CA 1 1 8 3358 1 1 19 GLU CB C -8.671 5.022 -0.021 1.00 . A A . 19 GLU CB 1 1 8 3359 1 1 19 GLU CD C -8.650 7.040 1.499 1.00 . A A . 19 GLU CD 1 1 8 3360 1 1 19 GLU CG C -8.788 6.535 0.077 1.00 . A A . 19 GLU CG 1 1 8 3361 1 1 19 GLU H H -8.024 2.620 -1.274 1.00 . A A . 19 GLU H 1 1 8 3362 1 1 19 GLU HA H -6.969 5.367 -1.273 1.00 . A A . 19 GLU HA 1 1 8 3363 1 1 19 GLU HB2 H -9.517 4.653 -0.582 1.00 . A A . 19 GLU HB2 1 1 8 3364 1 1 19 GLU HB3 H -8.707 4.614 0.978 1.00 . A A . 19 GLU HB3 1 1 8 3365 1 1 19 GLU HG2 H -8.010 6.983 -0.525 1.00 . A A . 19 GLU HG2 1 1 8 3366 1 1 19 GLU HG3 H -9.753 6.833 -0.305 1.00 . A A . 19 GLU HG3 1 1 8 3367 1 1 19 GLU N N -7.671 3.461 -1.627 1.00 . A A . 19 GLU N 1 1 8 3368 1 1 19 GLU O O -6.598 4.233 1.546 1.00 . A A . 19 GLU O 1 1 8 3369 1 1 19 GLU OE1 O -9.104 6.336 2.427 1.00 . A A . 19 GLU OE1 1 1 8 3370 1 1 19 GLU OE2 O -8.090 8.140 1.687 1.00 . A A . 19 GLU OE2 1 1 8 3371 1 1 20 CYS C C -2.828 3.752 0.332 1.00 . A A . 20 CYS C 1 1 8 3372 1 1 20 CYS CA C -4.162 3.173 0.776 1.00 . A A . 20 CYS CA 1 1 8 3373 1 1 20 CYS CB C -4.094 1.645 0.811 1.00 . A A . 20 CYS CB 1 1 8 3374 1 1 20 CYS H H -5.074 3.550 -1.090 1.00 . A A . 20 CYS H 1 1 8 3375 1 1 20 CYS HA H -4.390 3.541 1.765 1.00 . A A . 20 CYS HA 1 1 8 3376 1 1 20 CYS HB2 H -4.561 1.250 -0.078 1.00 . A A . 20 CYS HB2 1 1 8 3377 1 1 20 CYS HB3 H -3.059 1.337 0.837 1.00 . A A . 20 CYS HB3 1 1 8 3378 1 1 20 CYS N N -5.217 3.616 -0.121 1.00 . A A . 20 CYS N 1 1 8 3379 1 1 20 CYS O O -2.738 4.378 -0.724 1.00 . A A . 20 CYS O 1 1 8 3380 1 1 20 CYS SG S -4.930 0.901 2.251 1.00 . A A . 20 CYS SG 1 1 8 3381 1 1 21 VAL C C 0.550 2.957 0.681 1.00 . A A . 21 VAL C 1 1 8 3382 1 1 21 VAL CA C -0.481 4.072 0.809 1.00 . A A . 21 VAL CA 1 1 8 3383 1 1 21 VAL CB C 0.003 5.097 1.856 1.00 . A A . 21 VAL CB 1 1 8 3384 1 1 21 VAL CG1 C -0.991 6.242 1.977 1.00 . A A . 21 VAL CG1 1 1 8 3385 1 1 21 VAL CG2 C 0.223 4.431 3.207 1.00 . A A . 21 VAL CG2 1 1 8 3386 1 1 21 VAL H H -1.924 3.052 1.970 1.00 . A A . 21 VAL H 1 1 8 3387 1 1 21 VAL HA H -0.556 4.580 -0.143 1.00 . A A . 21 VAL HA 1 1 8 3388 1 1 21 VAL HB H 0.947 5.507 1.520 1.00 . A A . 21 VAL HB 1 1 8 3389 1 1 21 VAL HG11 H -1.254 6.596 0.991 1.00 . A A . 21 VAL HG11 1 1 8 3390 1 1 21 VAL HG12 H -1.880 5.894 2.483 1.00 . A A . 21 VAL HG12 1 1 8 3391 1 1 21 VAL HG13 H -0.546 7.047 2.542 1.00 . A A . 21 VAL HG13 1 1 8 3392 1 1 21 VAL HG21 H 0.826 3.544 3.077 1.00 . A A . 21 VAL HG21 1 1 8 3393 1 1 21 VAL HG22 H 0.731 5.117 3.868 1.00 . A A . 21 VAL HG22 1 1 8 3394 1 1 21 VAL HG23 H -0.730 4.159 3.634 1.00 . A A . 21 VAL HG23 1 1 8 3395 1 1 21 VAL N N -1.797 3.552 1.139 1.00 . A A . 21 VAL N 1 1 8 3396 1 1 21 VAL O O 0.363 1.851 1.187 1.00 . A A . 21 VAL O 1 1 8 3397 1 1 22 CYS C C 3.855 2.599 0.785 1.00 . A A . 22 CYS C 1 1 8 3398 1 1 22 CYS CA C 2.734 2.334 -0.215 1.00 . A A . 22 CYS CA 1 1 8 3399 1 1 22 CYS CB C 3.266 2.458 -1.649 1.00 . A A . 22 CYS CB 1 1 8 3400 1 1 22 CYS H H 1.708 4.176 -0.364 1.00 . A A . 22 CYS H 1 1 8 3401 1 1 22 CYS HA H 2.353 1.336 -0.060 1.00 . A A . 22 CYS HA 1 1 8 3402 1 1 22 CYS HB2 H 3.274 3.495 -1.934 1.00 . A A . 22 CYS HB2 1 1 8 3403 1 1 22 CYS HB3 H 4.274 2.078 -1.692 1.00 . A A . 22 CYS HB3 1 1 8 3404 1 1 22 CYS N N 1.640 3.276 0.001 1.00 . A A . 22 CYS N 1 1 8 3405 1 1 22 CYS O O 4.246 3.746 1.004 1.00 . A A . 22 CYS O 1 1 8 3406 1 1 22 CYS SG S 2.281 1.561 -2.889 1.00 . A A . 22 CYS SG 1 1 8 3407 1 1 23 LEU C C 6.785 1.339 1.790 1.00 . A A . 23 LEU C 1 1 8 3408 1 1 23 LEU CA C 5.421 1.662 2.393 1.00 . A A . 23 LEU CA 1 1 8 3409 1 1 23 LEU CB C 5.142 0.741 3.580 1.00 . A A . 23 LEU CB 1 1 8 3410 1 1 23 LEU CD1 C 3.332 -0.609 4.679 1.00 . A A . 23 LEU CD1 1 1 8 3411 1 1 23 LEU CD2 C 3.473 1.858 5.078 1.00 . A A . 23 LEU CD2 1 1 8 3412 1 1 23 LEU CG C 3.692 0.740 4.070 1.00 . A A . 23 LEU CG 1 1 8 3413 1 1 23 LEU H H 3.999 0.648 1.196 1.00 . A A . 23 LEU H 1 1 8 3414 1 1 23 LEU HA H 5.429 2.684 2.738 1.00 . A A . 23 LEU HA 1 1 8 3415 1 1 23 LEU HB2 H 5.408 -0.268 3.298 1.00 . A A . 23 LEU HB2 1 1 8 3416 1 1 23 LEU HB3 H 5.774 1.045 4.399 1.00 . A A . 23 LEU HB3 1 1 8 3417 1 1 23 LEU HD11 H 4.208 -1.238 4.708 1.00 . A A . 23 LEU HD11 1 1 8 3418 1 1 23 LEU HD12 H 2.959 -0.464 5.683 1.00 . A A . 23 LEU HD12 1 1 8 3419 1 1 23 LEU HD13 H 2.569 -1.082 4.077 1.00 . A A . 23 LEU HD13 1 1 8 3420 1 1 23 LEU HD21 H 3.958 2.758 4.729 1.00 . A A . 23 LEU HD21 1 1 8 3421 1 1 23 LEU HD22 H 2.414 2.040 5.189 1.00 . A A . 23 LEU HD22 1 1 8 3422 1 1 23 LEU HD23 H 3.890 1.572 6.031 1.00 . A A . 23 LEU HD23 1 1 8 3423 1 1 23 LEU HG H 3.036 0.913 3.231 1.00 . A A . 23 LEU HG 1 1 8 3424 1 1 23 LEU N N 4.359 1.536 1.402 1.00 . A A . 23 LEU N 1 1 8 3425 1 1 23 LEU O O 6.907 0.468 0.929 1.00 . A A . 23 LEU O 1 1 8 3426 1 1 24 GLU C C 9.611 0.413 1.903 1.00 . A A . 24 GLU C 1 1 8 3427 1 1 24 GLU CA C 9.169 1.866 1.767 1.00 . A A . 24 GLU CA 1 1 8 3428 1 1 24 GLU CB C 10.134 2.776 2.530 1.00 . A A . 24 GLU CB 1 1 8 3429 1 1 24 GLU CD C 10.086 4.047 4.714 1.00 . A A . 24 GLU CD 1 1 8 3430 1 1 24 GLU CG C 9.987 2.691 4.041 1.00 . A A . 24 GLU CG 1 1 8 3431 1 1 24 GLU H H 7.637 2.737 2.938 1.00 . A A . 24 GLU H 1 1 8 3432 1 1 24 GLU HA H 9.188 2.137 0.723 1.00 . A A . 24 GLU HA 1 1 8 3433 1 1 24 GLU HB2 H 11.148 2.504 2.273 1.00 . A A . 24 GLU HB2 1 1 8 3434 1 1 24 GLU HB3 H 9.958 3.799 2.231 1.00 . A A . 24 GLU HB3 1 1 8 3435 1 1 24 GLU HG2 H 9.025 2.261 4.274 1.00 . A A . 24 GLU HG2 1 1 8 3436 1 1 24 GLU HG3 H 10.768 2.055 4.431 1.00 . A A . 24 GLU HG3 1 1 8 3437 1 1 24 GLU N N 7.806 2.057 2.253 1.00 . A A . 24 GLU N 1 1 8 3438 1 1 24 GLU O O 10.168 -0.163 0.967 1.00 . A A . 24 GLU O 1 1 8 3439 1 1 24 GLU OE1 O 9.045 4.727 4.833 1.00 . A A . 24 GLU OE1 1 1 8 3440 1 1 24 GLU OE2 O 11.204 4.428 5.120 1.00 . A A . 24 GLU OE2 1 1 8 3441 1 1 25 HIS C C 9.181 -2.474 2.218 1.00 . A A . 25 HIS C 1 1 8 3442 1 1 25 HIS CA C 9.748 -1.571 3.306 1.00 . A A . 25 HIS CA 1 1 8 3443 1 1 25 HIS CB C 9.293 -2.063 4.690 1.00 . A A . 25 HIS CB 1 1 8 3444 1 1 25 HIS CD2 C 6.806 -1.607 5.285 1.00 . A A . 25 HIS CD2 1 1 8 3445 1 1 25 HIS CE1 C 7.078 0.277 6.372 1.00 . A A . 25 HIS CE1 1 1 8 3446 1 1 25 HIS CG C 8.129 -1.317 5.273 1.00 . A A . 25 HIS CG 1 1 8 3447 1 1 25 HIS H H 8.919 0.326 3.776 1.00 . A A . 25 HIS H 1 1 8 3448 1 1 25 HIS HA H 10.825 -1.621 3.258 1.00 . A A . 25 HIS HA 1 1 8 3449 1 1 25 HIS HB2 H 9.008 -3.101 4.615 1.00 . A A . 25 HIS HB2 1 1 8 3450 1 1 25 HIS HB3 H 10.120 -1.975 5.380 1.00 . A A . 25 HIS HB3 1 1 8 3451 1 1 25 HIS HD1 H 9.108 0.344 6.122 1.00 . A A . 25 HIS HD1 1 1 8 3452 1 1 25 HIS HD2 H 6.335 -2.470 4.835 1.00 . A A . 25 HIS HD2 1 1 8 3453 1 1 25 HIS HE1 H 6.879 1.175 6.936 1.00 . A A . 25 HIS HE1 1 1 8 3454 1 1 25 HIS HE2 H 5.242 -0.618 6.272 1.00 . A A . 25 HIS HE2 1 1 8 3455 1 1 25 HIS N N 9.365 -0.180 3.069 1.00 . A A . 25 HIS N 1 1 8 3456 1 1 25 HIS ND1 N 8.265 -0.130 5.960 1.00 . A A . 25 HIS ND1 1 1 8 3457 1 1 25 HIS NE2 N 6.175 -0.601 5.975 1.00 . A A . 25 HIS NE2 1 1 8 3458 1 1 25 HIS O O 9.746 -3.524 1.909 1.00 . A A . 25 HIS O 1 1 8 3459 1 1 26 GLY C C 6.116 -3.411 0.963 1.00 . A A . 26 GLY C 1 1 8 3460 1 1 26 GLY CA C 7.455 -2.821 0.569 1.00 . A A . 26 GLY CA 1 1 8 3461 1 1 26 GLY H H 7.670 -1.199 1.908 1.00 . A A . 26 GLY H 1 1 8 3462 1 1 26 GLY HA2 H 8.122 -3.623 0.290 1.00 . A A . 26 GLY HA2 1 1 8 3463 1 1 26 GLY HA3 H 7.313 -2.175 -0.283 1.00 . A A . 26 GLY HA3 1 1 8 3464 1 1 26 GLY N N 8.069 -2.050 1.628 1.00 . A A . 26 GLY N 1 1 8 3465 1 1 26 GLY O O 5.971 -4.630 1.042 1.00 . A A . 26 GLY O 1 1 8 3466 1 1 27 TYR C C 2.776 -1.867 1.446 1.00 . A A . 27 TYR C 1 1 8 3467 1 1 27 TYR CA C 3.795 -2.997 1.575 1.00 . A A . 27 TYR CA 1 1 8 3468 1 1 27 TYR CB C 3.795 -3.529 3.008 1.00 . A A . 27 TYR CB 1 1 8 3469 1 1 27 TYR CD1 C 3.703 -6.005 2.517 1.00 . A A . 27 TYR CD1 1 1 8 3470 1 1 27 TYR CD2 C 5.481 -5.194 3.883 1.00 . A A . 27 TYR CD2 1 1 8 3471 1 1 27 TYR CE1 C 4.196 -7.291 2.633 1.00 . A A . 27 TYR CE1 1 1 8 3472 1 1 27 TYR CE2 C 5.979 -6.477 4.004 1.00 . A A . 27 TYR CE2 1 1 8 3473 1 1 27 TYR CG C 4.336 -4.936 3.139 1.00 . A A . 27 TYR CG 1 1 8 3474 1 1 27 TYR CZ C 5.333 -7.522 3.377 1.00 . A A . 27 TYR CZ 1 1 8 3475 1 1 27 TYR H H 5.307 -1.586 1.109 1.00 . A A . 27 TYR H 1 1 8 3476 1 1 27 TYR HA H 3.514 -3.795 0.906 1.00 . A A . 27 TYR HA 1 1 8 3477 1 1 27 TYR HB2 H 4.402 -2.885 3.619 1.00 . A A . 27 TYR HB2 1 1 8 3478 1 1 27 TYR HB3 H 2.782 -3.526 3.385 1.00 . A A . 27 TYR HB3 1 1 8 3479 1 1 27 TYR HD1 H 2.812 -5.822 1.934 1.00 . A A . 27 TYR HD1 1 1 8 3480 1 1 27 TYR HD2 H 5.984 -4.374 4.373 1.00 . A A . 27 TYR HD2 1 1 8 3481 1 1 27 TYR HE1 H 3.691 -8.110 2.144 1.00 . A A . 27 TYR HE1 1 1 8 3482 1 1 27 TYR HE2 H 6.870 -6.657 4.586 1.00 . A A . 27 TYR HE2 1 1 8 3483 1 1 27 TYR HH H 6.150 -8.939 4.389 1.00 . A A . 27 TYR HH 1 1 8 3484 1 1 27 TYR N N 5.132 -2.547 1.197 1.00 . A A . 27 TYR N 1 1 8 3485 1 1 27 TYR O O 3.087 -0.704 1.702 1.00 . A A . 27 TYR O 1 1 8 3486 1 1 27 TYR OH O 5.827 -8.800 3.495 1.00 . A A . 27 TYR OH 1 1 8 3487 1 1 28 CYS C C -0.429 -1.245 2.115 1.00 . A A . 28 CYS C 1 1 8 3488 1 1 28 CYS CA C 0.484 -1.242 0.893 1.00 . A A . 28 CYS CA 1 1 8 3489 1 1 28 CYS CB C -0.340 -1.548 -0.363 1.00 . A A . 28 CYS CB 1 1 8 3490 1 1 28 CYS H H 1.375 -3.164 0.862 1.00 . A A . 28 CYS H 1 1 8 3491 1 1 28 CYS HA H 0.934 -0.267 0.793 1.00 . A A . 28 CYS HA 1 1 8 3492 1 1 28 CYS HB2 H -0.058 -2.518 -0.741 1.00 . A A . 28 CYS HB2 1 1 8 3493 1 1 28 CYS HB3 H -1.389 -1.560 -0.104 1.00 . A A . 28 CYS HB3 1 1 8 3494 1 1 28 CYS N N 1.556 -2.222 1.051 1.00 . A A . 28 CYS N 1 1 8 3495 1 1 28 CYS O O -1.150 -2.212 2.361 1.00 . A A . 28 CYS O 1 1 8 3496 1 1 28 CYS SG S -0.118 -0.346 -1.716 1.00 . A A . 28 CYS SG 1 1 8 3497 1 1 29 GLY C C -1.976 1.252 4.139 1.00 . A A . 29 GLY C 1 1 8 3498 1 1 29 GLY CA C -1.218 -0.058 4.068 1.00 . A A . 29 GLY CA 1 1 8 3499 1 1 29 GLY H H 0.204 0.580 2.634 1.00 . A A . 29 GLY H 1 1 8 3500 1 1 29 GLY HA2 H -0.587 -0.145 4.940 1.00 . A A . 29 GLY HA2 1 1 8 3501 1 1 29 GLY HA3 H -1.928 -0.872 4.068 1.00 . A A . 29 GLY HA3 1 1 8 3502 1 1 29 GLY N N -0.391 -0.159 2.879 1.00 . A A . 29 GLY N 1 1 8 3503 1 1 29 GLY O O -2.868 1.376 5.004 1.00 . A A . 29 GLY O 1 1 8 3504 1 1 29 GLY OXT O -1.676 2.156 3.331 1.00 . A A . 29 GLY OXT 1 1 9 3505 1 1 1 ARG C C -8.651 0.896 4.111 1.00 . A A . 1 ARG C 1 1 9 3506 1 1 1 ARG CA C -7.802 1.542 5.202 1.00 . A A . 1 ARG CA 1 1 9 3507 1 1 1 ARG CB C -7.142 2.820 4.676 1.00 . A A . 1 ARG CB 1 1 9 3508 1 1 1 ARG CD C -7.630 4.267 6.672 1.00 . A A . 1 ARG CD 1 1 9 3509 1 1 1 ARG CG C -7.806 4.094 5.171 1.00 . A A . 1 ARG CG 1 1 9 3510 1 1 1 ARG CZ C -9.015 4.078 8.700 1.00 . A A . 1 ARG CZ 1 1 9 3511 1 1 1 ARG H1 H -7.160 -0.327 5.772 1.00 . A A . 1 ARG H1 1 1 9 3512 1 1 1 ARG H2 H -5.982 0.616 4.957 1.00 . A A . 1 ARG H2 1 1 9 3513 1 1 1 ARG H3 H -6.388 0.973 6.583 1.00 . A A . 1 ARG H3 1 1 9 3514 1 1 1 ARG HA H -8.436 1.789 6.041 1.00 . A A . 1 ARG HA 1 1 9 3515 1 1 1 ARG HB2 H -6.110 2.832 4.990 1.00 . A A . 1 ARG HB2 1 1 9 3516 1 1 1 ARG HB3 H -7.182 2.814 3.597 1.00 . A A . 1 ARG HB3 1 1 9 3517 1 1 1 ARG HD2 H -6.766 3.701 6.987 1.00 . A A . 1 ARG HD2 1 1 9 3518 1 1 1 ARG HD3 H -7.472 5.314 6.884 1.00 . A A . 1 ARG HD3 1 1 9 3519 1 1 1 ARG HE H -9.455 3.258 6.935 1.00 . A A . 1 ARG HE 1 1 9 3520 1 1 1 ARG HG2 H -7.360 4.939 4.668 1.00 . A A . 1 ARG HG2 1 1 9 3521 1 1 1 ARG HG3 H -8.861 4.051 4.944 1.00 . A A . 1 ARG HG3 1 1 9 3522 1 1 1 ARG HH11 H -7.326 5.163 8.937 1.00 . A A . 1 ARG HH11 1 1 9 3523 1 1 1 ARG HH12 H -8.317 5.016 10.349 1.00 . A A . 1 ARG HH12 1 1 9 3524 1 1 1 ARG HH21 H -10.761 3.063 8.792 1.00 . A A . 1 ARG HH21 1 1 9 3525 1 1 1 ARG HH22 H -10.267 3.823 10.267 1.00 . A A . 1 ARG HH22 1 1 9 3526 1 1 1 ARG N N -6.737 0.618 5.670 1.00 . A A . 1 ARG N 1 1 9 3527 1 1 1 ARG NE N -8.798 3.803 7.417 1.00 . A A . 1 ARG NE 1 1 9 3528 1 1 1 ARG NH1 N -8.148 4.813 9.385 1.00 . A A . 1 ARG NH1 1 1 9 3529 1 1 1 ARG NH2 N -10.104 3.617 9.302 1.00 . A A . 1 ARG NH2 1 1 9 3530 1 1 1 ARG O O -8.601 -0.317 3.908 1.00 . A A . 1 ARG O 1 1 9 3531 1 1 2 VAL C C -9.466 0.700 1.171 1.00 . A A . 2 VAL C 1 1 9 3532 1 1 2 VAL CA C -10.292 1.221 2.343 1.00 . A A . 2 VAL CA 1 1 9 3533 1 1 2 VAL CB C -11.248 2.319 1.839 1.00 . A A . 2 VAL CB 1 1 9 3534 1 1 2 VAL CG1 C -12.235 1.748 0.831 1.00 . A A . 2 VAL CG1 1 1 9 3535 1 1 2 VAL CG2 C -11.981 2.967 3.003 1.00 . A A . 2 VAL CG2 1 1 9 3536 1 1 2 VAL H H -9.429 2.671 3.621 1.00 . A A . 2 VAL H 1 1 9 3537 1 1 2 VAL HA H -10.885 0.410 2.741 1.00 . A A . 2 VAL HA 1 1 9 3538 1 1 2 VAL HB H -10.662 3.079 1.342 1.00 . A A . 2 VAL HB 1 1 9 3539 1 1 2 VAL HG11 H -12.366 0.691 1.015 1.00 . A A . 2 VAL HG11 1 1 9 3540 1 1 2 VAL HG12 H -13.186 2.252 0.933 1.00 . A A . 2 VAL HG12 1 1 9 3541 1 1 2 VAL HG13 H -11.855 1.895 -0.168 1.00 . A A . 2 VAL HG13 1 1 9 3542 1 1 2 VAL HG21 H -11.405 2.841 3.908 1.00 . A A . 2 VAL HG21 1 1 9 3543 1 1 2 VAL HG22 H -12.111 4.021 2.806 1.00 . A A . 2 VAL HG22 1 1 9 3544 1 1 2 VAL HG23 H -12.948 2.502 3.125 1.00 . A A . 2 VAL HG23 1 1 9 3545 1 1 2 VAL N N -9.432 1.714 3.412 1.00 . A A . 2 VAL N 1 1 9 3546 1 1 2 VAL O O -9.343 1.361 0.140 1.00 . A A . 2 VAL O 1 1 9 3547 1 1 3 CYS C C -7.948 -2.610 0.529 1.00 . A A . 3 CYS C 1 1 9 3548 1 1 3 CYS CA C -8.089 -1.106 0.293 1.00 . A A . 3 CYS CA 1 1 9 3549 1 1 3 CYS CB C -6.706 -0.448 0.238 1.00 . A A . 3 CYS CB 1 1 9 3550 1 1 3 CYS H H -9.037 -0.973 2.180 1.00 . A A . 3 CYS H 1 1 9 3551 1 1 3 CYS HA H -8.590 -0.946 -0.649 1.00 . A A . 3 CYS HA 1 1 9 3552 1 1 3 CYS HB2 H -6.202 -0.765 -0.662 1.00 . A A . 3 CYS HB2 1 1 9 3553 1 1 3 CYS HB3 H -6.828 0.625 0.215 1.00 . A A . 3 CYS HB3 1 1 9 3554 1 1 3 CYS N N -8.902 -0.493 1.336 1.00 . A A . 3 CYS N 1 1 9 3555 1 1 3 CYS O O -7.608 -3.041 1.632 1.00 . A A . 3 CYS O 1 1 9 3556 1 1 3 CYS SG S -5.623 -0.854 1.648 1.00 . A A . 3 CYS SG 1 1 9 3557 1 1 4 PRO C C -6.848 -5.339 0.344 1.00 . A A . 4 PRO C 1 1 9 3558 1 1 4 PRO CA C -8.106 -4.893 -0.394 1.00 . A A . 4 PRO CA 1 1 9 3559 1 1 4 PRO CB C -8.059 -5.344 -1.851 1.00 . A A . 4 PRO CB 1 1 9 3560 1 1 4 PRO CD C -8.619 -3.014 -1.858 1.00 . A A . 4 PRO CD 1 1 9 3561 1 1 4 PRO CG C -8.851 -4.316 -2.583 1.00 . A A . 4 PRO CG 1 1 9 3562 1 1 4 PRO HA H -8.975 -5.316 0.089 1.00 . A A . 4 PRO HA 1 1 9 3563 1 1 4 PRO HB2 H -7.032 -5.371 -2.190 1.00 . A A . 4 PRO HB2 1 1 9 3564 1 1 4 PRO HB3 H -8.501 -6.324 -1.944 1.00 . A A . 4 PRO HB3 1 1 9 3565 1 1 4 PRO HD2 H -7.835 -2.449 -2.340 1.00 . A A . 4 PRO HD2 1 1 9 3566 1 1 4 PRO HD3 H -9.532 -2.438 -1.821 1.00 . A A . 4 PRO HD3 1 1 9 3567 1 1 4 PRO HG2 H -8.504 -4.243 -3.603 1.00 . A A . 4 PRO HG2 1 1 9 3568 1 1 4 PRO HG3 H -9.898 -4.576 -2.560 1.00 . A A . 4 PRO HG3 1 1 9 3569 1 1 4 PRO N N -8.208 -3.435 -0.503 1.00 . A A . 4 PRO N 1 1 9 3570 1 1 4 PRO O O -5.744 -4.891 0.036 1.00 . A A . 4 PRO O 1 1 9 3571 1 1 5 ARG C C -4.979 -7.578 1.239 1.00 . A A . 5 ARG C 1 1 9 3572 1 1 5 ARG CA C -5.902 -6.726 2.103 1.00 . A A . 5 ARG CA 1 1 9 3573 1 1 5 ARG CB C -6.408 -7.545 3.292 1.00 . A A . 5 ARG CB 1 1 9 3574 1 1 5 ARG CD C -4.157 -7.920 4.347 1.00 . A A . 5 ARG CD 1 1 9 3575 1 1 5 ARG CG C -5.566 -7.384 4.546 1.00 . A A . 5 ARG CG 1 1 9 3576 1 1 5 ARG CZ C -2.487 -9.132 5.695 1.00 . A A . 5 ARG CZ 1 1 9 3577 1 1 5 ARG H H -7.928 -6.541 1.522 1.00 . A A . 5 ARG H 1 1 9 3578 1 1 5 ARG HA H -5.347 -5.876 2.473 1.00 . A A . 5 ARG HA 1 1 9 3579 1 1 5 ARG HB2 H -7.419 -7.237 3.521 1.00 . A A . 5 ARG HB2 1 1 9 3580 1 1 5 ARG HB3 H -6.414 -8.590 3.019 1.00 . A A . 5 ARG HB3 1 1 9 3581 1 1 5 ARG HD2 H -4.119 -8.463 3.414 1.00 . A A . 5 ARG HD2 1 1 9 3582 1 1 5 ARG HD3 H -3.471 -7.087 4.305 1.00 . A A . 5 ARG HD3 1 1 9 3583 1 1 5 ARG HE H -4.460 -9.197 5.988 1.00 . A A . 5 ARG HE 1 1 9 3584 1 1 5 ARG HG2 H -5.507 -6.335 4.798 1.00 . A A . 5 ARG HG2 1 1 9 3585 1 1 5 ARG HG3 H -6.035 -7.924 5.355 1.00 . A A . 5 ARG HG3 1 1 9 3586 1 1 5 ARG HH11 H -1.706 -8.011 4.203 1.00 . A A . 5 ARG HH11 1 1 9 3587 1 1 5 ARG HH12 H -0.554 -8.873 5.165 1.00 . A A . 5 ARG HH12 1 1 9 3588 1 1 5 ARG HH21 H -2.945 -10.331 7.255 1.00 . A A . 5 ARG HH21 1 1 9 3589 1 1 5 ARG HH22 H -1.257 -10.191 6.898 1.00 . A A . 5 ARG HH22 1 1 9 3590 1 1 5 ARG N N -7.024 -6.222 1.322 1.00 . A A . 5 ARG N 1 1 9 3591 1 1 5 ARG NE N -3.753 -8.814 5.429 1.00 . A A . 5 ARG NE 1 1 9 3592 1 1 5 ARG NH1 N -1.502 -8.631 4.960 1.00 . A A . 5 ARG NH1 1 1 9 3593 1 1 5 ARG NH2 N -2.206 -9.952 6.698 1.00 . A A . 5 ARG NH2 1 1 9 3594 1 1 5 ARG O O -5.036 -8.807 1.275 1.00 . A A . 5 ARG O 1 1 9 3595 1 1 6 ILE C C -1.807 -6.971 -0.351 1.00 . A A . 6 ILE C 1 1 9 3596 1 1 6 ILE CA C -3.190 -7.610 -0.411 1.00 . A A . 6 ILE CA 1 1 9 3597 1 1 6 ILE CB C -3.678 -7.615 -1.873 1.00 . A A . 6 ILE CB 1 1 9 3598 1 1 6 ILE CD1 C -4.305 -6.077 -3.801 1.00 . A A . 6 ILE CD1 1 1 9 3599 1 1 6 ILE CG1 C -4.049 -6.198 -2.315 1.00 . A A . 6 ILE CG1 1 1 9 3600 1 1 6 ILE CG2 C -4.865 -8.552 -2.031 1.00 . A A . 6 ILE CG2 1 1 9 3601 1 1 6 ILE H H -4.131 -5.935 0.477 1.00 . A A . 6 ILE H 1 1 9 3602 1 1 6 ILE HA H -3.118 -8.634 -0.074 1.00 . A A . 6 ILE HA 1 1 9 3603 1 1 6 ILE HB H -2.876 -7.981 -2.495 1.00 . A A . 6 ILE HB 1 1 9 3604 1 1 6 ILE HD11 H -3.706 -6.805 -4.330 1.00 . A A . 6 ILE HD11 1 1 9 3605 1 1 6 ILE HD12 H -5.351 -6.256 -4.002 1.00 . A A . 6 ILE HD12 1 1 9 3606 1 1 6 ILE HD13 H -4.040 -5.084 -4.133 1.00 . A A . 6 ILE HD13 1 1 9 3607 1 1 6 ILE HG12 H -4.945 -5.889 -1.800 1.00 . A A . 6 ILE HG12 1 1 9 3608 1 1 6 ILE HG13 H -3.242 -5.526 -2.061 1.00 . A A . 6 ILE HG13 1 1 9 3609 1 1 6 ILE HG21 H -4.839 -9.301 -1.253 1.00 . A A . 6 ILE HG21 1 1 9 3610 1 1 6 ILE HG22 H -5.783 -7.988 -1.956 1.00 . A A . 6 ILE HG22 1 1 9 3611 1 1 6 ILE HG23 H -4.817 -9.035 -2.997 1.00 . A A . 6 ILE HG23 1 1 9 3612 1 1 6 ILE N N -4.128 -6.915 0.462 1.00 . A A . 6 ILE N 1 1 9 3613 1 1 6 ILE O O -1.667 -5.755 -0.481 1.00 . A A . 6 ILE O 1 1 9 3614 1 1 7 LEU C C 0.973 -6.564 -1.343 1.00 . A A . 7 LEU C 1 1 9 3615 1 1 7 LEU CA C 0.588 -7.320 -0.075 1.00 . A A . 7 LEU CA 1 1 9 3616 1 1 7 LEU CB C 1.545 -8.493 0.140 1.00 . A A . 7 LEU CB 1 1 9 3617 1 1 7 LEU CD1 C 2.132 -10.573 1.409 1.00 . A A . 7 LEU CD1 1 1 9 3618 1 1 7 LEU CD2 C 1.645 -8.453 2.647 1.00 . A A . 7 LEU CD2 1 1 9 3619 1 1 7 LEU CG C 1.310 -9.294 1.422 1.00 . A A . 7 LEU CG 1 1 9 3620 1 1 7 LEU H H -0.964 -8.760 -0.057 1.00 . A A . 7 LEU H 1 1 9 3621 1 1 7 LEU HA H 0.658 -6.649 0.768 1.00 . A A . 7 LEU HA 1 1 9 3622 1 1 7 LEU HB2 H 1.453 -9.165 -0.701 1.00 . A A . 7 LEU HB2 1 1 9 3623 1 1 7 LEU HB3 H 2.553 -8.108 0.162 1.00 . A A . 7 LEU HB3 1 1 9 3624 1 1 7 LEU HD11 H 2.996 -10.439 0.775 1.00 . A A . 7 LEU HD11 1 1 9 3625 1 1 7 LEU HD12 H 2.454 -10.804 2.414 1.00 . A A . 7 LEU HD12 1 1 9 3626 1 1 7 LEU HD13 H 1.529 -11.385 1.029 1.00 . A A . 7 LEU HD13 1 1 9 3627 1 1 7 LEU HD21 H 1.716 -7.413 2.361 1.00 . A A . 7 LEU HD21 1 1 9 3628 1 1 7 LEU HD22 H 0.868 -8.571 3.387 1.00 . A A . 7 LEU HD22 1 1 9 3629 1 1 7 LEU HD23 H 2.588 -8.778 3.060 1.00 . A A . 7 LEU HD23 1 1 9 3630 1 1 7 LEU HG H 0.267 -9.569 1.480 1.00 . A A . 7 LEU HG 1 1 9 3631 1 1 7 LEU N N -0.788 -7.800 -0.153 1.00 . A A . 7 LEU N 1 1 9 3632 1 1 7 LEU O O 0.610 -6.963 -2.449 1.00 . A A . 7 LEU O 1 1 9 3633 1 1 8 LEU C C 3.277 -3.729 -1.915 1.00 . A A . 8 LEU C 1 1 9 3634 1 1 8 LEU CA C 2.142 -4.664 -2.312 1.00 . A A . 8 LEU CA 1 1 9 3635 1 1 8 LEU CB C 0.969 -3.853 -2.866 1.00 . A A . 8 LEU CB 1 1 9 3636 1 1 8 LEU CD1 C -0.438 -3.707 -4.937 1.00 . A A . 8 LEU CD1 1 1 9 3637 1 1 8 LEU CD2 C 1.646 -2.338 -4.743 1.00 . A A . 8 LEU CD2 1 1 9 3638 1 1 8 LEU CG C 0.977 -3.656 -4.383 1.00 . A A . 8 LEU CG 1 1 9 3639 1 1 8 LEU H H 1.973 -5.199 -0.267 1.00 . A A . 8 LEU H 1 1 9 3640 1 1 8 LEU HA H 2.497 -5.336 -3.078 1.00 . A A . 8 LEU HA 1 1 9 3641 1 1 8 LEU HB2 H 0.052 -4.356 -2.593 1.00 . A A . 8 LEU HB2 1 1 9 3642 1 1 8 LEU HB3 H 0.978 -2.880 -2.399 1.00 . A A . 8 LEU HB3 1 1 9 3643 1 1 8 LEU HD11 H -1.100 -3.156 -4.287 1.00 . A A . 8 LEU HD11 1 1 9 3644 1 1 8 LEU HD12 H -0.454 -3.267 -5.923 1.00 . A A . 8 LEU HD12 1 1 9 3645 1 1 8 LEU HD13 H -0.765 -4.735 -4.996 1.00 . A A . 8 LEU HD13 1 1 9 3646 1 1 8 LEU HD21 H 1.114 -1.524 -4.272 1.00 . A A . 8 LEU HD21 1 1 9 3647 1 1 8 LEU HD22 H 2.670 -2.347 -4.398 1.00 . A A . 8 LEU HD22 1 1 9 3648 1 1 8 LEU HD23 H 1.630 -2.207 -5.815 1.00 . A A . 8 LEU HD23 1 1 9 3649 1 1 8 LEU HG H 1.544 -4.455 -4.839 1.00 . A A . 8 LEU HG 1 1 9 3650 1 1 8 LEU N N 1.711 -5.470 -1.175 1.00 . A A . 8 LEU N 1 1 9 3651 1 1 8 LEU O O 3.095 -2.836 -1.087 1.00 . A A . 8 LEU O 1 1 9 3652 1 1 9 GLU C C 5.825 -2.058 -3.289 1.00 . A A . 9 GLU C 1 1 9 3653 1 1 9 GLU CA C 5.618 -3.121 -2.216 1.00 . A A . 9 GLU CA 1 1 9 3654 1 1 9 GLU CB C 6.866 -4.000 -2.107 1.00 . A A . 9 GLU CB 1 1 9 3655 1 1 9 GLU CD C 8.479 -5.544 -3.288 1.00 . A A . 9 GLU CD 1 1 9 3656 1 1 9 GLU CG C 7.168 -4.787 -3.372 1.00 . A A . 9 GLU CG 1 1 9 3657 1 1 9 GLU H H 4.528 -4.670 -3.160 1.00 . A A . 9 GLU H 1 1 9 3658 1 1 9 GLU HA H 5.450 -2.630 -1.270 1.00 . A A . 9 GLU HA 1 1 9 3659 1 1 9 GLU HB2 H 7.717 -3.371 -1.889 1.00 . A A . 9 GLU HB2 1 1 9 3660 1 1 9 GLU HB3 H 6.729 -4.701 -1.297 1.00 . A A . 9 GLU HB3 1 1 9 3661 1 1 9 GLU HG2 H 6.371 -5.495 -3.540 1.00 . A A . 9 GLU HG2 1 1 9 3662 1 1 9 GLU HG3 H 7.219 -4.100 -4.205 1.00 . A A . 9 GLU HG3 1 1 9 3663 1 1 9 GLU N N 4.448 -3.941 -2.510 1.00 . A A . 9 GLU N 1 1 9 3664 1 1 9 GLU O O 5.774 -2.349 -4.484 1.00 . A A . 9 GLU O 1 1 9 3665 1 1 9 GLU OE1 O 9.451 -4.989 -2.734 1.00 . A A . 9 GLU OE1 1 1 9 3666 1 1 9 GLU OE2 O 8.532 -6.694 -3.774 1.00 . A A . 9 GLU OE2 1 1 9 3667 1 1 10 CYS C C 7.123 1.372 -3.152 1.00 . A A . 10 CYS C 1 1 9 3668 1 1 10 CYS CA C 6.254 0.288 -3.781 1.00 . A A . 10 CYS CA 1 1 9 3669 1 1 10 CYS CB C 4.905 0.882 -4.208 1.00 . A A . 10 CYS CB 1 1 9 3670 1 1 10 CYS H H 6.070 -0.648 -1.889 1.00 . A A . 10 CYS H 1 1 9 3671 1 1 10 CYS HA H 6.758 -0.100 -4.653 1.00 . A A . 10 CYS HA 1 1 9 3672 1 1 10 CYS HB2 H 4.866 1.919 -3.911 1.00 . A A . 10 CYS HB2 1 1 9 3673 1 1 10 CYS HB3 H 4.819 0.818 -5.283 1.00 . A A . 10 CYS HB3 1 1 9 3674 1 1 10 CYS N N 6.049 -0.821 -2.854 1.00 . A A . 10 CYS N 1 1 9 3675 1 1 10 CYS O O 7.292 1.420 -1.933 1.00 . A A . 10 CYS O 1 1 9 3676 1 1 10 CYS SG S 3.452 0.048 -3.486 1.00 . A A . 10 CYS SG 1 1 9 3677 1 1 11 LYS C C 7.668 4.520 -3.075 1.00 . A A . 11 LYS C 1 1 9 3678 1 1 11 LYS CA C 8.517 3.334 -3.523 1.00 . A A . 11 LYS CA 1 1 9 3679 1 1 11 LYS CB C 9.486 3.767 -4.626 1.00 . A A . 11 LYS CB 1 1 9 3680 1 1 11 LYS CD C 11.280 5.286 -3.737 1.00 . A A . 11 LYS CD 1 1 9 3681 1 1 11 LYS CE C 11.157 5.462 -2.232 1.00 . A A . 11 LYS CE 1 1 9 3682 1 1 11 LYS CG C 10.930 3.870 -4.164 1.00 . A A . 11 LYS CG 1 1 9 3683 1 1 11 LYS H H 7.495 2.156 -4.954 1.00 . A A . 11 LYS H 1 1 9 3684 1 1 11 LYS HA H 9.085 2.972 -2.679 1.00 . A A . 11 LYS HA 1 1 9 3685 1 1 11 LYS HB2 H 9.439 3.049 -5.432 1.00 . A A . 11 LYS HB2 1 1 9 3686 1 1 11 LYS HB3 H 9.182 4.734 -5.001 1.00 . A A . 11 LYS HB3 1 1 9 3687 1 1 11 LYS HD2 H 12.297 5.499 -4.031 1.00 . A A . 11 LYS HD2 1 1 9 3688 1 1 11 LYS HD3 H 10.608 5.976 -4.228 1.00 . A A . 11 LYS HD3 1 1 9 3689 1 1 11 LYS HE2 H 10.562 4.653 -1.835 1.00 . A A . 11 LYS HE2 1 1 9 3690 1 1 11 LYS HE3 H 12.145 5.429 -1.796 1.00 . A A . 11 LYS HE3 1 1 9 3691 1 1 11 LYS HG2 H 11.077 3.205 -3.325 1.00 . A A . 11 LYS HG2 1 1 9 3692 1 1 11 LYS HG3 H 11.579 3.576 -4.975 1.00 . A A . 11 LYS HG3 1 1 9 3693 1 1 11 LYS HZ1 H 9.915 7.086 -2.659 1.00 . A A . 11 LYS HZ1 1 1 9 3694 1 1 11 LYS HZ2 H 9.921 6.640 -1.028 1.00 . A A . 11 LYS HZ2 1 1 9 3695 1 1 11 LYS HZ3 H 11.238 7.475 -1.680 1.00 . A A . 11 LYS HZ3 1 1 9 3696 1 1 11 LYS N N 7.669 2.245 -3.993 1.00 . A A . 11 LYS N 1 1 9 3697 1 1 11 LYS NZ N 10.513 6.757 -1.875 1.00 . A A . 11 LYS NZ 1 1 9 3698 1 1 11 LYS O O 7.767 4.972 -1.935 1.00 . A A . 11 LYS O 1 1 9 3699 1 1 12 LYS C C 4.606 5.654 -3.172 1.00 . A A . 12 LYS C 1 1 9 3700 1 1 12 LYS CA C 5.957 6.144 -3.680 1.00 . A A . 12 LYS CA 1 1 9 3701 1 1 12 LYS CB C 5.764 7.012 -4.926 1.00 . A A . 12 LYS CB 1 1 9 3702 1 1 12 LYS CD C 5.423 9.466 -5.362 1.00 . A A . 12 LYS CD 1 1 9 3703 1 1 12 LYS CE C 5.360 10.672 -4.438 1.00 . A A . 12 LYS CE 1 1 9 3704 1 1 12 LYS CG C 4.866 8.216 -4.695 1.00 . A A . 12 LYS CG 1 1 9 3705 1 1 12 LYS H H 6.795 4.607 -4.872 1.00 . A A . 12 LYS H 1 1 9 3706 1 1 12 LYS HA H 6.428 6.733 -2.909 1.00 . A A . 12 LYS HA 1 1 9 3707 1 1 12 LYS HB2 H 6.730 7.365 -5.256 1.00 . A A . 12 LYS HB2 1 1 9 3708 1 1 12 LYS HB3 H 5.326 6.407 -5.707 1.00 . A A . 12 LYS HB3 1 1 9 3709 1 1 12 LYS HD2 H 6.453 9.290 -5.635 1.00 . A A . 12 LYS HD2 1 1 9 3710 1 1 12 LYS HD3 H 4.844 9.674 -6.251 1.00 . A A . 12 LYS HD3 1 1 9 3711 1 1 12 LYS HE2 H 4.582 11.337 -4.787 1.00 . A A . 12 LYS HE2 1 1 9 3712 1 1 12 LYS HE3 H 5.121 10.335 -3.439 1.00 . A A . 12 LYS HE3 1 1 9 3713 1 1 12 LYS HG2 H 3.889 8.008 -5.103 1.00 . A A . 12 LYS HG2 1 1 9 3714 1 1 12 LYS HG3 H 4.783 8.393 -3.632 1.00 . A A . 12 LYS HG3 1 1 9 3715 1 1 12 LYS HZ1 H 7.443 10.758 -4.554 1.00 . A A . 12 LYS HZ1 1 1 9 3716 1 1 12 LYS HZ2 H 6.666 12.138 -5.150 1.00 . A A . 12 LYS HZ2 1 1 9 3717 1 1 12 LYS HZ3 H 6.771 11.880 -3.482 1.00 . A A . 12 LYS HZ3 1 1 9 3718 1 1 12 LYS N N 6.831 5.014 -3.980 1.00 . A A . 12 LYS N 1 1 9 3719 1 1 12 LYS NZ N 6.650 11.414 -4.404 1.00 . A A . 12 LYS NZ 1 1 9 3720 1 1 12 LYS O O 4.067 4.668 -3.669 1.00 . A A . 12 LYS O 1 1 9 3721 1 1 13 ASP C C 1.672 6.007 -2.639 1.00 . A A . 13 ASP C 1 1 9 3722 1 1 13 ASP CA C 2.781 5.961 -1.597 1.00 . A A . 13 ASP CA 1 1 9 3723 1 1 13 ASP CB C 2.429 6.861 -0.411 1.00 . A A . 13 ASP CB 1 1 9 3724 1 1 13 ASP CG C 3.551 6.942 0.606 1.00 . A A . 13 ASP CG 1 1 9 3725 1 1 13 ASP H H 4.544 7.112 -1.809 1.00 . A A . 13 ASP H 1 1 9 3726 1 1 13 ASP HA H 2.873 4.951 -1.251 1.00 . A A . 13 ASP HA 1 1 9 3727 1 1 13 ASP HB2 H 2.219 7.855 -0.768 1.00 . A A . 13 ASP HB2 1 1 9 3728 1 1 13 ASP HB3 H 1.553 6.469 0.080 1.00 . A A . 13 ASP HB3 1 1 9 3729 1 1 13 ASP N N 4.065 6.341 -2.172 1.00 . A A . 13 ASP N 1 1 9 3730 1 1 13 ASP O O 0.750 5.193 -2.608 1.00 . A A . 13 ASP O 1 1 9 3731 1 1 13 ASP OD1 O 4.705 7.196 0.199 1.00 . A A . 13 ASP OD1 1 1 9 3732 1 1 13 ASP OD2 O 3.276 6.753 1.810 1.00 . A A . 13 ASP OD2 1 1 9 3733 1 1 14 SER C C 0.585 5.811 -5.387 1.00 . A A . 14 SER C 1 1 9 3734 1 1 14 SER CA C 0.778 7.114 -4.615 1.00 . A A . 14 SER CA 1 1 9 3735 1 1 14 SER CB C 1.196 8.230 -5.574 1.00 . A A . 14 SER CB 1 1 9 3736 1 1 14 SER H H 2.532 7.575 -3.525 1.00 . A A . 14 SER H 1 1 9 3737 1 1 14 SER HA H -0.159 7.385 -4.151 1.00 . A A . 14 SER HA 1 1 9 3738 1 1 14 SER HB2 H 1.914 8.871 -5.085 1.00 . A A . 14 SER HB2 1 1 9 3739 1 1 14 SER HB3 H 1.643 7.795 -6.455 1.00 . A A . 14 SER HB3 1 1 9 3740 1 1 14 SER N N 1.769 6.959 -3.557 1.00 . A A . 14 SER N 1 1 9 3741 1 1 14 SER O O -0.516 5.508 -5.847 1.00 . A A . 14 SER O 1 1 9 3742 1 1 14 SER OG O 0.079 9.011 -5.965 1.00 . A A . 14 SER OG 1 1 9 3743 1 1 15 ASP C C 0.504 2.876 -5.755 1.00 . A A . 15 ASP C 1 1 9 3744 1 1 15 ASP CA C 1.620 3.785 -6.265 1.00 . A A . 15 ASP CA 1 1 9 3745 1 1 15 ASP CB C 2.963 3.060 -6.165 1.00 . A A . 15 ASP CB 1 1 9 3746 1 1 15 ASP CG C 3.890 3.396 -7.317 1.00 . A A . 15 ASP CG 1 1 9 3747 1 1 15 ASP H H 2.518 5.345 -5.150 1.00 . A A . 15 ASP H 1 1 9 3748 1 1 15 ASP HA H 1.428 4.014 -7.303 1.00 . A A . 15 ASP HA 1 1 9 3749 1 1 15 ASP HB2 H 3.449 3.340 -5.244 1.00 . A A . 15 ASP HB2 1 1 9 3750 1 1 15 ASP HB3 H 2.791 1.994 -6.165 1.00 . A A . 15 ASP HB3 1 1 9 3751 1 1 15 ASP N N 1.666 5.049 -5.536 1.00 . A A . 15 ASP N 1 1 9 3752 1 1 15 ASP O O -0.094 2.126 -6.527 1.00 . A A . 15 ASP O 1 1 9 3753 1 1 15 ASP OD1 O 3.555 3.049 -8.469 1.00 . A A . 15 ASP OD1 1 1 9 3754 1 1 15 ASP OD2 O 4.951 4.007 -7.068 1.00 . A A . 15 ASP OD2 1 1 9 3755 1 1 16 CYS C C -2.094 2.158 -4.644 1.00 . A A . 16 CYS C 1 1 9 3756 1 1 16 CYS CA C -0.796 2.093 -3.849 1.00 . A A . 16 CYS CA 1 1 9 3757 1 1 16 CYS CB C -1.046 2.491 -2.391 1.00 . A A . 16 CYS CB 1 1 9 3758 1 1 16 CYS H H 0.755 3.539 -3.882 1.00 . A A . 16 CYS H 1 1 9 3759 1 1 16 CYS HA H -0.436 1.075 -3.871 1.00 . A A . 16 CYS HA 1 1 9 3760 1 1 16 CYS HB2 H -0.148 2.901 -1.983 1.00 . A A . 16 CYS HB2 1 1 9 3761 1 1 16 CYS HB3 H -1.815 3.244 -2.352 1.00 . A A . 16 CYS HB3 1 1 9 3762 1 1 16 CYS N N 0.237 2.932 -4.452 1.00 . A A . 16 CYS N 1 1 9 3763 1 1 16 CYS O O -2.227 2.944 -5.582 1.00 . A A . 16 CYS O 1 1 9 3764 1 1 16 CYS SG S -1.552 1.111 -1.308 1.00 . A A . 16 CYS SG 1 1 9 3765 1 1 17 LEU C C -5.464 1.654 -4.006 1.00 . A A . 17 LEU C 1 1 9 3766 1 1 17 LEU CA C -4.331 1.256 -4.943 1.00 . A A . 17 LEU CA 1 1 9 3767 1 1 17 LEU CB C -4.577 -0.154 -5.484 1.00 . A A . 17 LEU CB 1 1 9 3768 1 1 17 LEU CD1 C -5.983 -1.652 -4.046 1.00 . A A . 17 LEU CD1 1 1 9 3769 1 1 17 LEU CD2 C -3.797 -2.475 -4.938 1.00 . A A . 17 LEU CD2 1 1 9 3770 1 1 17 LEU CG C -4.564 -1.264 -4.430 1.00 . A A . 17 LEU CG 1 1 9 3771 1 1 17 LEU H H -2.863 0.713 -3.511 1.00 . A A . 17 LEU H 1 1 9 3772 1 1 17 LEU HA H -4.303 1.948 -5.769 1.00 . A A . 17 LEU HA 1 1 9 3773 1 1 17 LEU HB2 H -5.537 -0.164 -5.978 1.00 . A A . 17 LEU HB2 1 1 9 3774 1 1 17 LEU HB3 H -3.813 -0.373 -6.215 1.00 . A A . 17 LEU HB3 1 1 9 3775 1 1 17 LEU HD11 H -6.637 -1.513 -4.894 1.00 . A A . 17 LEU HD11 1 1 9 3776 1 1 17 LEU HD12 H -6.003 -2.688 -3.740 1.00 . A A . 17 LEU HD12 1 1 9 3777 1 1 17 LEU HD13 H -6.318 -1.030 -3.229 1.00 . A A . 17 LEU HD13 1 1 9 3778 1 1 17 LEU HD21 H -3.005 -2.150 -5.595 1.00 . A A . 17 LEU HD21 1 1 9 3779 1 1 17 LEU HD22 H -3.373 -3.010 -4.100 1.00 . A A . 17 LEU HD22 1 1 9 3780 1 1 17 LEU HD23 H -4.469 -3.126 -5.478 1.00 . A A . 17 LEU HD23 1 1 9 3781 1 1 17 LEU HG H -4.066 -0.900 -3.541 1.00 . A A . 17 LEU HG 1 1 9 3782 1 1 17 LEU N N -3.040 1.315 -4.264 1.00 . A A . 17 LEU N 1 1 9 3783 1 1 17 LEU O O -5.268 1.792 -2.798 1.00 . A A . 17 LEU O 1 1 9 3784 1 1 18 ALA C C -7.516 3.461 -2.934 1.00 . A A . 18 ALA C 1 1 9 3785 1 1 18 ALA CA C -7.821 2.226 -3.790 1.00 . A A . 18 ALA CA 1 1 9 3786 1 1 18 ALA CB C -8.286 1.052 -2.938 1.00 . A A . 18 ALA CB 1 1 9 3787 1 1 18 ALA H H -6.746 1.717 -5.540 1.00 . A A . 18 ALA H 1 1 9 3788 1 1 18 ALA HA H -8.614 2.473 -4.482 1.00 . A A . 18 ALA HA 1 1 9 3789 1 1 18 ALA HB1 H -8.459 0.194 -3.571 1.00 . A A . 18 ALA HB1 1 1 9 3790 1 1 18 ALA HB2 H -9.201 1.317 -2.429 1.00 . A A . 18 ALA HB2 1 1 9 3791 1 1 18 ALA HB3 H -7.525 0.814 -2.209 1.00 . A A . 18 ALA HB3 1 1 9 3792 1 1 18 ALA N N -6.653 1.841 -4.572 1.00 . A A . 18 ALA N 1 1 9 3793 1 1 18 ALA O O -7.089 4.489 -3.458 1.00 . A A . 18 ALA O 1 1 9 3794 1 1 19 GLU C C -6.448 4.086 0.342 1.00 . A A . 19 GLU C 1 1 9 3795 1 1 19 GLU CA C -7.465 4.478 -0.726 1.00 . A A . 19 GLU CA 1 1 9 3796 1 1 19 GLU CB C -8.764 4.947 -0.067 1.00 . A A . 19 GLU CB 1 1 9 3797 1 1 19 GLU CD C -10.240 6.919 0.492 1.00 . A A . 19 GLU CD 1 1 9 3798 1 1 19 GLU CG C -8.850 6.455 0.103 1.00 . A A . 19 GLU CG 1 1 9 3799 1 1 19 GLU H H -8.067 2.522 -1.250 1.00 . A A . 19 GLU H 1 1 9 3800 1 1 19 GLU HA H -7.058 5.287 -1.313 1.00 . A A . 19 GLU HA 1 1 9 3801 1 1 19 GLU HB2 H -9.598 4.626 -0.674 1.00 . A A . 19 GLU HB2 1 1 9 3802 1 1 19 GLU HB3 H -8.845 4.490 0.909 1.00 . A A . 19 GLU HB3 1 1 9 3803 1 1 19 GLU HG2 H -8.158 6.757 0.875 1.00 . A A . 19 GLU HG2 1 1 9 3804 1 1 19 GLU HG3 H -8.577 6.925 -0.830 1.00 . A A . 19 GLU HG3 1 1 9 3805 1 1 19 GLU N N -7.729 3.361 -1.623 1.00 . A A . 19 GLU N 1 1 9 3806 1 1 19 GLU O O -6.707 4.216 1.539 1.00 . A A . 19 GLU O 1 1 9 3807 1 1 19 GLU OE1 O -11.199 6.604 -0.245 1.00 . A A . 19 GLU OE1 1 1 9 3808 1 1 19 GLU OE2 O -10.371 7.596 1.533 1.00 . A A . 19 GLU OE2 1 1 9 3809 1 1 20 CYS C C -2.904 3.805 0.386 1.00 . A A . 20 CYS C 1 1 9 3810 1 1 20 CYS CA C -4.233 3.211 0.824 1.00 . A A . 20 CYS CA 1 1 9 3811 1 1 20 CYS CB C -4.136 1.686 0.897 1.00 . A A . 20 CYS CB 1 1 9 3812 1 1 20 CYS H H -5.123 3.534 -1.062 1.00 . A A . 20 CYS H 1 1 9 3813 1 1 20 CYS HA H -4.482 3.597 1.802 1.00 . A A . 20 CYS HA 1 1 9 3814 1 1 20 CYS HB2 H -4.563 1.262 0.001 1.00 . A A . 20 CYS HB2 1 1 9 3815 1 1 20 CYS HB3 H -3.095 1.401 0.963 1.00 . A A . 20 CYS HB3 1 1 9 3816 1 1 20 CYS N N -5.284 3.611 -0.097 1.00 . A A . 20 CYS N 1 1 9 3817 1 1 20 CYS O O -2.836 4.515 -0.617 1.00 . A A . 20 CYS O 1 1 9 3818 1 1 20 CYS SG S -5.003 0.957 2.324 1.00 . A A . 20 CYS SG 1 1 9 3819 1 1 21 VAL C C 0.499 2.939 0.676 1.00 . A A . 21 VAL C 1 1 9 3820 1 1 21 VAL CA C -0.537 4.049 0.806 1.00 . A A . 21 VAL CA 1 1 9 3821 1 1 21 VAL CB C -0.056 5.072 1.856 1.00 . A A . 21 VAL CB 1 1 9 3822 1 1 21 VAL CG1 C -1.054 6.213 1.984 1.00 . A A . 21 VAL CG1 1 1 9 3823 1 1 21 VAL CG2 C 0.170 4.401 3.203 1.00 . A A . 21 VAL CG2 1 1 9 3824 1 1 21 VAL H H -1.959 2.957 1.930 1.00 . A A . 21 VAL H 1 1 9 3825 1 1 21 VAL HA H -0.616 4.559 -0.143 1.00 . A A . 21 VAL HA 1 1 9 3826 1 1 21 VAL HB H 0.886 5.487 1.520 1.00 . A A . 21 VAL HB 1 1 9 3827 1 1 21 VAL HG11 H -2.051 5.810 2.083 1.00 . A A . 21 VAL HG11 1 1 9 3828 1 1 21 VAL HG12 H -0.816 6.804 2.855 1.00 . A A . 21 VAL HG12 1 1 9 3829 1 1 21 VAL HG13 H -1.004 6.836 1.103 1.00 . A A . 21 VAL HG13 1 1 9 3830 1 1 21 VAL HG21 H 0.811 3.542 3.075 1.00 . A A . 21 VAL HG21 1 1 9 3831 1 1 21 VAL HG22 H 0.637 5.101 3.881 1.00 . A A . 21 VAL HG22 1 1 9 3832 1 1 21 VAL HG23 H -0.779 4.084 3.611 1.00 . A A . 21 VAL HG23 1 1 9 3833 1 1 21 VAL N N -1.851 3.524 1.137 1.00 . A A . 21 VAL N 1 1 9 3834 1 1 21 VAL O O 0.313 1.828 1.172 1.00 . A A . 21 VAL O 1 1 9 3835 1 1 22 CYS C C 3.805 2.594 0.794 1.00 . A A . 22 CYS C 1 1 9 3836 1 1 22 CYS CA C 2.690 2.330 -0.213 1.00 . A A . 22 CYS CA 1 1 9 3837 1 1 22 CYS CB C 3.232 2.464 -1.644 1.00 . A A . 22 CYS CB 1 1 9 3838 1 1 22 CYS H H 1.657 4.169 -0.355 1.00 . A A . 22 CYS H 1 1 9 3839 1 1 22 CYS HA H 2.313 1.330 -0.067 1.00 . A A . 22 CYS HA 1 1 9 3840 1 1 22 CYS HB2 H 3.240 3.503 -1.921 1.00 . A A . 22 CYS HB2 1 1 9 3841 1 1 22 CYS HB3 H 4.238 2.087 -1.683 1.00 . A A . 22 CYS HB3 1 1 9 3842 1 1 22 CYS N N 1.590 3.267 0.004 1.00 . A A . 22 CYS N 1 1 9 3843 1 1 22 CYS O O 4.189 3.741 1.020 1.00 . A A . 22 CYS O 1 1 9 3844 1 1 22 CYS SG S 2.255 1.575 -2.897 1.00 . A A . 22 CYS SG 1 1 9 3845 1 1 23 LEU C C 6.732 1.338 1.812 1.00 . A A . 23 LEU C 1 1 9 3846 1 1 23 LEU CA C 5.363 1.654 2.406 1.00 . A A . 23 LEU CA 1 1 9 3847 1 1 23 LEU CB C 5.073 0.734 3.592 1.00 . A A . 23 LEU CB 1 1 9 3848 1 1 23 LEU CD1 C 3.229 -0.544 4.718 1.00 . A A . 23 LEU CD1 1 1 9 3849 1 1 23 LEU CD2 C 3.477 1.909 5.128 1.00 . A A . 23 LEU CD2 1 1 9 3850 1 1 23 LEU CG C 3.634 0.789 4.110 1.00 . A A . 23 LEU CG 1 1 9 3851 1 1 23 LEU H H 3.951 0.641 1.196 1.00 . A A . 23 LEU H 1 1 9 3852 1 1 23 LEU HA H 5.367 2.676 2.754 1.00 . A A . 23 LEU HA 1 1 9 3853 1 1 23 LEU HB2 H 5.291 -0.282 3.296 1.00 . A A . 23 LEU HB2 1 1 9 3854 1 1 23 LEU HB3 H 5.734 1.006 4.401 1.00 . A A . 23 LEU HB3 1 1 9 3855 1 1 23 LEU HD11 H 3.596 -1.348 4.096 1.00 . A A . 23 LEU HD11 1 1 9 3856 1 1 23 LEU HD12 H 3.652 -0.632 5.707 1.00 . A A . 23 LEU HD12 1 1 9 3857 1 1 23 LEU HD13 H 2.153 -0.600 4.779 1.00 . A A . 23 LEU HD13 1 1 9 3858 1 1 23 LEU HD21 H 4.167 1.752 5.944 1.00 . A A . 23 LEU HD21 1 1 9 3859 1 1 23 LEU HD22 H 3.686 2.857 4.656 1.00 . A A . 23 LEU HD22 1 1 9 3860 1 1 23 LEU HD23 H 2.465 1.910 5.509 1.00 . A A . 23 LEU HD23 1 1 9 3861 1 1 23 LEU HG H 2.969 0.994 3.283 1.00 . A A . 23 LEU HG 1 1 9 3862 1 1 23 LEU N N 4.307 1.530 1.409 1.00 . A A . 23 LEU N 1 1 9 3863 1 1 23 LEU O O 6.863 0.475 0.943 1.00 . A A . 23 LEU O 1 1 9 3864 1 1 24 GLU C C 9.586 0.440 1.933 1.00 . A A . 24 GLU C 1 1 9 3865 1 1 24 GLU CA C 9.114 1.886 1.809 1.00 . A A . 24 GLU CA 1 1 9 3866 1 1 24 GLU CB C 10.060 2.805 2.586 1.00 . A A . 24 GLU CB 1 1 9 3867 1 1 24 GLU CD C 10.876 3.593 4.841 1.00 . A A . 24 GLU CD 1 1 9 3868 1 1 24 GLU CG C 9.965 2.640 4.094 1.00 . A A . 24 GLU CG 1 1 9 3869 1 1 24 GLU H H 7.564 2.735 2.972 1.00 . A A . 24 GLU H 1 1 9 3870 1 1 24 GLU HA H 9.136 2.168 0.768 1.00 . A A . 24 GLU HA 1 1 9 3871 1 1 24 GLU HB2 H 11.075 2.593 2.285 1.00 . A A . 24 GLU HB2 1 1 9 3872 1 1 24 GLU HB3 H 9.828 3.831 2.341 1.00 . A A . 24 GLU HB3 1 1 9 3873 1 1 24 GLU HG2 H 8.947 2.827 4.401 1.00 . A A . 24 GLU HG2 1 1 9 3874 1 1 24 GLU HG3 H 10.238 1.627 4.351 1.00 . A A . 24 GLU HG3 1 1 9 3875 1 1 24 GLU N N 7.745 2.058 2.286 1.00 . A A . 24 GLU N 1 1 9 3876 1 1 24 GLU O O 10.181 -0.105 1.003 1.00 . A A . 24 GLU O 1 1 9 3877 1 1 24 GLU OE1 O 11.262 4.628 4.257 1.00 . A A . 24 GLU OE1 1 1 9 3878 1 1 24 GLU OE2 O 11.205 3.305 6.011 1.00 . A A . 24 GLU OE2 1 1 9 3879 1 1 25 HIS C C 9.184 -2.477 2.223 1.00 . A A . 25 HIS C 1 1 9 3880 1 1 25 HIS CA C 9.749 -1.561 3.303 1.00 . A A . 25 HIS CA 1 1 9 3881 1 1 25 HIS CB C 9.331 -2.048 4.693 1.00 . A A . 25 HIS CB 1 1 9 3882 1 1 25 HIS CD2 C 6.788 -2.551 4.656 1.00 . A A . 25 HIS CD2 1 1 9 3883 1 1 25 HIS CE1 C 6.118 -0.897 5.926 1.00 . A A . 25 HIS CE1 1 1 9 3884 1 1 25 HIS CG C 7.884 -1.840 5.010 1.00 . A A . 25 HIS CG 1 1 9 3885 1 1 25 HIS H H 8.856 0.297 3.792 1.00 . A A . 25 HIS H 1 1 9 3886 1 1 25 HIS HA H 10.826 -1.585 3.237 1.00 . A A . 25 HIS HA 1 1 9 3887 1 1 25 HIS HB2 H 9.535 -3.105 4.769 1.00 . A A . 25 HIS HB2 1 1 9 3888 1 1 25 HIS HB3 H 9.913 -1.523 5.436 1.00 . A A . 25 HIS HB3 1 1 9 3889 1 1 25 HIS HD1 H 7.986 -0.116 6.215 1.00 . A A . 25 HIS HD1 1 1 9 3890 1 1 25 HIS HD2 H 6.771 -3.430 4.027 1.00 . A A . 25 HIS HD2 1 1 9 3891 1 1 25 HIS HE1 H 5.490 -0.223 6.491 1.00 . A A . 25 HIS HE1 1 1 9 3892 1 1 25 HIS HE2 H 4.810 -2.345 5.319 1.00 . A A . 25 HIS HE2 1 1 9 3893 1 1 25 HIS N N 9.329 -0.181 3.082 1.00 . A A . 25 HIS N 1 1 9 3894 1 1 25 HIS ND1 N 7.429 -0.809 5.802 1.00 . A A . 25 HIS ND1 1 1 9 3895 1 1 25 HIS NE2 N 5.701 -1.945 5.239 1.00 . A A . 25 HIS NE2 1 1 9 3896 1 1 25 HIS O O 9.741 -3.540 1.945 1.00 . A A . 25 HIS O 1 1 9 3897 1 1 26 GLY C C 6.153 -3.441 0.928 1.00 . A A . 26 GLY C 1 1 9 3898 1 1 26 GLY CA C 7.488 -2.835 0.544 1.00 . A A . 26 GLY CA 1 1 9 3899 1 1 26 GLY H H 7.697 -1.189 1.853 1.00 . A A . 26 GLY H 1 1 9 3900 1 1 26 GLY HA2 H 8.167 -3.632 0.274 1.00 . A A . 26 GLY HA2 1 1 9 3901 1 1 26 GLY HA3 H 7.344 -2.197 -0.312 1.00 . A A . 26 GLY HA3 1 1 9 3902 1 1 26 GLY N N 8.089 -2.050 1.602 1.00 . A A . 26 GLY N 1 1 9 3903 1 1 26 GLY O O 6.023 -4.661 1.006 1.00 . A A . 26 GLY O 1 1 9 3904 1 1 27 TYR C C 2.810 -1.902 1.433 1.00 . A A . 27 TYR C 1 1 9 3905 1 1 27 TYR CA C 3.817 -3.048 1.515 1.00 . A A . 27 TYR CA 1 1 9 3906 1 1 27 TYR CB C 3.811 -3.638 2.927 1.00 . A A . 27 TYR CB 1 1 9 3907 1 1 27 TYR CD1 C 3.919 -6.012 2.065 1.00 . A A . 27 TYR CD1 1 1 9 3908 1 1 27 TYR CD2 C 5.173 -5.462 4.017 1.00 . A A . 27 TYR CD2 1 1 9 3909 1 1 27 TYR CE1 C 4.374 -7.314 2.134 1.00 . A A . 27 TYR CE1 1 1 9 3910 1 1 27 TYR CE2 C 5.633 -6.763 4.091 1.00 . A A . 27 TYR CE2 1 1 9 3911 1 1 27 TYR CG C 4.309 -5.063 3.004 1.00 . A A . 27 TYR CG 1 1 9 3912 1 1 27 TYR CZ C 5.231 -7.684 3.150 1.00 . A A . 27 TYR CZ 1 1 9 3913 1 1 27 TYR H H 5.322 -1.626 1.060 1.00 . A A . 27 TYR H 1 1 9 3914 1 1 27 TYR HA H 3.528 -3.815 0.813 1.00 . A A . 27 TYR HA 1 1 9 3915 1 1 27 TYR HB2 H 4.444 -3.037 3.556 1.00 . A A . 27 TYR HB2 1 1 9 3916 1 1 27 TYR HB3 H 2.803 -3.615 3.314 1.00 . A A . 27 TYR HB3 1 1 9 3917 1 1 27 TYR HD1 H 3.247 -5.718 1.271 1.00 . A A . 27 TYR HD1 1 1 9 3918 1 1 27 TYR HD2 H 5.485 -4.739 4.754 1.00 . A A . 27 TYR HD2 1 1 9 3919 1 1 27 TYR HE1 H 4.060 -8.036 1.396 1.00 . A A . 27 TYR HE1 1 1 9 3920 1 1 27 TYR HE2 H 6.304 -7.052 4.887 1.00 . A A . 27 TYR HE2 1 1 9 3921 1 1 27 TYR HH H 6.559 -9.036 2.822 1.00 . A A . 27 TYR HH 1 1 9 3922 1 1 27 TYR N N 5.156 -2.588 1.151 1.00 . A A . 27 TYR N 1 1 9 3923 1 1 27 TYR O O 3.147 -0.747 1.690 1.00 . A A . 27 TYR O 1 1 9 3924 1 1 27 TYR OH O 5.688 -8.980 3.221 1.00 . A A . 27 TYR OH 1 1 9 3925 1 1 28 CYS C C -0.359 -1.222 2.215 1.00 . A A . 28 CYS C 1 1 9 3926 1 1 28 CYS CA C 0.514 -1.227 0.964 1.00 . A A . 28 CYS CA 1 1 9 3927 1 1 28 CYS CB C -0.355 -1.498 -0.270 1.00 . A A . 28 CYS CB 1 1 9 3928 1 1 28 CYS H H 1.365 -3.167 0.880 1.00 . A A . 28 CYS H 1 1 9 3929 1 1 28 CYS HA H 0.983 -0.260 0.859 1.00 . A A . 28 CYS HA 1 1 9 3930 1 1 28 CYS HB2 H -0.121 -2.478 -0.655 1.00 . A A . 28 CYS HB2 1 1 9 3931 1 1 28 CYS HB3 H -1.397 -1.472 0.019 1.00 . A A . 28 CYS HB3 1 1 9 3932 1 1 28 CYS N N 1.572 -2.231 1.075 1.00 . A A . 28 CYS N 1 1 9 3933 1 1 28 CYS O O -1.040 -2.203 2.514 1.00 . A A . 28 CYS O 1 1 9 3934 1 1 28 CYS SG S -0.127 -0.303 -1.627 1.00 . A A . 28 CYS SG 1 1 9 3935 1 1 29 GLY C C -1.165 1.421 4.689 1.00 . A A . 29 GLY C 1 1 9 3936 1 1 29 GLY CA C -1.122 0.003 4.155 1.00 . A A . 29 GLY CA 1 1 9 3937 1 1 29 GLY H H 0.231 0.640 2.656 1.00 . A A . 29 GLY H 1 1 9 3938 1 1 29 GLY HA2 H -0.697 -0.641 4.910 1.00 . A A . 29 GLY HA2 1 1 9 3939 1 1 29 GLY HA3 H -2.129 -0.321 3.945 1.00 . A A . 29 GLY HA3 1 1 9 3940 1 1 29 GLY N N -0.331 -0.110 2.944 1.00 . A A . 29 GLY N 1 1 9 3941 1 1 29 GLY O O -1.940 2.237 4.147 1.00 . A A . 29 GLY O 1 1 9 3942 1 1 29 GLY OXT O -0.425 1.716 5.651 1.00 . A A . 29 GLY OXT 1 1 10 3943 1 1 1 ARG C C -9.279 2.045 3.687 1.00 . A A . 1 ARG C 1 1 10 3944 1 1 1 ARG CA C -8.568 3.338 4.073 1.00 . A A . 1 ARG CA 1 1 10 3945 1 1 1 ARG CB C -7.830 3.160 5.402 1.00 . A A . 1 ARG CB 1 1 10 3946 1 1 1 ARG CD C -8.202 5.072 6.989 1.00 . A A . 1 ARG CD 1 1 10 3947 1 1 1 ARG CG C -7.266 4.455 5.962 1.00 . A A . 1 ARG CG 1 1 10 3948 1 1 1 ARG CZ C -8.878 4.615 9.314 1.00 . A A . 1 ARG CZ 1 1 10 3949 1 1 1 ARG H1 H -10.084 4.517 3.336 1.00 . A A . 1 ARG H1 1 1 10 3950 1 1 1 ARG H2 H -10.147 4.249 5.028 1.00 . A A . 1 ARG H2 1 1 10 3951 1 1 1 ARG H3 H -8.985 5.331 4.373 1.00 . A A . 1 ARG H3 1 1 10 3952 1 1 1 ARG HA H -7.856 3.592 3.302 1.00 . A A . 1 ARG HA 1 1 10 3953 1 1 1 ARG HB2 H -8.515 2.747 6.128 1.00 . A A . 1 ARG HB2 1 1 10 3954 1 1 1 ARG HB3 H -7.012 2.470 5.257 1.00 . A A . 1 ARG HB3 1 1 10 3955 1 1 1 ARG HD2 H -8.028 6.138 7.021 1.00 . A A . 1 ARG HD2 1 1 10 3956 1 1 1 ARG HD3 H -9.222 4.883 6.686 1.00 . A A . 1 ARG HD3 1 1 10 3957 1 1 1 ARG HE H -7.149 4.049 8.493 1.00 . A A . 1 ARG HE 1 1 10 3958 1 1 1 ARG HG2 H -6.317 4.248 6.435 1.00 . A A . 1 ARG HG2 1 1 10 3959 1 1 1 ARG HG3 H -7.121 5.155 5.152 1.00 . A A . 1 ARG HG3 1 1 10 3960 1 1 1 ARG HH11 H -10.242 5.645 8.232 1.00 . A A . 1 ARG HH11 1 1 10 3961 1 1 1 ARG HH12 H -10.693 5.310 9.870 1.00 . A A . 1 ARG HH12 1 1 10 3962 1 1 1 ARG HH21 H -7.741 3.608 10.648 1.00 . A A . 1 ARG HH21 1 1 10 3963 1 1 1 ARG HH22 H -9.273 4.154 11.242 1.00 . A A . 1 ARG HH22 1 1 10 3964 1 1 1 ARG N N -9.533 4.459 4.215 1.00 . A A . 1 ARG N 1 1 10 3965 1 1 1 ARG NE N -7.994 4.519 8.324 1.00 . A A . 1 ARG NE 1 1 10 3966 1 1 1 ARG NH1 N -10.032 5.242 9.122 1.00 . A A . 1 ARG NH1 1 1 10 3967 1 1 1 ARG NH2 N -8.609 4.083 10.498 1.00 . A A . 1 ARG NH2 1 1 10 3968 1 1 1 ARG O O -9.153 1.026 4.367 1.00 . A A . 1 ARG O 1 1 10 3969 1 1 2 VAL C C -10.050 0.278 0.929 1.00 . A A . 2 VAL C 1 1 10 3970 1 1 2 VAL CA C -10.759 0.925 2.113 1.00 . A A . 2 VAL CA 1 1 10 3971 1 1 2 VAL CB C -12.196 1.293 1.701 1.00 . A A . 2 VAL CB 1 1 10 3972 1 1 2 VAL CG1 C -13.045 1.591 2.928 1.00 . A A . 2 VAL CG1 1 1 10 3973 1 1 2 VAL CG2 C -12.192 2.476 0.746 1.00 . A A . 2 VAL CG2 1 1 10 3974 1 1 2 VAL H H -10.089 2.933 2.089 1.00 . A A . 2 VAL H 1 1 10 3975 1 1 2 VAL HA H -10.810 0.211 2.922 1.00 . A A . 2 VAL HA 1 1 10 3976 1 1 2 VAL HB H -12.630 0.445 1.189 1.00 . A A . 2 VAL HB 1 1 10 3977 1 1 2 VAL HG11 H -12.610 1.110 3.792 1.00 . A A . 2 VAL HG11 1 1 10 3978 1 1 2 VAL HG12 H -13.081 2.657 3.089 1.00 . A A . 2 VAL HG12 1 1 10 3979 1 1 2 VAL HG13 H -14.045 1.214 2.774 1.00 . A A . 2 VAL HG13 1 1 10 3980 1 1 2 VAL HG21 H -11.223 2.556 0.277 1.00 . A A . 2 VAL HG21 1 1 10 3981 1 1 2 VAL HG22 H -12.947 2.330 -0.012 1.00 . A A . 2 VAL HG22 1 1 10 3982 1 1 2 VAL HG23 H -12.403 3.382 1.294 1.00 . A A . 2 VAL HG23 1 1 10 3983 1 1 2 VAL N N -10.027 2.093 2.589 1.00 . A A . 2 VAL N 1 1 10 3984 1 1 2 VAL O O -10.457 0.450 -0.222 1.00 . A A . 2 VAL O 1 1 10 3985 1 1 3 CYS C C -7.973 -2.604 0.544 1.00 . A A . 3 CYS C 1 1 10 3986 1 1 3 CYS CA C -8.224 -1.144 0.173 1.00 . A A . 3 CYS CA 1 1 10 3987 1 1 3 CYS CB C -6.893 -0.422 -0.065 1.00 . A A . 3 CYS CB 1 1 10 3988 1 1 3 CYS H H -8.713 -0.568 2.151 1.00 . A A . 3 CYS H 1 1 10 3989 1 1 3 CYS HA H -8.807 -1.109 -0.734 1.00 . A A . 3 CYS HA 1 1 10 3990 1 1 3 CYS HB2 H -6.470 -0.764 -0.997 1.00 . A A . 3 CYS HB2 1 1 10 3991 1 1 3 CYS HB3 H -7.077 0.641 -0.131 1.00 . A A . 3 CYS HB3 1 1 10 3992 1 1 3 CYS N N -8.988 -0.468 1.216 1.00 . A A . 3 CYS N 1 1 10 3993 1 1 3 CYS O O -7.519 -2.899 1.650 1.00 . A A . 3 CYS O 1 1 10 3994 1 1 3 CYS SG S -5.644 -0.689 1.237 1.00 . A A . 3 CYS SG 1 1 10 3995 1 1 4 PRO C C -6.711 -5.268 0.523 1.00 . A A . 4 PRO C 1 1 10 3996 1 1 4 PRO CA C -8.057 -4.975 -0.130 1.00 . A A . 4 PRO CA 1 1 10 3997 1 1 4 PRO CB C -8.113 -5.574 -1.532 1.00 . A A . 4 PRO CB 1 1 10 3998 1 1 4 PRO CD C -8.802 -3.290 -1.725 1.00 . A A . 4 PRO CD 1 1 10 3999 1 1 4 PRO CG C -9.024 -4.670 -2.286 1.00 . A A . 4 PRO CG 1 1 10 4000 1 1 4 PRO HA H -8.849 -5.390 0.476 1.00 . A A . 4 PRO HA 1 1 10 4001 1 1 4 PRO HB2 H -7.122 -5.588 -1.962 1.00 . A A . 4 PRO HB2 1 1 10 4002 1 1 4 PRO HB3 H -8.505 -6.579 -1.483 1.00 . A A . 4 PRO HB3 1 1 10 4003 1 1 4 PRO HD2 H -8.090 -2.747 -2.329 1.00 . A A . 4 PRO HD2 1 1 10 4004 1 1 4 PRO HD3 H -9.737 -2.751 -1.669 1.00 . A A . 4 PRO HD3 1 1 10 4005 1 1 4 PRO HG2 H -8.775 -4.691 -3.337 1.00 . A A . 4 PRO HG2 1 1 10 4006 1 1 4 PRO HG3 H -10.050 -4.974 -2.137 1.00 . A A . 4 PRO HG3 1 1 10 4007 1 1 4 PRO N N -8.261 -3.545 -0.375 1.00 . A A . 4 PRO N 1 1 10 4008 1 1 4 PRO O O -5.665 -4.863 0.017 1.00 . A A . 4 PRO O 1 1 10 4009 1 1 5 ARG C C -4.652 -7.252 1.538 1.00 . A A . 5 ARG C 1 1 10 4010 1 1 5 ARG CA C -5.525 -6.318 2.368 1.00 . A A . 5 ARG CA 1 1 10 4011 1 1 5 ARG CB C -5.866 -6.971 3.709 1.00 . A A . 5 ARG CB 1 1 10 4012 1 1 5 ARG CD C -5.601 -5.652 5.835 1.00 . A A . 5 ARG CD 1 1 10 4013 1 1 5 ARG CG C -4.923 -6.575 4.835 1.00 . A A . 5 ARG CG 1 1 10 4014 1 1 5 ARG CZ C -5.091 -3.371 5.054 1.00 . A A . 5 ARG CZ 1 1 10 4015 1 1 5 ARG H H -7.609 -6.268 2.004 1.00 . A A . 5 ARG H 1 1 10 4016 1 1 5 ARG HA H -4.980 -5.404 2.552 1.00 . A A . 5 ARG HA 1 1 10 4017 1 1 5 ARG HB2 H -6.868 -6.686 3.990 1.00 . A A . 5 ARG HB2 1 1 10 4018 1 1 5 ARG HB3 H -5.825 -8.044 3.595 1.00 . A A . 5 ARG HB3 1 1 10 4019 1 1 5 ARG HD2 H -6.499 -6.131 6.195 1.00 . A A . 5 ARG HD2 1 1 10 4020 1 1 5 ARG HD3 H -4.928 -5.483 6.663 1.00 . A A . 5 ARG HD3 1 1 10 4021 1 1 5 ARG HE H -6.888 -4.236 4.966 1.00 . A A . 5 ARG HE 1 1 10 4022 1 1 5 ARG HG2 H -4.597 -7.468 5.348 1.00 . A A . 5 ARG HG2 1 1 10 4023 1 1 5 ARG HG3 H -4.068 -6.068 4.413 1.00 . A A . 5 ARG HG3 1 1 10 4024 1 1 5 ARG HH11 H -3.507 -4.367 5.821 1.00 . A A . 5 ARG HH11 1 1 10 4025 1 1 5 ARG HH12 H -3.176 -2.760 5.266 1.00 . A A . 5 ARG HH12 1 1 10 4026 1 1 5 ARG HH21 H -6.455 -2.123 4.237 1.00 . A A . 5 ARG HH21 1 1 10 4027 1 1 5 ARG HH22 H -4.849 -1.485 4.368 1.00 . A A . 5 ARG HH22 1 1 10 4028 1 1 5 ARG N N -6.745 -5.973 1.648 1.00 . A A . 5 ARG N 1 1 10 4029 1 1 5 ARG NE N -5.956 -4.366 5.241 1.00 . A A . 5 ARG NE 1 1 10 4030 1 1 5 ARG NH1 N -3.821 -3.511 5.410 1.00 . A A . 5 ARG NH1 1 1 10 4031 1 1 5 ARG NH2 N -5.499 -2.233 4.508 1.00 . A A . 5 ARG NH2 1 1 10 4032 1 1 5 ARG O O -4.642 -8.464 1.753 1.00 . A A . 5 ARG O 1 1 10 4033 1 1 6 ILE C C -1.621 -6.902 -0.258 1.00 . A A . 6 ILE C 1 1 10 4034 1 1 6 ILE CA C -3.041 -7.458 -0.274 1.00 . A A . 6 ILE CA 1 1 10 4035 1 1 6 ILE CB C -3.554 -7.478 -1.727 1.00 . A A . 6 ILE CB 1 1 10 4036 1 1 6 ILE CD1 C -3.340 -5.834 -3.659 1.00 . A A . 6 ILE CD1 1 1 10 4037 1 1 6 ILE CG1 C -3.785 -6.051 -2.229 1.00 . A A . 6 ILE CG1 1 1 10 4038 1 1 6 ILE CG2 C -4.834 -8.295 -1.825 1.00 . A A . 6 ILE CG2 1 1 10 4039 1 1 6 ILE H H -3.971 -5.709 0.467 1.00 . A A . 6 ILE H 1 1 10 4040 1 1 6 ILE HA H -3.024 -8.474 0.094 1.00 . A A . 6 ILE HA 1 1 10 4041 1 1 6 ILE HB H -2.806 -7.952 -2.343 1.00 . A A . 6 ILE HB 1 1 10 4042 1 1 6 ILE HD11 H -3.251 -6.788 -4.157 1.00 . A A . 6 ILE HD11 1 1 10 4043 1 1 6 ILE HD12 H -4.068 -5.226 -4.174 1.00 . A A . 6 ILE HD12 1 1 10 4044 1 1 6 ILE HD13 H -2.383 -5.334 -3.666 1.00 . A A . 6 ILE HD13 1 1 10 4045 1 1 6 ILE HG12 H -4.840 -5.823 -2.173 1.00 . A A . 6 ILE HG12 1 1 10 4046 1 1 6 ILE HG13 H -3.238 -5.363 -1.602 1.00 . A A . 6 ILE HG13 1 1 10 4047 1 1 6 ILE HG21 H -4.888 -8.983 -0.995 1.00 . A A . 6 ILE HG21 1 1 10 4048 1 1 6 ILE HG22 H -5.687 -7.632 -1.800 1.00 . A A . 6 ILE HG22 1 1 10 4049 1 1 6 ILE HG23 H -4.838 -8.849 -2.752 1.00 . A A . 6 ILE HG23 1 1 10 4050 1 1 6 ILE N N -3.919 -6.679 0.589 1.00 . A A . 6 ILE N 1 1 10 4051 1 1 6 ILE O O -1.418 -5.690 -0.337 1.00 . A A . 6 ILE O 1 1 10 4052 1 1 7 LEU C C 1.129 -6.622 -1.388 1.00 . A A . 7 LEU C 1 1 10 4053 1 1 7 LEU CA C 0.759 -7.394 -0.125 1.00 . A A . 7 LEU CA 1 1 10 4054 1 1 7 LEU CB C 1.659 -8.623 0.017 1.00 . A A . 7 LEU CB 1 1 10 4055 1 1 7 LEU CD1 C 2.334 -10.673 1.292 1.00 . A A . 7 LEU CD1 1 1 10 4056 1 1 7 LEU CD2 C 1.672 -8.596 2.525 1.00 . A A . 7 LEU CD2 1 1 10 4057 1 1 7 LEU CG C 1.433 -9.447 1.286 1.00 . A A . 7 LEU CG 1 1 10 4058 1 1 7 LEU H H -0.868 -8.747 -0.093 1.00 . A A . 7 LEU H 1 1 10 4059 1 1 7 LEU HA H 0.904 -6.751 0.731 1.00 . A A . 7 LEU HA 1 1 10 4060 1 1 7 LEU HB2 H 1.495 -9.263 -0.839 1.00 . A A . 7 LEU HB2 1 1 10 4061 1 1 7 LEU HB3 H 2.687 -8.294 0.006 1.00 . A A . 7 LEU HB3 1 1 10 4062 1 1 7 LEU HD11 H 3.207 -10.482 0.686 1.00 . A A . 7 LEU HD11 1 1 10 4063 1 1 7 LEU HD12 H 2.639 -10.889 2.305 1.00 . A A . 7 LEU HD12 1 1 10 4064 1 1 7 LEU HD13 H 1.795 -11.517 0.890 1.00 . A A . 7 LEU HD13 1 1 10 4065 1 1 7 LEU HD21 H 2.023 -7.617 2.230 1.00 . A A . 7 LEU HD21 1 1 10 4066 1 1 7 LEU HD22 H 0.749 -8.495 3.076 1.00 . A A . 7 LEU HD22 1 1 10 4067 1 1 7 LEU HD23 H 2.415 -9.069 3.152 1.00 . A A . 7 LEU HD23 1 1 10 4068 1 1 7 LEU HG H 0.408 -9.788 1.306 1.00 . A A . 7 LEU HG 1 1 10 4069 1 1 7 LEU N N -0.642 -7.795 -0.153 1.00 . A A . 7 LEU N 1 1 10 4070 1 1 7 LEU O O 0.773 -7.020 -2.497 1.00 . A A . 7 LEU O 1 1 10 4071 1 1 8 LEU C C 3.399 -3.757 -1.940 1.00 . A A . 8 LEU C 1 1 10 4072 1 1 8 LEU CA C 2.265 -4.693 -2.342 1.00 . A A . 8 LEU CA 1 1 10 4073 1 1 8 LEU CB C 1.083 -3.885 -2.879 1.00 . A A . 8 LEU CB 1 1 10 4074 1 1 8 LEU CD1 C -0.344 -3.549 -4.913 1.00 . A A . 8 LEU CD1 1 1 10 4075 1 1 8 LEU CD2 C 1.888 -2.432 -4.755 1.00 . A A . 8 LEU CD2 1 1 10 4076 1 1 8 LEU CG C 1.080 -3.669 -4.393 1.00 . A A . 8 LEU CG 1 1 10 4077 1 1 8 LEU H H 2.105 -5.249 -0.304 1.00 . A A . 8 LEU H 1 1 10 4078 1 1 8 LEU HA H 2.619 -5.354 -3.120 1.00 . A A . 8 LEU HA 1 1 10 4079 1 1 8 LEU HB2 H 0.170 -4.397 -2.607 1.00 . A A . 8 LEU HB2 1 1 10 4080 1 1 8 LEU HB3 H 1.088 -2.917 -2.399 1.00 . A A . 8 LEU HB3 1 1 10 4081 1 1 8 LEU HD11 H -0.966 -3.095 -4.157 1.00 . A A . 8 LEU HD11 1 1 10 4082 1 1 8 LEU HD12 H -0.351 -2.936 -5.803 1.00 . A A . 8 LEU HD12 1 1 10 4083 1 1 8 LEU HD13 H -0.724 -4.531 -5.151 1.00 . A A . 8 LEU HD13 1 1 10 4084 1 1 8 LEU HD21 H 2.880 -2.514 -4.336 1.00 . A A . 8 LEU HD21 1 1 10 4085 1 1 8 LEU HD22 H 1.956 -2.348 -5.829 1.00 . A A . 8 LEU HD22 1 1 10 4086 1 1 8 LEU HD23 H 1.400 -1.554 -4.356 1.00 . A A . 8 LEU HD23 1 1 10 4087 1 1 8 LEU HG H 1.540 -4.520 -4.872 1.00 . A A . 8 LEU HG 1 1 10 4088 1 1 8 LEU N N 1.848 -5.517 -1.213 1.00 . A A . 8 LEU N 1 1 10 4089 1 1 8 LEU O O 3.226 -2.891 -1.081 1.00 . A A . 8 LEU O 1 1 10 4090 1 1 9 GLU C C 5.910 -2.031 -3.326 1.00 . A A . 9 GLU C 1 1 10 4091 1 1 9 GLU CA C 5.730 -3.122 -2.276 1.00 . A A . 9 GLU CA 1 1 10 4092 1 1 9 GLU CB C 6.983 -3.996 -2.216 1.00 . A A . 9 GLU CB 1 1 10 4093 1 1 9 GLU CD C 8.572 -4.205 -4.170 1.00 . A A . 9 GLU CD 1 1 10 4094 1 1 9 GLU CG C 7.293 -4.705 -3.525 1.00 . A A . 9 GLU CG 1 1 10 4095 1 1 9 GLU H H 4.629 -4.653 -3.237 1.00 . A A . 9 GLU H 1 1 10 4096 1 1 9 GLU HA H 5.579 -2.656 -1.314 1.00 . A A . 9 GLU HA 1 1 10 4097 1 1 9 GLU HB2 H 7.829 -3.377 -1.956 1.00 . A A . 9 GLU HB2 1 1 10 4098 1 1 9 GLU HB3 H 6.848 -4.746 -1.449 1.00 . A A . 9 GLU HB3 1 1 10 4099 1 1 9 GLU HG2 H 7.396 -5.762 -3.332 1.00 . A A . 9 GLU HG2 1 1 10 4100 1 1 9 GLU HG3 H 6.474 -4.543 -4.210 1.00 . A A . 9 GLU HG3 1 1 10 4101 1 1 9 GLU N N 4.559 -3.942 -2.565 1.00 . A A . 9 GLU N 1 1 10 4102 1 1 9 GLU O O 5.874 -2.301 -4.527 1.00 . A A . 9 GLU O 1 1 10 4103 1 1 9 GLU OE1 O 9.646 -4.766 -3.870 1.00 . A A . 9 GLU OE1 1 1 10 4104 1 1 9 GLU OE2 O 8.497 -3.253 -4.975 1.00 . A A . 9 GLU OE2 1 1 10 4105 1 1 10 CYS C C 7.062 1.455 -3.100 1.00 . A A . 10 CYS C 1 1 10 4106 1 1 10 CYS CA C 6.277 0.332 -3.773 1.00 . A A . 10 CYS CA 1 1 10 4107 1 1 10 CYS CB C 4.917 0.857 -4.248 1.00 . A A . 10 CYS CB 1 1 10 4108 1 1 10 CYS H H 6.110 -0.642 -1.899 1.00 . A A . 10 CYS H 1 1 10 4109 1 1 10 CYS HA H 6.835 -0.017 -4.629 1.00 . A A . 10 CYS HA 1 1 10 4110 1 1 10 CYS HB2 H 4.838 1.906 -4.007 1.00 . A A . 10 CYS HB2 1 1 10 4111 1 1 10 CYS HB3 H 4.848 0.734 -5.319 1.00 . A A . 10 CYS HB3 1 1 10 4112 1 1 10 CYS N N 6.099 -0.798 -2.867 1.00 . A A . 10 CYS N 1 1 10 4113 1 1 10 CYS O O 7.138 1.525 -1.874 1.00 . A A . 10 CYS O 1 1 10 4114 1 1 10 CYS SG S 3.482 0.012 -3.500 1.00 . A A . 10 CYS SG 1 1 10 4115 1 1 11 LYS C C 7.499 4.619 -3.027 1.00 . A A . 11 LYS C 1 1 10 4116 1 1 11 LYS CA C 8.415 3.458 -3.401 1.00 . A A . 11 LYS CA 1 1 10 4117 1 1 11 LYS CB C 9.439 3.915 -4.442 1.00 . A A . 11 LYS CB 1 1 10 4118 1 1 11 LYS CD C 11.572 3.434 -5.680 1.00 . A A . 11 LYS CD 1 1 10 4119 1 1 11 LYS CE C 12.306 2.309 -6.392 1.00 . A A . 11 LYS CE 1 1 10 4120 1 1 11 LYS CG C 10.535 2.896 -4.707 1.00 . A A . 11 LYS CG 1 1 10 4121 1 1 11 LYS H H 7.540 2.226 -4.883 1.00 . A A . 11 LYS H 1 1 10 4122 1 1 11 LYS HA H 8.936 3.125 -2.516 1.00 . A A . 11 LYS HA 1 1 10 4123 1 1 11 LYS HB2 H 8.928 4.112 -5.371 1.00 . A A . 11 LYS HB2 1 1 10 4124 1 1 11 LYS HB3 H 9.902 4.828 -4.095 1.00 . A A . 11 LYS HB3 1 1 10 4125 1 1 11 LYS HD2 H 11.077 4.048 -6.416 1.00 . A A . 11 LYS HD2 1 1 10 4126 1 1 11 LYS HD3 H 12.289 4.031 -5.133 1.00 . A A . 11 LYS HD3 1 1 10 4127 1 1 11 LYS HE2 H 13.135 1.992 -5.777 1.00 . A A . 11 LYS HE2 1 1 10 4128 1 1 11 LYS HE3 H 11.625 1.483 -6.530 1.00 . A A . 11 LYS HE3 1 1 10 4129 1 1 11 LYS HG2 H 11.023 2.655 -3.774 1.00 . A A . 11 LYS HG2 1 1 10 4130 1 1 11 LYS HG3 H 10.091 2.005 -5.125 1.00 . A A . 11 LYS HG3 1 1 10 4131 1 1 11 LYS HZ1 H 12.178 3.427 -8.152 1.00 . A A . 11 LYS HZ1 1 1 10 4132 1 1 11 LYS HZ2 H 13.762 3.179 -7.612 1.00 . A A . 11 LYS HZ2 1 1 10 4133 1 1 11 LYS HZ3 H 12.911 1.916 -8.352 1.00 . A A . 11 LYS HZ3 1 1 10 4134 1 1 11 LYS N N 7.639 2.334 -3.914 1.00 . A A . 11 LYS N 1 1 10 4135 1 1 11 LYS NZ N 12.826 2.737 -7.720 1.00 . A A . 11 LYS NZ 1 1 10 4136 1 1 11 LYS O O 7.487 5.069 -1.881 1.00 . A A . 11 LYS O 1 1 10 4137 1 1 12 LYS C C 4.478 5.691 -3.236 1.00 . A A . 12 LYS C 1 1 10 4138 1 1 12 LYS CA C 5.807 6.202 -3.776 1.00 . A A . 12 LYS CA 1 1 10 4139 1 1 12 LYS CB C 5.578 6.974 -5.077 1.00 . A A . 12 LYS CB 1 1 10 4140 1 1 12 LYS CD C 5.493 9.486 -5.037 1.00 . A A . 12 LYS CD 1 1 10 4141 1 1 12 LYS CE C 4.597 10.712 -4.948 1.00 . A A . 12 LYS CE 1 1 10 4142 1 1 12 LYS CG C 4.695 8.199 -4.909 1.00 . A A . 12 LYS CG 1 1 10 4143 1 1 12 LYS H H 6.785 4.692 -4.892 1.00 . A A . 12 LYS H 1 1 10 4144 1 1 12 LYS HA H 6.251 6.863 -3.047 1.00 . A A . 12 LYS HA 1 1 10 4145 1 1 12 LYS HB2 H 6.534 7.294 -5.465 1.00 . A A . 12 LYS HB2 1 1 10 4146 1 1 12 LYS HB3 H 5.112 6.316 -5.794 1.00 . A A . 12 LYS HB3 1 1 10 4147 1 1 12 LYS HD2 H 6.222 9.528 -4.240 1.00 . A A . 12 LYS HD2 1 1 10 4148 1 1 12 LYS HD3 H 6.000 9.490 -5.991 1.00 . A A . 12 LYS HD3 1 1 10 4149 1 1 12 LYS HE2 H 4.887 11.410 -5.720 1.00 . A A . 12 LYS HE2 1 1 10 4150 1 1 12 LYS HE3 H 3.574 10.406 -5.105 1.00 . A A . 12 LYS HE3 1 1 10 4151 1 1 12 LYS HG2 H 3.930 8.186 -5.670 1.00 . A A . 12 LYS HG2 1 1 10 4152 1 1 12 LYS HG3 H 4.235 8.168 -3.933 1.00 . A A . 12 LYS HG3 1 1 10 4153 1 1 12 LYS HZ1 H 5.642 11.208 -3.209 1.00 . A A . 12 LYS HZ1 1 1 10 4154 1 1 12 LYS HZ2 H 4.572 12.409 -3.732 1.00 . A A . 12 LYS HZ2 1 1 10 4155 1 1 12 LYS HZ3 H 3.978 11.016 -2.977 1.00 . A A . 12 LYS HZ3 1 1 10 4156 1 1 12 LYS N N 6.732 5.096 -4.001 1.00 . A A . 12 LYS N 1 1 10 4157 1 1 12 LYS NZ N 4.705 11.383 -3.624 1.00 . A A . 12 LYS NZ 1 1 10 4158 1 1 12 LYS O O 3.909 4.735 -3.765 1.00 . A A . 12 LYS O 1 1 10 4159 1 1 13 ASP C C 1.587 5.966 -2.574 1.00 . A A . 13 ASP C 1 1 10 4160 1 1 13 ASP CA C 2.726 5.919 -1.565 1.00 . A A . 13 ASP CA 1 1 10 4161 1 1 13 ASP CB C 2.397 6.796 -0.355 1.00 . A A . 13 ASP CB 1 1 10 4162 1 1 13 ASP CG C 3.547 6.882 0.632 1.00 . A A . 13 ASP CG 1 1 10 4163 1 1 13 ASP H H 4.485 7.073 -1.791 1.00 . A A . 13 ASP H 1 1 10 4164 1 1 13 ASP HA H 2.842 4.905 -1.238 1.00 . A A . 13 ASP HA 1 1 10 4165 1 1 13 ASP HB2 H 2.159 7.791 -0.690 1.00 . A A . 13 ASP HB2 1 1 10 4166 1 1 13 ASP HB3 H 1.541 6.381 0.155 1.00 . A A . 13 ASP HB3 1 1 10 4167 1 1 13 ASP N N 3.986 6.324 -2.175 1.00 . A A . 13 ASP N 1 1 10 4168 1 1 13 ASP O O 0.681 5.135 -2.538 1.00 . A A . 13 ASP O 1 1 10 4169 1 1 13 ASP OD1 O 4.626 6.327 0.339 1.00 . A A . 13 ASP OD1 1 1 10 4170 1 1 13 ASP OD2 O 3.366 7.505 1.699 1.00 . A A . 13 ASP OD2 1 1 10 4171 1 1 14 SER C C 0.455 5.791 -5.293 1.00 . A A . 14 SER C 1 1 10 4172 1 1 14 SER CA C 0.630 7.088 -4.509 1.00 . A A . 14 SER CA 1 1 10 4173 1 1 14 SER CB C 1.003 8.227 -5.459 1.00 . A A . 14 SER CB 1 1 10 4174 1 1 14 SER H H 2.402 7.559 -3.456 1.00 . A A . 14 SER H 1 1 10 4175 1 1 14 SER HA H -0.303 7.328 -4.021 1.00 . A A . 14 SER HA 1 1 10 4176 1 1 14 SER HB2 H 1.962 8.019 -5.910 1.00 . A A . 14 SER HB2 1 1 10 4177 1 1 14 SER HB3 H 0.252 8.308 -6.231 1.00 . A A . 14 SER HB3 1 1 10 4178 1 1 14 SER N N 1.648 6.934 -3.478 1.00 . A A . 14 SER N 1 1 10 4179 1 1 14 SER O O -0.645 5.466 -5.742 1.00 . A A . 14 SER O 1 1 10 4180 1 1 14 SER OG O 1.082 9.462 -4.769 1.00 . A A . 14 SER OG 1 1 10 4181 1 1 15 ASP C C 0.456 2.856 -5.682 1.00 . A A . 15 ASP C 1 1 10 4182 1 1 15 ASP CA C 1.535 3.802 -6.204 1.00 . A A . 15 ASP CA 1 1 10 4183 1 1 15 ASP CB C 2.905 3.124 -6.128 1.00 . A A . 15 ASP CB 1 1 10 4184 1 1 15 ASP CG C 3.331 2.531 -7.456 1.00 . A A . 15 ASP CG 1 1 10 4185 1 1 15 ASP H H 2.403 5.372 -5.082 1.00 . A A . 15 ASP H 1 1 10 4186 1 1 15 ASP HA H 1.320 4.033 -7.236 1.00 . A A . 15 ASP HA 1 1 10 4187 1 1 15 ASP HB2 H 3.643 3.853 -5.827 1.00 . A A . 15 ASP HB2 1 1 10 4188 1 1 15 ASP HB3 H 2.867 2.331 -5.396 1.00 . A A . 15 ASP HB3 1 1 10 4189 1 1 15 ASP N N 1.553 5.058 -5.464 1.00 . A A . 15 ASP N 1 1 10 4190 1 1 15 ASP O O -0.129 2.089 -6.446 1.00 . A A . 15 ASP O 1 1 10 4191 1 1 15 ASP OD1 O 2.501 1.851 -8.095 1.00 . A A . 15 ASP OD1 1 1 10 4192 1 1 15 ASP OD2 O 4.495 2.746 -7.856 1.00 . A A . 15 ASP OD2 1 1 10 4193 1 1 16 CYS C C -2.086 2.017 -4.529 1.00 . A A . 16 CYS C 1 1 10 4194 1 1 16 CYS CA C -0.778 2.019 -3.753 1.00 . A A . 16 CYS CA 1 1 10 4195 1 1 16 CYS CB C -1.038 2.428 -2.298 1.00 . A A . 16 CYS CB 1 1 10 4196 1 1 16 CYS H H 0.723 3.515 -3.812 1.00 . A A . 16 CYS H 1 1 10 4197 1 1 16 CYS HA H -0.375 1.018 -3.763 1.00 . A A . 16 CYS HA 1 1 10 4198 1 1 16 CYS HB2 H -0.157 2.881 -1.902 1.00 . A A . 16 CYS HB2 1 1 10 4199 1 1 16 CYS HB3 H -1.838 3.146 -2.269 1.00 . A A . 16 CYS HB3 1 1 10 4200 1 1 16 CYS N N 0.214 2.895 -4.374 1.00 . A A . 16 CYS N 1 1 10 4201 1 1 16 CYS O O -2.284 2.810 -5.450 1.00 . A A . 16 CYS O 1 1 10 4202 1 1 16 CYS SG S -1.484 1.041 -1.196 1.00 . A A . 16 CYS SG 1 1 10 4203 1 1 17 LEU C C -5.361 1.613 -3.929 1.00 . A A . 17 LEU C 1 1 10 4204 1 1 17 LEU CA C -4.273 0.986 -4.789 1.00 . A A . 17 LEU CA 1 1 10 4205 1 1 17 LEU CB C -4.595 -0.486 -5.050 1.00 . A A . 17 LEU CB 1 1 10 4206 1 1 17 LEU CD1 C -6.152 -1.496 -3.364 1.00 . A A . 17 LEU CD1 1 1 10 4207 1 1 17 LEU CD2 C -4.088 -2.729 -4.050 1.00 . A A . 17 LEU CD2 1 1 10 4208 1 1 17 LEU CG C -4.701 -1.360 -3.799 1.00 . A A . 17 LEU CG 1 1 10 4209 1 1 17 LEU H H -2.745 0.519 -3.400 1.00 . A A . 17 LEU H 1 1 10 4210 1 1 17 LEU HA H -4.228 1.511 -5.732 1.00 . A A . 17 LEU HA 1 1 10 4211 1 1 17 LEU HB2 H -5.535 -0.537 -5.582 1.00 . A A . 17 LEU HB2 1 1 10 4212 1 1 17 LEU HB3 H -3.821 -0.894 -5.684 1.00 . A A . 17 LEU HB3 1 1 10 4213 1 1 17 LEU HD11 H -6.560 -0.517 -3.157 1.00 . A A . 17 LEU HD11 1 1 10 4214 1 1 17 LEU HD12 H -6.722 -1.963 -4.153 1.00 . A A . 17 LEU HD12 1 1 10 4215 1 1 17 LEU HD13 H -6.205 -2.104 -2.473 1.00 . A A . 17 LEU HD13 1 1 10 4216 1 1 17 LEU HD21 H -3.258 -2.632 -4.734 1.00 . A A . 17 LEU HD21 1 1 10 4217 1 1 17 LEU HD22 H -3.737 -3.143 -3.116 1.00 . A A . 17 LEU HD22 1 1 10 4218 1 1 17 LEU HD23 H -4.833 -3.384 -4.476 1.00 . A A . 17 LEU HD23 1 1 10 4219 1 1 17 LEU HG H -4.155 -0.890 -2.993 1.00 . A A . 17 LEU HG 1 1 10 4220 1 1 17 LEU N N -2.973 1.115 -4.143 1.00 . A A . 17 LEU N 1 1 10 4221 1 1 17 LEU O O -5.192 1.775 -2.720 1.00 . A A . 17 LEU O 1 1 10 4222 1 1 18 ALA C C -7.086 3.741 -2.969 1.00 . A A . 18 ALA C 1 1 10 4223 1 1 18 ALA CA C -7.585 2.585 -3.837 1.00 . A A . 18 ALA CA 1 1 10 4224 1 1 18 ALA CB C -8.302 1.538 -2.994 1.00 . A A . 18 ALA CB 1 1 10 4225 1 1 18 ALA H H -6.555 1.822 -5.522 1.00 . A A . 18 ALA H 1 1 10 4226 1 1 18 ALA HA H -8.285 2.970 -4.566 1.00 . A A . 18 ALA HA 1 1 10 4227 1 1 18 ALA HB1 H -8.212 0.571 -3.467 1.00 . A A . 18 ALA HB1 1 1 10 4228 1 1 18 ALA HB2 H -7.857 1.501 -2.011 1.00 . A A . 18 ALA HB2 1 1 10 4229 1 1 18 ALA HB3 H -9.346 1.799 -2.906 1.00 . A A . 18 ALA HB3 1 1 10 4230 1 1 18 ALA N N -6.477 1.971 -4.556 1.00 . A A . 18 ALA N 1 1 10 4231 1 1 18 ALA O O -6.082 4.375 -3.295 1.00 . A A . 18 ALA O 1 1 10 4232 1 1 19 GLU C C -6.436 4.576 0.114 1.00 . A A . 19 GLU C 1 1 10 4233 1 1 19 GLU CA C -7.380 5.089 -0.972 1.00 . A A . 19 GLU CA 1 1 10 4234 1 1 19 GLU CB C -8.615 5.731 -0.336 1.00 . A A . 19 GLU CB 1 1 10 4235 1 1 19 GLU CD C -9.075 7.668 1.218 1.00 . A A . 19 GLU CD 1 1 10 4236 1 1 19 GLU CG C -8.469 7.225 -0.098 1.00 . A A . 19 GLU CG 1 1 10 4237 1 1 19 GLU H H -8.568 3.476 -1.650 1.00 . A A . 19 GLU H 1 1 10 4238 1 1 19 GLU HA H -6.862 5.832 -1.560 1.00 . A A . 19 GLU HA 1 1 10 4239 1 1 19 GLU HB2 H -9.463 5.573 -0.985 1.00 . A A . 19 GLU HB2 1 1 10 4240 1 1 19 GLU HB3 H -8.805 5.255 0.614 1.00 . A A . 19 GLU HB3 1 1 10 4241 1 1 19 GLU HG2 H -7.418 7.476 -0.095 1.00 . A A . 19 GLU HG2 1 1 10 4242 1 1 19 GLU HG3 H -8.962 7.755 -0.902 1.00 . A A . 19 GLU HG3 1 1 10 4243 1 1 19 GLU N N -7.777 4.012 -1.868 1.00 . A A . 19 GLU N 1 1 10 4244 1 1 19 GLU O O -6.723 4.700 1.305 1.00 . A A . 19 GLU O 1 1 10 4245 1 1 19 GLU OE1 O -10.313 7.822 1.280 1.00 . A A . 19 GLU OE1 1 1 10 4246 1 1 19 GLU OE2 O -8.312 7.860 2.188 1.00 . A A . 19 GLU OE2 1 1 10 4247 1 1 20 CYS C C -2.948 4.051 0.325 1.00 . A A . 20 CYS C 1 1 10 4248 1 1 20 CYS CA C -4.325 3.490 0.645 1.00 . A A . 20 CYS CA 1 1 10 4249 1 1 20 CYS CB C -4.302 1.960 0.610 1.00 . A A . 20 CYS CB 1 1 10 4250 1 1 20 CYS H H -5.116 3.938 -1.261 1.00 . A A . 20 CYS H 1 1 10 4251 1 1 20 CYS HA H -4.614 3.816 1.634 1.00 . A A . 20 CYS HA 1 1 10 4252 1 1 20 CYS HB2 H -4.706 1.623 -0.333 1.00 . A A . 20 CYS HB2 1 1 10 4253 1 1 20 CYS HB3 H -3.280 1.620 0.700 1.00 . A A . 20 CYS HB3 1 1 10 4254 1 1 20 CYS N N -5.303 4.007 -0.299 1.00 . A A . 20 CYS N 1 1 10 4255 1 1 20 CYS O O -2.815 4.929 -0.527 1.00 . A A . 20 CYS O 1 1 10 4256 1 1 20 CYS SG S -5.268 1.177 1.941 1.00 . A A . 20 CYS SG 1 1 10 4257 1 1 21 VAL C C 0.423 2.887 0.627 1.00 . A A . 21 VAL C 1 1 10 4258 1 1 21 VAL CA C -0.574 4.031 0.769 1.00 . A A . 21 VAL CA 1 1 10 4259 1 1 21 VAL CB C -0.105 4.982 1.890 1.00 . A A . 21 VAL CB 1 1 10 4260 1 1 21 VAL CG1 C -1.093 6.125 2.066 1.00 . A A . 21 VAL CG1 1 1 10 4261 1 1 21 VAL CG2 C 0.083 4.228 3.198 1.00 . A A . 21 VAL CG2 1 1 10 4262 1 1 21 VAL H H -2.082 2.856 1.676 1.00 . A A . 21 VAL H 1 1 10 4263 1 1 21 VAL HA H -0.584 4.591 -0.156 1.00 . A A . 21 VAL HA 1 1 10 4264 1 1 21 VAL HB H 0.848 5.405 1.601 1.00 . A A . 21 VAL HB 1 1 10 4265 1 1 21 VAL HG11 H -2.099 5.753 1.946 1.00 . A A . 21 VAL HG11 1 1 10 4266 1 1 21 VAL HG12 H -0.981 6.550 3.052 1.00 . A A . 21 VAL HG12 1 1 10 4267 1 1 21 VAL HG13 H -0.899 6.886 1.323 1.00 . A A . 21 VAL HG13 1 1 10 4268 1 1 21 VAL HG21 H 0.771 3.409 3.047 1.00 . A A . 21 VAL HG21 1 1 10 4269 1 1 21 VAL HG22 H 0.481 4.898 3.947 1.00 . A A . 21 VAL HG22 1 1 10 4270 1 1 21 VAL HG23 H -0.869 3.840 3.531 1.00 . A A . 21 VAL HG23 1 1 10 4271 1 1 21 VAL N N -1.926 3.552 1.005 1.00 . A A . 21 VAL N 1 1 10 4272 1 1 21 VAL O O 0.188 1.768 1.081 1.00 . A A . 21 VAL O 1 1 10 4273 1 1 22 CYS C C 3.717 2.445 0.810 1.00 . A A . 22 CYS C 1 1 10 4274 1 1 22 CYS CA C 2.620 2.244 -0.230 1.00 . A A . 22 CYS CA 1 1 10 4275 1 1 22 CYS CB C 3.193 2.412 -1.646 1.00 . A A . 22 CYS CB 1 1 10 4276 1 1 22 CYS H H 1.647 4.113 -0.326 1.00 . A A . 22 CYS H 1 1 10 4277 1 1 22 CYS HA H 2.214 1.249 -0.126 1.00 . A A . 22 CYS HA 1 1 10 4278 1 1 22 CYS HB2 H 3.190 3.455 -1.905 1.00 . A A . 22 CYS HB2 1 1 10 4279 1 1 22 CYS HB3 H 4.208 2.054 -1.670 1.00 . A A . 22 CYS HB3 1 1 10 4280 1 1 22 CYS N N 1.543 3.202 -0.006 1.00 . A A . 22 CYS N 1 1 10 4281 1 1 22 CYS O O 4.062 3.579 1.146 1.00 . A A . 22 CYS O 1 1 10 4282 1 1 22 CYS SG S 2.263 1.530 -2.937 1.00 . A A . 22 CYS SG 1 1 10 4283 1 1 23 LEU C C 6.676 1.203 1.757 1.00 . A A . 23 LEU C 1 1 10 4284 1 1 23 LEU CA C 5.289 1.418 2.352 1.00 . A A . 23 LEU CA 1 1 10 4285 1 1 23 LEU CB C 5.020 0.387 3.449 1.00 . A A . 23 LEU CB 1 1 10 4286 1 1 23 LEU CD1 C 3.171 -0.811 4.651 1.00 . A A . 23 LEU CD1 1 1 10 4287 1 1 23 LEU CD2 C 3.784 1.520 5.312 1.00 . A A . 23 LEU CD2 1 1 10 4288 1 1 23 LEU CG C 3.672 0.538 4.157 1.00 . A A . 23 LEU CG 1 1 10 4289 1 1 23 LEU H H 3.925 0.470 1.038 1.00 . A A . 23 LEU H 1 1 10 4290 1 1 23 LEU HA H 5.251 2.404 2.789 1.00 . A A . 23 LEU HA 1 1 10 4291 1 1 23 LEU HB2 H 5.067 -0.599 3.008 1.00 . A A . 23 LEU HB2 1 1 10 4292 1 1 23 LEU HB3 H 5.802 0.469 4.189 1.00 . A A . 23 LEU HB3 1 1 10 4293 1 1 23 LEU HD11 H 3.502 -1.586 3.976 1.00 . A A . 23 LEU HD11 1 1 10 4294 1 1 23 LEU HD12 H 3.563 -1.000 5.638 1.00 . A A . 23 LEU HD12 1 1 10 4295 1 1 23 LEU HD13 H 2.092 -0.802 4.687 1.00 . A A . 23 LEU HD13 1 1 10 4296 1 1 23 LEU HD21 H 4.611 1.240 5.945 1.00 . A A . 23 LEU HD21 1 1 10 4297 1 1 23 LEU HD22 H 3.948 2.515 4.923 1.00 . A A . 23 LEU HD22 1 1 10 4298 1 1 23 LEU HD23 H 2.869 1.505 5.886 1.00 . A A . 23 LEU HD23 1 1 10 4299 1 1 23 LEU HG H 2.947 0.925 3.456 1.00 . A A . 23 LEU HG 1 1 10 4300 1 1 23 LEU N N 4.248 1.347 1.333 1.00 . A A . 23 LEU N 1 1 10 4301 1 1 23 LEU O O 6.856 0.403 0.838 1.00 . A A . 23 LEU O 1 1 10 4302 1 1 24 GLU C C 9.562 0.424 1.887 1.00 . A A . 24 GLU C 1 1 10 4303 1 1 24 GLU CA C 9.031 1.853 1.824 1.00 . A A . 24 GLU CA 1 1 10 4304 1 1 24 GLU CB C 9.925 2.774 2.656 1.00 . A A . 24 GLU CB 1 1 10 4305 1 1 24 GLU CD C 9.895 3.851 4.941 1.00 . A A . 24 GLU CD 1 1 10 4306 1 1 24 GLU CG C 9.792 2.559 4.155 1.00 . A A . 24 GLU CG 1 1 10 4307 1 1 24 GLU H H 7.433 2.557 3.016 1.00 . A A . 24 GLU H 1 1 10 4308 1 1 24 GLU HA H 9.052 2.184 0.797 1.00 . A A . 24 GLU HA 1 1 10 4309 1 1 24 GLU HB2 H 10.954 2.603 2.380 1.00 . A A . 24 GLU HB2 1 1 10 4310 1 1 24 GLU HB3 H 9.667 3.800 2.438 1.00 . A A . 24 GLU HB3 1 1 10 4311 1 1 24 GLU HG2 H 8.831 2.109 4.358 1.00 . A A . 24 GLU HG2 1 1 10 4312 1 1 24 GLU HG3 H 10.576 1.892 4.481 1.00 . A A . 24 GLU HG3 1 1 10 4313 1 1 24 GLU N N 7.650 1.937 2.290 1.00 . A A . 24 GLU N 1 1 10 4314 1 1 24 GLU O O 10.148 -0.070 0.923 1.00 . A A . 24 GLU O 1 1 10 4315 1 1 24 GLU OE1 O 9.090 4.770 4.682 1.00 . A A . 24 GLU OE1 1 1 10 4316 1 1 24 GLU OE2 O 10.781 3.944 5.817 1.00 . A A . 24 GLU OE2 1 1 10 4317 1 1 25 HIS C C 9.265 -2.512 2.103 1.00 . A A . 25 HIS C 1 1 10 4318 1 1 25 HIS CA C 9.834 -1.609 3.191 1.00 . A A . 25 HIS CA 1 1 10 4319 1 1 25 HIS CB C 9.474 -2.149 4.578 1.00 . A A . 25 HIS CB 1 1 10 4320 1 1 25 HIS CD2 C 6.914 -2.567 4.571 1.00 . A A . 25 HIS CD2 1 1 10 4321 1 1 25 HIS CE1 C 6.340 -1.052 6.045 1.00 . A A . 25 HIS CE1 1 1 10 4322 1 1 25 HIS CG C 8.044 -1.937 4.967 1.00 . A A . 25 HIS CG 1 1 10 4323 1 1 25 HIS H H 8.891 0.201 3.760 1.00 . A A . 25 HIS H 1 1 10 4324 1 1 25 HIS HA H 10.909 -1.595 3.093 1.00 . A A . 25 HIS HA 1 1 10 4325 1 1 25 HIS HB2 H 9.666 -3.211 4.602 1.00 . A A . 25 HIS HB2 1 1 10 4326 1 1 25 HIS HB3 H 10.094 -1.662 5.316 1.00 . A A . 25 HIS HB3 1 1 10 4327 1 1 25 HIS HD1 H 8.241 -0.368 6.359 1.00 . A A . 25 HIS HD1 1 1 10 4328 1 1 25 HIS HD2 H 6.848 -3.369 3.849 1.00 . A A . 25 HIS HD2 1 1 10 4329 1 1 25 HIS HE1 H 5.752 -0.429 6.705 1.00 . A A . 25 HIS HE1 1 1 10 4330 1 1 25 HIS HE2 H 4.962 -2.370 5.308 1.00 . A A . 25 HIS HE2 1 1 10 4331 1 1 25 HIS N N 9.361 -0.239 3.024 1.00 . A A . 25 HIS N 1 1 10 4332 1 1 25 HIS ND1 N 7.650 -0.991 5.889 1.00 . A A . 25 HIS ND1 1 1 10 4333 1 1 25 HIS NE2 N 5.868 -2.000 5.257 1.00 . A A . 25 HIS NE2 1 1 10 4334 1 1 25 HIS O O 9.841 -3.552 1.782 1.00 . A A . 25 HIS O 1 1 10 4335 1 1 26 GLY C C 6.215 -3.512 0.877 1.00 . A A . 26 GLY C 1 1 10 4336 1 1 26 GLY CA C 7.528 -2.874 0.468 1.00 . A A . 26 GLY CA 1 1 10 4337 1 1 26 GLY H H 7.732 -1.258 1.814 1.00 . A A . 26 GLY H 1 1 10 4338 1 1 26 GLY HA2 H 8.213 -3.651 0.163 1.00 . A A . 26 GLY HA2 1 1 10 4339 1 1 26 GLY HA3 H 7.347 -2.221 -0.371 1.00 . A A . 26 GLY HA3 1 1 10 4340 1 1 26 GLY N N 8.141 -2.100 1.527 1.00 . A A . 26 GLY N 1 1 10 4341 1 1 26 GLY O O 6.111 -4.736 0.942 1.00 . A A . 26 GLY O 1 1 10 4342 1 1 27 TYR C C 2.859 -2.047 1.512 1.00 . A A . 27 TYR C 1 1 10 4343 1 1 27 TYR CA C 3.890 -3.172 1.535 1.00 . A A . 27 TYR CA 1 1 10 4344 1 1 27 TYR CB C 3.943 -3.792 2.933 1.00 . A A . 27 TYR CB 1 1 10 4345 1 1 27 TYR CD1 C 4.033 -6.149 2.032 1.00 . A A . 27 TYR CD1 1 1 10 4346 1 1 27 TYR CD2 C 5.394 -5.610 3.913 1.00 . A A . 27 TYR CD2 1 1 10 4347 1 1 27 TYR CE1 C 4.510 -7.447 2.055 1.00 . A A . 27 TYR CE1 1 1 10 4348 1 1 27 TYR CE2 C 5.876 -6.905 3.943 1.00 . A A . 27 TYR CE2 1 1 10 4349 1 1 27 TYR CG C 4.467 -5.211 2.960 1.00 . A A . 27 TYR CG 1 1 10 4350 1 1 27 TYR CZ C 5.430 -7.819 3.011 1.00 . A A . 27 TYR CZ 1 1 10 4351 1 1 27 TYR H H 5.355 -1.715 1.061 1.00 . A A . 27 TYR H 1 1 10 4352 1 1 27 TYR HA H 3.594 -3.931 0.826 1.00 . A A . 27 TYR HA 1 1 10 4353 1 1 27 TYR HB2 H 4.587 -3.194 3.557 1.00 . A A . 27 TYR HB2 1 1 10 4354 1 1 27 TYR HB3 H 2.948 -3.796 3.354 1.00 . A A . 27 TYR HB3 1 1 10 4355 1 1 27 TYR HD1 H 3.312 -5.856 1.285 1.00 . A A . 27 TYR HD1 1 1 10 4356 1 1 27 TYR HD2 H 5.741 -4.892 4.642 1.00 . A A . 27 TYR HD2 1 1 10 4357 1 1 27 TYR HE1 H 4.162 -8.163 1.326 1.00 . A A . 27 TYR HE1 1 1 10 4358 1 1 27 TYR HE2 H 6.597 -7.196 4.692 1.00 . A A . 27 TYR HE2 1 1 10 4359 1 1 27 TYR HH H 6.834 -9.113 2.785 1.00 . A A . 27 TYR HH 1 1 10 4360 1 1 27 TYR N N 5.209 -2.682 1.141 1.00 . A A . 27 TYR N 1 1 10 4361 1 1 27 TYR O O 3.161 -0.908 1.864 1.00 . A A . 27 TYR O 1 1 10 4362 1 1 27 TYR OH O 5.908 -9.109 3.037 1.00 . A A . 27 TYR OH 1 1 10 4363 1 1 28 CYS C C -0.341 -1.508 2.272 1.00 . A A . 28 CYS C 1 1 10 4364 1 1 28 CYS CA C 0.557 -1.394 1.043 1.00 . A A . 28 CYS CA 1 1 10 4365 1 1 28 CYS CB C -0.281 -1.592 -0.226 1.00 . A A . 28 CYS CB 1 1 10 4366 1 1 28 CYS H H 1.458 -3.302 0.836 1.00 . A A . 28 CYS H 1 1 10 4367 1 1 28 CYS HA H 1.002 -0.411 1.023 1.00 . A A . 28 CYS HA 1 1 10 4368 1 1 28 CYS HB2 H -0.040 -2.551 -0.659 1.00 . A A . 28 CYS HB2 1 1 10 4369 1 1 28 CYS HB3 H -1.329 -1.575 0.036 1.00 . A A . 28 CYS HB3 1 1 10 4370 1 1 28 CYS N N 1.637 -2.377 1.103 1.00 . A A . 28 CYS N 1 1 10 4371 1 1 28 CYS O O -0.885 -2.575 2.558 1.00 . A A . 28 CYS O 1 1 10 4372 1 1 28 CYS SG S -0.011 -0.325 -1.508 1.00 . A A . 28 CYS SG 1 1 10 4373 1 1 29 GLY C C -2.694 0.188 3.931 1.00 . A A . 29 GLY C 1 1 10 4374 1 1 29 GLY CA C -1.320 -0.400 4.183 1.00 . A A . 29 GLY CA 1 1 10 4375 1 1 29 GLY H H -0.030 0.417 2.717 1.00 . A A . 29 GLY H 1 1 10 4376 1 1 29 GLY HA2 H -0.829 0.181 4.950 1.00 . A A . 29 GLY HA2 1 1 10 4377 1 1 29 GLY HA3 H -1.432 -1.416 4.533 1.00 . A A . 29 GLY HA3 1 1 10 4378 1 1 29 GLY N N -0.490 -0.403 2.994 1.00 . A A . 29 GLY N 1 1 10 4379 1 1 29 GLY O O -3.616 -0.584 3.590 1.00 . A A . 29 GLY O 1 1 10 4380 1 1 29 GLY OXT O -2.849 1.419 4.073 1.00 . A A . 29 GLY OXT 1 1 11 4381 1 1 1 ARG C C -11.070 2.998 1.849 1.00 . A A . 1 ARG C 1 1 11 4382 1 1 1 ARG CA C -11.971 4.086 1.271 1.00 . A A . 1 ARG CA 1 1 11 4383 1 1 1 ARG CB C -11.944 4.038 -0.258 1.00 . A A . 1 ARG CB 1 1 11 4384 1 1 1 ARG CD C -13.543 3.901 -2.190 1.00 . A A . 1 ARG CD 1 1 11 4385 1 1 1 ARG CG C -13.120 3.291 -0.865 1.00 . A A . 1 ARG CG 1 1 11 4386 1 1 1 ARG CZ C -15.942 3.342 -2.290 1.00 . A A . 1 ARG CZ 1 1 11 4387 1 1 1 ARG H1 H -11.304 5.381 2.724 1.00 . A A . 1 ARG H1 1 1 11 4388 1 1 1 ARG H2 H -10.692 5.693 1.151 1.00 . A A . 1 ARG H2 1 1 11 4389 1 1 1 ARG H3 H -12.315 6.096 1.538 1.00 . A A . 1 ARG H3 1 1 11 4390 1 1 1 ARG HA H -12.982 3.925 1.614 1.00 . A A . 1 ARG HA 1 1 11 4391 1 1 1 ARG HB2 H -11.954 5.050 -0.638 1.00 . A A . 1 ARG HB2 1 1 11 4392 1 1 1 ARG HB3 H -11.033 3.552 -0.576 1.00 . A A . 1 ARG HB3 1 1 11 4393 1 1 1 ARG HD2 H -13.792 4.940 -2.030 1.00 . A A . 1 ARG HD2 1 1 11 4394 1 1 1 ARG HD3 H -12.719 3.832 -2.884 1.00 . A A . 1 ARG HD3 1 1 11 4395 1 1 1 ARG HE H -14.550 2.641 -3.537 1.00 . A A . 1 ARG HE 1 1 11 4396 1 1 1 ARG HG2 H -12.835 2.262 -1.028 1.00 . A A . 1 ARG HG2 1 1 11 4397 1 1 1 ARG HG3 H -13.952 3.331 -0.176 1.00 . A A . 1 ARG HG3 1 1 11 4398 1 1 1 ARG HH11 H -15.439 4.614 -0.800 1.00 . A A . 1 ARG HH11 1 1 11 4399 1 1 1 ARG HH12 H -17.119 4.205 -0.891 1.00 . A A . 1 ARG HH12 1 1 11 4400 1 1 1 ARG HH21 H -16.760 2.102 -3.660 1.00 . A A . 1 ARG HH21 1 1 11 4401 1 1 1 ARG HH22 H -17.869 2.778 -2.515 1.00 . A A . 1 ARG HH22 1 1 11 4402 1 1 1 ARG N N -11.531 5.436 1.710 1.00 . A A . 1 ARG N 1 1 11 4403 1 1 1 ARG NE N -14.703 3.220 -2.761 1.00 . A A . 1 ARG NE 1 1 11 4404 1 1 1 ARG NH1 N -16.186 4.116 -1.241 1.00 . A A . 1 ARG NH1 1 1 11 4405 1 1 1 ARG NH2 N -16.939 2.687 -2.869 1.00 . A A . 1 ARG NH2 1 1 11 4406 1 1 1 ARG O O -10.069 3.289 2.502 1.00 . A A . 1 ARG O 1 1 11 4407 1 1 2 VAL C C -9.959 -0.118 0.961 1.00 . A A . 2 VAL C 1 1 11 4408 1 1 2 VAL CA C -10.663 0.612 2.101 1.00 . A A . 2 VAL CA 1 1 11 4409 1 1 2 VAL CB C -11.558 -0.385 2.864 1.00 . A A . 2 VAL CB 1 1 11 4410 1 1 2 VAL CG1 C -12.631 -0.954 1.947 1.00 . A A . 2 VAL CG1 1 1 11 4411 1 1 2 VAL CG2 C -10.720 -1.501 3.472 1.00 . A A . 2 VAL CG2 1 1 11 4412 1 1 2 VAL H H -12.246 1.576 1.079 1.00 . A A . 2 VAL H 1 1 11 4413 1 1 2 VAL HA H -9.919 0.992 2.786 1.00 . A A . 2 VAL HA 1 1 11 4414 1 1 2 VAL HB H -12.049 0.145 3.667 1.00 . A A . 2 VAL HB 1 1 11 4415 1 1 2 VAL HG11 H -13.179 -0.143 1.490 1.00 . A A . 2 VAL HG11 1 1 11 4416 1 1 2 VAL HG12 H -12.167 -1.553 1.178 1.00 . A A . 2 VAL HG12 1 1 11 4417 1 1 2 VAL HG13 H -13.308 -1.568 2.523 1.00 . A A . 2 VAL HG13 1 1 11 4418 1 1 2 VAL HG21 H -9.859 -1.077 3.966 1.00 . A A . 2 VAL HG21 1 1 11 4419 1 1 2 VAL HG22 H -11.314 -2.046 4.191 1.00 . A A . 2 VAL HG22 1 1 11 4420 1 1 2 VAL HG23 H -10.393 -2.173 2.692 1.00 . A A . 2 VAL HG23 1 1 11 4421 1 1 2 VAL N N -11.437 1.744 1.604 1.00 . A A . 2 VAL N 1 1 11 4422 1 1 2 VAL O O -10.534 -0.325 -0.107 1.00 . A A . 2 VAL O 1 1 11 4423 1 1 3 CYS C C -7.824 -2.702 0.537 1.00 . A A . 3 CYS C 1 1 11 4424 1 1 3 CYS CA C -7.926 -1.216 0.193 1.00 . A A . 3 CYS CA 1 1 11 4425 1 1 3 CYS CB C -6.527 -0.606 0.079 1.00 . A A . 3 CYS CB 1 1 11 4426 1 1 3 CYS H H -8.307 -0.314 2.070 1.00 . A A . 3 CYS H 1 1 11 4427 1 1 3 CYS HA H -8.433 -1.109 -0.753 1.00 . A A . 3 CYS HA 1 1 11 4428 1 1 3 CYS HB2 H -6.018 -1.047 -0.763 1.00 . A A . 3 CYS HB2 1 1 11 4429 1 1 3 CYS HB3 H -6.620 0.458 -0.081 1.00 . A A . 3 CYS HB3 1 1 11 4430 1 1 3 CYS N N -8.710 -0.506 1.197 1.00 . A A . 3 CYS N 1 1 11 4431 1 1 3 CYS O O -7.485 -3.061 1.664 1.00 . A A . 3 CYS O 1 1 11 4432 1 1 3 CYS SG S -5.479 -0.856 1.550 1.00 . A A . 3 CYS SG 1 1 11 4433 1 1 4 PRO C C -6.807 -5.468 0.548 1.00 . A A . 4 PRO C 1 1 11 4434 1 1 4 PRO CA C -8.055 -5.041 -0.217 1.00 . A A . 4 PRO CA 1 1 11 4435 1 1 4 PRO CB C -8.024 -5.594 -1.640 1.00 . A A . 4 PRO CB 1 1 11 4436 1 1 4 PRO CD C -8.530 -3.258 -1.810 1.00 . A A . 4 PRO CD 1 1 11 4437 1 1 4 PRO CG C -8.795 -4.602 -2.439 1.00 . A A . 4 PRO CG 1 1 11 4438 1 1 4 PRO HA H -8.933 -5.404 0.295 1.00 . A A . 4 PRO HA 1 1 11 4439 1 1 4 PRO HB2 H -7.001 -5.669 -1.979 1.00 . A A . 4 PRO HB2 1 1 11 4440 1 1 4 PRO HB3 H -8.490 -6.567 -1.662 1.00 . A A . 4 PRO HB3 1 1 11 4441 1 1 4 PRO HD2 H -7.738 -2.745 -2.335 1.00 . A A . 4 PRO HD2 1 1 11 4442 1 1 4 PRO HD3 H -9.430 -2.660 -1.806 1.00 . A A . 4 PRO HD3 1 1 11 4443 1 1 4 PRO HG2 H -8.451 -4.609 -3.463 1.00 . A A . 4 PRO HG2 1 1 11 4444 1 1 4 PRO HG3 H -9.849 -4.834 -2.396 1.00 . A A . 4 PRO HG3 1 1 11 4445 1 1 4 PRO N N -8.116 -3.591 -0.431 1.00 . A A . 4 PRO N 1 1 11 4446 1 1 4 PRO O O -5.715 -4.949 0.316 1.00 . A A . 4 PRO O 1 1 11 4447 1 1 5 ARG C C -4.919 -7.758 1.412 1.00 . A A . 5 ARG C 1 1 11 4448 1 1 5 ARG CA C -5.863 -6.913 2.262 1.00 . A A . 5 ARG CA 1 1 11 4449 1 1 5 ARG CB C -6.383 -7.732 3.447 1.00 . A A . 5 ARG CB 1 1 11 4450 1 1 5 ARG CD C -7.499 -6.891 5.539 1.00 . A A . 5 ARG CD 1 1 11 4451 1 1 5 ARG CG C -6.186 -7.047 4.791 1.00 . A A . 5 ARG CG 1 1 11 4452 1 1 5 ARG CZ C -8.346 -5.575 7.443 1.00 . A A . 5 ARG CZ 1 1 11 4453 1 1 5 ARG H H -7.870 -6.793 1.603 1.00 . A A . 5 ARG H 1 1 11 4454 1 1 5 ARG HA H -5.320 -6.059 2.638 1.00 . A A . 5 ARG HA 1 1 11 4455 1 1 5 ARG HB2 H -7.439 -7.911 3.309 1.00 . A A . 5 ARG HB2 1 1 11 4456 1 1 5 ARG HB3 H -5.866 -8.681 3.471 1.00 . A A . 5 ARG HB3 1 1 11 4457 1 1 5 ARG HD2 H -8.203 -6.374 4.902 1.00 . A A . 5 ARG HD2 1 1 11 4458 1 1 5 ARG HD3 H -7.885 -7.872 5.775 1.00 . A A . 5 ARG HD3 1 1 11 4459 1 1 5 ARG HE H -6.429 -6.036 7.132 1.00 . A A . 5 ARG HE 1 1 11 4460 1 1 5 ARG HG2 H -5.511 -7.641 5.390 1.00 . A A . 5 ARG HG2 1 1 11 4461 1 1 5 ARG HG3 H -5.757 -6.070 4.625 1.00 . A A . 5 ARG HG3 1 1 11 4462 1 1 5 ARG HH11 H -9.774 -6.191 6.150 1.00 . A A . 5 ARG HH11 1 1 11 4463 1 1 5 ARG HH12 H -10.343 -5.264 7.497 1.00 . A A . 5 ARG HH12 1 1 11 4464 1 1 5 ARG HH21 H -7.175 -4.817 8.905 1.00 . A A . 5 ARG HH21 1 1 11 4465 1 1 5 ARG HH22 H -8.867 -4.484 9.061 1.00 . A A . 5 ARG HH22 1 1 11 4466 1 1 5 ARG N N -6.976 -6.418 1.462 1.00 . A A . 5 ARG N 1 1 11 4467 1 1 5 ARG NE N -7.337 -6.133 6.778 1.00 . A A . 5 ARG NE 1 1 11 4468 1 1 5 ARG NH1 N -9.589 -5.686 6.993 1.00 . A A . 5 ARG NH1 1 1 11 4469 1 1 5 ARG NH2 N -8.110 -4.903 8.562 1.00 . A A . 5 ARG NH2 1 1 11 4470 1 1 5 ARG O O -4.966 -8.987 1.447 1.00 . A A . 5 ARG O 1 1 11 4471 1 1 6 ILE C C -1.747 -7.079 -0.178 1.00 . A A . 6 ILE C 1 1 11 4472 1 1 6 ILE CA C -3.104 -7.772 -0.210 1.00 . A A . 6 ILE CA 1 1 11 4473 1 1 6 ILE CB C -3.601 -7.839 -1.666 1.00 . A A . 6 ILE CB 1 1 11 4474 1 1 6 ILE CD1 C -2.909 -5.785 -3.002 1.00 . A A . 6 ILE CD1 1 1 11 4475 1 1 6 ILE CG1 C -3.984 -6.443 -2.165 1.00 . A A . 6 ILE CG1 1 1 11 4476 1 1 6 ILE CG2 C -4.781 -8.792 -1.780 1.00 . A A . 6 ILE CG2 1 1 11 4477 1 1 6 ILE H H -4.074 -6.107 0.665 1.00 . A A . 6 ILE H 1 1 11 4478 1 1 6 ILE HA H -2.990 -8.782 0.157 1.00 . A A . 6 ILE HA 1 1 11 4479 1 1 6 ILE HB H -2.799 -8.224 -2.279 1.00 . A A . 6 ILE HB 1 1 11 4480 1 1 6 ILE HD11 H -2.275 -6.544 -3.436 1.00 . A A . 6 ILE HD11 1 1 11 4481 1 1 6 ILE HD12 H -3.370 -5.206 -3.790 1.00 . A A . 6 ILE HD12 1 1 11 4482 1 1 6 ILE HD13 H -2.314 -5.134 -2.378 1.00 . A A . 6 ILE HD13 1 1 11 4483 1 1 6 ILE HG12 H -4.875 -6.515 -2.769 1.00 . A A . 6 ILE HG12 1 1 11 4484 1 1 6 ILE HG13 H -4.180 -5.807 -1.315 1.00 . A A . 6 ILE HG13 1 1 11 4485 1 1 6 ILE HG21 H -4.765 -9.486 -0.954 1.00 . A A . 6 ILE HG21 1 1 11 4486 1 1 6 ILE HG22 H -5.702 -8.227 -1.759 1.00 . A A . 6 ILE HG22 1 1 11 4487 1 1 6 ILE HG23 H -4.715 -9.337 -2.710 1.00 . A A . 6 ILE HG23 1 1 11 4488 1 1 6 ILE N N -4.062 -7.088 0.650 1.00 . A A . 6 ILE N 1 1 11 4489 1 1 6 ILE O O -1.660 -5.856 -0.295 1.00 . A A . 6 ILE O 1 1 11 4490 1 1 7 LEU C C 0.992 -6.550 -1.239 1.00 . A A . 7 LEU C 1 1 11 4491 1 1 7 LEU CA C 0.666 -7.329 0.030 1.00 . A A . 7 LEU CA 1 1 11 4492 1 1 7 LEU CB C 1.679 -8.460 0.218 1.00 . A A . 7 LEU CB 1 1 11 4493 1 1 7 LEU CD1 C 2.629 -10.293 1.638 1.00 . A A . 7 LEU CD1 1 1 11 4494 1 1 7 LEU CD2 C 1.350 -8.425 2.707 1.00 . A A . 7 LEU CD2 1 1 11 4495 1 1 7 LEU CG C 1.480 -9.310 1.475 1.00 . A A . 7 LEU CG 1 1 11 4496 1 1 7 LEU H H -0.822 -8.833 0.070 1.00 . A A . 7 LEU H 1 1 11 4497 1 1 7 LEU HA H 0.727 -6.660 0.875 1.00 . A A . 7 LEU HA 1 1 11 4498 1 1 7 LEU HB2 H 1.623 -9.110 -0.643 1.00 . A A . 7 LEU HB2 1 1 11 4499 1 1 7 LEU HB3 H 2.667 -8.026 0.258 1.00 . A A . 7 LEU HB3 1 1 11 4500 1 1 7 LEU HD11 H 3.504 -9.908 1.138 1.00 . A A . 7 LEU HD11 1 1 11 4501 1 1 7 LEU HD12 H 2.842 -10.425 2.688 1.00 . A A . 7 LEU HD12 1 1 11 4502 1 1 7 LEU HD13 H 2.354 -11.243 1.205 1.00 . A A . 7 LEU HD13 1 1 11 4503 1 1 7 LEU HD21 H 1.662 -7.419 2.463 1.00 . A A . 7 LEU HD21 1 1 11 4504 1 1 7 LEU HD22 H 0.322 -8.411 3.035 1.00 . A A . 7 LEU HD22 1 1 11 4505 1 1 7 LEU HD23 H 1.975 -8.812 3.498 1.00 . A A . 7 LEU HD23 1 1 11 4506 1 1 7 LEU HG H 0.566 -9.879 1.374 1.00 . A A . 7 LEU HG 1 1 11 4507 1 1 7 LEU N N -0.689 -7.867 -0.018 1.00 . A A . 7 LEU N 1 1 11 4508 1 1 7 LEU O O 0.623 -6.957 -2.341 1.00 . A A . 7 LEU O 1 1 11 4509 1 1 8 LEU C C 3.229 -3.684 -1.857 1.00 . A A . 8 LEU C 1 1 11 4510 1 1 8 LEU CA C 2.061 -4.596 -2.217 1.00 . A A . 8 LEU CA 1 1 11 4511 1 1 8 LEU CB C 0.864 -3.759 -2.682 1.00 . A A . 8 LEU CB 1 1 11 4512 1 1 8 LEU CD1 C -0.628 -4.537 -4.547 1.00 . A A . 8 LEU CD1 1 1 11 4513 1 1 8 LEU CD2 C 0.525 -2.326 -4.716 1.00 . A A . 8 LEU CD2 1 1 11 4514 1 1 8 LEU CG C 0.627 -3.753 -4.196 1.00 . A A . 8 LEU CG 1 1 11 4515 1 1 8 LEU H H 1.956 -5.152 -0.175 1.00 . A A . 8 LEU H 1 1 11 4516 1 1 8 LEU HA H 2.365 -5.251 -3.019 1.00 . A A . 8 LEU HA 1 1 11 4517 1 1 8 LEU HB2 H -0.023 -4.143 -2.200 1.00 . A A . 8 LEU HB2 1 1 11 4518 1 1 8 LEU HB3 H 1.015 -2.740 -2.358 1.00 . A A . 8 LEU HB3 1 1 11 4519 1 1 8 LEU HD11 H -0.545 -5.542 -4.160 1.00 . A A . 8 LEU HD11 1 1 11 4520 1 1 8 LEU HD12 H -1.489 -4.053 -4.109 1.00 . A A . 8 LEU HD12 1 1 11 4521 1 1 8 LEU HD13 H -0.742 -4.572 -5.620 1.00 . A A . 8 LEU HD13 1 1 11 4522 1 1 8 LEU HD21 H 0.166 -1.681 -3.929 1.00 . A A . 8 LEU HD21 1 1 11 4523 1 1 8 LEU HD22 H 1.499 -1.990 -5.040 1.00 . A A . 8 LEU HD22 1 1 11 4524 1 1 8 LEU HD23 H -0.162 -2.295 -5.549 1.00 . A A . 8 LEU HD23 1 1 11 4525 1 1 8 LEU HG H 1.465 -4.227 -4.686 1.00 . A A . 8 LEU HG 1 1 11 4526 1 1 8 LEU N N 1.686 -5.427 -1.079 1.00 . A A . 8 LEU N 1 1 11 4527 1 1 8 LEU O O 3.094 -2.793 -1.022 1.00 . A A . 8 LEU O 1 1 11 4528 1 1 9 GLU C C 5.766 -2.058 -3.306 1.00 . A A . 9 GLU C 1 1 11 4529 1 1 9 GLU CA C 5.571 -3.123 -2.233 1.00 . A A . 9 GLU CA 1 1 11 4530 1 1 9 GLU CB C 6.803 -4.028 -2.169 1.00 . A A . 9 GLU CB 1 1 11 4531 1 1 9 GLU CD C 7.611 -6.156 -3.268 1.00 . A A . 9 GLU CD 1 1 11 4532 1 1 9 GLU CG C 7.099 -4.744 -3.478 1.00 . A A . 9 GLU CG 1 1 11 4533 1 1 9 GLU H H 4.419 -4.647 -3.145 1.00 . A A . 9 GLU H 1 1 11 4534 1 1 9 GLU HA H 5.444 -2.635 -1.279 1.00 . A A . 9 GLU HA 1 1 11 4535 1 1 9 GLU HB2 H 7.662 -3.428 -1.910 1.00 . A A . 9 GLU HB2 1 1 11 4536 1 1 9 GLU HB3 H 6.649 -4.773 -1.403 1.00 . A A . 9 GLU HB3 1 1 11 4537 1 1 9 GLU HG2 H 6.192 -4.790 -4.061 1.00 . A A . 9 GLU HG2 1 1 11 4538 1 1 9 GLU HG3 H 7.847 -4.182 -4.018 1.00 . A A . 9 GLU HG3 1 1 11 4539 1 1 9 GLU N N 4.374 -3.919 -2.491 1.00 . A A . 9 GLU N 1 1 11 4540 1 1 9 GLU O O 5.707 -2.348 -4.501 1.00 . A A . 9 GLU O 1 1 11 4541 1 1 9 GLU OE1 O 7.262 -6.766 -2.235 1.00 . A A . 9 GLU OE1 1 1 11 4542 1 1 9 GLU OE2 O 8.359 -6.650 -4.136 1.00 . A A . 9 GLU OE2 1 1 11 4543 1 1 10 CYS C C 7.009 1.401 -3.147 1.00 . A A . 10 CYS C 1 1 11 4544 1 1 10 CYS CA C 6.188 0.289 -3.795 1.00 . A A . 10 CYS CA 1 1 11 4545 1 1 10 CYS CB C 4.835 0.844 -4.261 1.00 . A A . 10 CYS CB 1 1 11 4546 1 1 10 CYS H H 6.019 -0.652 -1.905 1.00 . A A . 10 CYS H 1 1 11 4547 1 1 10 CYS HA H 6.726 -0.085 -4.652 1.00 . A A . 10 CYS HA 1 1 11 4548 1 1 10 CYS HB2 H 4.788 1.898 -4.035 1.00 . A A . 10 CYS HB2 1 1 11 4549 1 1 10 CYS HB3 H 4.748 0.706 -5.329 1.00 . A A . 10 CYS HB3 1 1 11 4550 1 1 10 CYS N N 5.992 -0.822 -2.870 1.00 . A A . 10 CYS N 1 1 11 4551 1 1 10 CYS O O 7.073 1.504 -1.921 1.00 . A A . 10 CYS O 1 1 11 4552 1 1 10 CYS SG S 3.388 0.049 -3.481 1.00 . A A . 10 CYS SG 1 1 11 4553 1 1 11 LYS C C 7.555 4.498 -3.033 1.00 . A A . 11 LYS C 1 1 11 4554 1 1 11 LYS CA C 8.441 3.340 -3.486 1.00 . A A . 11 LYS CA 1 1 11 4555 1 1 11 LYS CB C 9.410 3.813 -4.574 1.00 . A A . 11 LYS CB 1 1 11 4556 1 1 11 LYS CD C 11.441 2.524 -5.315 1.00 . A A . 11 LYS CD 1 1 11 4557 1 1 11 LYS CE C 12.576 1.694 -4.738 1.00 . A A . 11 LYS CE 1 1 11 4558 1 1 11 LYS CG C 10.864 3.476 -4.279 1.00 . A A . 11 LYS CG 1 1 11 4559 1 1 11 LYS H H 7.536 2.100 -4.944 1.00 . A A . 11 LYS H 1 1 11 4560 1 1 11 LYS HA H 9.009 2.985 -2.640 1.00 . A A . 11 LYS HA 1 1 11 4561 1 1 11 LYS HB2 H 9.136 3.348 -5.510 1.00 . A A . 11 LYS HB2 1 1 11 4562 1 1 11 LYS HB3 H 9.326 4.884 -4.677 1.00 . A A . 11 LYS HB3 1 1 11 4563 1 1 11 LYS HD2 H 10.660 1.859 -5.654 1.00 . A A . 11 LYS HD2 1 1 11 4564 1 1 11 LYS HD3 H 11.814 3.099 -6.149 1.00 . A A . 11 LYS HD3 1 1 11 4565 1 1 11 LYS HE2 H 12.205 1.142 -3.888 1.00 . A A . 11 LYS HE2 1 1 11 4566 1 1 11 LYS HE3 H 12.920 1.003 -5.494 1.00 . A A . 11 LYS HE3 1 1 11 4567 1 1 11 LYS HG2 H 11.442 4.387 -4.282 1.00 . A A . 11 LYS HG2 1 1 11 4568 1 1 11 LYS HG3 H 10.925 3.013 -3.305 1.00 . A A . 11 LYS HG3 1 1 11 4569 1 1 11 LYS HZ1 H 13.854 3.331 -4.968 1.00 . A A . 11 LYS HZ1 1 1 11 4570 1 1 11 LYS HZ2 H 13.533 2.932 -3.354 1.00 . A A . 11 LYS HZ2 1 1 11 4571 1 1 11 LYS HZ3 H 14.591 1.980 -4.267 1.00 . A A . 11 LYS HZ3 1 1 11 4572 1 1 11 LYS N N 7.629 2.233 -3.978 1.00 . A A . 11 LYS N 1 1 11 4573 1 1 11 LYS NZ N 13.719 2.543 -4.301 1.00 . A A . 11 LYS NZ 1 1 11 4574 1 1 11 LYS O O 7.500 4.822 -1.847 1.00 . A A . 11 LYS O 1 1 11 4575 1 1 12 LYS C C 4.628 5.723 -3.169 1.00 . A A . 12 LYS C 1 1 11 4576 1 1 12 LYS CA C 5.971 6.229 -3.685 1.00 . A A . 12 LYS CA 1 1 11 4577 1 1 12 LYS CB C 5.761 7.092 -4.930 1.00 . A A . 12 LYS CB 1 1 11 4578 1 1 12 LYS CD C 5.500 9.593 -5.014 1.00 . A A . 12 LYS CD 1 1 11 4579 1 1 12 LYS CE C 5.128 10.103 -6.396 1.00 . A A . 12 LYS CE 1 1 11 4580 1 1 12 LYS CG C 4.821 8.268 -4.706 1.00 . A A . 12 LYS CG 1 1 11 4581 1 1 12 LYS H H 6.942 4.804 -4.912 1.00 . A A . 12 LYS H 1 1 11 4582 1 1 12 LYS HA H 6.437 6.827 -2.915 1.00 . A A . 12 LYS HA 1 1 11 4583 1 1 12 LYS HB2 H 6.717 7.477 -5.252 1.00 . A A . 12 LYS HB2 1 1 11 4584 1 1 12 LYS HB3 H 5.350 6.475 -5.715 1.00 . A A . 12 LYS HB3 1 1 11 4585 1 1 12 LYS HD2 H 5.196 10.321 -4.278 1.00 . A A . 12 LYS HD2 1 1 11 4586 1 1 12 LYS HD3 H 6.571 9.456 -4.967 1.00 . A A . 12 LYS HD3 1 1 11 4587 1 1 12 LYS HE2 H 5.147 9.275 -7.089 1.00 . A A . 12 LYS HE2 1 1 11 4588 1 1 12 LYS HE3 H 4.131 10.516 -6.357 1.00 . A A . 12 LYS HE3 1 1 11 4589 1 1 12 LYS HG2 H 3.962 8.157 -5.350 1.00 . A A . 12 LYS HG2 1 1 11 4590 1 1 12 LYS HG3 H 4.502 8.269 -3.674 1.00 . A A . 12 LYS HG3 1 1 11 4591 1 1 12 LYS HZ1 H 6.069 11.959 -6.216 1.00 . A A . 12 LYS HZ1 1 1 11 4592 1 1 12 LYS HZ2 H 7.035 10.770 -6.931 1.00 . A A . 12 LYS HZ2 1 1 11 4593 1 1 12 LYS HZ3 H 5.784 11.489 -7.815 1.00 . A A . 12 LYS HZ3 1 1 11 4594 1 1 12 LYS N N 6.860 5.112 -3.986 1.00 . A A . 12 LYS N 1 1 11 4595 1 1 12 LYS NZ N 6.070 11.154 -6.873 1.00 . A A . 12 LYS NZ 1 1 11 4596 1 1 12 LYS O O 4.078 4.754 -3.692 1.00 . A A . 12 LYS O 1 1 11 4597 1 1 13 ASP C C 1.709 6.056 -2.577 1.00 . A A . 13 ASP C 1 1 11 4598 1 1 13 ASP CA C 2.834 5.982 -1.553 1.00 . A A . 13 ASP CA 1 1 11 4599 1 1 13 ASP CB C 2.498 6.850 -0.338 1.00 . A A . 13 ASP CB 1 1 11 4600 1 1 13 ASP CG C 3.634 6.907 0.667 1.00 . A A . 13 ASP CG 1 1 11 4601 1 1 13 ASP H H 4.593 7.136 -1.757 1.00 . A A . 13 ASP H 1 1 11 4602 1 1 13 ASP HA H 2.931 4.963 -1.234 1.00 . A A . 13 ASP HA 1 1 11 4603 1 1 13 ASP HB2 H 2.281 7.853 -0.665 1.00 . A A . 13 ASP HB2 1 1 11 4604 1 1 13 ASP HB3 H 1.629 6.444 0.155 1.00 . A A . 13 ASP HB3 1 1 11 4605 1 1 13 ASP N N 4.108 6.377 -2.137 1.00 . A A . 13 ASP N 1 1 11 4606 1 1 13 ASP O O 0.787 5.241 -2.560 1.00 . A A . 13 ASP O 1 1 11 4607 1 1 13 ASP OD1 O 4.708 6.334 0.385 1.00 . A A . 13 ASP OD1 1 1 11 4608 1 1 13 ASP OD2 O 3.449 7.527 1.735 1.00 . A A . 13 ASP OD2 1 1 11 4609 1 1 14 SER C C 0.597 5.938 -5.317 1.00 . A A . 14 SER C 1 1 11 4610 1 1 14 SER CA C 0.792 7.219 -4.510 1.00 . A A . 14 SER CA 1 1 11 4611 1 1 14 SER CB C 1.195 8.364 -5.440 1.00 . A A . 14 SER CB 1 1 11 4612 1 1 14 SER H H 2.559 7.649 -3.429 1.00 . A A . 14 SER H 1 1 11 4613 1 1 14 SER HA H -0.142 7.470 -4.028 1.00 . A A . 14 SER HA 1 1 11 4614 1 1 14 SER HB2 H 1.760 9.096 -4.883 1.00 . A A . 14 SER HB2 1 1 11 4615 1 1 14 SER HB3 H 1.803 7.975 -6.244 1.00 . A A . 14 SER HB3 1 1 11 4616 1 1 14 SER N N 1.796 7.035 -3.468 1.00 . A A . 14 SER N 1 1 11 4617 1 1 14 SER O O -0.505 5.641 -5.775 1.00 . A A . 14 SER O 1 1 11 4618 1 1 14 SER OG O 0.054 8.996 -5.995 1.00 . A A . 14 SER OG 1 1 11 4619 1 1 15 ASP C C 0.535 3.013 -5.769 1.00 . A A . 15 ASP C 1 1 11 4620 1 1 15 ASP CA C 1.642 3.944 -6.259 1.00 . A A . 15 ASP CA 1 1 11 4621 1 1 15 ASP CB C 2.995 3.231 -6.181 1.00 . A A . 15 ASP CB 1 1 11 4622 1 1 15 ASP CG C 3.525 2.846 -7.548 1.00 . A A . 15 ASP CG 1 1 11 4623 1 1 15 ASP H H 2.536 5.480 -5.108 1.00 . A A . 15 ASP H 1 1 11 4624 1 1 15 ASP HA H 1.445 4.199 -7.289 1.00 . A A . 15 ASP HA 1 1 11 4625 1 1 15 ASP HB2 H 3.713 3.886 -5.710 1.00 . A A . 15 ASP HB2 1 1 11 4626 1 1 15 ASP HB3 H 2.891 2.334 -5.590 1.00 . A A . 15 ASP HB3 1 1 11 4627 1 1 15 ASP N N 1.683 5.188 -5.497 1.00 . A A . 15 ASP N 1 1 11 4628 1 1 15 ASP O O -0.060 2.279 -6.557 1.00 . A A . 15 ASP O 1 1 11 4629 1 1 15 ASP OD1 O 3.876 3.758 -8.327 1.00 . A A . 15 ASP OD1 1 1 11 4630 1 1 15 ASP OD2 O 3.589 1.634 -7.841 1.00 . A A . 15 ASP OD2 1 1 11 4631 1 1 16 CYS C C -2.046 2.230 -4.665 1.00 . A A . 16 CYS C 1 1 11 4632 1 1 16 CYS CA C -0.746 2.167 -3.875 1.00 . A A . 16 CYS CA 1 1 11 4633 1 1 16 CYS CB C -0.998 2.539 -2.409 1.00 . A A . 16 CYS CB 1 1 11 4634 1 1 16 CYS H H 0.794 3.625 -3.882 1.00 . A A . 16 CYS H 1 1 11 4635 1 1 16 CYS HA H -0.374 1.153 -3.914 1.00 . A A . 16 CYS HA 1 1 11 4636 1 1 16 CYS HB2 H -0.092 2.916 -1.987 1.00 . A A . 16 CYS HB2 1 1 11 4637 1 1 16 CYS HB3 H -1.749 3.310 -2.362 1.00 . A A . 16 CYS HB3 1 1 11 4638 1 1 16 CYS N N 0.277 3.030 -4.463 1.00 . A A . 16 CYS N 1 1 11 4639 1 1 16 CYS O O -2.200 3.046 -5.574 1.00 . A A . 16 CYS O 1 1 11 4640 1 1 16 CYS SG S -1.548 1.150 -1.359 1.00 . A A . 16 CYS SG 1 1 11 4641 1 1 17 LEU C C -5.395 1.710 -4.054 1.00 . A A . 17 LEU C 1 1 11 4642 1 1 17 LEU CA C -4.265 1.287 -4.986 1.00 . A A . 17 LEU CA 1 1 11 4643 1 1 17 LEU CB C -4.522 -0.130 -5.503 1.00 . A A . 17 LEU CB 1 1 11 4644 1 1 17 LEU CD1 C -6.064 -1.407 -3.994 1.00 . A A . 17 LEU CD1 1 1 11 4645 1 1 17 LEU CD2 C -4.021 -2.516 -4.915 1.00 . A A . 17 LEU CD2 1 1 11 4646 1 1 17 LEU CG C -4.617 -1.207 -4.420 1.00 . A A . 17 LEU CG 1 1 11 4647 1 1 17 LEU H H -2.780 0.731 -3.582 1.00 . A A . 17 LEU H 1 1 11 4648 1 1 17 LEU HA H -4.236 1.965 -5.825 1.00 . A A . 17 LEU HA 1 1 11 4649 1 1 17 LEU HB2 H -5.447 -0.125 -6.060 1.00 . A A . 17 LEU HB2 1 1 11 4650 1 1 17 LEU HB3 H -3.718 -0.397 -6.173 1.00 . A A . 17 LEU HB3 1 1 11 4651 1 1 17 LEU HD11 H -6.635 -0.522 -4.231 1.00 . A A . 17 LEU HD11 1 1 11 4652 1 1 17 LEU HD12 H -6.479 -2.255 -4.518 1.00 . A A . 17 LEU HD12 1 1 11 4653 1 1 17 LEU HD13 H -6.104 -1.587 -2.929 1.00 . A A . 17 LEU HD13 1 1 11 4654 1 1 17 LEU HD21 H -4.095 -2.560 -5.991 1.00 . A A . 17 LEU HD21 1 1 11 4655 1 1 17 LEU HD22 H -2.982 -2.571 -4.624 1.00 . A A . 17 LEU HD22 1 1 11 4656 1 1 17 LEU HD23 H -4.561 -3.344 -4.482 1.00 . A A . 17 LEU HD23 1 1 11 4657 1 1 17 LEU HG H -4.056 -0.888 -3.553 1.00 . A A . 17 LEU HG 1 1 11 4658 1 1 17 LEU N N -2.973 1.353 -4.312 1.00 . A A . 17 LEU N 1 1 11 4659 1 1 17 LEU O O -5.197 1.852 -2.847 1.00 . A A . 17 LEU O 1 1 11 4660 1 1 18 ALA C C -7.425 3.559 -3.005 1.00 . A A . 18 ALA C 1 1 11 4661 1 1 18 ALA CA C -7.742 2.317 -3.845 1.00 . A A . 18 ALA CA 1 1 11 4662 1 1 18 ALA CB C -8.218 1.158 -2.976 1.00 . A A . 18 ALA CB 1 1 11 4663 1 1 18 ALA H H -6.674 1.780 -5.591 1.00 . A A . 18 ALA H 1 1 11 4664 1 1 18 ALA HA H -8.535 2.562 -4.540 1.00 . A A . 18 ALA HA 1 1 11 4665 1 1 18 ALA HB1 H -8.433 0.304 -3.601 1.00 . A A . 18 ALA HB1 1 1 11 4666 1 1 18 ALA HB2 H -9.111 1.450 -2.445 1.00 . A A . 18 ALA HB2 1 1 11 4667 1 1 18 ALA HB3 H -7.446 0.899 -2.267 1.00 . A A . 18 ALA HB3 1 1 11 4668 1 1 18 ALA N N -6.580 1.910 -4.624 1.00 . A A . 18 ALA N 1 1 11 4669 1 1 18 ALA O O -6.987 4.575 -3.543 1.00 . A A . 18 ALA O 1 1 11 4670 1 1 19 GLU C C -6.369 4.210 0.277 1.00 . A A . 19 GLU C 1 1 11 4671 1 1 19 GLU CA C -7.363 4.606 -0.811 1.00 . A A . 19 GLU CA 1 1 11 4672 1 1 19 GLU CB C -8.659 5.117 -0.179 1.00 . A A . 19 GLU CB 1 1 11 4673 1 1 19 GLU CD C -9.932 7.243 -0.684 1.00 . A A . 19 GLU CD 1 1 11 4674 1 1 19 GLU CG C -8.708 6.630 -0.031 1.00 . A A . 19 GLU CG 1 1 11 4675 1 1 19 GLU H H -7.986 2.650 -1.308 1.00 . A A . 19 GLU H 1 1 11 4676 1 1 19 GLU HA H -6.929 5.395 -1.408 1.00 . A A . 19 GLU HA 1 1 11 4677 1 1 19 GLU HB2 H -9.491 4.810 -0.794 1.00 . A A . 19 GLU HB2 1 1 11 4678 1 1 19 GLU HB3 H -8.765 4.677 0.802 1.00 . A A . 19 GLU HB3 1 1 11 4679 1 1 19 GLU HG2 H -8.720 6.876 1.020 1.00 . A A . 19 GLU HG2 1 1 11 4680 1 1 19 GLU HG3 H -7.825 7.052 -0.488 1.00 . A A . 19 GLU HG3 1 1 11 4681 1 1 19 GLU N N -7.640 3.480 -1.693 1.00 . A A . 19 GLU N 1 1 11 4682 1 1 19 GLU O O -6.639 4.369 1.467 1.00 . A A . 19 GLU O 1 1 11 4683 1 1 19 GLU OE1 O -10.208 6.912 -1.857 1.00 . A A . 19 GLU OE1 1 1 11 4684 1 1 19 GLU OE2 O -10.615 8.053 -0.023 1.00 . A A . 19 GLU OE2 1 1 11 4685 1 1 20 CYS C C -2.838 3.872 0.390 1.00 . A A . 20 CYS C 1 1 11 4686 1 1 20 CYS CA C -4.181 3.289 0.801 1.00 . A A . 20 CYS CA 1 1 11 4687 1 1 20 CYS CB C -4.098 1.762 0.873 1.00 . A A . 20 CYS CB 1 1 11 4688 1 1 20 CYS H H -5.045 3.599 -1.102 1.00 . A A . 20 CYS H 1 1 11 4689 1 1 20 CYS HA H -4.446 3.674 1.774 1.00 . A A . 20 CYS HA 1 1 11 4690 1 1 20 CYS HB2 H -4.440 1.346 -0.063 1.00 . A A . 20 CYS HB2 1 1 11 4691 1 1 20 CYS HB3 H -3.070 1.473 1.036 1.00 . A A . 20 CYS HB3 1 1 11 4692 1 1 20 CYS N N -5.213 3.698 -0.139 1.00 . A A . 20 CYS N 1 1 11 4693 1 1 20 CYS O O -2.740 4.571 -0.617 1.00 . A A . 20 CYS O 1 1 11 4694 1 1 20 CYS SG S -5.102 1.028 2.205 1.00 . A A . 20 CYS SG 1 1 11 4695 1 1 21 VAL C C 0.541 2.981 0.712 1.00 . A A . 21 VAL C 1 1 11 4696 1 1 21 VAL CA C -0.478 4.105 0.873 1.00 . A A . 21 VAL CA 1 1 11 4697 1 1 21 VAL CB C 0.008 5.083 1.962 1.00 . A A . 21 VAL CB 1 1 11 4698 1 1 21 VAL CG1 C -0.985 6.221 2.138 1.00 . A A . 21 VAL CG1 1 1 11 4699 1 1 21 VAL CG2 C 0.232 4.357 3.282 1.00 . A A . 21 VAL CG2 1 1 11 4700 1 1 21 VAL H H -1.938 3.032 1.966 1.00 . A A . 21 VAL H 1 1 11 4701 1 1 21 VAL HA H -0.539 4.649 -0.058 1.00 . A A . 21 VAL HA 1 1 11 4702 1 1 21 VAL HB H 0.951 5.505 1.643 1.00 . A A . 21 VAL HB 1 1 11 4703 1 1 21 VAL HG11 H -1.107 6.740 1.198 1.00 . A A . 21 VAL HG11 1 1 11 4704 1 1 21 VAL HG12 H -1.937 5.822 2.456 1.00 . A A . 21 VAL HG12 1 1 11 4705 1 1 21 VAL HG13 H -0.615 6.909 2.884 1.00 . A A . 21 VAL HG13 1 1 11 4706 1 1 21 VAL HG21 H 0.912 3.531 3.128 1.00 . A A . 21 VAL HG21 1 1 11 4707 1 1 21 VAL HG22 H 0.654 5.041 4.003 1.00 . A A . 21 VAL HG22 1 1 11 4708 1 1 21 VAL HG23 H -0.711 3.982 3.651 1.00 . A A . 21 VAL HG23 1 1 11 4709 1 1 21 VAL N N -1.806 3.591 1.173 1.00 . A A . 21 VAL N 1 1 11 4710 1 1 21 VAL O O 0.349 1.870 1.202 1.00 . A A . 21 VAL O 1 1 11 4711 1 1 22 CYS C C 3.846 2.592 0.765 1.00 . A A . 22 CYS C 1 1 11 4712 1 1 22 CYS CA C 2.708 2.352 -0.223 1.00 . A A . 22 CYS CA 1 1 11 4713 1 1 22 CYS CB C 3.225 2.490 -1.663 1.00 . A A . 22 CYS CB 1 1 11 4714 1 1 22 CYS H H 1.698 4.206 -0.326 1.00 . A A . 22 CYS H 1 1 11 4715 1 1 22 CYS HA H 2.320 1.355 -0.077 1.00 . A A . 22 CYS HA 1 1 11 4716 1 1 22 CYS HB2 H 3.229 3.530 -1.937 1.00 . A A . 22 CYS HB2 1 1 11 4717 1 1 22 CYS HB3 H 4.231 2.113 -1.721 1.00 . A A . 22 CYS HB3 1 1 11 4718 1 1 22 CYS N N 1.625 3.302 0.023 1.00 . A A . 22 CYS N 1 1 11 4719 1 1 22 CYS O O 4.253 3.731 0.991 1.00 . A A . 22 CYS O 1 1 11 4720 1 1 22 CYS SG S 2.227 1.607 -2.903 1.00 . A A . 22 CYS SG 1 1 11 4721 1 1 23 LEU C C 6.775 1.286 1.714 1.00 . A A . 23 LEU C 1 1 11 4722 1 1 23 LEU CA C 5.424 1.618 2.340 1.00 . A A . 23 LEU CA 1 1 11 4723 1 1 23 LEU CB C 5.154 0.690 3.525 1.00 . A A . 23 LEU CB 1 1 11 4724 1 1 23 LEU CD1 C 3.334 -0.600 4.678 1.00 . A A . 23 LEU CD1 1 1 11 4725 1 1 23 LEU CD2 C 3.592 1.854 5.103 1.00 . A A . 23 LEU CD2 1 1 11 4726 1 1 23 LEU CG C 3.726 0.741 4.073 1.00 . A A . 23 LEU CG 1 1 11 4727 1 1 23 LEU H H 3.973 0.634 1.153 1.00 . A A . 23 LEU H 1 1 11 4728 1 1 23 LEU HA H 5.450 2.638 2.695 1.00 . A A . 23 LEU HA 1 1 11 4729 1 1 23 LEU HB2 H 5.364 -0.324 3.216 1.00 . A A . 23 LEU HB2 1 1 11 4730 1 1 23 LEU HB3 H 5.831 0.954 4.322 1.00 . A A . 23 LEU HB3 1 1 11 4731 1 1 23 LEU HD11 H 4.189 -1.259 4.680 1.00 . A A . 23 LEU HD11 1 1 11 4732 1 1 23 LEU HD12 H 2.989 -0.454 5.691 1.00 . A A . 23 LEU HD12 1 1 11 4733 1 1 23 LEU HD13 H 2.543 -1.042 4.089 1.00 . A A . 23 LEU HD13 1 1 11 4734 1 1 23 LEU HD21 H 4.260 2.663 4.847 1.00 . A A . 23 LEU HD21 1 1 11 4735 1 1 23 LEU HD22 H 2.574 2.215 5.113 1.00 . A A . 23 LEU HD22 1 1 11 4736 1 1 23 LEU HD23 H 3.848 1.472 6.080 1.00 . A A . 23 LEU HD23 1 1 11 4737 1 1 23 LEU HG H 3.044 0.953 3.262 1.00 . A A . 23 LEU HG 1 1 11 4738 1 1 23 LEU N N 4.345 1.515 1.364 1.00 . A A . 23 LEU N 1 1 11 4739 1 1 23 LEU O O 6.874 0.418 0.846 1.00 . A A . 23 LEU O 1 1 11 4740 1 1 24 GLU C C 9.602 0.333 1.786 1.00 . A A . 24 GLU C 1 1 11 4741 1 1 24 GLU CA C 9.164 1.790 1.655 1.00 . A A . 24 GLU CA 1 1 11 4742 1 1 24 GLU CB C 10.150 2.697 2.396 1.00 . A A . 24 GLU CB 1 1 11 4743 1 1 24 GLU CD C 9.837 4.098 4.477 1.00 . A A . 24 GLU CD 1 1 11 4744 1 1 24 GLU CG C 9.962 2.698 3.905 1.00 . A A . 24 GLU CG 1 1 11 4745 1 1 24 GLU H H 7.659 2.669 2.854 1.00 . A A . 24 GLU H 1 1 11 4746 1 1 24 GLU HA H 9.165 2.057 0.610 1.00 . A A . 24 GLU HA 1 1 11 4747 1 1 24 GLU HB2 H 11.156 2.367 2.181 1.00 . A A . 24 GLU HB2 1 1 11 4748 1 1 24 GLU HB3 H 10.028 3.708 2.038 1.00 . A A . 24 GLU HB3 1 1 11 4749 1 1 24 GLU HG2 H 9.065 2.148 4.145 1.00 . A A . 24 GLU HG2 1 1 11 4750 1 1 24 GLU HG3 H 10.814 2.214 4.361 1.00 . A A . 24 GLU HG3 1 1 11 4751 1 1 24 GLU N N 7.811 1.991 2.164 1.00 . A A . 24 GLU N 1 1 11 4752 1 1 24 GLU O O 10.144 -0.244 0.844 1.00 . A A . 24 GLU O 1 1 11 4753 1 1 24 GLU OE1 O 10.403 5.036 3.879 1.00 . A A . 24 GLU OE1 1 1 11 4754 1 1 24 GLU OE2 O 9.171 4.254 5.522 1.00 . A A . 24 GLU OE2 1 1 11 4755 1 1 25 HIS C C 9.133 -2.559 2.127 1.00 . A A . 25 HIS C 1 1 11 4756 1 1 25 HIS CA C 9.747 -1.652 3.186 1.00 . A A . 25 HIS CA 1 1 11 4757 1 1 25 HIS CB C 9.342 -2.128 4.590 1.00 . A A . 25 HIS CB 1 1 11 4758 1 1 25 HIS CD2 C 6.858 -1.684 5.206 1.00 . A A . 25 HIS CD2 1 1 11 4759 1 1 25 HIS CE1 C 7.134 0.191 6.308 1.00 . A A . 25 HIS CE1 1 1 11 4760 1 1 25 HIS CG C 8.180 -1.393 5.189 1.00 . A A . 25 HIS CG 1 1 11 4761 1 1 25 HIS H H 8.932 0.248 3.668 1.00 . A A . 25 HIS H 1 1 11 4762 1 1 25 HIS HA H 10.822 -1.710 3.098 1.00 . A A . 25 HIS HA 1 1 11 4763 1 1 25 HIS HB2 H 9.075 -3.172 4.541 1.00 . A A . 25 HIS HB2 1 1 11 4764 1 1 25 HIS HB3 H 10.186 -2.011 5.255 1.00 . A A . 25 HIS HB3 1 1 11 4765 1 1 25 HIS HD1 H 9.162 0.263 6.049 1.00 . A A . 25 HIS HD1 1 1 11 4766 1 1 25 HIS HD2 H 6.386 -2.543 4.750 1.00 . A A . 25 HIS HD2 1 1 11 4767 1 1 25 HIS HE1 H 6.936 1.084 6.881 1.00 . A A . 25 HIS HE1 1 1 11 4768 1 1 25 HIS HE2 H 5.297 -0.705 6.207 1.00 . A A . 25 HIS HE2 1 1 11 4769 1 1 25 HIS N N 9.367 -0.259 2.955 1.00 . A A . 25 HIS N 1 1 11 4770 1 1 25 HIS ND1 N 8.319 -0.211 5.886 1.00 . A A . 25 HIS ND1 1 1 11 4771 1 1 25 HIS NE2 N 6.229 -0.686 5.908 1.00 . A A . 25 HIS NE2 1 1 11 4772 1 1 25 HIS O O 9.657 -3.635 1.837 1.00 . A A . 25 HIS O 1 1 11 4773 1 1 26 GLY C C 6.040 -3.452 0.939 1.00 . A A . 26 GLY C 1 1 11 4774 1 1 26 GLY CA C 7.377 -2.884 0.507 1.00 . A A . 26 GLY CA 1 1 11 4775 1 1 26 GLY H H 7.664 -1.240 1.802 1.00 . A A . 26 GLY H 1 1 11 4776 1 1 26 GLY HA2 H 8.025 -3.700 0.220 1.00 . A A . 26 GLY HA2 1 1 11 4777 1 1 26 GLY HA3 H 7.222 -2.247 -0.350 1.00 . A A . 26 GLY HA3 1 1 11 4778 1 1 26 GLY N N 8.030 -2.110 1.539 1.00 . A A . 26 GLY N 1 1 11 4779 1 1 26 GLY O O 5.885 -4.668 1.049 1.00 . A A . 26 GLY O 1 1 11 4780 1 1 27 TYR C C 2.729 -1.857 1.475 1.00 . A A . 27 TYR C 1 1 11 4781 1 1 27 TYR CA C 3.734 -3.002 1.586 1.00 . A A . 27 TYR CA 1 1 11 4782 1 1 27 TYR CB C 3.760 -3.525 3.024 1.00 . A A . 27 TYR CB 1 1 11 4783 1 1 27 TYR CD1 C 3.693 -5.974 2.409 1.00 . A A . 27 TYR CD1 1 1 11 4784 1 1 27 TYR CD2 C 5.302 -5.258 4.016 1.00 . A A . 27 TYR CD2 1 1 11 4785 1 1 27 TYR CE1 C 4.150 -7.273 2.525 1.00 . A A . 27 TYR CE1 1 1 11 4786 1 1 27 TYR CE2 C 5.764 -6.555 4.137 1.00 . A A . 27 TYR CE2 1 1 11 4787 1 1 27 TYR CG C 4.260 -4.946 3.152 1.00 . A A . 27 TYR CG 1 1 11 4788 1 1 27 TYR CZ C 5.185 -7.558 3.389 1.00 . A A . 27 TYR CZ 1 1 11 4789 1 1 27 TYR H H 5.251 -1.617 1.060 1.00 . A A . 27 TYR H 1 1 11 4790 1 1 27 TYR HA H 3.425 -3.800 0.929 1.00 . A A . 27 TYR HA 1 1 11 4791 1 1 27 TYR HB2 H 4.405 -2.895 3.612 1.00 . A A . 27 TYR HB2 1 1 11 4792 1 1 27 TYR HB3 H 2.760 -3.487 3.431 1.00 . A A . 27 TYR HB3 1 1 11 4793 1 1 27 TYR HD1 H 2.883 -5.747 1.732 1.00 . A A . 27 TYR HD1 1 1 11 4794 1 1 27 TYR HD2 H 5.753 -4.471 4.602 1.00 . A A . 27 TYR HD2 1 1 11 4795 1 1 27 TYR HE1 H 3.697 -8.059 1.939 1.00 . A A . 27 TYR HE1 1 1 11 4796 1 1 27 TYR HE2 H 6.575 -6.778 4.815 1.00 . A A . 27 TYR HE2 1 1 11 4797 1 1 27 TYR HH H 6.431 -8.961 2.969 1.00 . A A . 27 TYR HH 1 1 11 4798 1 1 27 TYR N N 5.068 -2.574 1.174 1.00 . A A . 27 TYR N 1 1 11 4799 1 1 27 TYR O O 3.058 -0.700 1.740 1.00 . A A . 27 TYR O 1 1 11 4800 1 1 27 TYR OH O 5.643 -8.851 3.507 1.00 . A A . 27 TYR OH 1 1 11 4801 1 1 28 CYS C C -0.463 -1.195 2.170 1.00 . A A . 28 CYS C 1 1 11 4802 1 1 28 CYS CA C 0.443 -1.194 0.943 1.00 . A A . 28 CYS CA 1 1 11 4803 1 1 28 CYS CB C -0.393 -1.474 -0.313 1.00 . A A . 28 CYS CB 1 1 11 4804 1 1 28 CYS H H 1.305 -3.130 0.889 1.00 . A A . 28 CYS H 1 1 11 4805 1 1 28 CYS HA H 0.908 -0.225 0.849 1.00 . A A . 28 CYS HA 1 1 11 4806 1 1 28 CYS HB2 H -0.142 -2.454 -0.689 1.00 . A A . 28 CYS HB2 1 1 11 4807 1 1 28 CYS HB3 H -1.441 -1.454 -0.050 1.00 . A A . 28 CYS HB3 1 1 11 4808 1 1 28 CYS N N 1.502 -2.190 1.085 1.00 . A A . 28 CYS N 1 1 11 4809 1 1 28 CYS O O -1.171 -2.167 2.430 1.00 . A A . 28 CYS O 1 1 11 4810 1 1 28 CYS SG S -0.138 -0.282 -1.667 1.00 . A A . 28 CYS SG 1 1 11 4811 1 1 29 GLY C C -2.432 0.939 3.932 1.00 . A A . 29 GLY C 1 1 11 4812 1 1 29 GLY CA C -1.253 0.003 4.115 1.00 . A A . 29 GLY CA 1 1 11 4813 1 1 29 GLY H H 0.152 0.643 2.668 1.00 . A A . 29 GLY H 1 1 11 4814 1 1 29 GLY HA2 H -0.643 0.367 4.929 1.00 . A A . 29 GLY HA2 1 1 11 4815 1 1 29 GLY HA3 H -1.624 -0.979 4.371 1.00 . A A . 29 GLY HA3 1 1 11 4816 1 1 29 GLY N N -0.432 -0.100 2.924 1.00 . A A . 29 GLY N 1 1 11 4817 1 1 29 GLY O O -2.325 1.874 3.110 1.00 . A A . 29 GLY O 1 1 11 4818 1 1 29 GLY OXT O -3.462 0.738 4.609 1.00 . A A . 29 GLY OXT 1 1 12 4819 1 1 1 ARG C C -9.321 2.103 4.110 1.00 . A A . 1 ARG C 1 1 12 4820 1 1 1 ARG CA C -8.501 3.296 4.594 1.00 . A A . 1 ARG CA 1 1 12 4821 1 1 1 ARG CB C -8.723 3.513 6.092 1.00 . A A . 1 ARG CB 1 1 12 4822 1 1 1 ARG CD C -8.604 5.916 6.824 1.00 . A A . 1 ARG CD 1 1 12 4823 1 1 1 ARG CG C -7.847 4.604 6.687 1.00 . A A . 1 ARG CG 1 1 12 4824 1 1 1 ARG CZ C -8.768 6.279 9.256 1.00 . A A . 1 ARG CZ 1 1 12 4825 1 1 1 ARG H1 H -9.921 4.587 3.848 1.00 . A A . 1 ARG H1 1 1 12 4826 1 1 1 ARG H2 H -8.484 5.345 4.400 1.00 . A A . 1 ARG H2 1 1 12 4827 1 1 1 ARG H3 H -8.483 4.488 2.916 1.00 . A A . 1 ARG H3 1 1 12 4828 1 1 1 ARG HA H -7.455 3.102 4.415 1.00 . A A . 1 ARG HA 1 1 12 4829 1 1 1 ARG HB2 H -9.757 3.782 6.256 1.00 . A A . 1 ARG HB2 1 1 12 4830 1 1 1 ARG HB3 H -8.515 2.590 6.612 1.00 . A A . 1 ARG HB3 1 1 12 4831 1 1 1 ARG HD2 H -8.352 6.552 5.989 1.00 . A A . 1 ARG HD2 1 1 12 4832 1 1 1 ARG HD3 H -9.664 5.707 6.810 1.00 . A A . 1 ARG HD3 1 1 12 4833 1 1 1 ARG HE H -7.650 7.365 8.010 1.00 . A A . 1 ARG HE 1 1 12 4834 1 1 1 ARG HG2 H -7.512 4.290 7.664 1.00 . A A . 1 ARG HG2 1 1 12 4835 1 1 1 ARG HG3 H -6.993 4.757 6.044 1.00 . A A . 1 ARG HG3 1 1 12 4836 1 1 1 ARG HH11 H -9.884 4.741 8.562 1.00 . A A . 1 ARG HH11 1 1 12 4837 1 1 1 ARG HH12 H -9.983 5.018 10.267 1.00 . A A . 1 ARG HH12 1 1 12 4838 1 1 1 ARG HH21 H -7.780 7.731 10.255 1.00 . A A . 1 ARG HH21 1 1 12 4839 1 1 1 ARG HH22 H -8.789 6.715 11.229 1.00 . A A . 1 ARG HH22 1 1 12 4840 1 1 1 ARG N N -8.882 4.542 3.875 1.00 . A A . 1 ARG N 1 1 12 4841 1 1 1 ARG NE N -8.274 6.611 8.066 1.00 . A A . 1 ARG NE 1 1 12 4842 1 1 1 ARG NH1 N -9.615 5.262 9.371 1.00 . A A . 1 ARG NH1 1 1 12 4843 1 1 1 ARG NH2 N -8.417 6.964 10.335 1.00 . A A . 1 ARG NH2 1 1 12 4844 1 1 1 ARG O O -9.457 1.105 4.817 1.00 . A A . 1 ARG O 1 1 12 4845 1 1 2 VAL C C -9.943 0.469 1.163 1.00 . A A . 2 VAL C 1 1 12 4846 1 1 2 VAL CA C -10.669 1.140 2.327 1.00 . A A . 2 VAL CA 1 1 12 4847 1 1 2 VAL CB C -12.034 1.663 1.837 1.00 . A A . 2 VAL CB 1 1 12 4848 1 1 2 VAL CG1 C -12.955 1.936 3.015 1.00 . A A . 2 VAL CG1 1 1 12 4849 1 1 2 VAL CG2 C -11.853 2.914 0.990 1.00 . A A . 2 VAL CG2 1 1 12 4850 1 1 2 VAL H H -9.722 3.030 2.383 1.00 . A A . 2 VAL H 1 1 12 4851 1 1 2 VAL HA H -10.846 0.405 3.099 1.00 . A A . 2 VAL HA 1 1 12 4852 1 1 2 VAL HB H -12.489 0.901 1.222 1.00 . A A . 2 VAL HB 1 1 12 4853 1 1 2 VAL HG11 H -12.364 2.138 3.896 1.00 . A A . 2 VAL HG11 1 1 12 4854 1 1 2 VAL HG12 H -13.578 2.791 2.796 1.00 . A A . 2 VAL HG12 1 1 12 4855 1 1 2 VAL HG13 H -13.581 1.073 3.191 1.00 . A A . 2 VAL HG13 1 1 12 4856 1 1 2 VAL HG21 H -11.187 2.700 0.169 1.00 . A A . 2 VAL HG21 1 1 12 4857 1 1 2 VAL HG22 H -12.812 3.228 0.604 1.00 . A A . 2 VAL HG22 1 1 12 4858 1 1 2 VAL HG23 H -11.434 3.702 1.598 1.00 . A A . 2 VAL HG23 1 1 12 4859 1 1 2 VAL N N -9.865 2.211 2.901 1.00 . A A . 2 VAL N 1 1 12 4860 1 1 2 VAL O O -10.326 0.631 0.004 1.00 . A A . 2 VAL O 1 1 12 4861 1 1 3 CYS C C -8.014 -2.471 0.774 1.00 . A A . 3 CYS C 1 1 12 4862 1 1 3 CYS CA C -8.117 -0.978 0.459 1.00 . A A . 3 CYS CA 1 1 12 4863 1 1 3 CYS CB C -6.719 -0.364 0.345 1.00 . A A . 3 CYS CB 1 1 12 4864 1 1 3 CYS H H -8.639 -0.375 2.420 1.00 . A A . 3 CYS H 1 1 12 4865 1 1 3 CYS HA H -8.630 -0.854 -0.483 1.00 . A A . 3 CYS HA 1 1 12 4866 1 1 3 CYS HB2 H -6.246 -0.730 -0.554 1.00 . A A . 3 CYS HB2 1 1 12 4867 1 1 3 CYS HB3 H -6.810 0.710 0.284 1.00 . A A . 3 CYS HB3 1 1 12 4868 1 1 3 CYS N N -8.895 -0.283 1.479 1.00 . A A . 3 CYS N 1 1 12 4869 1 1 3 CYS O O -7.665 -2.852 1.891 1.00 . A A . 3 CYS O 1 1 12 4870 1 1 3 CYS SG S -5.611 -0.750 1.743 1.00 . A A . 3 CYS SG 1 1 12 4871 1 1 4 PRO C C -6.960 -5.241 0.655 1.00 . A A . 4 PRO C 1 1 12 4872 1 1 4 PRO CA C -8.250 -4.795 -0.022 1.00 . A A . 4 PRO CA 1 1 12 4873 1 1 4 PRO CB C -8.311 -5.329 -1.452 1.00 . A A . 4 PRO CB 1 1 12 4874 1 1 4 PRO CD C -8.739 -2.980 -1.576 1.00 . A A . 4 PRO CD 1 1 12 4875 1 1 4 PRO CG C -9.093 -4.306 -2.197 1.00 . A A . 4 PRO CG 1 1 12 4876 1 1 4 PRO HA H -9.096 -5.160 0.539 1.00 . A A . 4 PRO HA 1 1 12 4877 1 1 4 PRO HB2 H -7.309 -5.426 -1.846 1.00 . A A . 4 PRO HB2 1 1 12 4878 1 1 4 PRO HB3 H -8.803 -6.288 -1.461 1.00 . A A . 4 PRO HB3 1 1 12 4879 1 1 4 PRO HD2 H -7.931 -2.514 -2.120 1.00 . A A . 4 PRO HD2 1 1 12 4880 1 1 4 PRO HD3 H -9.603 -2.332 -1.553 1.00 . A A . 4 PRO HD3 1 1 12 4881 1 1 4 PRO HG2 H -8.817 -4.319 -3.240 1.00 . A A . 4 PRO HG2 1 1 12 4882 1 1 4 PRO HG3 H -10.150 -4.499 -2.086 1.00 . A A . 4 PRO HG3 1 1 12 4883 1 1 4 PRO N N -8.315 -3.341 -0.209 1.00 . A A . 4 PRO N 1 1 12 4884 1 1 4 PRO O O -5.915 -4.607 0.503 1.00 . A A . 4 PRO O 1 1 12 4885 1 1 5 ARG C C -4.958 -7.610 1.127 1.00 . A A . 5 ARG C 1 1 12 4886 1 1 5 ARG CA C -5.872 -6.869 2.097 1.00 . A A . 5 ARG CA 1 1 12 4887 1 1 5 ARG CB C -6.308 -7.809 3.223 1.00 . A A . 5 ARG CB 1 1 12 4888 1 1 5 ARG CD C -8.395 -7.140 4.453 1.00 . A A . 5 ARG CD 1 1 12 4889 1 1 5 ARG CG C -6.876 -7.085 4.433 1.00 . A A . 5 ARG CG 1 1 12 4890 1 1 5 ARG CZ C -10.203 -6.318 5.914 1.00 . A A . 5 ARG CZ 1 1 12 4891 1 1 5 ARG H H -7.896 -6.803 1.482 1.00 . A A . 5 ARG H 1 1 12 4892 1 1 5 ARG HA H -5.331 -6.038 2.521 1.00 . A A . 5 ARG HA 1 1 12 4893 1 1 5 ARG HB2 H -7.063 -8.481 2.844 1.00 . A A . 5 ARG HB2 1 1 12 4894 1 1 5 ARG HB3 H -5.453 -8.386 3.544 1.00 . A A . 5 ARG HB3 1 1 12 4895 1 1 5 ARG HD2 H -8.765 -6.874 3.475 1.00 . A A . 5 ARG HD2 1 1 12 4896 1 1 5 ARG HD3 H -8.702 -8.146 4.693 1.00 . A A . 5 ARG HD3 1 1 12 4897 1 1 5 ARG HE H -8.390 -5.496 5.764 1.00 . A A . 5 ARG HE 1 1 12 4898 1 1 5 ARG HG2 H -6.497 -7.552 5.330 1.00 . A A . 5 ARG HG2 1 1 12 4899 1 1 5 ARG HG3 H -6.562 -6.052 4.403 1.00 . A A . 5 ARG HG3 1 1 12 4900 1 1 5 ARG HH11 H -10.686 -7.950 4.820 1.00 . A A . 5 ARG HH11 1 1 12 4901 1 1 5 ARG HH12 H -11.939 -7.353 5.857 1.00 . A A . 5 ARG HH12 1 1 12 4902 1 1 5 ARG HH21 H -10.037 -4.710 7.128 1.00 . A A . 5 ARG HH21 1 1 12 4903 1 1 5 ARG HH22 H -11.570 -5.514 7.166 1.00 . A A . 5 ARG HH22 1 1 12 4904 1 1 5 ARG N N -7.037 -6.338 1.401 1.00 . A A . 5 ARG N 1 1 12 4905 1 1 5 ARG NE N -8.963 -6.222 5.439 1.00 . A A . 5 ARG NE 1 1 12 4906 1 1 5 ARG NH1 N -11.008 -7.287 5.496 1.00 . A A . 5 ARG NH1 1 1 12 4907 1 1 5 ARG NH2 N -10.639 -5.443 6.809 1.00 . A A . 5 ARG NH2 1 1 12 4908 1 1 5 ARG O O -4.977 -8.838 1.054 1.00 . A A . 5 ARG O 1 1 12 4909 1 1 6 ILE C C -1.853 -6.806 -0.478 1.00 . A A . 6 ILE C 1 1 12 4910 1 1 6 ILE CA C -3.239 -7.434 -0.587 1.00 . A A . 6 ILE CA 1 1 12 4911 1 1 6 ILE CB C -3.759 -7.260 -2.026 1.00 . A A . 6 ILE CB 1 1 12 4912 1 1 6 ILE CD1 C -5.919 -7.219 -3.373 1.00 . A A . 6 ILE CD1 1 1 12 4913 1 1 6 ILE CG1 C -5.220 -7.702 -2.121 1.00 . A A . 6 ILE CG1 1 1 12 4914 1 1 6 ILE CG2 C -2.896 -8.048 -3.001 1.00 . A A . 6 ILE CG2 1 1 12 4915 1 1 6 ILE H H -4.194 -5.878 0.483 1.00 . A A . 6 ILE H 1 1 12 4916 1 1 6 ILE HA H -3.161 -8.491 -0.379 1.00 . A A . 6 ILE HA 1 1 12 4917 1 1 6 ILE HB H -3.688 -6.216 -2.287 1.00 . A A . 6 ILE HB 1 1 12 4918 1 1 6 ILE HD11 H -5.278 -7.379 -4.227 1.00 . A A . 6 ILE HD11 1 1 12 4919 1 1 6 ILE HD12 H -6.840 -7.765 -3.505 1.00 . A A . 6 ILE HD12 1 1 12 4920 1 1 6 ILE HD13 H -6.136 -6.164 -3.279 1.00 . A A . 6 ILE HD13 1 1 12 4921 1 1 6 ILE HG12 H -5.265 -8.781 -2.113 1.00 . A A . 6 ILE HG12 1 1 12 4922 1 1 6 ILE HG13 H -5.761 -7.318 -1.269 1.00 . A A . 6 ILE HG13 1 1 12 4923 1 1 6 ILE HG21 H -1.926 -8.224 -2.562 1.00 . A A . 6 ILE HG21 1 1 12 4924 1 1 6 ILE HG22 H -3.370 -8.995 -3.217 1.00 . A A . 6 ILE HG22 1 1 12 4925 1 1 6 ILE HG23 H -2.783 -7.486 -3.916 1.00 . A A . 6 ILE HG23 1 1 12 4926 1 1 6 ILE N N -4.160 -6.852 0.382 1.00 . A A . 6 ILE N 1 1 12 4927 1 1 6 ILE O O -1.688 -5.604 -0.685 1.00 . A A . 6 ILE O 1 1 12 4928 1 1 7 LEU C C 0.991 -6.494 -1.309 1.00 . A A . 7 LEU C 1 1 12 4929 1 1 7 LEU CA C 0.514 -7.156 -0.020 1.00 . A A . 7 LEU CA 1 1 12 4930 1 1 7 LEU CB C 1.441 -8.319 0.341 1.00 . A A . 7 LEU CB 1 1 12 4931 1 1 7 LEU CD1 C 1.806 -10.364 1.745 1.00 . A A . 7 LEU CD1 1 1 12 4932 1 1 7 LEU CD2 C 1.593 -8.123 2.836 1.00 . A A . 7 LEU CD2 1 1 12 4933 1 1 7 LEU CG C 1.138 -8.999 1.678 1.00 . A A . 7 LEU CG 1 1 12 4934 1 1 7 LEU H H -1.056 -8.577 -0.005 1.00 . A A . 7 LEU H 1 1 12 4935 1 1 7 LEU HA H 0.538 -6.428 0.776 1.00 . A A . 7 LEU HA 1 1 12 4936 1 1 7 LEU HB2 H 1.372 -9.061 -0.441 1.00 . A A . 7 LEU HB2 1 1 12 4937 1 1 7 LEU HB3 H 2.454 -7.947 0.373 1.00 . A A . 7 LEU HB3 1 1 12 4938 1 1 7 LEU HD11 H 1.896 -10.770 0.748 1.00 . A A . 7 LEU HD11 1 1 12 4939 1 1 7 LEU HD12 H 2.787 -10.263 2.184 1.00 . A A . 7 LEU HD12 1 1 12 4940 1 1 7 LEU HD13 H 1.207 -11.028 2.350 1.00 . A A . 7 LEU HD13 1 1 12 4941 1 1 7 LEU HD21 H 1.748 -7.113 2.485 1.00 . A A . 7 LEU HD21 1 1 12 4942 1 1 7 LEU HD22 H 0.836 -8.122 3.606 1.00 . A A . 7 LEU HD22 1 1 12 4943 1 1 7 LEU HD23 H 2.517 -8.509 3.240 1.00 . A A . 7 LEU HD23 1 1 12 4944 1 1 7 LEU HG H 0.071 -9.145 1.766 1.00 . A A . 7 LEU HG 1 1 12 4945 1 1 7 LEU N N -0.861 -7.629 -0.155 1.00 . A A . 7 LEU N 1 1 12 4946 1 1 7 LEU O O 0.694 -6.966 -2.406 1.00 . A A . 7 LEU O 1 1 12 4947 1 1 8 LEU C C 3.376 -3.738 -1.925 1.00 . A A . 8 LEU C 1 1 12 4948 1 1 8 LEU CA C 2.245 -4.676 -2.330 1.00 . A A . 8 LEU CA 1 1 12 4949 1 1 8 LEU CB C 1.122 -3.884 -3.002 1.00 . A A . 8 LEU CB 1 1 12 4950 1 1 8 LEU CD1 C -0.211 -3.992 -5.127 1.00 . A A . 8 LEU CD1 1 1 12 4951 1 1 8 LEU CD2 C 1.833 -2.557 -5.007 1.00 . A A . 8 LEU CD2 1 1 12 4952 1 1 8 LEU CG C 1.182 -3.847 -4.532 1.00 . A A . 8 LEU CG 1 1 12 4953 1 1 8 LEU H H 1.937 -5.068 -0.269 1.00 . A A . 8 LEU H 1 1 12 4954 1 1 8 LEU HA H 2.629 -5.404 -3.028 1.00 . A A . 8 LEU HA 1 1 12 4955 1 1 8 LEU HB2 H 0.178 -4.322 -2.710 1.00 . A A . 8 LEU HB2 1 1 12 4956 1 1 8 LEU HB3 H 1.157 -2.869 -2.639 1.00 . A A . 8 LEU HB3 1 1 12 4957 1 1 8 LEU HD11 H -0.915 -3.424 -4.537 1.00 . A A . 8 LEU HD11 1 1 12 4958 1 1 8 LEU HD12 H -0.209 -3.622 -6.141 1.00 . A A . 8 LEU HD12 1 1 12 4959 1 1 8 LEU HD13 H -0.496 -5.034 -5.124 1.00 . A A . 8 LEU HD13 1 1 12 4960 1 1 8 LEU HD21 H 2.733 -2.377 -4.436 1.00 . A A . 8 LEU HD21 1 1 12 4961 1 1 8 LEU HD22 H 2.082 -2.644 -6.055 1.00 . A A . 8 LEU HD22 1 1 12 4962 1 1 8 LEU HD23 H 1.148 -1.734 -4.867 1.00 . A A . 8 LEU HD23 1 1 12 4963 1 1 8 LEU HG H 1.782 -4.674 -4.882 1.00 . A A . 8 LEU HG 1 1 12 4964 1 1 8 LEU N N 1.731 -5.398 -1.171 1.00 . A A . 8 LEU N 1 1 12 4965 1 1 8 LEU O O 3.195 -2.865 -1.076 1.00 . A A . 8 LEU O 1 1 12 4966 1 1 9 GLU C C 5.904 -2.020 -3.289 1.00 . A A . 9 GLU C 1 1 12 4967 1 1 9 GLU CA C 5.711 -3.105 -2.236 1.00 . A A . 9 GLU CA 1 1 12 4968 1 1 9 GLU CB C 6.965 -3.978 -2.154 1.00 . A A . 9 GLU CB 1 1 12 4969 1 1 9 GLU CD C 8.537 -5.529 -3.378 1.00 . A A . 9 GLU CD 1 1 12 4970 1 1 9 GLU CG C 7.185 -4.844 -3.382 1.00 . A A . 9 GLU CG 1 1 12 4971 1 1 9 GLU H H 4.623 -4.645 -3.199 1.00 . A A . 9 GLU H 1 1 12 4972 1 1 9 GLU HA H 5.547 -2.634 -1.279 1.00 . A A . 9 GLU HA 1 1 12 4973 1 1 9 GLU HB2 H 7.826 -3.338 -2.031 1.00 . A A . 9 GLU HB2 1 1 12 4974 1 1 9 GLU HB3 H 6.882 -4.625 -1.293 1.00 . A A . 9 GLU HB3 1 1 12 4975 1 1 9 GLU HG2 H 6.416 -5.601 -3.417 1.00 . A A . 9 GLU HG2 1 1 12 4976 1 1 9 GLU HG3 H 7.116 -4.222 -4.263 1.00 . A A . 9 GLU HG3 1 1 12 4977 1 1 9 GLU N N 4.544 -3.929 -2.535 1.00 . A A . 9 GLU N 1 1 12 4978 1 1 9 GLU O O 5.864 -2.292 -4.489 1.00 . A A . 9 GLU O 1 1 12 4979 1 1 9 GLU OE1 O 9.560 -4.825 -3.237 1.00 . A A . 9 GLU OE1 1 1 12 4980 1 1 9 GLU OE2 O 8.575 -6.771 -3.516 1.00 . A A . 9 GLU OE2 1 1 12 4981 1 1 10 CYS C C 7.080 1.462 -3.058 1.00 . A A . 10 CYS C 1 1 12 4982 1 1 10 CYS CA C 6.303 0.339 -3.739 1.00 . A A . 10 CYS CA 1 1 12 4983 1 1 10 CYS CB C 4.950 0.866 -4.236 1.00 . A A . 10 CYS CB 1 1 12 4984 1 1 10 CYS H H 6.124 -0.632 -1.864 1.00 . A A . 10 CYS H 1 1 12 4985 1 1 10 CYS HA H 6.873 -0.013 -4.585 1.00 . A A . 10 CYS HA 1 1 12 4986 1 1 10 CYS HB2 H 4.872 1.917 -4.000 1.00 . A A . 10 CYS HB2 1 1 12 4987 1 1 10 CYS HB3 H 4.899 0.742 -5.309 1.00 . A A . 10 CYS HB3 1 1 12 4988 1 1 10 CYS N N 6.109 -0.788 -2.833 1.00 . A A . 10 CYS N 1 1 12 4989 1 1 10 CYS O O 7.175 1.509 -1.831 1.00 . A A . 10 CYS O 1 1 12 4990 1 1 10 CYS SG S 3.501 0.030 -3.511 1.00 . A A . 10 CYS SG 1 1 12 4991 1 1 11 LYS C C 7.473 4.655 -2.988 1.00 . A A . 11 LYS C 1 1 12 4992 1 1 11 LYS CA C 8.396 3.493 -3.340 1.00 . A A . 11 LYS CA 1 1 12 4993 1 1 11 LYS CB C 9.441 3.946 -4.361 1.00 . A A . 11 LYS CB 1 1 12 4994 1 1 11 LYS CD C 11.446 3.287 -5.726 1.00 . A A . 11 LYS CD 1 1 12 4995 1 1 11 LYS CE C 12.389 2.139 -6.048 1.00 . A A . 11 LYS CE 1 1 12 4996 1 1 11 LYS CG C 10.199 2.797 -5.006 1.00 . A A . 11 LYS CG 1 1 12 4997 1 1 11 LYS H H 7.517 2.275 -4.831 1.00 . A A . 11 LYS H 1 1 12 4998 1 1 11 LYS HA H 8.900 3.164 -2.442 1.00 . A A . 11 LYS HA 1 1 12 4999 1 1 11 LYS HB2 H 8.946 4.506 -5.142 1.00 . A A . 11 LYS HB2 1 1 12 5000 1 1 11 LYS HB3 H 10.155 4.588 -3.868 1.00 . A A . 11 LYS HB3 1 1 12 5001 1 1 11 LYS HD2 H 11.153 3.768 -6.647 1.00 . A A . 11 LYS HD2 1 1 12 5002 1 1 11 LYS HD3 H 11.959 3.997 -5.094 1.00 . A A . 11 LYS HD3 1 1 12 5003 1 1 11 LYS HE2 H 13.406 2.474 -5.904 1.00 . A A . 11 LYS HE2 1 1 12 5004 1 1 11 LYS HE3 H 12.182 1.320 -5.375 1.00 . A A . 11 LYS HE3 1 1 12 5005 1 1 11 LYS HG2 H 10.491 2.095 -4.240 1.00 . A A . 11 LYS HG2 1 1 12 5006 1 1 11 LYS HG3 H 9.552 2.307 -5.720 1.00 . A A . 11 LYS HG3 1 1 12 5007 1 1 11 LYS HZ1 H 11.859 2.433 -8.047 1.00 . A A . 11 LYS HZ1 1 1 12 5008 1 1 11 LYS HZ2 H 13.148 1.360 -7.831 1.00 . A A . 11 LYS HZ2 1 1 12 5009 1 1 11 LYS HZ3 H 11.569 0.864 -7.485 1.00 . A A . 11 LYS HZ3 1 1 12 5010 1 1 11 LYS N N 7.630 2.366 -3.863 1.00 . A A . 11 LYS N 1 1 12 5011 1 1 11 LYS NZ N 12.230 1.666 -7.451 1.00 . A A . 11 LYS NZ 1 1 12 5012 1 1 11 LYS O O 7.388 5.067 -1.831 1.00 . A A . 11 LYS O 1 1 12 5013 1 1 12 LYS C C 4.515 5.783 -3.274 1.00 . A A . 12 LYS C 1 1 12 5014 1 1 12 LYS CA C 5.857 6.289 -3.793 1.00 . A A . 12 LYS CA 1 1 12 5015 1 1 12 LYS CB C 5.656 7.056 -5.103 1.00 . A A . 12 LYS CB 1 1 12 5016 1 1 12 LYS CD C 5.071 9.296 -6.077 1.00 . A A . 12 LYS CD 1 1 12 5017 1 1 12 LYS CE C 6.474 9.878 -5.995 1.00 . A A . 12 LYS CE 1 1 12 5018 1 1 12 LYS CG C 4.809 8.309 -4.952 1.00 . A A . 12 LYS CG 1 1 12 5019 1 1 12 LYS H H 6.888 4.804 -4.894 1.00 . A A . 12 LYS H 1 1 12 5020 1 1 12 LYS HA H 6.289 6.952 -3.059 1.00 . A A . 12 LYS HA 1 1 12 5021 1 1 12 LYS HB2 H 6.622 7.345 -5.488 1.00 . A A . 12 LYS HB2 1 1 12 5022 1 1 12 LYS HB3 H 5.173 6.405 -5.816 1.00 . A A . 12 LYS HB3 1 1 12 5023 1 1 12 LYS HD2 H 4.958 8.788 -7.023 1.00 . A A . 12 LYS HD2 1 1 12 5024 1 1 12 LYS HD3 H 4.353 10.101 -6.010 1.00 . A A . 12 LYS HD3 1 1 12 5025 1 1 12 LYS HE2 H 7.058 9.284 -5.308 1.00 . A A . 12 LYS HE2 1 1 12 5026 1 1 12 LYS HE3 H 6.924 9.838 -6.975 1.00 . A A . 12 LYS HE3 1 1 12 5027 1 1 12 LYS HG2 H 3.766 8.031 -4.966 1.00 . A A . 12 LYS HG2 1 1 12 5028 1 1 12 LYS HG3 H 5.045 8.780 -4.008 1.00 . A A . 12 LYS HG3 1 1 12 5029 1 1 12 LYS HZ1 H 5.836 11.387 -4.699 1.00 . A A . 12 LYS HZ1 1 1 12 5030 1 1 12 LYS HZ2 H 7.423 11.584 -5.250 1.00 . A A . 12 LYS HZ2 1 1 12 5031 1 1 12 LYS HZ3 H 6.123 11.918 -6.280 1.00 . A A . 12 LYS HZ3 1 1 12 5032 1 1 12 LYS N N 6.779 5.178 -3.995 1.00 . A A . 12 LYS N 1 1 12 5033 1 1 12 LYS NZ N 6.463 11.290 -5.523 1.00 . A A . 12 LYS NZ 1 1 12 5034 1 1 12 LYS O O 3.926 4.866 -3.845 1.00 . A A . 12 LYS O 1 1 12 5035 1 1 13 ASP C C 1.645 6.005 -2.614 1.00 . A A . 13 ASP C 1 1 12 5036 1 1 13 ASP CA C 2.770 5.973 -1.590 1.00 . A A . 13 ASP CA 1 1 12 5037 1 1 13 ASP CB C 2.420 6.859 -0.393 1.00 . A A . 13 ASP CB 1 1 12 5038 1 1 13 ASP CG C 3.556 6.957 0.607 1.00 . A A . 13 ASP CG 1 1 12 5039 1 1 13 ASP H H 4.555 7.097 -1.767 1.00 . A A . 13 ASP H 1 1 12 5040 1 1 13 ASP HA H 2.885 4.962 -1.251 1.00 . A A . 13 ASP HA 1 1 12 5041 1 1 13 ASP HB2 H 2.186 7.852 -0.741 1.00 . A A . 13 ASP HB2 1 1 12 5042 1 1 13 ASP HB3 H 1.558 6.449 0.107 1.00 . A A . 13 ASP HB3 1 1 12 5043 1 1 13 ASP N N 4.039 6.378 -2.185 1.00 . A A . 13 ASP N 1 1 12 5044 1 1 13 ASP O O 0.740 5.171 -2.581 1.00 . A A . 13 ASP O 1 1 12 5045 1 1 13 ASP OD1 O 4.693 7.253 0.187 1.00 . A A . 13 ASP OD1 1 1 12 5046 1 1 13 ASP OD2 O 3.306 6.735 1.810 1.00 . A A . 13 ASP OD2 1 1 12 5047 1 1 14 SER C C 0.554 5.803 -5.354 1.00 . A A . 14 SER C 1 1 12 5048 1 1 14 SER CA C 0.710 7.106 -4.573 1.00 . A A . 14 SER CA 1 1 12 5049 1 1 14 SER CB C 1.088 8.242 -5.524 1.00 . A A . 14 SER CB 1 1 12 5050 1 1 14 SER H H 2.466 7.593 -3.502 1.00 . A A . 14 SER H 1 1 12 5051 1 1 14 SER HA H -0.231 7.342 -4.100 1.00 . A A . 14 SER HA 1 1 12 5052 1 1 14 SER HB2 H 1.231 9.150 -4.957 1.00 . A A . 14 SER HB2 1 1 12 5053 1 1 14 SER HB3 H 2.005 7.990 -6.038 1.00 . A A . 14 SER HB3 1 1 12 5054 1 1 14 SER N N 1.714 6.965 -3.527 1.00 . A A . 14 SER N 1 1 12 5055 1 1 14 SER O O -0.539 5.469 -5.813 1.00 . A A . 14 SER O 1 1 12 5056 1 1 14 SER OG O 0.071 8.462 -6.487 1.00 . A A . 14 SER OG 1 1 12 5057 1 1 15 ASP C C 0.564 2.875 -5.745 1.00 . A A . 15 ASP C 1 1 12 5058 1 1 15 ASP CA C 1.657 3.817 -6.245 1.00 . A A . 15 ASP CA 1 1 12 5059 1 1 15 ASP CB C 3.023 3.137 -6.133 1.00 . A A . 15 ASP CB 1 1 12 5060 1 1 15 ASP CG C 3.466 2.512 -7.440 1.00 . A A . 15 ASP CG 1 1 12 5061 1 1 15 ASP H H 2.501 5.399 -5.121 1.00 . A A . 15 ASP H 1 1 12 5062 1 1 15 ASP HA H 1.467 4.044 -7.283 1.00 . A A . 15 ASP HA 1 1 12 5063 1 1 15 ASP HB2 H 3.760 3.869 -5.838 1.00 . A A . 15 ASP HB2 1 1 12 5064 1 1 15 ASP HB3 H 2.973 2.362 -5.382 1.00 . A A . 15 ASP HB3 1 1 12 5065 1 1 15 ASP N N 1.659 5.078 -5.511 1.00 . A A . 15 ASP N 1 1 12 5066 1 1 15 ASP O O -0.006 2.109 -6.522 1.00 . A A . 15 ASP O 1 1 12 5067 1 1 15 ASP OD1 O 3.310 3.164 -8.494 1.00 . A A . 15 ASP OD1 1 1 12 5068 1 1 15 ASP OD2 O 3.969 1.368 -7.411 1.00 . A A . 15 ASP OD2 1 1 12 5069 1 1 16 CYS C C -2.020 2.083 -4.644 1.00 . A A . 16 CYS C 1 1 12 5070 1 1 16 CYS CA C -0.723 2.052 -3.846 1.00 . A A . 16 CYS CA 1 1 12 5071 1 1 16 CYS CB C -0.988 2.444 -2.388 1.00 . A A . 16 CYS CB 1 1 12 5072 1 1 16 CYS H H 0.785 3.542 -3.871 1.00 . A A . 16 CYS H 1 1 12 5073 1 1 16 CYS HA H -0.335 1.044 -3.867 1.00 . A A . 16 CYS HA 1 1 12 5074 1 1 16 CYS HB2 H -0.098 2.866 -1.975 1.00 . A A . 16 CYS HB2 1 1 12 5075 1 1 16 CYS HB3 H -1.768 3.186 -2.354 1.00 . A A . 16 CYS HB3 1 1 12 5076 1 1 16 CYS N N 0.289 2.921 -4.444 1.00 . A A . 16 CYS N 1 1 12 5077 1 1 16 CYS O O -2.171 2.865 -5.583 1.00 . A A . 16 CYS O 1 1 12 5078 1 1 16 CYS SG S -1.482 1.056 -1.310 1.00 . A A . 16 CYS SG 1 1 12 5079 1 1 17 LEU C C -5.372 1.561 -4.037 1.00 . A A . 17 LEU C 1 1 12 5080 1 1 17 LEU CA C -4.233 1.122 -4.948 1.00 . A A . 17 LEU CA 1 1 12 5081 1 1 17 LEU CB C -4.477 -0.312 -5.425 1.00 . A A . 17 LEU CB 1 1 12 5082 1 1 17 LEU CD1 C -5.561 -2.326 -4.391 1.00 . A A . 17 LEU CD1 1 1 12 5083 1 1 17 LEU CD2 C -3.067 -2.159 -4.476 1.00 . A A . 17 LEU CD2 1 1 12 5084 1 1 17 LEU CG C -4.369 -1.382 -4.335 1.00 . A A . 17 LEU CG 1 1 12 5085 1 1 17 LEU H H -2.756 0.619 -3.515 1.00 . A A . 17 LEU H 1 1 12 5086 1 1 17 LEU HA H -4.202 1.775 -5.806 1.00 . A A . 17 LEU HA 1 1 12 5087 1 1 17 LEU HB2 H -5.466 -0.361 -5.857 1.00 . A A . 17 LEU HB2 1 1 12 5088 1 1 17 LEU HB3 H -3.755 -0.539 -6.195 1.00 . A A . 17 LEU HB3 1 1 12 5089 1 1 17 LEU HD11 H -5.756 -2.600 -5.417 1.00 . A A . 17 LEU HD11 1 1 12 5090 1 1 17 LEU HD12 H -5.345 -3.214 -3.815 1.00 . A A . 17 LEU HD12 1 1 12 5091 1 1 17 LEU HD13 H -6.429 -1.833 -3.978 1.00 . A A . 17 LEU HD13 1 1 12 5092 1 1 17 LEU HD21 H -2.780 -2.195 -5.516 1.00 . A A . 17 LEU HD21 1 1 12 5093 1 1 17 LEU HD22 H -2.293 -1.669 -3.904 1.00 . A A . 17 LEU HD22 1 1 12 5094 1 1 17 LEU HD23 H -3.206 -3.164 -4.106 1.00 . A A . 17 LEU HD23 1 1 12 5095 1 1 17 LEU HG H -4.370 -0.902 -3.368 1.00 . A A . 17 LEU HG 1 1 12 5096 1 1 17 LEU N N -2.946 1.215 -4.267 1.00 . A A . 17 LEU N 1 1 12 5097 1 1 17 LEU O O -5.178 1.778 -2.842 1.00 . A A . 17 LEU O 1 1 12 5098 1 1 18 ALA C C -7.447 3.380 -3.056 1.00 . A A . 18 ALA C 1 1 12 5099 1 1 18 ALA CA C -7.739 2.107 -3.858 1.00 . A A . 18 ALA CA 1 1 12 5100 1 1 18 ALA CB C -8.203 0.970 -2.955 1.00 . A A . 18 ALA CB 1 1 12 5101 1 1 18 ALA H H -6.654 1.505 -5.572 1.00 . A A . 18 ALA H 1 1 12 5102 1 1 18 ALA HA H -8.528 2.316 -4.565 1.00 . A A . 18 ALA HA 1 1 12 5103 1 1 18 ALA HB1 H -8.333 0.073 -3.543 1.00 . A A . 18 ALA HB1 1 1 12 5104 1 1 18 ALA HB2 H -9.141 1.237 -2.493 1.00 . A A . 18 ALA HB2 1 1 12 5105 1 1 18 ALA HB3 H -7.462 0.793 -2.189 1.00 . A A . 18 ALA HB3 1 1 12 5106 1 1 18 ALA N N -6.564 1.692 -4.614 1.00 . A A . 18 ALA N 1 1 12 5107 1 1 18 ALA O O -7.021 4.386 -3.624 1.00 . A A . 18 ALA O 1 1 12 5108 1 1 19 GLU C C -6.438 4.146 0.218 1.00 . A A . 19 GLU C 1 1 12 5109 1 1 19 GLU CA C -7.420 4.498 -0.897 1.00 . A A . 19 GLU CA 1 1 12 5110 1 1 19 GLU CB C -8.735 5.019 -0.309 1.00 . A A . 19 GLU CB 1 1 12 5111 1 1 19 GLU CD C -8.850 7.534 -0.106 1.00 . A A . 19 GLU CD 1 1 12 5112 1 1 19 GLU CG C -9.209 6.318 -0.939 1.00 . A A . 19 GLU CG 1 1 12 5113 1 1 19 GLU H H -8.007 2.517 -1.336 1.00 . A A . 19 GLU H 1 1 12 5114 1 1 19 GLU HA H -6.981 5.270 -1.513 1.00 . A A . 19 GLU HA 1 1 12 5115 1 1 19 GLU HB2 H -9.502 4.272 -0.458 1.00 . A A . 19 GLU HB2 1 1 12 5116 1 1 19 GLU HB3 H -8.607 5.184 0.750 1.00 . A A . 19 GLU HB3 1 1 12 5117 1 1 19 GLU HG2 H -8.751 6.420 -1.911 1.00 . A A . 19 GLU HG2 1 1 12 5118 1 1 19 GLU HG3 H -10.283 6.279 -1.049 1.00 . A A . 19 GLU HG3 1 1 12 5119 1 1 19 GLU N N -7.671 3.340 -1.744 1.00 . A A . 19 GLU N 1 1 12 5120 1 1 19 GLU O O -6.736 4.315 1.401 1.00 . A A . 19 GLU O 1 1 12 5121 1 1 19 GLU OE1 O -7.937 7.427 0.739 1.00 . A A . 19 GLU OE1 1 1 12 5122 1 1 19 GLU OE2 O -9.484 8.592 -0.300 1.00 . A A . 19 GLU OE2 1 1 12 5123 1 1 20 CYS C C -2.901 3.889 0.401 1.00 . A A . 20 CYS C 1 1 12 5124 1 1 20 CYS CA C -4.239 3.291 0.803 1.00 . A A . 20 CYS CA 1 1 12 5125 1 1 20 CYS CB C -4.132 1.768 0.913 1.00 . A A . 20 CYS CB 1 1 12 5126 1 1 20 CYS H H -5.069 3.547 -1.121 1.00 . A A . 20 CYS H 1 1 12 5127 1 1 20 CYS HA H -4.529 3.695 1.761 1.00 . A A . 20 CYS HA 1 1 12 5128 1 1 20 CYS HB2 H -4.573 1.319 0.036 1.00 . A A . 20 CYS HB2 1 1 12 5129 1 1 20 CYS HB3 H -3.090 1.489 0.968 1.00 . A A . 20 CYS HB3 1 1 12 5130 1 1 20 CYS N N -5.260 3.658 -0.164 1.00 . A A . 20 CYS N 1 1 12 5131 1 1 20 CYS O O -2.830 4.700 -0.522 1.00 . A A . 20 CYS O 1 1 12 5132 1 1 20 CYS SG S -4.971 1.071 2.373 1.00 . A A . 20 CYS SG 1 1 12 5133 1 1 21 VAL C C 0.508 2.898 0.640 1.00 . A A . 21 VAL C 1 1 12 5134 1 1 21 VAL CA C -0.518 4.014 0.785 1.00 . A A . 21 VAL CA 1 1 12 5135 1 1 21 VAL CB C -0.039 5.012 1.860 1.00 . A A . 21 VAL CB 1 1 12 5136 1 1 21 VAL CG1 C -1.043 6.143 2.020 1.00 . A A . 21 VAL CG1 1 1 12 5137 1 1 21 VAL CG2 C 0.192 4.305 3.189 1.00 . A A . 21 VAL CG2 1 1 12 5138 1 1 21 VAL H H -1.950 2.849 1.820 1.00 . A A . 21 VAL H 1 1 12 5139 1 1 21 VAL HA H -0.583 4.544 -0.155 1.00 . A A . 21 VAL HA 1 1 12 5140 1 1 21 VAL HB H 0.899 5.439 1.534 1.00 . A A . 21 VAL HB 1 1 12 5141 1 1 21 VAL HG11 H -2.042 5.735 2.066 1.00 . A A . 21 VAL HG11 1 1 12 5142 1 1 21 VAL HG12 H -0.834 6.683 2.932 1.00 . A A . 21 VAL HG12 1 1 12 5143 1 1 21 VAL HG13 H -0.966 6.814 1.179 1.00 . A A . 21 VAL HG13 1 1 12 5144 1 1 21 VAL HG21 H 0.916 3.515 3.056 1.00 . A A . 21 VAL HG21 1 1 12 5145 1 1 21 VAL HG22 H 0.564 5.014 3.915 1.00 . A A . 21 VAL HG22 1 1 12 5146 1 1 21 VAL HG23 H -0.739 3.886 3.541 1.00 . A A . 21 VAL HG23 1 1 12 5147 1 1 21 VAL N N -1.841 3.496 1.092 1.00 . A A . 21 VAL N 1 1 12 5148 1 1 21 VAL O O 0.310 1.778 1.113 1.00 . A A . 21 VAL O 1 1 12 5149 1 1 22 CYS C C 3.811 2.525 0.778 1.00 . A A . 22 CYS C 1 1 12 5150 1 1 22 CYS CA C 2.702 2.289 -0.243 1.00 . A A . 22 CYS CA 1 1 12 5151 1 1 22 CYS CB C 3.251 2.444 -1.669 1.00 . A A . 22 CYS CB 1 1 12 5152 1 1 22 CYS H H 1.687 4.139 -0.355 1.00 . A A . 22 CYS H 1 1 12 5153 1 1 22 CYS HA H 2.314 1.289 -0.117 1.00 . A A . 22 CYS HA 1 1 12 5154 1 1 22 CYS HB2 H 3.247 3.486 -1.936 1.00 . A A . 22 CYS HB2 1 1 12 5155 1 1 22 CYS HB3 H 4.263 2.080 -1.705 1.00 . A A . 22 CYS HB3 1 1 12 5156 1 1 22 CYS N N 1.609 3.230 -0.016 1.00 . A A . 22 CYS N 1 1 12 5157 1 1 22 CYS O O 4.184 3.666 1.050 1.00 . A A . 22 CYS O 1 1 12 5158 1 1 22 CYS SG S 2.294 1.554 -2.935 1.00 . A A . 22 CYS SG 1 1 12 5159 1 1 23 LEU C C 6.747 1.261 1.762 1.00 . A A . 23 LEU C 1 1 12 5160 1 1 23 LEU CA C 5.373 1.539 2.360 1.00 . A A . 23 LEU CA 1 1 12 5161 1 1 23 LEU CB C 5.093 0.567 3.506 1.00 . A A . 23 LEU CB 1 1 12 5162 1 1 23 LEU CD1 C 3.260 -0.766 4.591 1.00 . A A . 23 LEU CD1 1 1 12 5163 1 1 23 LEU CD2 C 3.512 1.668 5.111 1.00 . A A . 23 LEU CD2 1 1 12 5164 1 1 23 LEU CG C 3.658 0.597 4.041 1.00 . A A . 23 LEU CG 1 1 12 5165 1 1 23 LEU H H 3.976 0.559 1.107 1.00 . A A . 23 LEU H 1 1 12 5166 1 1 23 LEU HA H 5.363 2.546 2.749 1.00 . A A . 23 LEU HA 1 1 12 5167 1 1 23 LEU HB2 H 5.307 -0.434 3.162 1.00 . A A . 23 LEU HB2 1 1 12 5168 1 1 23 LEU HB3 H 5.761 0.802 4.320 1.00 . A A . 23 LEU HB3 1 1 12 5169 1 1 23 LEU HD11 H 4.115 -1.427 4.573 1.00 . A A . 23 LEU HD11 1 1 12 5170 1 1 23 LEU HD12 H 2.911 -0.660 5.607 1.00 . A A . 23 LEU HD12 1 1 12 5171 1 1 23 LEU HD13 H 2.472 -1.183 3.981 1.00 . A A . 23 LEU HD13 1 1 12 5172 1 1 23 LEU HD21 H 4.121 2.522 4.852 1.00 . A A . 23 LEU HD21 1 1 12 5173 1 1 23 LEU HD22 H 2.478 1.972 5.178 1.00 . A A . 23 LEU HD22 1 1 12 5174 1 1 23 LEU HD23 H 3.834 1.273 6.064 1.00 . A A . 23 LEU HD23 1 1 12 5175 1 1 23 LEU HG H 2.985 0.838 3.232 1.00 . A A . 23 LEU HG 1 1 12 5176 1 1 23 LEU N N 4.323 1.442 1.353 1.00 . A A . 23 LEU N 1 1 12 5177 1 1 23 LEU O O 6.892 0.430 0.864 1.00 . A A . 23 LEU O 1 1 12 5178 1 1 24 GLU C C 9.601 0.374 1.905 1.00 . A A . 24 GLU C 1 1 12 5179 1 1 24 GLU CA C 9.125 1.820 1.796 1.00 . A A . 24 GLU CA 1 1 12 5180 1 1 24 GLU CB C 10.059 2.734 2.591 1.00 . A A . 24 GLU CB 1 1 12 5181 1 1 24 GLU CD C 10.755 3.544 4.880 1.00 . A A . 24 GLU CD 1 1 12 5182 1 1 24 GLU CG C 10.043 2.467 4.087 1.00 . A A . 24 GLU CG 1 1 12 5183 1 1 24 GLU H H 7.565 2.616 2.981 1.00 . A A . 24 GLU H 1 1 12 5184 1 1 24 GLU HA H 9.149 2.115 0.758 1.00 . A A . 24 GLU HA 1 1 12 5185 1 1 24 GLU HB2 H 11.069 2.598 2.232 1.00 . A A . 24 GLU HB2 1 1 12 5186 1 1 24 GLU HB3 H 9.764 3.760 2.427 1.00 . A A . 24 GLU HB3 1 1 12 5187 1 1 24 GLU HG2 H 9.017 2.415 4.420 1.00 . A A . 24 GLU HG2 1 1 12 5188 1 1 24 GLU HG3 H 10.531 1.521 4.275 1.00 . A A . 24 GLU HG3 1 1 12 5189 1 1 24 GLU N N 7.753 1.969 2.270 1.00 . A A . 24 GLU N 1 1 12 5190 1 1 24 GLU O O 10.159 -0.174 0.955 1.00 . A A . 24 GLU O 1 1 12 5191 1 1 24 GLU OE1 O 12.004 3.528 4.916 1.00 . A A . 24 GLU OE1 1 1 12 5192 1 1 24 GLU OE2 O 10.064 4.405 5.465 1.00 . A A . 24 GLU OE2 1 1 12 5193 1 1 25 HIS C C 9.248 -2.526 2.183 1.00 . A A . 25 HIS C 1 1 12 5194 1 1 25 HIS CA C 9.801 -1.626 3.279 1.00 . A A . 25 HIS CA 1 1 12 5195 1 1 25 HIS CB C 9.365 -2.145 4.658 1.00 . A A . 25 HIS CB 1 1 12 5196 1 1 25 HIS CD2 C 6.844 -1.824 5.188 1.00 . A A . 25 HIS CD2 1 1 12 5197 1 1 25 HIS CE1 C 6.994 0.040 6.332 1.00 . A A . 25 HIS CE1 1 1 12 5198 1 1 25 HIS CG C 8.151 -1.473 5.225 1.00 . A A . 25 HIS CG 1 1 12 5199 1 1 25 HIS H H 8.934 0.245 3.786 1.00 . A A . 25 HIS H 1 1 12 5200 1 1 25 HIS HA H 10.879 -1.649 3.225 1.00 . A A . 25 HIS HA 1 1 12 5201 1 1 25 HIS HB2 H 9.149 -3.199 4.582 1.00 . A A . 25 HIS HB2 1 1 12 5202 1 1 25 HIS HB3 H 10.178 -2.003 5.356 1.00 . A A . 25 HIS HB3 1 1 12 5203 1 1 25 HIS HD1 H 9.024 0.207 6.150 1.00 . A A . 25 HIS HD1 1 1 12 5204 1 1 25 HIS HD2 H 6.427 -2.695 4.699 1.00 . A A . 25 HIS HD2 1 1 12 5205 1 1 25 HIS HE1 H 6.736 0.912 6.913 1.00 . A A . 25 HIS HE1 1 1 12 5206 1 1 25 HIS HE2 H 5.203 -0.932 6.144 1.00 . A A . 25 HIS HE2 1 1 12 5207 1 1 25 HIS N N 9.382 -0.240 3.066 1.00 . A A . 25 HIS N 1 1 12 5208 1 1 25 HIS ND1 N 8.211 -0.301 5.948 1.00 . A A . 25 HIS ND1 1 1 12 5209 1 1 25 HIS NE2 N 6.145 -0.867 5.883 1.00 . A A . 25 HIS NE2 1 1 12 5210 1 1 25 HIS O O 9.829 -3.564 1.863 1.00 . A A . 25 HIS O 1 1 12 5211 1 1 26 GLY C C 6.194 -3.490 0.910 1.00 . A A . 26 GLY C 1 1 12 5212 1 1 26 GLY CA C 7.529 -2.882 0.528 1.00 . A A . 26 GLY CA 1 1 12 5213 1 1 26 GLY H H 7.718 -1.272 1.883 1.00 . A A . 26 GLY H 1 1 12 5214 1 1 26 GLY HA2 H 8.206 -3.675 0.246 1.00 . A A . 26 GLY HA2 1 1 12 5215 1 1 26 GLY HA3 H 7.383 -2.231 -0.319 1.00 . A A . 26 GLY HA3 1 1 12 5216 1 1 26 GLY N N 8.130 -2.113 1.597 1.00 . A A . 26 GLY N 1 1 12 5217 1 1 26 GLY O O 6.058 -4.712 0.960 1.00 . A A . 26 GLY O 1 1 12 5218 1 1 27 TYR C C 2.855 -1.966 1.458 1.00 . A A . 27 TYR C 1 1 12 5219 1 1 27 TYR CA C 3.871 -3.103 1.537 1.00 . A A . 27 TYR CA 1 1 12 5220 1 1 27 TYR CB C 3.878 -3.690 2.950 1.00 . A A . 27 TYR CB 1 1 12 5221 1 1 27 TYR CD1 C 3.985 -6.068 2.101 1.00 . A A . 27 TYR CD1 1 1 12 5222 1 1 27 TYR CD2 C 5.285 -5.495 4.015 1.00 . A A . 27 TYR CD2 1 1 12 5223 1 1 27 TYR CE1 C 4.454 -7.366 2.167 1.00 . A A . 27 TYR CE1 1 1 12 5224 1 1 27 TYR CE2 C 5.759 -6.790 4.087 1.00 . A A . 27 TYR CE2 1 1 12 5225 1 1 27 TYR CG C 4.392 -5.111 3.023 1.00 . A A . 27 TYR CG 1 1 12 5226 1 1 27 TYR CZ C 5.340 -7.722 3.160 1.00 . A A . 27 TYR CZ 1 1 12 5227 1 1 27 TYR H H 5.375 -1.676 1.101 1.00 . A A . 27 TYR H 1 1 12 5228 1 1 27 TYR HA H 3.584 -3.876 0.840 1.00 . A A . 27 TYR HA 1 1 12 5229 1 1 27 TYR HB2 H 4.508 -3.081 3.577 1.00 . A A . 27 TYR HB2 1 1 12 5230 1 1 27 TYR HB3 H 2.872 -3.680 3.341 1.00 . A A . 27 TYR HB3 1 1 12 5231 1 1 27 TYR HD1 H 3.291 -5.785 1.323 1.00 . A A . 27 TYR HD1 1 1 12 5232 1 1 27 TYR HD2 H 5.611 -4.762 4.740 1.00 . A A . 27 TYR HD2 1 1 12 5233 1 1 27 TYR HE1 H 4.127 -8.095 1.440 1.00 . A A . 27 TYR HE1 1 1 12 5234 1 1 27 TYR HE2 H 6.452 -7.070 4.866 1.00 . A A . 27 TYR HE2 1 1 12 5235 1 1 27 TYR HH H 6.709 -9.046 2.895 1.00 . A A . 27 TYR HH 1 1 12 5236 1 1 27 TYR N N 5.206 -2.639 1.168 1.00 . A A . 27 TYR N 1 1 12 5237 1 1 27 TYR O O 3.178 -0.814 1.744 1.00 . A A . 27 TYR O 1 1 12 5238 1 1 27 TYR OH O 5.810 -9.014 3.228 1.00 . A A . 27 TYR OH 1 1 12 5239 1 1 28 CYS C C -0.332 -1.333 2.199 1.00 . A A . 28 CYS C 1 1 12 5240 1 1 28 CYS CA C 0.562 -1.304 0.963 1.00 . A A . 28 CYS CA 1 1 12 5241 1 1 28 CYS CB C -0.284 -1.559 -0.290 1.00 . A A . 28 CYS CB 1 1 12 5242 1 1 28 CYS H H 1.433 -3.234 0.858 1.00 . A A . 28 CYS H 1 1 12 5243 1 1 28 CYS HA H 1.022 -0.330 0.885 1.00 . A A . 28 CYS HA 1 1 12 5244 1 1 28 CYS HB2 H -0.038 -2.532 -0.687 1.00 . A A . 28 CYS HB2 1 1 12 5245 1 1 28 CYS HB3 H -1.330 -1.542 -0.019 1.00 . A A . 28 CYS HB3 1 1 12 5246 1 1 28 CYS N N 1.627 -2.299 1.074 1.00 . A A . 28 CYS N 1 1 12 5247 1 1 28 CYS O O -0.991 -2.335 2.477 1.00 . A A . 28 CYS O 1 1 12 5248 1 1 28 CYS SG S -0.038 -0.341 -1.623 1.00 . A A . 28 CYS SG 1 1 12 5249 1 1 29 GLY C C -1.839 1.203 4.287 1.00 . A A . 29 GLY C 1 1 12 5250 1 1 29 GLY CA C -1.166 -0.146 4.132 1.00 . A A . 29 GLY CA 1 1 12 5251 1 1 29 GLY H H 0.195 0.541 2.665 1.00 . A A . 29 GLY H 1 1 12 5252 1 1 29 GLY HA2 H -0.540 -0.324 4.995 1.00 . A A . 29 GLY HA2 1 1 12 5253 1 1 29 GLY HA3 H -1.927 -0.912 4.089 1.00 . A A . 29 GLY HA3 1 1 12 5254 1 1 29 GLY N N -0.350 -0.227 2.936 1.00 . A A . 29 GLY N 1 1 12 5255 1 1 29 GLY O O -2.173 1.821 3.254 1.00 . A A . 29 GLY O 1 1 12 5256 1 1 29 GLY OXT O -2.033 1.641 5.440 1.00 . A A . 29 GLY OXT 1 1 13 5257 1 1 1 ARG C C -10.208 2.782 3.065 1.00 . A A . 1 ARG C 1 1 13 5258 1 1 1 ARG CA C -10.776 4.175 2.818 1.00 . A A . 1 ARG CA 1 1 13 5259 1 1 1 ARG CB C -11.476 4.690 4.077 1.00 . A A . 1 ARG CB 1 1 13 5260 1 1 1 ARG CD C -10.762 6.465 5.711 1.00 . A A . 1 ARG CD 1 1 13 5261 1 1 1 ARG CG C -11.288 6.181 4.312 1.00 . A A . 1 ARG CG 1 1 13 5262 1 1 1 ARG CZ C -10.514 8.434 7.173 1.00 . A A . 1 ARG CZ 1 1 13 5263 1 1 1 ARG H1 H -11.353 3.599 0.929 1.00 . A A . 1 ARG H1 1 1 13 5264 1 1 1 ARG H2 H -12.638 3.745 2.058 1.00 . A A . 1 ARG H2 1 1 13 5265 1 1 1 ARG H3 H -11.905 5.151 1.402 1.00 . A A . 1 ARG H3 1 1 13 5266 1 1 1 ARG HA H -9.968 4.845 2.561 1.00 . A A . 1 ARG HA 1 1 13 5267 1 1 1 ARG HB2 H -12.535 4.493 3.992 1.00 . A A . 1 ARG HB2 1 1 13 5268 1 1 1 ARG HB3 H -11.089 4.160 4.934 1.00 . A A . 1 ARG HB3 1 1 13 5269 1 1 1 ARG HD2 H -11.179 5.739 6.393 1.00 . A A . 1 ARG HD2 1 1 13 5270 1 1 1 ARG HD3 H -9.686 6.375 5.703 1.00 . A A . 1 ARG HD3 1 1 13 5271 1 1 1 ARG HE H -11.856 8.260 5.706 1.00 . A A . 1 ARG HE 1 1 13 5272 1 1 1 ARG HG2 H -10.582 6.563 3.590 1.00 . A A . 1 ARG HG2 1 1 13 5273 1 1 1 ARG HG3 H -12.239 6.678 4.186 1.00 . A A . 1 ARG HG3 1 1 13 5274 1 1 1 ARG HH11 H -9.218 6.931 7.564 1.00 . A A . 1 ARG HH11 1 1 13 5275 1 1 1 ARG HH12 H -9.065 8.326 8.577 1.00 . A A . 1 ARG HH12 1 1 13 5276 1 1 1 ARG HH21 H -11.655 10.096 7.037 1.00 . A A . 1 ARG HH21 1 1 13 5277 1 1 1 ARG HH22 H -10.448 10.124 8.279 1.00 . A A . 1 ARG HH22 1 1 13 5278 1 1 1 ARG N N -11.756 4.167 1.701 1.00 . A A . 1 ARG N 1 1 13 5279 1 1 1 ARG NE N -11.122 7.805 6.169 1.00 . A A . 1 ARG NE 1 1 13 5280 1 1 1 ARG NH1 N -9.517 7.848 7.824 1.00 . A A . 1 ARG NH1 1 1 13 5281 1 1 1 ARG NH2 N -10.904 9.651 7.525 1.00 . A A . 1 ARG NH2 1 1 13 5282 1 1 1 ARG O O -9.004 2.616 3.260 1.00 . A A . 1 ARG O 1 1 13 5283 1 1 2 VAL C C -10.126 -0.225 1.999 1.00 . A A . 2 VAL C 1 1 13 5284 1 1 2 VAL CA C -10.669 0.403 3.280 1.00 . A A . 2 VAL CA 1 1 13 5285 1 1 2 VAL CB C -11.836 -0.455 3.812 1.00 . A A . 2 VAL CB 1 1 13 5286 1 1 2 VAL CG1 C -12.964 -0.520 2.793 1.00 . A A . 2 VAL CG1 1 1 13 5287 1 1 2 VAL CG2 C -11.352 -1.851 4.174 1.00 . A A . 2 VAL CG2 1 1 13 5288 1 1 2 VAL H H -12.029 1.976 2.896 1.00 . A A . 2 VAL H 1 1 13 5289 1 1 2 VAL HA H -9.886 0.407 4.025 1.00 . A A . 2 VAL HA 1 1 13 5290 1 1 2 VAL HB H -12.218 0.013 4.707 1.00 . A A . 2 VAL HB 1 1 13 5291 1 1 2 VAL HG11 H -12.906 0.334 2.135 1.00 . A A . 2 VAL HG11 1 1 13 5292 1 1 2 VAL HG12 H -12.875 -1.428 2.215 1.00 . A A . 2 VAL HG12 1 1 13 5293 1 1 2 VAL HG13 H -13.914 -0.514 3.308 1.00 . A A . 2 VAL HG13 1 1 13 5294 1 1 2 VAL HG21 H -10.723 -2.231 3.383 1.00 . A A . 2 VAL HG21 1 1 13 5295 1 1 2 VAL HG22 H -10.787 -1.809 5.094 1.00 . A A . 2 VAL HG22 1 1 13 5296 1 1 2 VAL HG23 H -12.203 -2.505 4.304 1.00 . A A . 2 VAL HG23 1 1 13 5297 1 1 2 VAL N N -11.083 1.781 3.056 1.00 . A A . 2 VAL N 1 1 13 5298 1 1 2 VAL O O -10.865 -0.436 1.038 1.00 . A A . 2 VAL O 1 1 13 5299 1 1 3 CYS C C -7.995 -2.628 1.040 1.00 . A A . 3 CYS C 1 1 13 5300 1 1 3 CYS CA C -8.189 -1.126 0.833 1.00 . A A . 3 CYS CA 1 1 13 5301 1 1 3 CYS CB C -6.841 -0.452 0.556 1.00 . A A . 3 CYS CB 1 1 13 5302 1 1 3 CYS H H -8.294 -0.330 2.791 1.00 . A A . 3 CYS H 1 1 13 5303 1 1 3 CYS HA H -8.838 -0.971 -0.017 1.00 . A A . 3 CYS HA 1 1 13 5304 1 1 3 CYS HB2 H -6.490 -0.753 -0.419 1.00 . A A . 3 CYS HB2 1 1 13 5305 1 1 3 CYS HB3 H -6.977 0.621 0.566 1.00 . A A . 3 CYS HB3 1 1 13 5306 1 1 3 CYS N N -8.831 -0.522 1.994 1.00 . A A . 3 CYS N 1 1 13 5307 1 1 3 CYS O O -7.481 -3.055 2.074 1.00 . A A . 3 CYS O 1 1 13 5308 1 1 3 CYS SG S -5.534 -0.858 1.761 1.00 . A A . 3 CYS SG 1 1 13 5309 1 1 4 PRO C C -6.940 -5.353 0.732 1.00 . A A . 4 PRO C 1 1 13 5310 1 1 4 PRO CA C -8.274 -4.913 0.141 1.00 . A A . 4 PRO CA 1 1 13 5311 1 1 4 PRO CB C -8.378 -5.343 -1.318 1.00 . A A . 4 PRO CB 1 1 13 5312 1 1 4 PRO CD C -9.032 -3.036 -1.214 1.00 . A A . 4 PRO CD 1 1 13 5313 1 1 4 PRO CG C -9.285 -4.337 -1.936 1.00 . A A . 4 PRO CG 1 1 13 5314 1 1 4 PRO HA H -9.082 -5.353 0.707 1.00 . A A . 4 PRO HA 1 1 13 5315 1 1 4 PRO HB2 H -7.397 -5.325 -1.772 1.00 . A A . 4 PRO HB2 1 1 13 5316 1 1 4 PRO HB3 H -8.791 -6.337 -1.376 1.00 . A A . 4 PRO HB3 1 1 13 5317 1 1 4 PRO HD2 H -8.360 -2.413 -1.785 1.00 . A A . 4 PRO HD2 1 1 13 5318 1 1 4 PRO HD3 H -9.963 -2.520 -1.031 1.00 . A A . 4 PRO HD3 1 1 13 5319 1 1 4 PRO HG2 H -9.055 -4.232 -2.987 1.00 . A A . 4 PRO HG2 1 1 13 5320 1 1 4 PRO HG3 H -10.313 -4.642 -1.806 1.00 . A A . 4 PRO HG3 1 1 13 5321 1 1 4 PRO N N -8.407 -3.455 0.058 1.00 . A A . 4 PRO N 1 1 13 5322 1 1 4 PRO O O -5.885 -4.835 0.364 1.00 . A A . 4 PRO O 1 1 13 5323 1 1 5 ARG C C -4.903 -7.542 1.271 1.00 . A A . 5 ARG C 1 1 13 5324 1 1 5 ARG CA C -5.785 -6.823 2.286 1.00 . A A . 5 ARG CA 1 1 13 5325 1 1 5 ARG CB C -6.148 -7.773 3.429 1.00 . A A . 5 ARG CB 1 1 13 5326 1 1 5 ARG CD C -8.108 -9.233 4.024 1.00 . A A . 5 ARG CD 1 1 13 5327 1 1 5 ARG CG C -7.028 -8.935 2.996 1.00 . A A . 5 ARG CG 1 1 13 5328 1 1 5 ARG CZ C -8.642 -11.025 5.629 1.00 . A A . 5 ARG CZ 1 1 13 5329 1 1 5 ARG H H -7.861 -6.689 1.901 1.00 . A A . 5 ARG H 1 1 13 5330 1 1 5 ARG HA H -5.241 -5.981 2.688 1.00 . A A . 5 ARG HA 1 1 13 5331 1 1 5 ARG HB2 H -5.238 -8.176 3.849 1.00 . A A . 5 ARG HB2 1 1 13 5332 1 1 5 ARG HB3 H -6.671 -7.217 4.192 1.00 . A A . 5 ARG HB3 1 1 13 5333 1 1 5 ARG HD2 H -8.238 -8.364 4.652 1.00 . A A . 5 ARG HD2 1 1 13 5334 1 1 5 ARG HD3 H -9.032 -9.442 3.505 1.00 . A A . 5 ARG HD3 1 1 13 5335 1 1 5 ARG HE H -6.834 -10.681 4.858 1.00 . A A . 5 ARG HE 1 1 13 5336 1 1 5 ARG HG2 H -7.499 -8.687 2.057 1.00 . A A . 5 ARG HG2 1 1 13 5337 1 1 5 ARG HG3 H -6.411 -9.814 2.871 1.00 . A A . 5 ARG HG3 1 1 13 5338 1 1 5 ARG HH11 H -10.217 -9.867 5.113 1.00 . A A . 5 ARG HH11 1 1 13 5339 1 1 5 ARG HH12 H -10.566 -11.134 6.239 1.00 . A A . 5 ARG HH12 1 1 13 5340 1 1 5 ARG HH21 H -7.290 -12.350 6.339 1.00 . A A . 5 ARG HH21 1 1 13 5341 1 1 5 ARG HH22 H -8.905 -12.544 6.937 1.00 . A A . 5 ARG HH22 1 1 13 5342 1 1 5 ARG N N -6.992 -6.314 1.649 1.00 . A A . 5 ARG N 1 1 13 5343 1 1 5 ARG NE N -7.765 -10.379 4.864 1.00 . A A . 5 ARG NE 1 1 13 5344 1 1 5 ARG NH1 N -9.913 -10.644 5.662 1.00 . A A . 5 ARG NH1 1 1 13 5345 1 1 5 ARG NH2 N -8.246 -12.057 6.361 1.00 . A A . 5 ARG NH2 1 1 13 5346 1 1 5 ARG O O -4.898 -8.770 1.197 1.00 . A A . 5 ARG O 1 1 13 5347 1 1 6 ILE C C -1.863 -6.756 -0.389 1.00 . A A . 6 ILE C 1 1 13 5348 1 1 6 ILE CA C -3.272 -7.324 -0.522 1.00 . A A . 6 ILE CA 1 1 13 5349 1 1 6 ILE CB C -3.796 -7.042 -1.942 1.00 . A A . 6 ILE CB 1 1 13 5350 1 1 6 ILE CD1 C -5.923 -6.969 -3.338 1.00 . A A . 6 ILE CD1 1 1 13 5351 1 1 6 ILE CG1 C -5.275 -7.418 -2.047 1.00 . A A . 6 ILE CG1 1 1 13 5352 1 1 6 ILE CG2 C -2.975 -7.806 -2.971 1.00 . A A . 6 ILE CG2 1 1 13 5353 1 1 6 ILE H H -4.209 -5.793 0.599 1.00 . A A . 6 ILE H 1 1 13 5354 1 1 6 ILE HA H -3.234 -8.394 -0.379 1.00 . A A . 6 ILE HA 1 1 13 5355 1 1 6 ILE HB H -3.685 -5.987 -2.141 1.00 . A A . 6 ILE HB 1 1 13 5356 1 1 6 ILE HD11 H -5.223 -7.086 -4.152 1.00 . A A . 6 ILE HD11 1 1 13 5357 1 1 6 ILE HD12 H -6.800 -7.569 -3.528 1.00 . A A . 6 ILE HD12 1 1 13 5358 1 1 6 ILE HD13 H -6.209 -5.931 -3.256 1.00 . A A . 6 ILE HD13 1 1 13 5359 1 1 6 ILE HG12 H -5.374 -8.491 -1.983 1.00 . A A . 6 ILE HG12 1 1 13 5360 1 1 6 ILE HG13 H -5.814 -6.961 -1.229 1.00 . A A . 6 ILE HG13 1 1 13 5361 1 1 6 ILE HG21 H -2.008 -8.047 -2.553 1.00 . A A . 6 ILE HG21 1 1 13 5362 1 1 6 ILE HG22 H -3.490 -8.717 -3.237 1.00 . A A . 6 ILE HG22 1 1 13 5363 1 1 6 ILE HG23 H -2.844 -7.195 -3.851 1.00 . A A . 6 ILE HG23 1 1 13 5364 1 1 6 ILE N N -4.159 -6.765 0.491 1.00 . A A . 6 ILE N 1 1 13 5365 1 1 6 ILE O O -1.679 -5.543 -0.286 1.00 . A A . 6 ILE O 1 1 13 5366 1 1 7 LEU C C 0.978 -6.497 -1.534 1.00 . A A . 7 LEU C 1 1 13 5367 1 1 7 LEU CA C 0.521 -7.226 -0.275 1.00 . A A . 7 LEU CA 1 1 13 5368 1 1 7 LEU CB C 1.419 -8.439 -0.020 1.00 . A A . 7 LEU CB 1 1 13 5369 1 1 7 LEU CD1 C 1.197 -8.112 2.463 1.00 . A A . 7 LEU CD1 1 1 13 5370 1 1 7 LEU CD2 C -0.068 -9.946 1.324 1.00 . A A . 7 LEU CD2 1 1 13 5371 1 1 7 LEU CG C 1.216 -9.130 1.332 1.00 . A A . 7 LEU CG 1 1 13 5372 1 1 7 LEU H H -1.081 -8.593 -0.481 1.00 . A A . 7 LEU H 1 1 13 5373 1 1 7 LEU HA H 0.595 -6.550 0.563 1.00 . A A . 7 LEU HA 1 1 13 5374 1 1 7 LEU HB2 H 1.240 -9.163 -0.801 1.00 . A A . 7 LEU HB2 1 1 13 5375 1 1 7 LEU HB3 H 2.447 -8.117 -0.082 1.00 . A A . 7 LEU HB3 1 1 13 5376 1 1 7 LEU HD11 H 1.629 -7.184 2.121 1.00 . A A . 7 LEU HD11 1 1 13 5377 1 1 7 LEU HD12 H 0.178 -7.941 2.777 1.00 . A A . 7 LEU HD12 1 1 13 5378 1 1 7 LEU HD13 H 1.770 -8.490 3.297 1.00 . A A . 7 LEU HD13 1 1 13 5379 1 1 7 LEU HD21 H -0.256 -10.312 0.326 1.00 . A A . 7 LEU HD21 1 1 13 5380 1 1 7 LEU HD22 H 0.033 -10.783 2.001 1.00 . A A . 7 LEU HD22 1 1 13 5381 1 1 7 LEU HD23 H -0.891 -9.324 1.642 1.00 . A A . 7 LEU HD23 1 1 13 5382 1 1 7 LEU HG H 2.041 -9.807 1.508 1.00 . A A . 7 LEU HG 1 1 13 5383 1 1 7 LEU N N -0.872 -7.640 -0.394 1.00 . A A . 7 LEU N 1 1 13 5384 1 1 7 LEU O O 0.670 -6.914 -2.650 1.00 . A A . 7 LEU O 1 1 13 5385 1 1 8 LEU C C 3.341 -3.699 -2.027 1.00 . A A . 8 LEU C 1 1 13 5386 1 1 8 LEU CA C 2.214 -4.622 -2.473 1.00 . A A . 8 LEU CA 1 1 13 5387 1 1 8 LEU CB C 1.082 -3.803 -3.096 1.00 . A A . 8 LEU CB 1 1 13 5388 1 1 8 LEU CD1 C -0.211 -3.540 -5.228 1.00 . A A . 8 LEU CD1 1 1 13 5389 1 1 8 LEU CD2 C 1.979 -2.367 -4.944 1.00 . A A . 8 LEU CD2 1 1 13 5390 1 1 8 LEU CG C 1.177 -3.616 -4.611 1.00 . A A . 8 LEU CG 1 1 13 5391 1 1 8 LEU H H 1.931 -5.122 -0.433 1.00 . A A . 8 LEU H 1 1 13 5392 1 1 8 LEU HA H 2.598 -5.310 -3.212 1.00 . A A . 8 LEU HA 1 1 13 5393 1 1 8 LEU HB2 H 0.145 -4.292 -2.872 1.00 . A A . 8 LEU HB2 1 1 13 5394 1 1 8 LEU HB3 H 1.078 -2.826 -2.636 1.00 . A A . 8 LEU HB3 1 1 13 5395 1 1 8 LEU HD11 H -0.922 -4.026 -4.576 1.00 . A A . 8 LEU HD11 1 1 13 5396 1 1 8 LEU HD12 H -0.491 -2.505 -5.359 1.00 . A A . 8 LEU HD12 1 1 13 5397 1 1 8 LEU HD13 H -0.206 -4.035 -6.188 1.00 . A A . 8 LEU HD13 1 1 13 5398 1 1 8 LEU HD21 H 2.908 -2.378 -4.393 1.00 . A A . 8 LEU HD21 1 1 13 5399 1 1 8 LEU HD22 H 2.189 -2.346 -6.003 1.00 . A A . 8 LEU HD22 1 1 13 5400 1 1 8 LEU HD23 H 1.411 -1.490 -4.673 1.00 . A A . 8 LEU HD23 1 1 13 5401 1 1 8 LEU HG H 1.687 -4.467 -5.041 1.00 . A A . 8 LEU HG 1 1 13 5402 1 1 8 LEU N N 1.715 -5.407 -1.348 1.00 . A A . 8 LEU N 1 1 13 5403 1 1 8 LEU O O 3.142 -2.833 -1.176 1.00 . A A . 8 LEU O 1 1 13 5404 1 1 9 GLU C C 5.915 -1.990 -3.301 1.00 . A A . 9 GLU C 1 1 13 5405 1 1 9 GLU CA C 5.686 -3.085 -2.266 1.00 . A A . 9 GLU CA 1 1 13 5406 1 1 9 GLU CB C 6.932 -3.969 -2.161 1.00 . A A . 9 GLU CB 1 1 13 5407 1 1 9 GLU CD C 8.644 -4.774 -3.836 1.00 . A A . 9 GLU CD 1 1 13 5408 1 1 9 GLU CG C 7.191 -4.805 -3.403 1.00 . A A . 9 GLU CG 1 1 13 5409 1 1 9 GLU H H 4.614 -4.605 -3.275 1.00 . A A . 9 GLU H 1 1 13 5410 1 1 9 GLU HA H 5.501 -2.624 -1.309 1.00 . A A . 9 GLU HA 1 1 13 5411 1 1 9 GLU HB2 H 7.792 -3.338 -1.992 1.00 . A A . 9 GLU HB2 1 1 13 5412 1 1 9 GLU HB3 H 6.814 -4.637 -1.321 1.00 . A A . 9 GLU HB3 1 1 13 5413 1 1 9 GLU HG2 H 6.915 -5.828 -3.197 1.00 . A A . 9 GLU HG2 1 1 13 5414 1 1 9 GLU HG3 H 6.581 -4.426 -4.212 1.00 . A A . 9 GLU HG3 1 1 13 5415 1 1 9 GLU N N 4.522 -3.896 -2.606 1.00 . A A . 9 GLU N 1 1 13 5416 1 1 9 GLU O O 5.899 -2.245 -4.505 1.00 . A A . 9 GLU O 1 1 13 5417 1 1 9 GLU OE1 O 9.261 -3.690 -3.765 1.00 . A A . 9 GLU OE1 1 1 13 5418 1 1 9 GLU OE2 O 9.164 -5.833 -4.245 1.00 . A A . 9 GLU OE2 1 1 13 5419 1 1 10 CYS C C 7.135 1.466 -2.995 1.00 . A A . 10 CYS C 1 1 13 5420 1 1 10 CYS CA C 6.345 0.371 -3.707 1.00 . A A . 10 CYS CA 1 1 13 5421 1 1 10 CYS CB C 5.009 0.934 -4.210 1.00 . A A . 10 CYS CB 1 1 13 5422 1 1 10 CYS H H 6.115 -0.624 -1.853 1.00 . A A . 10 CYS H 1 1 13 5423 1 1 10 CYS HA H 6.920 0.024 -4.553 1.00 . A A . 10 CYS HA 1 1 13 5424 1 1 10 CYS HB2 H 4.935 1.974 -3.931 1.00 . A A . 10 CYS HB2 1 1 13 5425 1 1 10 CYS HB3 H 4.979 0.855 -5.287 1.00 . A A . 10 CYS HB3 1 1 13 5426 1 1 10 CYS N N 6.121 -0.766 -2.823 1.00 . A A . 10 CYS N 1 1 13 5427 1 1 10 CYS O O 7.184 1.510 -1.765 1.00 . A A . 10 CYS O 1 1 13 5428 1 1 10 CYS SG S 3.535 0.084 -3.551 1.00 . A A . 10 CYS SG 1 1 13 5429 1 1 11 LYS C C 7.634 4.640 -2.900 1.00 . A A . 11 LYS C 1 1 13 5430 1 1 11 LYS CA C 8.530 3.447 -3.220 1.00 . A A . 11 LYS CA 1 1 13 5431 1 1 11 LYS CB C 9.629 3.864 -4.199 1.00 . A A . 11 LYS CB 1 1 13 5432 1 1 11 LYS CD C 10.859 1.698 -4.545 1.00 . A A . 11 LYS CD 1 1 13 5433 1 1 11 LYS CE C 11.567 1.577 -5.885 1.00 . A A . 11 LYS CE 1 1 13 5434 1 1 11 LYS CG C 10.937 3.115 -3.998 1.00 . A A . 11 LYS CG 1 1 13 5435 1 1 11 LYS H H 7.668 2.264 -4.749 1.00 . A A . 11 LYS H 1 1 13 5436 1 1 11 LYS HA H 8.987 3.099 -2.306 1.00 . A A . 11 LYS HA 1 1 13 5437 1 1 11 LYS HB2 H 9.286 3.682 -5.207 1.00 . A A . 11 LYS HB2 1 1 13 5438 1 1 11 LYS HB3 H 9.822 4.920 -4.078 1.00 . A A . 11 LYS HB3 1 1 13 5439 1 1 11 LYS HD2 H 11.326 1.025 -3.841 1.00 . A A . 11 LYS HD2 1 1 13 5440 1 1 11 LYS HD3 H 9.821 1.427 -4.670 1.00 . A A . 11 LYS HD3 1 1 13 5441 1 1 11 LYS HE2 H 11.277 0.645 -6.347 1.00 . A A . 11 LYS HE2 1 1 13 5442 1 1 11 LYS HE3 H 11.263 2.400 -6.514 1.00 . A A . 11 LYS HE3 1 1 13 5443 1 1 11 LYS HG2 H 11.727 3.644 -4.512 1.00 . A A . 11 LYS HG2 1 1 13 5444 1 1 11 LYS HG3 H 11.157 3.073 -2.941 1.00 . A A . 11 LYS HG3 1 1 13 5445 1 1 11 LYS HZ1 H 13.326 1.144 -4.843 1.00 . A A . 11 LYS HZ1 1 1 13 5446 1 1 11 LYS HZ2 H 13.496 1.095 -6.526 1.00 . A A . 11 LYS HZ2 1 1 13 5447 1 1 11 LYS HZ3 H 13.391 2.584 -5.729 1.00 . A A . 11 LYS HZ3 1 1 13 5448 1 1 11 LYS N N 7.747 2.350 -3.776 1.00 . A A . 11 LYS N 1 1 13 5449 1 1 11 LYS NZ N 13.048 1.602 -5.735 1.00 . A A . 11 LYS NZ 1 1 13 5450 1 1 11 LYS O O 7.643 5.153 -1.781 1.00 . A A . 11 LYS O 1 1 13 5451 1 1 12 LYS C C 4.589 5.717 -3.210 1.00 . A A . 12 LYS C 1 1 13 5452 1 1 12 LYS CA C 5.946 6.198 -3.711 1.00 . A A . 12 LYS CA 1 1 13 5453 1 1 12 LYS CB C 5.778 6.958 -5.029 1.00 . A A . 12 LYS CB 1 1 13 5454 1 1 12 LYS CD C 5.789 9.414 -5.574 1.00 . A A . 12 LYS CD 1 1 13 5455 1 1 12 LYS CE C 4.849 10.542 -5.968 1.00 . A A . 12 LYS CE 1 1 13 5456 1 1 12 LYS CG C 5.047 8.283 -4.880 1.00 . A A . 12 LYS CG 1 1 13 5457 1 1 12 LYS H H 6.889 4.616 -4.757 1.00 . A A . 12 LYS H 1 1 13 5458 1 1 12 LYS HA H 6.377 6.860 -2.975 1.00 . A A . 12 LYS HA 1 1 13 5459 1 1 12 LYS HB2 H 6.756 7.155 -5.444 1.00 . A A . 12 LYS HB2 1 1 13 5460 1 1 12 LYS HB3 H 5.222 6.340 -5.718 1.00 . A A . 12 LYS HB3 1 1 13 5461 1 1 12 LYS HD2 H 6.541 9.803 -4.903 1.00 . A A . 12 LYS HD2 1 1 13 5462 1 1 12 LYS HD3 H 6.264 9.026 -6.463 1.00 . A A . 12 LYS HD3 1 1 13 5463 1 1 12 LYS HE2 H 4.625 10.457 -7.020 1.00 . A A . 12 LYS HE2 1 1 13 5464 1 1 12 LYS HE3 H 3.936 10.449 -5.398 1.00 . A A . 12 LYS HE3 1 1 13 5465 1 1 12 LYS HG2 H 4.063 8.190 -5.316 1.00 . A A . 12 LYS HG2 1 1 13 5466 1 1 12 LYS HG3 H 4.955 8.515 -3.829 1.00 . A A . 12 LYS HG3 1 1 13 5467 1 1 12 LYS HZ1 H 6.486 11.810 -5.686 1.00 . A A . 12 LYS HZ1 1 1 13 5468 1 1 12 LYS HZ2 H 5.173 12.547 -6.458 1.00 . A A . 12 LYS HZ2 1 1 13 5469 1 1 12 LYS HZ3 H 5.117 12.250 -4.793 1.00 . A A . 12 LYS HZ3 1 1 13 5470 1 1 12 LYS N N 6.856 5.071 -3.888 1.00 . A A . 12 LYS N 1 1 13 5471 1 1 12 LYS NZ N 5.448 11.881 -5.708 1.00 . A A . 12 LYS NZ 1 1 13 5472 1 1 12 LYS O O 4.022 4.764 -3.747 1.00 . A A . 12 LYS O 1 1 13 5473 1 1 13 ASP C C 1.683 6.047 -2.647 1.00 . A A . 13 ASP C 1 1 13 5474 1 1 13 ASP CA C 2.787 5.996 -1.601 1.00 . A A . 13 ASP CA 1 1 13 5475 1 1 13 ASP CB C 2.435 6.899 -0.419 1.00 . A A . 13 ASP CB 1 1 13 5476 1 1 13 ASP CG C 3.553 6.981 0.602 1.00 . A A . 13 ASP CG 1 1 13 5477 1 1 13 ASP H H 4.574 7.116 -1.783 1.00 . A A . 13 ASP H 1 1 13 5478 1 1 13 ASP HA H 2.874 4.986 -1.254 1.00 . A A . 13 ASP HA 1 1 13 5479 1 1 13 ASP HB2 H 2.225 7.893 -0.778 1.00 . A A . 13 ASP HB2 1 1 13 5480 1 1 13 ASP HB3 H 1.556 6.510 0.071 1.00 . A A . 13 ASP HB3 1 1 13 5481 1 1 13 ASP N N 4.075 6.372 -2.174 1.00 . A A . 13 ASP N 1 1 13 5482 1 1 13 ASP O O 0.762 5.231 -2.627 1.00 . A A . 13 ASP O 1 1 13 5483 1 1 13 ASP OD1 O 4.711 7.212 0.195 1.00 . A A . 13 ASP OD1 1 1 13 5484 1 1 13 ASP OD2 O 3.272 6.816 1.807 1.00 . A A . 13 ASP OD2 1 1 13 5485 1 1 14 SER C C 0.652 5.856 -5.413 1.00 . A A . 14 SER C 1 1 13 5486 1 1 14 SER CA C 0.807 7.155 -4.627 1.00 . A A . 14 SER CA 1 1 13 5487 1 1 14 SER CB C 1.215 8.294 -5.567 1.00 . A A . 14 SER CB 1 1 13 5488 1 1 14 SER H H 2.552 7.614 -3.526 1.00 . A A . 14 SER H 1 1 13 5489 1 1 14 SER HA H -0.140 7.399 -4.171 1.00 . A A . 14 SER HA 1 1 13 5490 1 1 14 SER HB2 H 0.329 8.739 -5.995 1.00 . A A . 14 SER HB2 1 1 13 5491 1 1 14 SER HB3 H 1.756 9.042 -5.007 1.00 . A A . 14 SER HB3 1 1 13 5492 1 1 14 SER N N 1.789 7.000 -3.562 1.00 . A A . 14 SER N 1 1 13 5493 1 1 14 SER O O -0.433 5.533 -5.894 1.00 . A A . 14 SER O 1 1 13 5494 1 1 14 SER OG O 2.041 7.825 -6.619 1.00 . A A . 14 SER OG 1 1 13 5495 1 1 15 ASP C C 0.634 2.933 -5.809 1.00 . A A . 15 ASP C 1 1 13 5496 1 1 15 ASP CA C 1.753 3.859 -6.280 1.00 . A A . 15 ASP CA 1 1 13 5497 1 1 15 ASP CB C 3.106 3.159 -6.134 1.00 . A A . 15 ASP CB 1 1 13 5498 1 1 15 ASP CG C 3.595 2.568 -7.441 1.00 . A A . 15 ASP CG 1 1 13 5499 1 1 15 ASP H H 2.591 5.431 -5.140 1.00 . A A . 15 ASP H 1 1 13 5500 1 1 15 ASP HA H 1.593 4.088 -7.323 1.00 . A A . 15 ASP HA 1 1 13 5501 1 1 15 ASP HB2 H 3.838 3.873 -5.787 1.00 . A A . 15 ASP HB2 1 1 13 5502 1 1 15 ASP HB3 H 3.016 2.362 -5.411 1.00 . A A . 15 ASP HB3 1 1 13 5503 1 1 15 ASP N N 1.753 5.118 -5.546 1.00 . A A . 15 ASP N 1 1 13 5504 1 1 15 ASP O O 0.070 2.178 -6.600 1.00 . A A . 15 ASP O 1 1 13 5505 1 1 15 ASP OD1 O 2.791 1.907 -8.132 1.00 . A A . 15 ASP OD1 1 1 13 5506 1 1 15 ASP OD2 O 4.782 2.767 -7.776 1.00 . A A . 15 ASP OD2 1 1 13 5507 1 1 16 CYS C C -1.993 2.198 -4.773 1.00 . A A . 16 CYS C 1 1 13 5508 1 1 16 CYS CA C -0.715 2.128 -3.947 1.00 . A A . 16 CYS CA 1 1 13 5509 1 1 16 CYS CB C -1.004 2.510 -2.490 1.00 . A A . 16 CYS CB 1 1 13 5510 1 1 16 CYS H H 0.816 3.593 -3.927 1.00 . A A . 16 CYS H 1 1 13 5511 1 1 16 CYS HA H -0.350 1.113 -3.973 1.00 . A A . 16 CYS HA 1 1 13 5512 1 1 16 CYS HB2 H -0.120 2.924 -2.058 1.00 . A A . 16 CYS HB2 1 1 13 5513 1 1 16 CYS HB3 H -1.781 3.254 -2.464 1.00 . A A . 16 CYS HB3 1 1 13 5514 1 1 16 CYS N N 0.326 2.981 -4.514 1.00 . A A . 16 CYS N 1 1 13 5515 1 1 16 CYS O O -2.102 2.990 -5.709 1.00 . A A . 16 CYS O 1 1 13 5516 1 1 16 CYS SG S -1.523 1.114 -1.434 1.00 . A A . 16 CYS SG 1 1 13 5517 1 1 17 LEU C C -5.382 1.641 -4.197 1.00 . A A . 17 LEU C 1 1 13 5518 1 1 17 LEU CA C -4.225 1.304 -5.128 1.00 . A A . 17 LEU CA 1 1 13 5519 1 1 17 LEU CB C -4.437 -0.082 -5.740 1.00 . A A . 17 LEU CB 1 1 13 5520 1 1 17 LEU CD1 C -5.867 -1.981 -4.928 1.00 . A A . 17 LEU CD1 1 1 13 5521 1 1 17 LEU CD2 C -3.375 -2.169 -4.835 1.00 . A A . 17 LEU CD2 1 1 13 5522 1 1 17 LEU CG C -4.562 -1.224 -4.726 1.00 . A A . 17 LEU CG 1 1 13 5523 1 1 17 LEU H H -2.794 0.751 -3.667 1.00 . A A . 17 LEU H 1 1 13 5524 1 1 17 LEU HA H -4.193 2.036 -5.922 1.00 . A A . 17 LEU HA 1 1 13 5525 1 1 17 LEU HB2 H -5.338 -0.053 -6.336 1.00 . A A . 17 LEU HB2 1 1 13 5526 1 1 17 LEU HB3 H -3.602 -0.296 -6.390 1.00 . A A . 17 LEU HB3 1 1 13 5527 1 1 17 LEU HD11 H -6.057 -2.096 -5.985 1.00 . A A . 17 LEU HD11 1 1 13 5528 1 1 17 LEU HD12 H -5.793 -2.955 -4.467 1.00 . A A . 17 LEU HD12 1 1 13 5529 1 1 17 LEU HD13 H -6.677 -1.429 -4.475 1.00 . A A . 17 LEU HD13 1 1 13 5530 1 1 17 LEU HD21 H -2.458 -1.599 -4.822 1.00 . A A . 17 LEU HD21 1 1 13 5531 1 1 17 LEU HD22 H -3.383 -2.856 -4.002 1.00 . A A . 17 LEU HD22 1 1 13 5532 1 1 17 LEU HD23 H -3.440 -2.724 -5.760 1.00 . A A . 17 LEU HD23 1 1 13 5533 1 1 17 LEU HG H -4.569 -0.811 -3.728 1.00 . A A . 17 LEU HG 1 1 13 5534 1 1 17 LEU N N -2.951 1.356 -4.420 1.00 . A A . 17 LEU N 1 1 13 5535 1 1 17 LEU O O -5.205 1.751 -2.984 1.00 . A A . 17 LEU O 1 1 13 5536 1 1 18 ALA C C -7.506 3.364 -3.121 1.00 . A A . 18 ALA C 1 1 13 5537 1 1 18 ALA CA C -7.756 2.131 -3.994 1.00 . A A . 18 ALA CA 1 1 13 5538 1 1 18 ALA CB C -8.177 0.927 -3.161 1.00 . A A . 18 ALA CB 1 1 13 5539 1 1 18 ALA H H -6.648 1.705 -5.746 1.00 . A A . 18 ALA H 1 1 13 5540 1 1 18 ALA HA H -8.555 2.354 -4.687 1.00 . A A . 18 ALA HA 1 1 13 5541 1 1 18 ALA HB1 H -8.300 0.068 -3.804 1.00 . A A . 18 ALA HB1 1 1 13 5542 1 1 18 ALA HB2 H -9.111 1.141 -2.664 1.00 . A A . 18 ALA HB2 1 1 13 5543 1 1 18 ALA HB3 H -7.417 0.717 -2.422 1.00 . A A . 18 ALA HB3 1 1 13 5544 1 1 18 ALA N N -6.570 1.805 -4.774 1.00 . A A . 18 ALA N 1 1 13 5545 1 1 18 ALA O O -7.118 4.416 -3.628 1.00 . A A . 18 ALA O 1 1 13 5546 1 1 19 GLU C C -6.494 3.980 0.182 1.00 . A A . 19 GLU C 1 1 13 5547 1 1 19 GLU CA C -7.504 4.353 -0.899 1.00 . A A . 19 GLU CA 1 1 13 5548 1 1 19 GLU CB C -8.829 4.780 -0.259 1.00 . A A . 19 GLU CB 1 1 13 5549 1 1 19 GLU CD C -8.407 6.793 1.207 1.00 . A A . 19 GLU CD 1 1 13 5550 1 1 19 GLU CG C -8.974 6.284 -0.104 1.00 . A A . 19 GLU CG 1 1 13 5551 1 1 19 GLU H H -8.026 2.383 -1.451 1.00 . A A . 19 GLU H 1 1 13 5552 1 1 19 GLU HA H -7.111 5.180 -1.473 1.00 . A A . 19 GLU HA 1 1 13 5553 1 1 19 GLU HB2 H -9.643 4.423 -0.874 1.00 . A A . 19 GLU HB2 1 1 13 5554 1 1 19 GLU HB3 H -8.905 4.328 0.718 1.00 . A A . 19 GLU HB3 1 1 13 5555 1 1 19 GLU HG2 H -8.453 6.770 -0.916 1.00 . A A . 19 GLU HG2 1 1 13 5556 1 1 19 GLU HG3 H -10.023 6.538 -0.149 1.00 . A A . 19 GLU HG3 1 1 13 5557 1 1 19 GLU N N -7.720 3.239 -1.812 1.00 . A A . 19 GLU N 1 1 13 5558 1 1 19 GLU O O -6.784 4.075 1.375 1.00 . A A . 19 GLU O 1 1 13 5559 1 1 19 GLU OE1 O -7.188 6.637 1.427 1.00 . A A . 19 GLU OE1 1 1 13 5560 1 1 19 GLU OE2 O -9.183 7.347 2.015 1.00 . A A . 19 GLU OE2 1 1 13 5561 1 1 20 CYS C C -2.930 3.789 0.274 1.00 . A A . 20 CYS C 1 1 13 5562 1 1 20 CYS CA C -4.257 3.182 0.697 1.00 . A A . 20 CYS CA 1 1 13 5563 1 1 20 CYS CB C -4.142 1.659 0.784 1.00 . A A . 20 CYS CB 1 1 13 5564 1 1 20 CYS H H -5.118 3.508 -1.203 1.00 . A A . 20 CYS H 1 1 13 5565 1 1 20 CYS HA H -4.525 3.572 1.669 1.00 . A A . 20 CYS HA 1 1 13 5566 1 1 20 CYS HB2 H -4.682 1.216 -0.040 1.00 . A A . 20 CYS HB2 1 1 13 5567 1 1 20 CYS HB3 H -3.100 1.377 0.716 1.00 . A A . 20 CYS HB3 1 1 13 5568 1 1 20 CYS N N -5.303 3.560 -0.239 1.00 . A A . 20 CYS N 1 1 13 5569 1 1 20 CYS O O -2.862 4.518 -0.716 1.00 . A A . 20 CYS O 1 1 13 5570 1 1 20 CYS SG S -4.809 0.953 2.326 1.00 . A A . 20 CYS SG 1 1 13 5571 1 1 21 VAL C C 0.475 2.912 0.579 1.00 . A A . 21 VAL C 1 1 13 5572 1 1 21 VAL CA C -0.562 4.022 0.704 1.00 . A A . 21 VAL CA 1 1 13 5573 1 1 21 VAL CB C -0.093 5.044 1.760 1.00 . A A . 21 VAL CB 1 1 13 5574 1 1 21 VAL CG1 C -1.103 6.173 1.894 1.00 . A A . 21 VAL CG1 1 1 13 5575 1 1 21 VAL CG2 C 0.138 4.367 3.105 1.00 . A A . 21 VAL CG2 1 1 13 5576 1 1 21 VAL H H -1.988 2.906 1.799 1.00 . A A . 21 VAL H 1 1 13 5577 1 1 21 VAL HA H -0.634 4.533 -0.245 1.00 . A A . 21 VAL HA 1 1 13 5578 1 1 21 VAL HB H 0.845 5.470 1.429 1.00 . A A . 21 VAL HB 1 1 13 5579 1 1 21 VAL HG11 H -2.099 5.760 1.951 1.00 . A A . 21 VAL HG11 1 1 13 5580 1 1 21 VAL HG12 H -0.895 6.738 2.790 1.00 . A A . 21 VAL HG12 1 1 13 5581 1 1 21 VAL HG13 H -1.032 6.823 1.034 1.00 . A A . 21 VAL HG13 1 1 13 5582 1 1 21 VAL HG21 H -0.481 3.484 3.174 1.00 . A A . 21 VAL HG21 1 1 13 5583 1 1 21 VAL HG22 H 1.176 4.086 3.193 1.00 . A A . 21 VAL HG22 1 1 13 5584 1 1 21 VAL HG23 H -0.120 5.050 3.901 1.00 . A A . 21 VAL HG23 1 1 13 5585 1 1 21 VAL N N -1.877 3.492 1.020 1.00 . A A . 21 VAL N 1 1 13 5586 1 1 21 VAL O O 0.274 1.793 1.051 1.00 . A A . 21 VAL O 1 1 13 5587 1 1 22 CYS C C 3.778 2.553 0.774 1.00 . A A . 22 CYS C 1 1 13 5588 1 1 22 CYS CA C 2.686 2.314 -0.264 1.00 . A A . 22 CYS CA 1 1 13 5589 1 1 22 CYS CB C 3.259 2.471 -1.680 1.00 . A A . 22 CYS CB 1 1 13 5590 1 1 22 CYS H H 1.663 4.157 -0.398 1.00 . A A . 22 CYS H 1 1 13 5591 1 1 22 CYS HA H 2.302 1.311 -0.146 1.00 . A A . 22 CYS HA 1 1 13 5592 1 1 22 CYS HB2 H 3.268 3.515 -1.942 1.00 . A A . 22 CYS HB2 1 1 13 5593 1 1 22 CYS HB3 H 4.270 2.100 -1.702 1.00 . A A . 22 CYS HB3 1 1 13 5594 1 1 22 CYS N N 1.584 3.250 -0.058 1.00 . A A . 22 CYS N 1 1 13 5595 1 1 22 CYS O O 4.157 3.694 1.037 1.00 . A A . 22 CYS O 1 1 13 5596 1 1 22 CYS SG S 2.317 1.596 -2.967 1.00 . A A . 22 CYS SG 1 1 13 5597 1 1 23 LEU C C 6.683 1.272 1.829 1.00 . A A . 23 LEU C 1 1 13 5598 1 1 23 LEU CA C 5.301 1.574 2.399 1.00 . A A . 23 LEU CA 1 1 13 5599 1 1 23 LEU CB C 4.986 0.626 3.556 1.00 . A A . 23 LEU CB 1 1 13 5600 1 1 23 LEU CD1 C 3.117 -0.669 4.619 1.00 . A A . 23 LEU CD1 1 1 13 5601 1 1 23 LEU CD2 C 3.374 1.771 5.096 1.00 . A A . 23 LEU CD2 1 1 13 5602 1 1 23 LEU CG C 3.540 0.678 4.052 1.00 . A A . 23 LEU CG 1 1 13 5603 1 1 23 LEU H H 3.917 0.590 1.132 1.00 . A A . 23 LEU H 1 1 13 5604 1 1 23 LEU HA H 5.295 2.587 2.770 1.00 . A A . 23 LEU HA 1 1 13 5605 1 1 23 LEU HB2 H 5.202 -0.385 3.237 1.00 . A A . 23 LEU HB2 1 1 13 5606 1 1 23 LEU HB3 H 5.635 0.872 4.382 1.00 . A A . 23 LEU HB3 1 1 13 5607 1 1 23 LEU HD11 H 3.465 -1.457 3.969 1.00 . A A . 23 LEU HD11 1 1 13 5608 1 1 23 LEU HD12 H 3.545 -0.797 5.602 1.00 . A A . 23 LEU HD12 1 1 13 5609 1 1 23 LEU HD13 H 2.039 -0.708 4.688 1.00 . A A . 23 LEU HD13 1 1 13 5610 1 1 23 LEU HD21 H 3.784 2.696 4.717 1.00 . A A . 23 LEU HD21 1 1 13 5611 1 1 23 LEU HD22 H 2.324 1.906 5.314 1.00 . A A . 23 LEU HD22 1 1 13 5612 1 1 23 LEU HD23 H 3.896 1.490 5.999 1.00 . A A . 23 LEU HD23 1 1 13 5613 1 1 23 LEU HG H 2.888 0.907 3.221 1.00 . A A . 23 LEU HG 1 1 13 5614 1 1 23 LEU N N 4.268 1.473 1.374 1.00 . A A . 23 LEU N 1 1 13 5615 1 1 23 LEU O O 6.836 0.431 0.942 1.00 . A A . 23 LEU O 1 1 13 5616 1 1 24 GLU C C 9.536 0.373 2.011 1.00 . A A . 24 GLU C 1 1 13 5617 1 1 24 GLU CA C 9.064 1.820 1.899 1.00 . A A . 24 GLU CA 1 1 13 5618 1 1 24 GLU CB C 9.987 2.728 2.712 1.00 . A A . 24 GLU CB 1 1 13 5619 1 1 24 GLU CD C 10.285 3.686 5.031 1.00 . A A . 24 GLU CD 1 1 13 5620 1 1 24 GLU CG C 9.935 2.462 4.208 1.00 . A A . 24 GLU CG 1 1 13 5621 1 1 24 GLU H H 7.487 2.638 3.044 1.00 . A A . 24 GLU H 1 1 13 5622 1 1 24 GLU HA H 9.111 2.119 0.863 1.00 . A A . 24 GLU HA 1 1 13 5623 1 1 24 GLU HB2 H 11.004 2.582 2.378 1.00 . A A . 24 GLU HB2 1 1 13 5624 1 1 24 GLU HB3 H 9.705 3.756 2.541 1.00 . A A . 24 GLU HB3 1 1 13 5625 1 1 24 GLU HG2 H 8.937 2.145 4.470 1.00 . A A . 24 GLU HG2 1 1 13 5626 1 1 24 GLU HG3 H 10.636 1.674 4.445 1.00 . A A . 24 GLU HG3 1 1 13 5627 1 1 24 GLU N N 7.684 1.981 2.345 1.00 . A A . 24 GLU N 1 1 13 5628 1 1 24 GLU O O 10.147 -0.158 1.083 1.00 . A A . 24 GLU O 1 1 13 5629 1 1 24 GLU OE1 O 9.799 4.786 4.694 1.00 . A A . 24 GLU OE1 1 1 13 5630 1 1 24 GLU OE2 O 11.044 3.545 6.013 1.00 . A A . 24 GLU OE2 1 1 13 5631 1 1 25 HIS C C 9.140 -2.547 2.254 1.00 . A A . 25 HIS C 1 1 13 5632 1 1 25 HIS CA C 9.680 -1.646 3.356 1.00 . A A . 25 HIS CA 1 1 13 5633 1 1 25 HIS CB C 9.236 -2.154 4.731 1.00 . A A . 25 HIS CB 1 1 13 5634 1 1 25 HIS CD2 C 6.691 -2.642 4.636 1.00 . A A . 25 HIS CD2 1 1 13 5635 1 1 25 HIS CE1 C 6.005 -1.012 5.929 1.00 . A A . 25 HIS CE1 1 1 13 5636 1 1 25 HIS CG C 7.784 -1.945 5.025 1.00 . A A . 25 HIS CG 1 1 13 5637 1 1 25 HIS H H 8.778 0.206 3.856 1.00 . A A . 25 HIS H 1 1 13 5638 1 1 25 HIS HA H 10.760 -1.667 3.313 1.00 . A A . 25 HIS HA 1 1 13 5639 1 1 25 HIS HB2 H 9.434 -3.213 4.794 1.00 . A A . 25 HIS HB2 1 1 13 5640 1 1 25 HIS HB3 H 9.806 -1.644 5.495 1.00 . A A . 25 HIS HB3 1 1 13 5641 1 1 25 HIS HD1 H 7.872 -0.249 6.272 1.00 . A A . 25 HIS HD1 1 1 13 5642 1 1 25 HIS HD2 H 6.681 -3.507 3.988 1.00 . A A . 25 HIS HD2 1 1 13 5643 1 1 25 HIS HE1 H 5.371 -0.348 6.499 1.00 . A A . 25 HIS HE1 1 1 13 5644 1 1 25 HIS HE2 H 4.702 -2.438 5.263 1.00 . A A . 25 HIS HE2 1 1 13 5645 1 1 25 HIS N N 9.263 -0.263 3.148 1.00 . A A . 25 HIS N 1 1 13 5646 1 1 25 HIS ND1 N 7.320 -0.929 5.834 1.00 . A A . 25 HIS ND1 1 1 13 5647 1 1 25 HIS NE2 N 5.597 -2.043 5.212 1.00 . A A . 25 HIS NE2 1 1 13 5648 1 1 25 HIS O O 9.705 -3.604 1.969 1.00 . A A . 25 HIS O 1 1 13 5649 1 1 26 GLY C C 6.129 -3.492 0.889 1.00 . A A . 26 GLY C 1 1 13 5650 1 1 26 GLY CA C 7.474 -2.885 0.540 1.00 . A A . 26 GLY CA 1 1 13 5651 1 1 26 GLY H H 7.654 -1.259 1.880 1.00 . A A . 26 GLY H 1 1 13 5652 1 1 26 GLY HA2 H 8.156 -3.680 0.275 1.00 . A A . 26 GLY HA2 1 1 13 5653 1 1 26 GLY HA3 H 7.350 -2.235 -0.311 1.00 . A A . 26 GLY HA3 1 1 13 5654 1 1 26 GLY N N 8.055 -2.115 1.621 1.00 . A A . 26 GLY N 1 1 13 5655 1 1 26 GLY O O 5.993 -4.713 0.945 1.00 . A A . 26 GLY O 1 1 13 5656 1 1 27 TYR C C 2.781 -1.950 1.360 1.00 . A A . 27 TYR C 1 1 13 5657 1 1 27 TYR CA C 3.784 -3.097 1.437 1.00 . A A . 27 TYR CA 1 1 13 5658 1 1 27 TYR CB C 3.751 -3.718 2.835 1.00 . A A . 27 TYR CB 1 1 13 5659 1 1 27 TYR CD1 C 3.836 -6.072 1.925 1.00 . A A . 27 TYR CD1 1 1 13 5660 1 1 27 TYR CD2 C 5.088 -5.579 3.893 1.00 . A A . 27 TYR CD2 1 1 13 5661 1 1 27 TYR CE1 C 4.277 -7.382 1.968 1.00 . A A . 27 TYR CE1 1 1 13 5662 1 1 27 TYR CE2 C 5.533 -6.887 3.943 1.00 . A A . 27 TYR CE2 1 1 13 5663 1 1 27 TYR CG C 4.235 -5.150 2.885 1.00 . A A . 27 TYR CG 1 1 13 5664 1 1 27 TYR CZ C 5.125 -7.784 2.978 1.00 . A A . 27 TYR CZ 1 1 13 5665 1 1 27 TYR H H 5.303 -1.675 1.035 1.00 . A A . 27 TYR H 1 1 13 5666 1 1 27 TYR HA H 3.506 -3.850 0.714 1.00 . A A . 27 TYR HA 1 1 13 5667 1 1 27 TYR HB2 H 4.379 -3.138 3.489 1.00 . A A . 27 TYR HB2 1 1 13 5668 1 1 27 TYR HB3 H 2.737 -3.696 3.207 1.00 . A A . 27 TYR HB3 1 1 13 5669 1 1 27 TYR HD1 H 3.173 -5.755 1.134 1.00 . A A . 27 TYR HD1 1 1 13 5670 1 1 27 TYR HD2 H 5.406 -4.875 4.647 1.00 . A A . 27 TYR HD2 1 1 13 5671 1 1 27 TYR HE1 H 3.957 -8.084 1.213 1.00 . A A . 27 TYR HE1 1 1 13 5672 1 1 27 TYR HE2 H 6.196 -7.201 4.734 1.00 . A A . 27 TYR HE2 1 1 13 5673 1 1 27 TYR HH H 6.471 -9.130 2.712 1.00 . A A . 27 TYR HH 1 1 13 5674 1 1 27 TYR N N 5.132 -2.638 1.107 1.00 . A A . 27 TYR N 1 1 13 5675 1 1 27 TYR O O 3.111 -0.803 1.657 1.00 . A A . 27 TYR O 1 1 13 5676 1 1 27 TYR OH O 5.565 -9.087 3.025 1.00 . A A . 27 TYR OH 1 1 13 5677 1 1 28 CYS C C -0.407 -1.297 2.081 1.00 . A A . 28 CYS C 1 1 13 5678 1 1 28 CYS CA C 0.496 -1.266 0.852 1.00 . A A . 28 CYS CA 1 1 13 5679 1 1 28 CYS CB C -0.343 -1.507 -0.408 1.00 . A A . 28 CYS CB 1 1 13 5680 1 1 28 CYS H H 1.351 -3.202 0.739 1.00 . A A . 28 CYS H 1 1 13 5681 1 1 28 CYS HA H 0.965 -0.296 0.785 1.00 . A A . 28 CYS HA 1 1 13 5682 1 1 28 CYS HB2 H -0.102 -2.479 -0.810 1.00 . A A . 28 CYS HB2 1 1 13 5683 1 1 28 CYS HB3 H -1.390 -1.482 -0.146 1.00 . A A . 28 CYS HB3 1 1 13 5684 1 1 28 CYS N N 1.551 -2.270 0.964 1.00 . A A . 28 CYS N 1 1 13 5685 1 1 28 CYS O O -1.071 -2.298 2.351 1.00 . A A . 28 CYS O 1 1 13 5686 1 1 28 CYS SG S -0.075 -0.283 -1.732 1.00 . A A . 28 CYS SG 1 1 13 5687 1 1 29 GLY C C -1.126 1.221 4.717 1.00 . A A . 29 GLY C 1 1 13 5688 1 1 29 GLY CA C -1.248 -0.117 4.015 1.00 . A A . 29 GLY CA 1 1 13 5689 1 1 29 GLY H H 0.127 0.572 2.559 1.00 . A A . 29 GLY H 1 1 13 5690 1 1 29 GLY HA2 H -0.948 -0.898 4.698 1.00 . A A . 29 GLY HA2 1 1 13 5691 1 1 29 GLY HA3 H -2.279 -0.272 3.737 1.00 . A A . 29 GLY HA3 1 1 13 5692 1 1 29 GLY N N -0.424 -0.194 2.823 1.00 . A A . 29 GLY N 1 1 13 5693 1 1 29 GLY O O -0.206 1.375 5.547 1.00 . A A . 29 GLY O 1 1 13 5694 1 1 29 GLY OXT O -1.951 2.116 4.437 1.00 . A A . 29 GLY OXT 1 1 14 5695 1 1 1 ARG C C -11.059 2.884 1.333 1.00 . A A . 1 ARG C 1 1 14 5696 1 1 1 ARG CA C -12.023 3.920 0.764 1.00 . A A . 1 ARG CA 1 1 14 5697 1 1 1 ARG CB C -11.864 4.013 -0.755 1.00 . A A . 1 ARG CB 1 1 14 5698 1 1 1 ARG CD C -13.667 2.694 -1.907 1.00 . A A . 1 ARG CD 1 1 14 5699 1 1 1 ARG CG C -13.187 4.078 -1.501 1.00 . A A . 1 ARG CG 1 1 14 5700 1 1 1 ARG CZ C -16.031 2.665 -1.213 1.00 . A A . 1 ARG CZ 1 1 14 5701 1 1 1 ARG H1 H -10.745 5.426 1.343 1.00 . A A . 1 ARG H1 1 1 14 5702 1 1 1 ARG H2 H -12.266 5.964 0.756 1.00 . A A . 1 ARG H2 1 1 14 5703 1 1 1 ARG H3 H -12.145 5.262 2.318 1.00 . A A . 1 ARG H3 1 1 14 5704 1 1 1 ARG HA H -13.034 3.627 0.999 1.00 . A A . 1 ARG HA 1 1 14 5705 1 1 1 ARG HB2 H -11.297 4.900 -0.994 1.00 . A A . 1 ARG HB2 1 1 14 5706 1 1 1 ARG HB3 H -11.322 3.145 -1.104 1.00 . A A . 1 ARG HB3 1 1 14 5707 1 1 1 ARG HD2 H -13.142 2.393 -2.802 1.00 . A A . 1 ARG HD2 1 1 14 5708 1 1 1 ARG HD3 H -13.442 2.002 -1.108 1.00 . A A . 1 ARG HD3 1 1 14 5709 1 1 1 ARG HE H -15.393 2.650 -3.104 1.00 . A A . 1 ARG HE 1 1 14 5710 1 1 1 ARG HG2 H -13.927 4.533 -0.861 1.00 . A A . 1 ARG HG2 1 1 14 5711 1 1 1 ARG HG3 H -13.058 4.680 -2.389 1.00 . A A . 1 ARG HG3 1 1 14 5712 1 1 1 ARG HH11 H -14.709 2.707 0.318 1.00 . A A . 1 ARG HH11 1 1 14 5713 1 1 1 ARG HH12 H -16.378 2.685 0.779 1.00 . A A . 1 ARG HH12 1 1 14 5714 1 1 1 ARG HH21 H -17.588 2.624 -2.500 1.00 . A A . 1 ARG HH21 1 1 14 5715 1 1 1 ARG HH22 H -18.013 2.636 -0.821 1.00 . A A . 1 ARG HH22 1 1 14 5716 1 1 1 ARG N N -11.772 5.264 1.349 1.00 . A A . 1 ARG N 1 1 14 5717 1 1 1 ARG NE N -15.103 2.668 -2.168 1.00 . A A . 1 ARG NE 1 1 14 5718 1 1 1 ARG NH1 N -15.676 2.687 0.066 1.00 . A A . 1 ARG NH1 1 1 14 5719 1 1 1 ARG NH2 N -17.316 2.640 -1.538 1.00 . A A . 1 ARG NH2 1 1 14 5720 1 1 1 ARG O O -9.914 3.198 1.658 1.00 . A A . 1 ARG O 1 1 14 5721 1 1 2 VAL C C -9.971 -0.159 0.857 1.00 . A A . 2 VAL C 1 1 14 5722 1 1 2 VAL CA C -10.710 0.564 1.978 1.00 . A A . 2 VAL CA 1 1 14 5723 1 1 2 VAL CB C -11.559 -0.456 2.758 1.00 . A A . 2 VAL CB 1 1 14 5724 1 1 2 VAL CG1 C -12.103 0.166 4.036 1.00 . A A . 2 VAL CG1 1 1 14 5725 1 1 2 VAL CG2 C -12.691 -0.984 1.890 1.00 . A A . 2 VAL CG2 1 1 14 5726 1 1 2 VAL H H -12.452 1.458 1.174 1.00 . A A . 2 VAL H 1 1 14 5727 1 1 2 VAL HA H -9.986 0.994 2.655 1.00 . A A . 2 VAL HA 1 1 14 5728 1 1 2 VAL HB H -10.926 -1.289 3.031 1.00 . A A . 2 VAL HB 1 1 14 5729 1 1 2 VAL HG11 H -12.168 1.237 3.915 1.00 . A A . 2 VAL HG11 1 1 14 5730 1 1 2 VAL HG12 H -13.085 -0.234 4.242 1.00 . A A . 2 VAL HG12 1 1 14 5731 1 1 2 VAL HG13 H -11.441 -0.064 4.858 1.00 . A A . 2 VAL HG13 1 1 14 5732 1 1 2 VAL HG21 H -12.296 -1.297 0.935 1.00 . A A . 2 VAL HG21 1 1 14 5733 1 1 2 VAL HG22 H -13.158 -1.826 2.379 1.00 . A A . 2 VAL HG22 1 1 14 5734 1 1 2 VAL HG23 H -13.423 -0.205 1.739 1.00 . A A . 2 VAL HG23 1 1 14 5735 1 1 2 VAL N N -11.530 1.647 1.450 1.00 . A A . 2 VAL N 1 1 14 5736 1 1 2 VAL O O -10.533 -0.411 -0.209 1.00 . A A . 2 VAL O 1 1 14 5737 1 1 3 CYS C C -7.825 -2.681 0.422 1.00 . A A . 3 CYS C 1 1 14 5738 1 1 3 CYS CA C -7.893 -1.185 0.115 1.00 . A A . 3 CYS CA 1 1 14 5739 1 1 3 CYS CB C -6.481 -0.591 0.072 1.00 . A A . 3 CYS CB 1 1 14 5740 1 1 3 CYS H H -8.315 -0.263 1.973 1.00 . A A . 3 CYS H 1 1 14 5741 1 1 3 CYS HA H -8.359 -1.047 -0.848 1.00 . A A . 3 CYS HA 1 1 14 5742 1 1 3 CYS HB2 H -5.947 -1.015 -0.765 1.00 . A A . 3 CYS HB2 1 1 14 5743 1 1 3 CYS HB3 H -6.554 0.478 -0.059 1.00 . A A . 3 CYS HB3 1 1 14 5744 1 1 3 CYS N N -8.708 -0.491 1.105 1.00 . A A . 3 CYS N 1 1 14 5745 1 1 3 CYS O O -7.542 -3.076 1.553 1.00 . A A . 3 CYS O 1 1 14 5746 1 1 3 CYS SG S -5.490 -0.900 1.570 1.00 . A A . 3 CYS SG 1 1 14 5747 1 1 4 PRO C C -6.876 -5.467 0.430 1.00 . A A . 4 PRO C 1 1 14 5748 1 1 4 PRO CA C -8.057 -4.995 -0.414 1.00 . A A . 4 PRO CA 1 1 14 5749 1 1 4 PRO CB C -7.929 -5.497 -1.849 1.00 . A A . 4 PRO CB 1 1 14 5750 1 1 4 PRO CD C -8.436 -3.157 -1.969 1.00 . A A . 4 PRO CD 1 1 14 5751 1 1 4 PRO CG C -8.649 -4.479 -2.663 1.00 . A A . 4 PRO CG 1 1 14 5752 1 1 4 PRO HA H -8.976 -5.362 0.018 1.00 . A A . 4 PRO HA 1 1 14 5753 1 1 4 PRO HB2 H -6.885 -5.559 -2.121 1.00 . A A . 4 PRO HB2 1 1 14 5754 1 1 4 PRO HB3 H -8.389 -6.470 -1.937 1.00 . A A . 4 PRO HB3 1 1 14 5755 1 1 4 PRO HD2 H -7.626 -2.614 -2.432 1.00 . A A . 4 PRO HD2 1 1 14 5756 1 1 4 PRO HD3 H -9.343 -2.571 -1.988 1.00 . A A . 4 PRO HD3 1 1 14 5757 1 1 4 PRO HG2 H -8.237 -4.448 -3.660 1.00 . A A . 4 PRO HG2 1 1 14 5758 1 1 4 PRO HG3 H -9.702 -4.716 -2.699 1.00 . A A . 4 PRO HG3 1 1 14 5759 1 1 4 PRO N N -8.088 -3.539 -0.583 1.00 . A A . 4 PRO N 1 1 14 5760 1 1 4 PRO O O -5.820 -4.836 0.445 1.00 . A A . 4 PRO O 1 1 14 5761 1 1 5 ARG C C -5.028 -7.956 1.170 1.00 . A A . 5 ARG C 1 1 14 5762 1 1 5 ARG CA C -6.022 -7.134 1.986 1.00 . A A . 5 ARG CA 1 1 14 5763 1 1 5 ARG CB C -6.640 -8.004 3.082 1.00 . A A . 5 ARG CB 1 1 14 5764 1 1 5 ARG CD C -8.476 -6.843 4.345 1.00 . A A . 5 ARG CD 1 1 14 5765 1 1 5 ARG CG C -7.006 -7.230 4.339 1.00 . A A . 5 ARG CG 1 1 14 5766 1 1 5 ARG CZ C -10.598 -7.818 5.131 1.00 . A A . 5 ARG CZ 1 1 14 5767 1 1 5 ARG H H -7.933 -7.033 1.082 1.00 . A A . 5 ARG H 1 1 14 5768 1 1 5 ARG HA H -5.496 -6.311 2.446 1.00 . A A . 5 ARG HA 1 1 14 5769 1 1 5 ARG HB2 H -7.536 -8.467 2.697 1.00 . A A . 5 ARG HB2 1 1 14 5770 1 1 5 ARG HB3 H -5.935 -8.776 3.353 1.00 . A A . 5 ARG HB3 1 1 14 5771 1 1 5 ARG HD2 H -8.618 -6.031 5.042 1.00 . A A . 5 ARG HD2 1 1 14 5772 1 1 5 ARG HD3 H -8.754 -6.517 3.353 1.00 . A A . 5 ARG HD3 1 1 14 5773 1 1 5 ARG HE H -8.951 -8.859 4.704 1.00 . A A . 5 ARG HE 1 1 14 5774 1 1 5 ARG HG2 H -6.803 -7.846 5.201 1.00 . A A . 5 ARG HG2 1 1 14 5775 1 1 5 ARG HG3 H -6.407 -6.333 4.384 1.00 . A A . 5 ARG HG3 1 1 14 5776 1 1 5 ARG HH11 H -10.623 -5.805 4.933 1.00 . A A . 5 ARG HH11 1 1 14 5777 1 1 5 ARG HH12 H -12.103 -6.515 5.485 1.00 . A A . 5 ARG HH12 1 1 14 5778 1 1 5 ARG HH21 H -10.896 -9.794 5.429 1.00 . A A . 5 ARG HH21 1 1 14 5779 1 1 5 ARG HH22 H -12.259 -8.780 5.768 1.00 . A A . 5 ARG HH22 1 1 14 5780 1 1 5 ARG N N -7.067 -6.578 1.134 1.00 . A A . 5 ARG N 1 1 14 5781 1 1 5 ARG NE N -9.335 -7.958 4.736 1.00 . A A . 5 ARG NE 1 1 14 5782 1 1 5 ARG NH1 N -11.154 -6.614 5.188 1.00 . A A . 5 ARG NH1 1 1 14 5783 1 1 5 ARG NH2 N -11.309 -8.885 5.470 1.00 . A A . 5 ARG NH2 1 1 14 5784 1 1 5 ARG O O -5.107 -9.184 1.133 1.00 . A A . 5 ARG O 1 1 14 5785 1 1 6 ILE C C -1.756 -7.179 -0.239 1.00 . A A . 6 ILE C 1 1 14 5786 1 1 6 ILE CA C -3.080 -7.936 -0.290 1.00 . A A . 6 ILE CA 1 1 14 5787 1 1 6 ILE CB C -3.533 -8.070 -1.759 1.00 . A A . 6 ILE CB 1 1 14 5788 1 1 6 ILE CD1 C -6.067 -7.850 -1.633 1.00 . A A . 6 ILE CD1 1 1 14 5789 1 1 6 ILE CG1 C -4.888 -8.776 -1.833 1.00 . A A . 6 ILE CG1 1 1 14 5790 1 1 6 ILE CG2 C -2.492 -8.826 -2.575 1.00 . A A . 6 ILE CG2 1 1 14 5791 1 1 6 ILE H H -4.080 -6.293 0.593 1.00 . A A . 6 ILE H 1 1 14 5792 1 1 6 ILE HA H -2.931 -8.928 0.111 1.00 . A A . 6 ILE HA 1 1 14 5793 1 1 6 ILE HB H -3.630 -7.078 -2.174 1.00 . A A . 6 ILE HB 1 1 14 5794 1 1 6 ILE HD11 H -5.719 -6.906 -1.240 1.00 . A A . 6 ILE HD11 1 1 14 5795 1 1 6 ILE HD12 H -6.560 -7.686 -2.580 1.00 . A A . 6 ILE HD12 1 1 14 5796 1 1 6 ILE HD13 H -6.761 -8.296 -0.937 1.00 . A A . 6 ILE HD13 1 1 14 5797 1 1 6 ILE HG12 H -4.993 -9.239 -2.803 1.00 . A A . 6 ILE HG12 1 1 14 5798 1 1 6 ILE HG13 H -4.931 -9.539 -1.070 1.00 . A A . 6 ILE HG13 1 1 14 5799 1 1 6 ILE HG21 H -1.576 -8.906 -2.009 1.00 . A A . 6 ILE HG21 1 1 14 5800 1 1 6 ILE HG22 H -2.862 -9.814 -2.804 1.00 . A A . 6 ILE HG22 1 1 14 5801 1 1 6 ILE HG23 H -2.300 -8.292 -3.495 1.00 . A A . 6 ILE HG23 1 1 14 5802 1 1 6 ILE N N -4.092 -7.271 0.521 1.00 . A A . 6 ILE N 1 1 14 5803 1 1 6 ILE O O -1.706 -5.976 -0.494 1.00 . A A . 6 ILE O 1 1 14 5804 1 1 7 LEU C C 1.019 -6.598 -1.120 1.00 . A A . 7 LEU C 1 1 14 5805 1 1 7 LEU CA C 0.642 -7.295 0.183 1.00 . A A . 7 LEU CA 1 1 14 5806 1 1 7 LEU CB C 1.684 -8.363 0.519 1.00 . A A . 7 LEU CB 1 1 14 5807 1 1 7 LEU CD1 C 2.516 -10.170 2.044 1.00 . A A . 7 LEU CD1 1 1 14 5808 1 1 7 LEU CD2 C 1.510 -8.088 3.007 1.00 . A A . 7 LEU CD2 1 1 14 5809 1 1 7 LEU CG C 1.471 -9.081 1.853 1.00 . A A . 7 LEU CG 1 1 14 5810 1 1 7 LEU H H -0.791 -8.849 0.288 1.00 . A A . 7 LEU H 1 1 14 5811 1 1 7 LEU HA H 0.623 -6.562 0.976 1.00 . A A . 7 LEU HA 1 1 14 5812 1 1 7 LEU HB2 H 1.677 -9.102 -0.270 1.00 . A A . 7 LEU HB2 1 1 14 5813 1 1 7 LEU HB3 H 2.656 -7.894 0.539 1.00 . A A . 7 LEU HB3 1 1 14 5814 1 1 7 LEU HD11 H 3.400 -9.922 1.477 1.00 . A A . 7 LEU HD11 1 1 14 5815 1 1 7 LEU HD12 H 2.769 -10.246 3.091 1.00 . A A . 7 LEU HD12 1 1 14 5816 1 1 7 LEU HD13 H 2.120 -11.114 1.700 1.00 . A A . 7 LEU HD13 1 1 14 5817 1 1 7 LEU HD21 H 1.610 -7.086 2.619 1.00 . A A . 7 LEU HD21 1 1 14 5818 1 1 7 LEU HD22 H 0.596 -8.164 3.577 1.00 . A A . 7 LEU HD22 1 1 14 5819 1 1 7 LEU HD23 H 2.351 -8.312 3.647 1.00 . A A . 7 LEU HD23 1 1 14 5820 1 1 7 LEU HG H 0.498 -9.552 1.848 1.00 . A A . 7 LEU HG 1 1 14 5821 1 1 7 LEU N N -0.686 -7.895 0.095 1.00 . A A . 7 LEU N 1 1 14 5822 1 1 7 LEU O O 0.736 -7.100 -2.209 1.00 . A A . 7 LEU O 1 1 14 5823 1 1 8 LEU C C 3.224 -3.738 -1.825 1.00 . A A . 8 LEU C 1 1 14 5824 1 1 8 LEU CA C 2.074 -4.675 -2.175 1.00 . A A . 8 LEU CA 1 1 14 5825 1 1 8 LEU CB C 0.895 -3.874 -2.735 1.00 . A A . 8 LEU CB 1 1 14 5826 1 1 8 LEU CD1 C -0.740 -3.907 -4.636 1.00 . A A . 8 LEU CD1 1 1 14 5827 1 1 8 LEU CD2 C 1.483 -2.798 -4.921 1.00 . A A . 8 LEU CD2 1 1 14 5828 1 1 8 LEU CG C 0.731 -3.941 -4.254 1.00 . A A . 8 LEU CG 1 1 14 5829 1 1 8 LEU H H 1.859 -5.088 -0.107 1.00 . A A . 8 LEU H 1 1 14 5830 1 1 8 LEU HA H 2.410 -5.375 -2.925 1.00 . A A . 8 LEU HA 1 1 14 5831 1 1 8 LEU HB2 H -0.012 -4.245 -2.279 1.00 . A A . 8 LEU HB2 1 1 14 5832 1 1 8 LEU HB3 H 1.022 -2.840 -2.454 1.00 . A A . 8 LEU HB3 1 1 14 5833 1 1 8 LEU HD11 H -1.339 -4.210 -3.789 1.00 . A A . 8 LEU HD11 1 1 14 5834 1 1 8 LEU HD12 H -1.013 -2.905 -4.930 1.00 . A A . 8 LEU HD12 1 1 14 5835 1 1 8 LEU HD13 H -0.914 -4.584 -5.459 1.00 . A A . 8 LEU HD13 1 1 14 5836 1 1 8 LEU HD21 H 1.096 -1.856 -4.563 1.00 . A A . 8 LEU HD21 1 1 14 5837 1 1 8 LEU HD22 H 2.534 -2.869 -4.681 1.00 . A A . 8 LEU HD22 1 1 14 5838 1 1 8 LEU HD23 H 1.353 -2.858 -5.991 1.00 . A A . 8 LEU HD23 1 1 14 5839 1 1 8 LEU HG H 1.148 -4.871 -4.614 1.00 . A A . 8 LEU HG 1 1 14 5840 1 1 8 LEU N N 1.658 -5.438 -1.003 1.00 . A A . 8 LEU N 1 1 14 5841 1 1 8 LEU O O 3.070 -2.835 -1.005 1.00 . A A . 8 LEU O 1 1 14 5842 1 1 9 GLU C C 5.739 -2.090 -3.282 1.00 . A A . 9 GLU C 1 1 14 5843 1 1 9 GLU CA C 5.557 -3.142 -2.195 1.00 . A A . 9 GLU CA 1 1 14 5844 1 1 9 GLU CB C 6.805 -4.021 -2.111 1.00 . A A . 9 GLU CB 1 1 14 5845 1 1 9 GLU CD C 8.349 -4.598 -4.029 1.00 . A A . 9 GLU CD 1 1 14 5846 1 1 9 GLU CG C 7.026 -4.885 -3.344 1.00 . A A . 9 GLU CG 1 1 14 5847 1 1 9 GLU H H 4.438 -4.702 -3.090 1.00 . A A . 9 GLU H 1 1 14 5848 1 1 9 GLU HA H 5.415 -2.642 -1.249 1.00 . A A . 9 GLU HA 1 1 14 5849 1 1 9 GLU HB2 H 7.670 -3.388 -1.981 1.00 . A A . 9 GLU HB2 1 1 14 5850 1 1 9 GLU HB3 H 6.716 -4.673 -1.253 1.00 . A A . 9 GLU HB3 1 1 14 5851 1 1 9 GLU HG2 H 7.009 -5.923 -3.048 1.00 . A A . 9 GLU HG2 1 1 14 5852 1 1 9 GLU HG3 H 6.226 -4.698 -4.045 1.00 . A A . 9 GLU HG3 1 1 14 5853 1 1 9 GLU N N 4.378 -3.964 -2.449 1.00 . A A . 9 GLU N 1 1 14 5854 1 1 9 GLU O O 5.659 -2.390 -4.473 1.00 . A A . 9 GLU O 1 1 14 5855 1 1 9 GLU OE1 O 9.351 -4.382 -3.316 1.00 . A A . 9 GLU OE1 1 1 14 5856 1 1 9 GLU OE2 O 8.382 -4.591 -5.277 1.00 . A A . 9 GLU OE2 1 1 14 5857 1 1 10 CYS C C 7.014 1.356 -3.176 1.00 . A A . 10 CYS C 1 1 14 5858 1 1 10 CYS CA C 6.163 0.252 -3.796 1.00 . A A . 10 CYS CA 1 1 14 5859 1 1 10 CYS CB C 4.805 0.820 -4.232 1.00 . A A . 10 CYS CB 1 1 14 5860 1 1 10 CYS H H 6.021 -0.673 -1.897 1.00 . A A . 10 CYS H 1 1 14 5861 1 1 10 CYS HA H 6.675 -0.135 -4.665 1.00 . A A . 10 CYS HA 1 1 14 5862 1 1 10 CYS HB2 H 4.766 1.871 -3.986 1.00 . A A . 10 CYS HB2 1 1 14 5863 1 1 10 CYS HB3 H 4.703 0.704 -5.301 1.00 . A A . 10 CYS HB3 1 1 14 5864 1 1 10 CYS N N 5.978 -0.851 -2.860 1.00 . A A . 10 CYS N 1 1 14 5865 1 1 10 CYS O O 7.178 1.417 -1.957 1.00 . A A . 10 CYS O 1 1 14 5866 1 1 10 CYS SG S 3.365 0.019 -3.448 1.00 . A A . 10 CYS SG 1 1 14 5867 1 1 11 LYS C C 7.515 4.510 -3.118 1.00 . A A . 11 LYS C 1 1 14 5868 1 1 11 LYS CA C 8.381 3.333 -3.557 1.00 . A A . 11 LYS CA 1 1 14 5869 1 1 11 LYS CB C 9.344 3.775 -4.661 1.00 . A A . 11 LYS CB 1 1 14 5870 1 1 11 LYS CD C 11.852 3.578 -4.718 1.00 . A A . 11 LYS CD 1 1 14 5871 1 1 11 LYS CE C 12.309 4.195 -6.032 1.00 . A A . 11 LYS CE 1 1 14 5872 1 1 11 LYS CG C 10.662 4.323 -4.134 1.00 . A A . 11 LYS CG 1 1 14 5873 1 1 11 LYS H H 7.382 2.129 -4.982 1.00 . A A . 11 LYS H 1 1 14 5874 1 1 11 LYS HA H 8.952 2.985 -2.710 1.00 . A A . 11 LYS HA 1 1 14 5875 1 1 11 LYS HB2 H 9.557 2.929 -5.296 1.00 . A A . 11 LYS HB2 1 1 14 5876 1 1 11 LYS HB3 H 8.869 4.546 -5.249 1.00 . A A . 11 LYS HB3 1 1 14 5877 1 1 11 LYS HD2 H 12.669 3.614 -4.013 1.00 . A A . 11 LYS HD2 1 1 14 5878 1 1 11 LYS HD3 H 11.570 2.550 -4.893 1.00 . A A . 11 LYS HD3 1 1 14 5879 1 1 11 LYS HE2 H 11.731 5.089 -6.216 1.00 . A A . 11 LYS HE2 1 1 14 5880 1 1 11 LYS HE3 H 13.354 4.454 -5.948 1.00 . A A . 11 LYS HE3 1 1 14 5881 1 1 11 LYS HG2 H 10.738 5.367 -4.400 1.00 . A A . 11 LYS HG2 1 1 14 5882 1 1 11 LYS HG3 H 10.678 4.221 -3.058 1.00 . A A . 11 LYS HG3 1 1 14 5883 1 1 11 LYS HZ1 H 11.241 2.730 -7.069 1.00 . A A . 11 LYS HZ1 1 1 14 5884 1 1 11 LYS HZ2 H 12.100 3.790 -8.070 1.00 . A A . 11 LYS HZ2 1 1 14 5885 1 1 11 LYS HZ3 H 12.920 2.585 -7.213 1.00 . A A . 11 LYS HZ3 1 1 14 5886 1 1 11 LYS N N 7.551 2.229 -4.022 1.00 . A A . 11 LYS N 1 1 14 5887 1 1 11 LYS NZ N 12.130 3.260 -7.176 1.00 . A A . 11 LYS NZ 1 1 14 5888 1 1 11 LYS O O 7.500 4.877 -1.942 1.00 . A A . 11 LYS O 1 1 14 5889 1 1 12 LYS C C 4.571 5.737 -3.260 1.00 . A A . 12 LYS C 1 1 14 5890 1 1 12 LYS CA C 5.919 6.223 -3.779 1.00 . A A . 12 LYS CA 1 1 14 5891 1 1 12 LYS CB C 5.718 7.074 -5.034 1.00 . A A . 12 LYS CB 1 1 14 5892 1 1 12 LYS CD C 5.625 9.586 -5.175 1.00 . A A . 12 LYS CD 1 1 14 5893 1 1 12 LYS CE C 5.420 10.685 -4.145 1.00 . A A . 12 LYS CE 1 1 14 5894 1 1 12 LYS CG C 4.873 8.318 -4.798 1.00 . A A . 12 LYS CG 1 1 14 5895 1 1 12 LYS H H 6.846 4.752 -4.986 1.00 . A A . 12 LYS H 1 1 14 5896 1 1 12 LYS HA H 6.392 6.824 -3.017 1.00 . A A . 12 LYS HA 1 1 14 5897 1 1 12 LYS HB2 H 6.685 7.384 -5.403 1.00 . A A . 12 LYS HB2 1 1 14 5898 1 1 12 LYS HB3 H 5.232 6.474 -5.788 1.00 . A A . 12 LYS HB3 1 1 14 5899 1 1 12 LYS HD2 H 6.679 9.363 -5.242 1.00 . A A . 12 LYS HD2 1 1 14 5900 1 1 12 LYS HD3 H 5.268 9.932 -6.134 1.00 . A A . 12 LYS HD3 1 1 14 5901 1 1 12 LYS HE2 H 4.551 11.263 -4.423 1.00 . A A . 12 LYS HE2 1 1 14 5902 1 1 12 LYS HE3 H 5.254 10.228 -3.180 1.00 . A A . 12 LYS HE3 1 1 14 5903 1 1 12 LYS HG2 H 3.977 8.251 -5.397 1.00 . A A . 12 LYS HG2 1 1 14 5904 1 1 12 LYS HG3 H 4.607 8.365 -3.752 1.00 . A A . 12 LYS HG3 1 1 14 5905 1 1 12 LYS HZ1 H 6.873 11.912 -5.008 1.00 . A A . 12 LYS HZ1 1 1 14 5906 1 1 12 LYS HZ2 H 6.369 12.422 -3.477 1.00 . A A . 12 LYS HZ2 1 1 14 5907 1 1 12 LYS HZ3 H 7.402 11.092 -3.626 1.00 . A A . 12 LYS HZ3 1 1 14 5908 1 1 12 LYS N N 6.794 5.093 -4.068 1.00 . A A . 12 LYS N 1 1 14 5909 1 1 12 LYS NZ N 6.598 11.591 -4.057 1.00 . A A . 12 LYS NZ 1 1 14 5910 1 1 12 LYS O O 3.979 4.812 -3.816 1.00 . A A . 12 LYS O 1 1 14 5911 1 1 13 ASP C C 1.694 6.022 -2.618 1.00 . A A . 13 ASP C 1 1 14 5912 1 1 13 ASP CA C 2.817 5.972 -1.593 1.00 . A A . 13 ASP CA 1 1 14 5913 1 1 13 ASP CB C 2.484 6.862 -0.395 1.00 . A A . 13 ASP CB 1 1 14 5914 1 1 13 ASP CG C 3.620 6.937 0.606 1.00 . A A . 13 ASP CG 1 1 14 5915 1 1 13 ASP H H 4.610 7.080 -1.780 1.00 . A A . 13 ASP H 1 1 14 5916 1 1 13 ASP HA H 2.917 4.959 -1.254 1.00 . A A . 13 ASP HA 1 1 14 5917 1 1 13 ASP HB2 H 2.267 7.860 -0.741 1.00 . A A . 13 ASP HB2 1 1 14 5918 1 1 13 ASP HB3 H 1.614 6.466 0.106 1.00 . A A . 13 ASP HB3 1 1 14 5919 1 1 13 ASP N N 4.093 6.356 -2.185 1.00 . A A . 13 ASP N 1 1 14 5920 1 1 13 ASP O O 0.776 5.202 -2.584 1.00 . A A . 13 ASP O 1 1 14 5921 1 1 13 ASP OD1 O 4.765 7.204 0.184 1.00 . A A . 13 ASP OD1 1 1 14 5922 1 1 13 ASP OD2 O 3.367 6.726 1.810 1.00 . A A . 13 ASP OD2 1 1 14 5923 1 1 14 SER C C 0.597 5.832 -5.353 1.00 . A A . 14 SER C 1 1 14 5924 1 1 14 SER CA C 0.776 7.135 -4.579 1.00 . A A . 14 SER CA 1 1 14 5925 1 1 14 SER CB C 1.174 8.260 -5.536 1.00 . A A . 14 SER CB 1 1 14 5926 1 1 14 SER H H 2.540 7.597 -3.507 1.00 . A A . 14 SER H 1 1 14 5927 1 1 14 SER HA H -0.161 7.389 -4.106 1.00 . A A . 14 SER HA 1 1 14 5928 1 1 14 SER HB2 H 1.897 7.888 -6.245 1.00 . A A . 14 SER HB2 1 1 14 5929 1 1 14 SER HB3 H 0.297 8.607 -6.064 1.00 . A A . 14 SER HB3 1 1 14 5930 1 1 14 SER N N 1.779 6.980 -3.532 1.00 . A A . 14 SER N 1 1 14 5931 1 1 14 SER O O -0.501 5.512 -5.807 1.00 . A A . 14 SER O 1 1 14 5932 1 1 14 SER OG O 1.744 9.350 -4.833 1.00 . A A . 14 SER OG 1 1 14 5933 1 1 15 ASP C C 0.548 2.911 -5.740 1.00 . A A . 15 ASP C 1 1 14 5934 1 1 15 ASP CA C 1.667 3.823 -6.234 1.00 . A A . 15 ASP CA 1 1 14 5935 1 1 15 ASP CB C 3.013 3.111 -6.097 1.00 . A A . 15 ASP CB 1 1 14 5936 1 1 15 ASP CG C 3.383 2.330 -7.343 1.00 . A A . 15 ASP CG 1 1 14 5937 1 1 15 ASP H H 2.538 5.399 -5.122 1.00 . A A . 15 ASP H 1 1 14 5938 1 1 15 ASP HA H 1.497 4.047 -7.276 1.00 . A A . 15 ASP HA 1 1 14 5939 1 1 15 ASP HB2 H 3.785 3.844 -5.913 1.00 . A A . 15 ASP HB2 1 1 14 5940 1 1 15 ASP HB3 H 2.968 2.425 -5.264 1.00 . A A . 15 ASP HB3 1 1 14 5941 1 1 15 ASP N N 1.691 5.088 -5.507 1.00 . A A . 15 ASP N 1 1 14 5942 1 1 15 ASP O O -0.037 2.158 -6.519 1.00 . A A . 15 ASP O 1 1 14 5943 1 1 15 ASP OD1 O 2.829 1.228 -7.539 1.00 . A A . 15 ASP OD1 1 1 14 5944 1 1 15 ASP OD2 O 4.226 2.821 -8.122 1.00 . A A . 15 ASP OD2 1 1 14 5945 1 1 16 CYS C C -2.074 2.221 -4.644 1.00 . A A . 16 CYS C 1 1 14 5946 1 1 16 CYS CA C -0.777 2.130 -3.850 1.00 . A A . 16 CYS CA 1 1 14 5947 1 1 16 CYS CB C -1.022 2.516 -2.386 1.00 . A A . 16 CYS CB 1 1 14 5948 1 1 16 CYS H H 0.770 3.580 -3.867 1.00 . A A . 16 CYS H 1 1 14 5949 1 1 16 CYS HA H -0.428 1.109 -3.885 1.00 . A A . 16 CYS HA 1 1 14 5950 1 1 16 CYS HB2 H -0.115 2.903 -1.973 1.00 . A A . 16 CYS HB2 1 1 14 5951 1 1 16 CYS HB3 H -1.775 3.284 -2.342 1.00 . A A . 16 CYS HB3 1 1 14 5952 1 1 16 CYS N N 0.262 2.969 -4.441 1.00 . A A . 16 CYS N 1 1 14 5953 1 1 16 CYS O O -2.187 3.006 -5.587 1.00 . A A . 16 CYS O 1 1 14 5954 1 1 16 CYS SG S -1.560 1.136 -1.317 1.00 . A A . 16 CYS SG 1 1 14 5955 1 1 17 LEU C C -5.458 1.788 -3.998 1.00 . A A . 17 LEU C 1 1 14 5956 1 1 17 LEU CA C -4.334 1.375 -4.939 1.00 . A A . 17 LEU CA 1 1 14 5957 1 1 17 LEU CB C -4.608 -0.024 -5.494 1.00 . A A . 17 LEU CB 1 1 14 5958 1 1 17 LEU CD1 C -6.095 -1.471 -4.083 1.00 . A A . 17 LEU CD1 1 1 14 5959 1 1 17 LEU CD2 C -3.933 -2.379 -4.949 1.00 . A A . 17 LEU CD2 1 1 14 5960 1 1 17 LEU CG C -4.656 -1.139 -4.445 1.00 . A A . 17 LEU CG 1 1 14 5961 1 1 17 LEU H H -2.882 0.802 -3.506 1.00 . A A . 17 LEU H 1 1 14 5962 1 1 17 LEU HA H -4.294 2.075 -5.760 1.00 . A A . 17 LEU HA 1 1 14 5963 1 1 17 LEU HB2 H -5.557 -0.003 -6.013 1.00 . A A . 17 LEU HB2 1 1 14 5964 1 1 17 LEU HB3 H -3.833 -0.264 -6.206 1.00 . A A . 17 LEU HB3 1 1 14 5965 1 1 17 LEU HD11 H -6.730 -1.307 -4.943 1.00 . A A . 17 LEU HD11 1 1 14 5966 1 1 17 LEU HD12 H -6.161 -2.505 -3.781 1.00 . A A . 17 LEU HD12 1 1 14 5967 1 1 17 LEU HD13 H -6.418 -0.837 -3.271 1.00 . A A . 17 LEU HD13 1 1 14 5968 1 1 17 LEU HD21 H -3.949 -2.391 -6.029 1.00 . A A . 17 LEU HD21 1 1 14 5969 1 1 17 LEU HD22 H -2.909 -2.363 -4.605 1.00 . A A . 17 LEU HD22 1 1 14 5970 1 1 17 LEU HD23 H -4.426 -3.262 -4.571 1.00 . A A . 17 LEU HD23 1 1 14 5971 1 1 17 LEU HG H -4.157 -0.801 -3.548 1.00 . A A . 17 LEU HG 1 1 14 5972 1 1 17 LEU N N -3.043 1.404 -4.261 1.00 . A A . 17 LEU N 1 1 14 5973 1 1 17 LEU O O -5.264 1.883 -2.786 1.00 . A A . 17 LEU O 1 1 14 5974 1 1 18 ALA C C -7.450 3.650 -2.896 1.00 . A A . 18 ALA C 1 1 14 5975 1 1 18 ALA CA C -7.792 2.442 -3.777 1.00 . A A . 18 ALA CA 1 1 14 5976 1 1 18 ALA CB C -8.294 1.267 -2.948 1.00 . A A . 18 ALA CB 1 1 14 5977 1 1 18 ALA H H -6.727 1.945 -5.536 1.00 . A A . 18 ALA H 1 1 14 5978 1 1 18 ALA HA H -8.576 2.727 -4.465 1.00 . A A . 18 ALA HA 1 1 14 5979 1 1 18 ALA HB1 H -8.505 0.431 -3.599 1.00 . A A . 18 ALA HB1 1 1 14 5980 1 1 18 ALA HB2 H -9.196 1.554 -2.426 1.00 . A A . 18 ALA HB2 1 1 14 5981 1 1 18 ALA HB3 H -7.538 0.983 -2.231 1.00 . A A . 18 ALA HB3 1 1 14 5982 1 1 18 ALA N N -6.636 2.037 -4.564 1.00 . A A . 18 ALA N 1 1 14 5983 1 1 18 ALA O O -6.988 4.674 -3.399 1.00 . A A . 18 ALA O 1 1 14 5984 1 1 19 GLU C C -6.358 4.181 0.385 1.00 . A A . 19 GLU C 1 1 14 5985 1 1 19 GLU CA C -7.373 4.624 -0.669 1.00 . A A . 19 GLU CA 1 1 14 5986 1 1 19 GLU CB C -8.659 5.118 0.001 1.00 . A A . 19 GLU CB 1 1 14 5987 1 1 19 GLU CD C -8.615 7.623 0.326 1.00 . A A . 19 GLU CD 1 1 14 5988 1 1 19 GLU CG C -9.130 6.469 -0.513 1.00 . A A . 19 GLU CG 1 1 14 5989 1 1 19 GLU H H -8.036 2.699 -1.231 1.00 . A A . 19 GLU H 1 1 14 5990 1 1 19 GLU HA H -6.944 5.432 -1.243 1.00 . A A . 19 GLU HA 1 1 14 5991 1 1 19 GLU HB2 H -9.444 4.398 -0.176 1.00 . A A . 19 GLU HB2 1 1 14 5992 1 1 19 GLU HB3 H -8.493 5.202 1.066 1.00 . A A . 19 GLU HB3 1 1 14 5993 1 1 19 GLU HG2 H -8.780 6.597 -1.526 1.00 . A A . 19 GLU HG2 1 1 14 5994 1 1 19 GLU HG3 H -10.209 6.489 -0.500 1.00 . A A . 19 GLU HG3 1 1 14 5995 1 1 19 GLU N N -7.671 3.534 -1.587 1.00 . A A . 19 GLU N 1 1 14 5996 1 1 19 GLU O O -6.605 4.288 1.585 1.00 . A A . 19 GLU O 1 1 14 5997 1 1 19 GLU OE1 O -8.603 7.495 1.568 1.00 . A A . 19 GLU OE1 1 1 14 5998 1 1 19 GLU OE2 O -8.224 8.654 -0.260 1.00 . A A . 19 GLU OE2 1 1 14 5999 1 1 20 CYS C C -2.823 3.807 0.389 1.00 . A A . 20 CYS C 1 1 14 6000 1 1 20 CYS CA C -4.163 3.236 0.826 1.00 . A A . 20 CYS CA 1 1 14 6001 1 1 20 CYS CB C -4.105 1.707 0.860 1.00 . A A . 20 CYS CB 1 1 14 6002 1 1 20 CYS H H -5.062 3.629 -1.044 1.00 . A A . 20 CYS H 1 1 14 6003 1 1 20 CYS HA H -4.394 3.604 1.815 1.00 . A A . 20 CYS HA 1 1 14 6004 1 1 20 CYS HB2 H -4.516 1.318 -0.060 1.00 . A A . 20 CYS HB2 1 1 14 6005 1 1 20 CYS HB3 H -3.074 1.395 0.948 1.00 . A A . 20 CYS HB3 1 1 14 6006 1 1 20 CYS N N -5.211 3.686 -0.074 1.00 . A A . 20 CYS N 1 1 14 6007 1 1 20 CYS O O -2.720 4.427 -0.669 1.00 . A A . 20 CYS O 1 1 14 6008 1 1 20 CYS SG S -5.032 0.961 2.240 1.00 . A A . 20 CYS SG 1 1 14 6009 1 1 21 VAL C C 0.546 2.996 0.740 1.00 . A A . 21 VAL C 1 1 14 6010 1 1 21 VAL CA C -0.475 4.118 0.883 1.00 . A A . 21 VAL CA 1 1 14 6011 1 1 21 VAL CB C 0.017 5.123 1.945 1.00 . A A . 21 VAL CB 1 1 14 6012 1 1 21 VAL CG1 C -0.977 6.264 2.098 1.00 . A A . 21 VAL CG1 1 1 14 6013 1 1 21 VAL CG2 C 0.253 4.429 3.279 1.00 . A A . 21 VAL CG2 1 1 14 6014 1 1 21 VAL H H -1.933 3.110 2.039 1.00 . A A . 21 VAL H 1 1 14 6015 1 1 21 VAL HA H -0.547 4.640 -0.061 1.00 . A A . 21 VAL HA 1 1 14 6016 1 1 21 VAL HB H 0.956 5.540 1.607 1.00 . A A . 21 VAL HB 1 1 14 6017 1 1 21 VAL HG11 H -1.963 5.923 1.818 1.00 . A A . 21 VAL HG11 1 1 14 6018 1 1 21 VAL HG12 H -0.989 6.595 3.126 1.00 . A A . 21 VAL HG12 1 1 14 6019 1 1 21 VAL HG13 H -0.686 7.084 1.460 1.00 . A A . 21 VAL HG13 1 1 14 6020 1 1 21 VAL HG21 H 0.918 3.592 3.136 1.00 . A A . 21 VAL HG21 1 1 14 6021 1 1 21 VAL HG22 H 0.694 5.127 3.974 1.00 . A A . 21 VAL HG22 1 1 14 6022 1 1 21 VAL HG23 H -0.690 4.078 3.673 1.00 . A A . 21 VAL HG23 1 1 14 6023 1 1 21 VAL N N -1.797 3.606 1.205 1.00 . A A . 21 VAL N 1 1 14 6024 1 1 21 VAL O O 0.361 1.893 1.254 1.00 . A A . 21 VAL O 1 1 14 6025 1 1 22 CYS C C 3.853 2.617 0.786 1.00 . A A . 22 CYS C 1 1 14 6026 1 1 22 CYS CA C 2.711 2.355 -0.190 1.00 . A A . 22 CYS CA 1 1 14 6027 1 1 22 CYS CB C 3.220 2.464 -1.636 1.00 . A A . 22 CYS CB 1 1 14 6028 1 1 22 CYS H H 1.694 4.202 -0.330 1.00 . A A . 22 CYS H 1 1 14 6029 1 1 22 CYS HA H 2.326 1.360 -0.023 1.00 . A A . 22 CYS HA 1 1 14 6030 1 1 22 CYS HB2 H 3.234 3.499 -1.926 1.00 . A A . 22 CYS HB2 1 1 14 6031 1 1 22 CYS HB3 H 4.222 2.073 -1.693 1.00 . A A . 22 CYS HB3 1 1 14 6032 1 1 22 CYS N N 1.626 3.305 0.040 1.00 . A A . 22 CYS N 1 1 14 6033 1 1 22 CYS O O 4.259 3.763 0.987 1.00 . A A . 22 CYS O 1 1 14 6034 1 1 22 CYS SG S 2.204 1.571 -2.853 1.00 . A A . 22 CYS SG 1 1 14 6035 1 1 23 LEU C C 6.785 1.334 1.749 1.00 . A A . 23 LEU C 1 1 14 6036 1 1 23 LEU CA C 5.438 1.679 2.374 1.00 . A A . 23 LEU CA 1 1 14 6037 1 1 23 LEU CB C 5.173 0.774 3.578 1.00 . A A . 23 LEU CB 1 1 14 6038 1 1 23 LEU CD1 C 3.376 -0.562 4.716 1.00 . A A . 23 LEU CD1 1 1 14 6039 1 1 23 LEU CD2 C 3.515 1.912 5.076 1.00 . A A . 23 LEU CD2 1 1 14 6040 1 1 23 LEU CG C 3.728 0.778 4.083 1.00 . A A . 23 LEU CG 1 1 14 6041 1 1 23 LEU H H 3.983 0.669 1.214 1.00 . A A . 23 LEU H 1 1 14 6042 1 1 23 LEU HA H 5.464 2.705 2.708 1.00 . A A . 23 LEU HA 1 1 14 6043 1 1 23 LEU HB2 H 5.436 -0.238 3.307 1.00 . A A . 23 LEU HB2 1 1 14 6044 1 1 23 LEU HB3 H 5.814 1.091 4.386 1.00 . A A . 23 LEU HB3 1 1 14 6045 1 1 23 LEU HD11 H 4.258 -1.185 4.755 1.00 . A A . 23 LEU HD11 1 1 14 6046 1 1 23 LEU HD12 H 3.005 -0.403 5.718 1.00 . A A . 23 LEU HD12 1 1 14 6047 1 1 23 LEU HD13 H 2.618 -1.051 4.125 1.00 . A A . 23 LEU HD13 1 1 14 6048 1 1 23 LEU HD21 H 4.341 1.942 5.772 1.00 . A A . 23 LEU HD21 1 1 14 6049 1 1 23 LEU HD22 H 3.458 2.851 4.544 1.00 . A A . 23 LEU HD22 1 1 14 6050 1 1 23 LEU HD23 H 2.594 1.748 5.617 1.00 . A A . 23 LEU HD23 1 1 14 6051 1 1 23 LEU HG H 3.062 0.936 3.248 1.00 . A A . 23 LEU HG 1 1 14 6052 1 1 23 LEU N N 4.355 1.555 1.404 1.00 . A A . 23 LEU N 1 1 14 6053 1 1 23 LEU O O 6.880 0.456 0.890 1.00 . A A . 23 LEU O 1 1 14 6054 1 1 24 GLU C C 9.607 0.374 1.821 1.00 . A A . 24 GLU C 1 1 14 6055 1 1 24 GLU CA C 9.176 1.830 1.678 1.00 . A A . 24 GLU CA 1 1 14 6056 1 1 24 GLU CB C 10.165 2.739 2.411 1.00 . A A . 24 GLU CB 1 1 14 6057 1 1 24 GLU CD C 10.186 4.011 4.593 1.00 . A A . 24 GLU CD 1 1 14 6058 1 1 24 GLU CG C 10.062 2.655 3.925 1.00 . A A . 24 GLU CG 1 1 14 6059 1 1 24 GLU H H 7.677 2.728 2.871 1.00 . A A . 24 GLU H 1 1 14 6060 1 1 24 GLU HA H 9.177 2.090 0.630 1.00 . A A . 24 GLU HA 1 1 14 6061 1 1 24 GLU HB2 H 11.170 2.462 2.124 1.00 . A A . 24 GLU HB2 1 1 14 6062 1 1 24 GLU HB3 H 9.984 3.761 2.115 1.00 . A A . 24 GLU HB3 1 1 14 6063 1 1 24 GLU HG2 H 9.105 2.230 4.185 1.00 . A A . 24 GLU HG2 1 1 14 6064 1 1 24 GLU HG3 H 10.851 2.015 4.292 1.00 . A A . 24 GLU HG3 1 1 14 6065 1 1 24 GLU N N 7.825 2.041 2.187 1.00 . A A . 24 GLU N 1 1 14 6066 1 1 24 GLU O O 10.151 -0.214 0.886 1.00 . A A . 24 GLU O 1 1 14 6067 1 1 24 GLU OE1 O 11.290 4.594 4.552 1.00 . A A . 24 GLU OE1 1 1 14 6068 1 1 24 GLU OE2 O 9.179 4.489 5.156 1.00 . A A . 24 GLU OE2 1 1 14 6069 1 1 25 HIS C C 9.147 -2.511 2.176 1.00 . A A . 25 HIS C 1 1 14 6070 1 1 25 HIS CA C 9.742 -1.599 3.241 1.00 . A A . 25 HIS CA 1 1 14 6071 1 1 25 HIS CB C 9.309 -2.068 4.639 1.00 . A A . 25 HIS CB 1 1 14 6072 1 1 25 HIS CD2 C 6.846 -1.546 5.273 1.00 . A A . 25 HIS CD2 1 1 14 6073 1 1 25 HIS CE1 C 7.186 0.331 6.353 1.00 . A A . 25 HIS CE1 1 1 14 6074 1 1 25 HIS CG C 8.176 -1.292 5.241 1.00 . A A . 25 HIS CG 1 1 14 6075 1 1 25 HIS H H 8.933 0.310 3.701 1.00 . A A . 25 HIS H 1 1 14 6076 1 1 25 HIS HA H 10.818 -1.658 3.173 1.00 . A A . 25 HIS HA 1 1 14 6077 1 1 25 HIS HB2 H 9.002 -3.101 4.582 1.00 . A A . 25 HIS HB2 1 1 14 6078 1 1 25 HIS HB3 H 10.155 -1.991 5.309 1.00 . A A . 25 HIS HB3 1 1 14 6079 1 1 25 HIS HD1 H 9.213 0.341 6.076 1.00 . A A . 25 HIS HD1 1 1 14 6080 1 1 25 HIS HD2 H 6.345 -2.394 4.831 1.00 . A A . 25 HIS HD2 1 1 14 6081 1 1 25 HIS HE1 H 7.020 1.236 6.921 1.00 . A A . 25 HIS HE1 1 1 14 6082 1 1 25 HIS HE2 H 5.321 -0.505 6.270 1.00 . A A . 25 HIS HE2 1 1 14 6083 1 1 25 HIS N N 9.367 -0.206 2.994 1.00 . A A . 25 HIS N 1 1 14 6084 1 1 25 HIS ND1 N 8.355 -0.108 5.925 1.00 . A A . 25 HIS ND1 1 1 14 6085 1 1 25 HIS NE2 N 6.254 -0.522 5.972 1.00 . A A . 25 HIS NE2 1 1 14 6086 1 1 25 HIS O O 9.690 -3.576 1.883 1.00 . A A . 25 HIS O 1 1 14 6087 1 1 26 GLY C C 6.060 -3.426 0.965 1.00 . A A . 26 GLY C 1 1 14 6088 1 1 26 GLY CA C 7.402 -2.857 0.547 1.00 . A A . 26 GLY CA 1 1 14 6089 1 1 26 GLY H H 7.657 -1.214 1.852 1.00 . A A . 26 GLY H 1 1 14 6090 1 1 26 GLY HA2 H 8.055 -3.671 0.273 1.00 . A A . 26 GLY HA2 1 1 14 6091 1 1 26 GLY HA3 H 7.256 -2.223 -0.312 1.00 . A A . 26 GLY HA3 1 1 14 6092 1 1 26 GLY N N 8.039 -2.076 1.587 1.00 . A A . 26 GLY N 1 1 14 6093 1 1 26 GLY O O 5.903 -4.643 1.064 1.00 . A A . 26 GLY O 1 1 14 6094 1 1 27 TYR C C 2.748 -1.830 1.465 1.00 . A A . 27 TYR C 1 1 14 6095 1 1 27 TYR CA C 3.750 -2.974 1.600 1.00 . A A . 27 TYR CA 1 1 14 6096 1 1 27 TYR CB C 3.758 -3.482 3.042 1.00 . A A . 27 TYR CB 1 1 14 6097 1 1 27 TYR CD1 C 3.829 -5.940 2.466 1.00 . A A . 27 TYR CD1 1 1 14 6098 1 1 27 TYR CD2 C 5.367 -5.119 4.092 1.00 . A A . 27 TYR CD2 1 1 14 6099 1 1 27 TYR CE1 C 4.348 -7.212 2.612 1.00 . A A . 27 TYR CE1 1 1 14 6100 1 1 27 TYR CE2 C 5.892 -6.389 4.242 1.00 . A A . 27 TYR CE2 1 1 14 6101 1 1 27 TYR CG C 4.327 -4.873 3.202 1.00 . A A . 27 TYR CG 1 1 14 6102 1 1 27 TYR CZ C 5.380 -7.432 3.500 1.00 . A A . 27 TYR CZ 1 1 14 6103 1 1 27 TYR H H 5.275 -1.590 1.096 1.00 . A A . 27 TYR H 1 1 14 6104 1 1 27 TYR HA H 3.451 -3.779 0.947 1.00 . A A . 27 TYR HA 1 1 14 6105 1 1 27 TYR HB2 H 4.350 -2.813 3.643 1.00 . A A . 27 TYR HB2 1 1 14 6106 1 1 27 TYR HB3 H 2.745 -3.492 3.417 1.00 . A A . 27 TYR HB3 1 1 14 6107 1 1 27 TYR HD1 H 3.020 -5.765 1.771 1.00 . A A . 27 TYR HD1 1 1 14 6108 1 1 27 TYR HD2 H 5.766 -4.301 4.672 1.00 . A A . 27 TYR HD2 1 1 14 6109 1 1 27 TYR HE1 H 3.947 -8.029 2.031 1.00 . A A . 27 TYR HE1 1 1 14 6110 1 1 27 TYR HE2 H 6.700 -6.559 4.938 1.00 . A A . 27 TYR HE2 1 1 14 6111 1 1 27 TYR HH H 6.564 -8.851 2.971 1.00 . A A . 27 TYR HH 1 1 14 6112 1 1 27 TYR N N 5.089 -2.547 1.200 1.00 . A A . 27 TYR N 1 1 14 6113 1 1 27 TYR O O 3.083 -0.667 1.687 1.00 . A A . 27 TYR O 1 1 14 6114 1 1 27 TYR OH O 5.900 -8.697 3.646 1.00 . A A . 27 TYR OH 1 1 14 6115 1 1 28 CYS C C -0.433 -1.132 2.180 1.00 . A A . 28 CYS C 1 1 14 6116 1 1 28 CYS CA C 0.457 -1.175 0.942 1.00 . A A . 28 CYS CA 1 1 14 6117 1 1 28 CYS CB C -0.397 -1.494 -0.292 1.00 . A A . 28 CYS CB 1 1 14 6118 1 1 28 CYS H H 1.311 -3.115 0.939 1.00 . A A . 28 CYS H 1 1 14 6119 1 1 28 CYS HA H 0.922 -0.211 0.810 1.00 . A A . 28 CYS HA 1 1 14 6120 1 1 28 CYS HB2 H -0.135 -2.476 -0.656 1.00 . A A . 28 CYS HB2 1 1 14 6121 1 1 28 CYS HB3 H -1.440 -1.488 -0.012 1.00 . A A . 28 CYS HB3 1 1 14 6122 1 1 28 CYS N N 1.514 -2.171 1.103 1.00 . A A . 28 CYS N 1 1 14 6123 1 1 28 CYS O O -1.182 -2.071 2.452 1.00 . A A . 28 CYS O 1 1 14 6124 1 1 28 CYS SG S -0.189 -0.323 -1.673 1.00 . A A . 28 CYS SG 1 1 14 6125 1 1 29 GLY C C -1.634 1.525 4.339 1.00 . A A . 29 GLY C 1 1 14 6126 1 1 29 GLY CA C -1.147 0.105 4.130 1.00 . A A . 29 GLY CA 1 1 14 6127 1 1 29 GLY H H 0.269 0.678 2.665 1.00 . A A . 29 GLY H 1 1 14 6128 1 1 29 GLY HA2 H -0.554 -0.189 4.983 1.00 . A A . 29 GLY HA2 1 1 14 6129 1 1 29 GLY HA3 H -2.002 -0.550 4.057 1.00 . A A . 29 GLY HA3 1 1 14 6130 1 1 29 GLY N N -0.345 -0.038 2.929 1.00 . A A . 29 GLY N 1 1 14 6131 1 1 29 GLY O O -2.718 1.863 3.818 1.00 . A A . 29 GLY O 1 1 14 6132 1 1 29 GLY OXT O -0.932 2.299 5.024 1.00 . A A . 29 GLY OXT 1 1 15 6133 1 1 1 ARG C C -10.612 3.107 2.106 1.00 . A A . 1 ARG C 1 1 15 6134 1 1 1 ARG CA C -11.212 4.382 1.526 1.00 . A A . 1 ARG CA 1 1 15 6135 1 1 1 ARG CB C -12.500 4.748 2.269 1.00 . A A . 1 ARG CB 1 1 15 6136 1 1 1 ARG CD C -13.389 6.494 3.843 1.00 . A A . 1 ARG CD 1 1 15 6137 1 1 1 ARG CG C -12.641 6.237 2.545 1.00 . A A . 1 ARG CG 1 1 15 6138 1 1 1 ARG CZ C -13.042 7.819 5.892 1.00 . A A . 1 ARG CZ 1 1 15 6139 1 1 1 ARG H1 H -10.753 3.678 -0.351 1.00 . A A . 1 ARG H1 1 1 15 6140 1 1 1 ARG H2 H -12.431 3.707 0.011 1.00 . A A . 1 ARG H2 1 1 15 6141 1 1 1 ARG H3 H -11.604 5.168 -0.335 1.00 . A A . 1 ARG H3 1 1 15 6142 1 1 1 ARG HA H -10.500 5.187 1.633 1.00 . A A . 1 ARG HA 1 1 15 6143 1 1 1 ARG HB2 H -13.346 4.432 1.676 1.00 . A A . 1 ARG HB2 1 1 15 6144 1 1 1 ARG HB3 H -12.518 4.225 3.214 1.00 . A A . 1 ARG HB3 1 1 15 6145 1 1 1 ARG HD2 H -14.416 6.735 3.611 1.00 . A A . 1 ARG HD2 1 1 15 6146 1 1 1 ARG HD3 H -13.357 5.599 4.446 1.00 . A A . 1 ARG HD3 1 1 15 6147 1 1 1 ARG HE H -12.204 8.207 4.122 1.00 . A A . 1 ARG HE 1 1 15 6148 1 1 1 ARG HG2 H -11.657 6.674 2.614 1.00 . A A . 1 ARG HG2 1 1 15 6149 1 1 1 ARG HG3 H -13.184 6.693 1.729 1.00 . A A . 1 ARG HG3 1 1 15 6150 1 1 1 ARG HH11 H -14.284 6.239 6.117 1.00 . A A . 1 ARG HH11 1 1 15 6151 1 1 1 ARG HH12 H -14.023 7.187 7.542 1.00 . A A . 1 ARG HH12 1 1 15 6152 1 1 1 ARG HH21 H -11.860 9.455 5.997 1.00 . A A . 1 ARG HH21 1 1 15 6153 1 1 1 ARG HH22 H -12.647 9.013 7.474 1.00 . A A . 1 ARG HH22 1 1 15 6154 1 1 1 ARG N N -11.528 4.219 0.083 1.00 . A A . 1 ARG N 1 1 15 6155 1 1 1 ARG NE N -12.804 7.598 4.601 1.00 . A A . 1 ARG NE 1 1 15 6156 1 1 1 ARG NH1 N -13.849 7.015 6.572 1.00 . A A . 1 ARG NH1 1 1 15 6157 1 1 1 ARG NH2 N -12.469 8.846 6.504 1.00 . A A . 1 ARG NH2 1 1 15 6158 1 1 1 ARG O O -9.633 3.152 2.851 1.00 . A A . 1 ARG O 1 1 15 6159 1 1 2 VAL C C -10.089 -0.130 1.122 1.00 . A A . 2 VAL C 1 1 15 6160 1 1 2 VAL CA C -10.727 0.679 2.247 1.00 . A A . 2 VAL CA 1 1 15 6161 1 1 2 VAL CB C -11.869 -0.144 2.873 1.00 . A A . 2 VAL CB 1 1 15 6162 1 1 2 VAL CG1 C -11.328 -1.412 3.515 1.00 . A A . 2 VAL CG1 1 1 15 6163 1 1 2 VAL CG2 C -12.635 0.691 3.891 1.00 . A A . 2 VAL CG2 1 1 15 6164 1 1 2 VAL H H -11.981 1.996 1.164 1.00 . A A . 2 VAL H 1 1 15 6165 1 1 2 VAL HA H -9.984 0.864 3.009 1.00 . A A . 2 VAL HA 1 1 15 6166 1 1 2 VAL HB H -12.553 -0.429 2.088 1.00 . A A . 2 VAL HB 1 1 15 6167 1 1 2 VAL HG11 H -10.302 -1.253 3.818 1.00 . A A . 2 VAL HG11 1 1 15 6168 1 1 2 VAL HG12 H -11.924 -1.662 4.380 1.00 . A A . 2 VAL HG12 1 1 15 6169 1 1 2 VAL HG13 H -11.370 -2.223 2.802 1.00 . A A . 2 VAL HG13 1 1 15 6170 1 1 2 VAL HG21 H -12.428 1.738 3.728 1.00 . A A . 2 VAL HG21 1 1 15 6171 1 1 2 VAL HG22 H -13.694 0.512 3.779 1.00 . A A . 2 VAL HG22 1 1 15 6172 1 1 2 VAL HG23 H -12.326 0.414 4.888 1.00 . A A . 2 VAL HG23 1 1 15 6173 1 1 2 VAL N N -11.204 1.968 1.760 1.00 . A A . 2 VAL N 1 1 15 6174 1 1 2 VAL O O -10.748 -0.467 0.139 1.00 . A A . 2 VAL O 1 1 15 6175 1 1 3 CYS C C -7.951 -2.671 0.697 1.00 . A A . 3 CYS C 1 1 15 6176 1 1 3 CYS CA C -8.080 -1.208 0.271 1.00 . A A . 3 CYS CA 1 1 15 6177 1 1 3 CYS CB C -6.693 -0.603 0.036 1.00 . A A . 3 CYS CB 1 1 15 6178 1 1 3 CYS H H -8.336 -0.141 2.082 1.00 . A A . 3 CYS H 1 1 15 6179 1 1 3 CYS HA H -8.643 -1.160 -0.648 1.00 . A A . 3 CYS HA 1 1 15 6180 1 1 3 CYS HB2 H -6.257 -1.055 -0.842 1.00 . A A . 3 CYS HB2 1 1 15 6181 1 1 3 CYS HB3 H -6.796 0.460 -0.128 1.00 . A A . 3 CYS HB3 1 1 15 6182 1 1 3 CYS N N -8.806 -0.438 1.275 1.00 . A A . 3 CYS N 1 1 15 6183 1 1 3 CYS O O -7.536 -2.961 1.820 1.00 . A A . 3 CYS O 1 1 15 6184 1 1 3 CYS SG S -5.525 -0.840 1.416 1.00 . A A . 3 CYS SG 1 1 15 6185 1 1 4 PRO C C -6.911 -5.431 0.795 1.00 . A A . 4 PRO C 1 1 15 6186 1 1 4 PRO CA C -8.214 -5.050 0.100 1.00 . A A . 4 PRO CA 1 1 15 6187 1 1 4 PRO CB C -8.284 -5.688 -1.284 1.00 . A A . 4 PRO CB 1 1 15 6188 1 1 4 PRO CD C -8.801 -3.367 -1.563 1.00 . A A . 4 PRO CD 1 1 15 6189 1 1 4 PRO CG C -9.114 -4.745 -2.085 1.00 . A A . 4 PRO CG 1 1 15 6190 1 1 4 PRO HA H -9.051 -5.383 0.697 1.00 . A A . 4 PRO HA 1 1 15 6191 1 1 4 PRO HB2 H -7.288 -5.785 -1.690 1.00 . A A . 4 PRO HB2 1 1 15 6192 1 1 4 PRO HB3 H -8.747 -6.661 -1.214 1.00 . A A . 4 PRO HB3 1 1 15 6193 1 1 4 PRO HD2 H -8.043 -2.896 -2.170 1.00 . A A . 4 PRO HD2 1 1 15 6194 1 1 4 PRO HD3 H -9.695 -2.762 -1.539 1.00 . A A . 4 PRO HD3 1 1 15 6195 1 1 4 PRO HG2 H -8.849 -4.819 -3.129 1.00 . A A . 4 PRO HG2 1 1 15 6196 1 1 4 PRO HG3 H -10.161 -4.969 -1.946 1.00 . A A . 4 PRO HG3 1 1 15 6197 1 1 4 PRO N N -8.299 -3.617 -0.196 1.00 . A A . 4 PRO N 1 1 15 6198 1 1 4 PRO O O -5.868 -4.822 0.554 1.00 . A A . 4 PRO O 1 1 15 6199 1 1 5 ARG C C -4.870 -7.687 1.455 1.00 . A A . 5 ARG C 1 1 15 6200 1 1 5 ARG CA C -5.796 -6.900 2.377 1.00 . A A . 5 ARG CA 1 1 15 6201 1 1 5 ARG CB C -6.209 -7.761 3.575 1.00 . A A . 5 ARG CB 1 1 15 6202 1 1 5 ARG CD C -4.813 -8.282 5.603 1.00 . A A . 5 ARG CD 1 1 15 6203 1 1 5 ARG CG C -5.681 -7.246 4.905 1.00 . A A . 5 ARG CG 1 1 15 6204 1 1 5 ARG CZ C -3.004 -8.304 7.276 1.00 . A A . 5 ARG CZ 1 1 15 6205 1 1 5 ARG H H -7.834 -6.890 1.803 1.00 . A A . 5 ARG H 1 1 15 6206 1 1 5 ARG HA H -5.269 -6.028 2.737 1.00 . A A . 5 ARG HA 1 1 15 6207 1 1 5 ARG HB2 H -7.287 -7.789 3.628 1.00 . A A . 5 ARG HB2 1 1 15 6208 1 1 5 ARG HB3 H -5.840 -8.766 3.429 1.00 . A A . 5 ARG HB3 1 1 15 6209 1 1 5 ARG HD2 H -5.429 -8.850 6.285 1.00 . A A . 5 ARG HD2 1 1 15 6210 1 1 5 ARG HD3 H -4.397 -8.946 4.859 1.00 . A A . 5 ARG HD3 1 1 15 6211 1 1 5 ARG HE H -3.509 -6.730 6.157 1.00 . A A . 5 ARG HE 1 1 15 6212 1 1 5 ARG HG2 H -5.091 -6.359 4.728 1.00 . A A . 5 ARG HG2 1 1 15 6213 1 1 5 ARG HG3 H -6.517 -7.003 5.543 1.00 . A A . 5 ARG HG3 1 1 15 6214 1 1 5 ARG HH11 H -3.994 -10.057 7.092 1.00 . A A . 5 ARG HH11 1 1 15 6215 1 1 5 ARG HH12 H -2.717 -10.045 8.262 1.00 . A A . 5 ARG HH12 1 1 15 6216 1 1 5 ARG HH21 H -1.830 -6.712 7.696 1.00 . A A . 5 ARG HH21 1 1 15 6217 1 1 5 ARG HH22 H -1.490 -8.146 8.606 1.00 . A A . 5 ARG HH22 1 1 15 6218 1 1 5 ARG N N -6.975 -6.442 1.654 1.00 . A A . 5 ARG N 1 1 15 6219 1 1 5 ARG NE N -3.720 -7.667 6.352 1.00 . A A . 5 ARG NE 1 1 15 6220 1 1 5 ARG NH1 N -3.259 -9.573 7.566 1.00 . A A . 5 ARG NH1 1 1 15 6221 1 1 5 ARG NH2 N -2.028 -7.668 7.911 1.00 . A A . 5 ARG NH2 1 1 15 6222 1 1 5 ARG O O -4.860 -8.917 1.467 1.00 . A A . 5 ARG O 1 1 15 6223 1 1 6 ILE C C -1.777 -6.962 -0.165 1.00 . A A . 6 ILE C 1 1 15 6224 1 1 6 ILE CA C -3.162 -7.589 -0.274 1.00 . A A . 6 ILE CA 1 1 15 6225 1 1 6 ILE CB C -3.653 -7.471 -1.730 1.00 . A A . 6 ILE CB 1 1 15 6226 1 1 6 ILE CD1 C -5.392 -9.291 -1.352 1.00 . A A . 6 ILE CD1 1 1 15 6227 1 1 6 ILE CG1 C -5.124 -7.881 -1.832 1.00 . A A . 6 ILE CG1 1 1 15 6228 1 1 6 ILE CG2 C -2.795 -8.326 -2.651 1.00 . A A . 6 ILE CG2 1 1 15 6229 1 1 6 ILE H H -4.150 -5.986 0.692 1.00 . A A . 6 ILE H 1 1 15 6230 1 1 6 ILE HA H -3.093 -8.638 -0.024 1.00 . A A . 6 ILE HA 1 1 15 6231 1 1 6 ILE HB H -3.552 -6.441 -2.039 1.00 . A A . 6 ILE HB 1 1 15 6232 1 1 6 ILE HD11 H -4.455 -9.779 -1.126 1.00 . A A . 6 ILE HD11 1 1 15 6233 1 1 6 ILE HD12 H -6.004 -9.259 -0.463 1.00 . A A . 6 ILE HD12 1 1 15 6234 1 1 6 ILE HD13 H -5.907 -9.843 -2.125 1.00 . A A . 6 ILE HD13 1 1 15 6235 1 1 6 ILE HG12 H -5.721 -7.209 -1.234 1.00 . A A . 6 ILE HG12 1 1 15 6236 1 1 6 ILE HG13 H -5.438 -7.815 -2.863 1.00 . A A . 6 ILE HG13 1 1 15 6237 1 1 6 ILE HG21 H -1.841 -8.513 -2.182 1.00 . A A . 6 ILE HG21 1 1 15 6238 1 1 6 ILE HG22 H -3.294 -9.265 -2.838 1.00 . A A . 6 ILE HG22 1 1 15 6239 1 1 6 ILE HG23 H -2.642 -7.807 -3.585 1.00 . A A . 6 ILE HG23 1 1 15 6240 1 1 6 ILE N N -4.094 -6.964 0.655 1.00 . A A . 6 ILE N 1 1 15 6241 1 1 6 ILE O O -1.645 -5.748 -0.018 1.00 . A A . 6 ILE O 1 1 15 6242 1 1 7 LEU C C 1.030 -6.578 -1.412 1.00 . A A . 7 LEU C 1 1 15 6243 1 1 7 LEU CA C 0.628 -7.324 -0.145 1.00 . A A . 7 LEU CA 1 1 15 6244 1 1 7 LEU CB C 1.582 -8.499 0.093 1.00 . A A . 7 LEU CB 1 1 15 6245 1 1 7 LEU CD1 C 1.343 -8.222 2.579 1.00 . A A . 7 LEU CD1 1 1 15 6246 1 1 7 LEU CD2 C 0.163 -10.093 1.411 1.00 . A A . 7 LEU CD2 1 1 15 6247 1 1 7 LEU CG C 1.409 -9.221 1.432 1.00 . A A . 7 LEU CG 1 1 15 6248 1 1 7 LEU H H -0.916 -8.756 -0.355 1.00 . A A . 7 LEU H 1 1 15 6249 1 1 7 LEU HA H 0.690 -6.646 0.693 1.00 . A A . 7 LEU HA 1 1 15 6250 1 1 7 LEU HB2 H 1.437 -9.218 -0.700 1.00 . A A . 7 LEU HB2 1 1 15 6251 1 1 7 LEU HB3 H 2.595 -8.129 0.038 1.00 . A A . 7 LEU HB3 1 1 15 6252 1 1 7 LEU HD11 H 1.747 -7.275 2.255 1.00 . A A . 7 LEU HD11 1 1 15 6253 1 1 7 LEU HD12 H 0.316 -8.089 2.883 1.00 . A A . 7 LEU HD12 1 1 15 6254 1 1 7 LEU HD13 H 1.919 -8.593 3.413 1.00 . A A . 7 LEU HD13 1 1 15 6255 1 1 7 LEU HD21 H 0.121 -10.638 0.479 1.00 . A A . 7 LEU HD21 1 1 15 6256 1 1 7 LEU HD22 H 0.198 -10.791 2.234 1.00 . A A . 7 LEU HD22 1 1 15 6257 1 1 7 LEU HD23 H -0.714 -9.469 1.503 1.00 . A A . 7 LEU HD23 1 1 15 6258 1 1 7 LEU HG H 2.263 -9.862 1.600 1.00 . A A . 7 LEU HG 1 1 15 6259 1 1 7 LEU N N -0.747 -7.799 -0.237 1.00 . A A . 7 LEU N 1 1 15 6260 1 1 7 LEU O O 0.678 -6.983 -2.520 1.00 . A A . 7 LEU O 1 1 15 6261 1 1 8 LEU C C 3.339 -3.744 -1.972 1.00 . A A . 8 LEU C 1 1 15 6262 1 1 8 LEU CA C 2.213 -4.686 -2.381 1.00 . A A . 8 LEU CA 1 1 15 6263 1 1 8 LEU CB C 1.042 -3.887 -2.960 1.00 . A A . 8 LEU CB 1 1 15 6264 1 1 8 LEU CD1 C -0.457 -3.918 -4.970 1.00 . A A . 8 LEU CD1 1 1 15 6265 1 1 8 LEU CD2 C 1.654 -2.575 -5.006 1.00 . A A . 8 LEU CD2 1 1 15 6266 1 1 8 LEU CG C 0.984 -3.839 -4.488 1.00 . A A . 8 LEU CG 1 1 15 6267 1 1 8 LEU H H 2.020 -5.209 -0.336 1.00 . A A . 8 LEU H 1 1 15 6268 1 1 8 LEU HA H 2.583 -5.362 -3.137 1.00 . A A . 8 LEU HA 1 1 15 6269 1 1 8 LEU HB2 H 0.123 -4.324 -2.596 1.00 . A A . 8 LEU HB2 1 1 15 6270 1 1 8 LEU HB3 H 1.108 -2.873 -2.592 1.00 . A A . 8 LEU HB3 1 1 15 6271 1 1 8 LEU HD11 H -0.954 -4.744 -4.485 1.00 . A A . 8 LEU HD11 1 1 15 6272 1 1 8 LEU HD12 H -0.968 -2.998 -4.728 1.00 . A A . 8 LEU HD12 1 1 15 6273 1 1 8 LEU HD13 H -0.469 -4.067 -6.040 1.00 . A A . 8 LEU HD13 1 1 15 6274 1 1 8 LEU HD21 H 1.544 -1.786 -4.278 1.00 . A A . 8 LEU HD21 1 1 15 6275 1 1 8 LEU HD22 H 2.702 -2.768 -5.175 1.00 . A A . 8 LEU HD22 1 1 15 6276 1 1 8 LEU HD23 H 1.189 -2.277 -5.934 1.00 . A A . 8 LEU HD23 1 1 15 6277 1 1 8 LEU HG H 1.516 -4.690 -4.888 1.00 . A A . 8 LEU HG 1 1 15 6278 1 1 8 LEU N N 1.768 -5.485 -1.245 1.00 . A A . 8 LEU N 1 1 15 6279 1 1 8 LEU O O 3.152 -2.874 -1.121 1.00 . A A . 8 LEU O 1 1 15 6280 1 1 9 GLU C C 5.861 -2.007 -3.321 1.00 . A A . 9 GLU C 1 1 15 6281 1 1 9 GLU CA C 5.670 -3.099 -2.275 1.00 . A A . 9 GLU CA 1 1 15 6282 1 1 9 GLU CB C 6.929 -3.964 -2.194 1.00 . A A . 9 GLU CB 1 1 15 6283 1 1 9 GLU CD C 8.611 -5.366 -3.452 1.00 . A A . 9 GLU CD 1 1 15 6284 1 1 9 GLU CG C 7.257 -4.688 -3.490 1.00 . A A . 9 GLU CG 1 1 15 6285 1 1 9 GLU H H 4.592 -4.640 -3.247 1.00 . A A . 9 GLU H 1 1 15 6286 1 1 9 GLU HA H 5.503 -2.633 -1.316 1.00 . A A . 9 GLU HA 1 1 15 6287 1 1 9 GLU HB2 H 7.768 -3.335 -1.936 1.00 . A A . 9 GLU HB2 1 1 15 6288 1 1 9 GLU HB3 H 6.793 -4.704 -1.419 1.00 . A A . 9 GLU HB3 1 1 15 6289 1 1 9 GLU HG2 H 6.500 -5.437 -3.671 1.00 . A A . 9 GLU HG2 1 1 15 6290 1 1 9 GLU HG3 H 7.252 -3.970 -4.298 1.00 . A A . 9 GLU HG3 1 1 15 6291 1 1 9 GLU N N 4.508 -3.926 -2.580 1.00 . A A . 9 GLU N 1 1 15 6292 1 1 9 GLU O O 5.812 -2.268 -4.524 1.00 . A A . 9 GLU O 1 1 15 6293 1 1 9 GLU OE1 O 8.674 -6.545 -3.041 1.00 . A A . 9 GLU OE1 1 1 15 6294 1 1 9 GLU OE2 O 9.610 -4.720 -3.833 1.00 . A A . 9 GLU OE2 1 1 15 6295 1 1 10 CYS C C 7.048 1.471 -3.057 1.00 . A A . 10 CYS C 1 1 15 6296 1 1 10 CYS CA C 6.268 0.356 -3.749 1.00 . A A . 10 CYS CA 1 1 15 6297 1 1 10 CYS CB C 4.916 0.891 -4.240 1.00 . A A . 10 CYS CB 1 1 15 6298 1 1 10 CYS H H 6.096 -0.635 -1.884 1.00 . A A . 10 CYS H 1 1 15 6299 1 1 10 CYS HA H 6.837 0.012 -4.600 1.00 . A A . 10 CYS HA 1 1 15 6300 1 1 10 CYS HB2 H 4.839 1.940 -3.992 1.00 . A A . 10 CYS HB2 1 1 15 6301 1 1 10 CYS HB3 H 4.862 0.777 -5.312 1.00 . A A . 10 CYS HB3 1 1 15 6302 1 1 10 CYS N N 6.075 -0.780 -2.854 1.00 . A A . 10 CYS N 1 1 15 6303 1 1 10 CYS O O 7.117 1.524 -1.829 1.00 . A A . 10 CYS O 1 1 15 6304 1 1 10 CYS SG S 3.464 0.050 -3.521 1.00 . A A . 10 CYS SG 1 1 15 6305 1 1 11 LYS C C 7.483 4.631 -2.934 1.00 . A A . 11 LYS C 1 1 15 6306 1 1 11 LYS CA C 8.403 3.477 -3.320 1.00 . A A . 11 LYS CA 1 1 15 6307 1 1 11 LYS CB C 9.434 3.949 -4.347 1.00 . A A . 11 LYS CB 1 1 15 6308 1 1 11 LYS CD C 11.930 4.032 -4.635 1.00 . A A . 11 LYS CD 1 1 15 6309 1 1 11 LYS CE C 12.641 4.481 -3.369 1.00 . A A . 11 LYS CE 1 1 15 6310 1 1 11 LYS CG C 10.729 3.154 -4.316 1.00 . A A . 11 LYS CG 1 1 15 6311 1 1 11 LYS H H 7.537 2.265 -4.825 1.00 . A A . 11 LYS H 1 1 15 6312 1 1 11 LYS HA H 8.918 3.131 -2.437 1.00 . A A . 11 LYS HA 1 1 15 6313 1 1 11 LYS HB2 H 9.007 3.861 -5.335 1.00 . A A . 11 LYS HB2 1 1 15 6314 1 1 11 LYS HB3 H 9.668 4.986 -4.156 1.00 . A A . 11 LYS HB3 1 1 15 6315 1 1 11 LYS HD2 H 12.622 3.470 -5.244 1.00 . A A . 11 LYS HD2 1 1 15 6316 1 1 11 LYS HD3 H 11.592 4.902 -5.178 1.00 . A A . 11 LYS HD3 1 1 15 6317 1 1 11 LYS HE2 H 13.348 5.257 -3.625 1.00 . A A . 11 LYS HE2 1 1 15 6318 1 1 11 LYS HE3 H 11.909 4.877 -2.681 1.00 . A A . 11 LYS HE3 1 1 15 6319 1 1 11 LYS HG2 H 10.857 2.730 -3.332 1.00 . A A . 11 LYS HG2 1 1 15 6320 1 1 11 LYS HG3 H 10.671 2.360 -5.047 1.00 . A A . 11 LYS HG3 1 1 15 6321 1 1 11 LYS HZ1 H 13.613 2.633 -3.413 1.00 . A A . 11 LYS HZ1 1 1 15 6322 1 1 11 LYS HZ2 H 14.245 3.712 -2.275 1.00 . A A . 11 LYS HZ2 1 1 15 6323 1 1 11 LYS HZ3 H 12.774 2.931 -1.975 1.00 . A A . 11 LYS HZ3 1 1 15 6324 1 1 11 LYS N N 7.631 2.360 -3.854 1.00 . A A . 11 LYS N 1 1 15 6325 1 1 11 LYS NZ N 13.369 3.361 -2.711 1.00 . A A . 11 LYS NZ 1 1 15 6326 1 1 11 LYS O O 7.377 4.988 -1.761 1.00 . A A . 11 LYS O 1 1 15 6327 1 1 12 LYS C C 4.548 5.796 -3.209 1.00 . A A . 12 LYS C 1 1 15 6328 1 1 12 LYS CA C 5.897 6.315 -3.694 1.00 . A A . 12 LYS CA 1 1 15 6329 1 1 12 LYS CB C 5.715 7.134 -4.973 1.00 . A A . 12 LYS CB 1 1 15 6330 1 1 12 LYS CD C 5.510 9.600 -5.424 1.00 . A A . 12 LYS CD 1 1 15 6331 1 1 12 LYS CE C 5.084 10.884 -4.732 1.00 . A A . 12 LYS CE 1 1 15 6332 1 1 12 LYS CG C 4.866 8.381 -4.782 1.00 . A A . 12 LYS CG 1 1 15 6333 1 1 12 LYS H H 6.938 4.873 -4.842 1.00 . A A . 12 LYS H 1 1 15 6334 1 1 12 LYS HA H 6.326 6.945 -2.929 1.00 . A A . 12 LYS HA 1 1 15 6335 1 1 12 LYS HB2 H 6.687 7.437 -5.333 1.00 . A A . 12 LYS HB2 1 1 15 6336 1 1 12 LYS HB3 H 5.241 6.513 -5.719 1.00 . A A . 12 LYS HB3 1 1 15 6337 1 1 12 LYS HD2 H 6.583 9.506 -5.355 1.00 . A A . 12 LYS HD2 1 1 15 6338 1 1 12 LYS HD3 H 5.216 9.645 -6.462 1.00 . A A . 12 LYS HD3 1 1 15 6339 1 1 12 LYS HE2 H 5.022 10.703 -3.669 1.00 . A A . 12 LYS HE2 1 1 15 6340 1 1 12 LYS HE3 H 5.826 11.646 -4.924 1.00 . A A . 12 LYS HE3 1 1 15 6341 1 1 12 LYS HG2 H 3.898 8.219 -5.234 1.00 . A A . 12 LYS HG2 1 1 15 6342 1 1 12 LYS HG3 H 4.745 8.564 -3.724 1.00 . A A . 12 LYS HG3 1 1 15 6343 1 1 12 LYS HZ1 H 3.575 10.996 -6.173 1.00 . A A . 12 LYS HZ1 1 1 15 6344 1 1 12 LYS HZ2 H 3.006 11.039 -4.581 1.00 . A A . 12 LYS HZ2 1 1 15 6345 1 1 12 LYS HZ3 H 3.748 12.403 -5.252 1.00 . A A . 12 LYS HZ3 1 1 15 6346 1 1 12 LYS N N 6.814 5.206 -3.929 1.00 . A A . 12 LYS N 1 1 15 6347 1 1 12 LYS NZ N 3.760 11.365 -5.218 1.00 . A A . 12 LYS NZ 1 1 15 6348 1 1 12 LYS O O 3.972 4.887 -3.806 1.00 . A A . 12 LYS O 1 1 15 6349 1 1 13 ASP C C 1.662 6.005 -2.592 1.00 . A A . 13 ASP C 1 1 15 6350 1 1 13 ASP CA C 2.773 5.955 -1.552 1.00 . A A . 13 ASP CA 1 1 15 6351 1 1 13 ASP CB C 2.406 6.819 -0.344 1.00 . A A . 13 ASP CB 1 1 15 6352 1 1 13 ASP CG C 3.528 6.897 0.674 1.00 . A A . 13 ASP CG 1 1 15 6353 1 1 13 ASP H H 4.558 7.086 -1.680 1.00 . A A . 13 ASP H 1 1 15 6354 1 1 13 ASP HA H 2.885 4.939 -1.230 1.00 . A A . 13 ASP HA 1 1 15 6355 1 1 13 ASP HB2 H 2.174 7.817 -0.675 1.00 . A A . 13 ASP HB2 1 1 15 6356 1 1 13 ASP HB3 H 1.538 6.397 0.138 1.00 . A A . 13 ASP HB3 1 1 15 6357 1 1 13 ASP N N 4.051 6.372 -2.118 1.00 . A A . 13 ASP N 1 1 15 6358 1 1 13 ASP O O 0.757 5.170 -2.584 1.00 . A A . 13 ASP O 1 1 15 6359 1 1 13 ASP OD1 O 4.678 7.164 0.270 1.00 . A A . 13 ASP OD1 1 1 15 6360 1 1 13 ASP OD2 O 3.254 6.692 1.876 1.00 . A A . 13 ASP OD2 1 1 15 6361 1 1 14 SER C C 0.589 5.843 -5.337 1.00 . A A . 14 SER C 1 1 15 6362 1 1 14 SER CA C 0.749 7.137 -4.543 1.00 . A A . 14 SER CA 1 1 15 6363 1 1 14 SER CB C 1.146 8.278 -5.480 1.00 . A A . 14 SER CB 1 1 15 6364 1 1 14 SER H H 2.491 7.610 -3.441 1.00 . A A . 14 SER H 1 1 15 6365 1 1 14 SER HA H -0.195 7.378 -4.077 1.00 . A A . 14 SER HA 1 1 15 6366 1 1 14 SER HB2 H 1.773 8.979 -4.948 1.00 . A A . 14 SER HB2 1 1 15 6367 1 1 14 SER HB3 H 1.690 7.876 -6.323 1.00 . A A . 14 SER HB3 1 1 15 6368 1 1 14 SER N N 1.741 6.981 -3.486 1.00 . A A . 14 SER N 1 1 15 6369 1 1 14 SER O O -0.503 5.521 -5.805 1.00 . A A . 14 SER O 1 1 15 6370 1 1 14 SER OG O 0.004 8.965 -5.962 1.00 . A A . 14 SER OG 1 1 15 6371 1 1 15 ASP C C 0.575 2.921 -5.755 1.00 . A A . 15 ASP C 1 1 15 6372 1 1 15 ASP CA C 1.683 3.855 -6.234 1.00 . A A . 15 ASP CA 1 1 15 6373 1 1 15 ASP CB C 3.040 3.159 -6.108 1.00 . A A . 15 ASP CB 1 1 15 6374 1 1 15 ASP CG C 3.492 2.533 -7.412 1.00 . A A . 15 ASP CG 1 1 15 6375 1 1 15 ASP H H 2.531 5.422 -5.091 1.00 . A A . 15 ASP H 1 1 15 6376 1 1 15 ASP HA H 1.511 4.091 -7.273 1.00 . A A . 15 ASP HA 1 1 15 6377 1 1 15 ASP HB2 H 3.782 3.882 -5.802 1.00 . A A . 15 ASP HB2 1 1 15 6378 1 1 15 ASP HB3 H 2.972 2.382 -5.360 1.00 . A A . 15 ASP HB3 1 1 15 6379 1 1 15 ASP N N 1.690 5.110 -5.489 1.00 . A A . 15 ASP N 1 1 15 6380 1 1 15 ASP O O 0.005 2.167 -6.545 1.00 . A A . 15 ASP O 1 1 15 6381 1 1 15 ASP OD1 O 3.119 3.057 -8.483 1.00 . A A . 15 ASP OD1 1 1 15 6382 1 1 15 ASP OD2 O 4.217 1.517 -7.363 1.00 . A A . 15 ASP OD2 1 1 15 6383 1 1 16 CYS C C -2.036 2.163 -4.686 1.00 . A A . 16 CYS C 1 1 15 6384 1 1 16 CYS CA C -0.745 2.098 -3.879 1.00 . A A . 16 CYS CA 1 1 15 6385 1 1 16 CYS CB C -1.012 2.474 -2.417 1.00 . A A . 16 CYS CB 1 1 15 6386 1 1 16 CYS H H 0.779 3.571 -3.873 1.00 . A A . 16 CYS H 1 1 15 6387 1 1 16 CYS HA H -0.374 1.084 -3.913 1.00 . A A . 16 CYS HA 1 1 15 6388 1 1 16 CYS HB2 H -0.119 2.883 -1.996 1.00 . A A . 16 CYS HB2 1 1 15 6389 1 1 16 CYS HB3 H -1.786 3.221 -2.376 1.00 . A A . 16 CYS HB3 1 1 15 6390 1 1 16 CYS N N 0.283 2.959 -4.458 1.00 . A A . 16 CYS N 1 1 15 6391 1 1 16 CYS O O -2.159 2.948 -5.627 1.00 . A A . 16 CYS O 1 1 15 6392 1 1 16 CYS SG S -1.521 1.077 -1.358 1.00 . A A . 16 CYS SG 1 1 15 6393 1 1 17 LEU C C -5.405 1.750 -4.111 1.00 . A A . 17 LEU C 1 1 15 6394 1 1 17 LEU CA C -4.273 1.265 -5.007 1.00 . A A . 17 LEU CA 1 1 15 6395 1 1 17 LEU CB C -4.560 -0.164 -5.474 1.00 . A A . 17 LEU CB 1 1 15 6396 1 1 17 LEU CD1 C -6.273 -1.253 -4.001 1.00 . A A . 17 LEU CD1 1 1 15 6397 1 1 17 LEU CD2 C -4.269 -2.547 -4.751 1.00 . A A . 17 LEU CD2 1 1 15 6398 1 1 17 LEU CG C -4.795 -1.177 -4.351 1.00 . A A . 17 LEU CG 1 1 15 6399 1 1 17 LEU H H -2.822 0.720 -3.562 1.00 . A A . 17 LEU H 1 1 15 6400 1 1 17 LEU HA H -4.213 1.909 -5.871 1.00 . A A . 17 LEU HA 1 1 15 6401 1 1 17 LEU HB2 H -5.437 -0.145 -6.104 1.00 . A A . 17 LEU HB2 1 1 15 6402 1 1 17 LEU HB3 H -3.721 -0.503 -6.064 1.00 . A A . 17 LEU HB3 1 1 15 6403 1 1 17 LEU HD11 H -6.768 -0.352 -4.329 1.00 . A A . 17 LEU HD11 1 1 15 6404 1 1 17 LEU HD12 H -6.715 -2.107 -4.494 1.00 . A A . 17 LEU HD12 1 1 15 6405 1 1 17 LEU HD13 H -6.386 -1.357 -2.932 1.00 . A A . 17 LEU HD13 1 1 15 6406 1 1 17 LEU HD21 H -3.317 -2.436 -5.249 1.00 . A A . 17 LEU HD21 1 1 15 6407 1 1 17 LEU HD22 H -4.146 -3.157 -3.868 1.00 . A A . 17 LEU HD22 1 1 15 6408 1 1 17 LEU HD23 H -4.972 -3.021 -5.420 1.00 . A A . 17 LEU HD23 1 1 15 6409 1 1 17 LEU HG H -4.260 -0.857 -3.469 1.00 . A A . 17 LEU HG 1 1 15 6410 1 1 17 LEU N N -2.990 1.322 -4.316 1.00 . A A . 17 LEU N 1 1 15 6411 1 1 17 LEU O O -5.224 1.941 -2.909 1.00 . A A . 17 LEU O 1 1 15 6412 1 1 18 ALA C C -7.406 3.657 -3.139 1.00 . A A . 18 ALA C 1 1 15 6413 1 1 18 ALA CA C -7.746 2.415 -3.970 1.00 . A A . 18 ALA CA 1 1 15 6414 1 1 18 ALA CB C -8.291 1.289 -3.100 1.00 . A A . 18 ALA CB 1 1 15 6415 1 1 18 ALA H H -6.658 1.781 -5.670 1.00 . A A . 18 ALA H 1 1 15 6416 1 1 18 ALA HA H -8.506 2.679 -4.691 1.00 . A A . 18 ALA HA 1 1 15 6417 1 1 18 ALA HB1 H -8.515 0.433 -3.718 1.00 . A A . 18 ALA HB1 1 1 15 6418 1 1 18 ALA HB2 H -9.191 1.620 -2.604 1.00 . A A . 18 ALA HB2 1 1 15 6419 1 1 18 ALA HB3 H -7.553 1.015 -2.360 1.00 . A A . 18 ALA HB3 1 1 15 6420 1 1 18 ALA N N -6.578 1.951 -4.709 1.00 . A A . 18 ALA N 1 1 15 6421 1 1 18 ALA O O -6.915 4.649 -3.678 1.00 . A A . 18 ALA O 1 1 15 6422 1 1 19 GLU C C -6.404 4.327 0.150 1.00 . A A . 19 GLU C 1 1 15 6423 1 1 19 GLU CA C -7.369 4.736 -0.960 1.00 . A A . 19 GLU CA 1 1 15 6424 1 1 19 GLU CB C -8.661 5.290 -0.356 1.00 . A A . 19 GLU CB 1 1 15 6425 1 1 19 GLU CD C -9.950 7.329 0.396 1.00 . A A . 19 GLU CD 1 1 15 6426 1 1 19 GLU CG C -8.636 6.794 -0.141 1.00 . A A . 19 GLU CG 1 1 15 6427 1 1 19 GLU H H -8.050 2.797 -1.447 1.00 . A A . 19 GLU H 1 1 15 6428 1 1 19 GLU HA H -6.903 5.505 -1.558 1.00 . A A . 19 GLU HA 1 1 15 6429 1 1 19 GLU HB2 H -9.483 5.055 -1.018 1.00 . A A . 19 GLU HB2 1 1 15 6430 1 1 19 GLU HB3 H -8.833 4.813 0.598 1.00 . A A . 19 GLU HB3 1 1 15 6431 1 1 19 GLU HG2 H -7.855 7.031 0.564 1.00 . A A . 19 GLU HG2 1 1 15 6432 1 1 19 GLU HG3 H -8.427 7.276 -1.084 1.00 . A A . 19 GLU HG3 1 1 15 6433 1 1 19 GLU N N -7.661 3.608 -1.833 1.00 . A A . 19 GLU N 1 1 15 6434 1 1 19 GLU O O -6.682 4.526 1.332 1.00 . A A . 19 GLU O 1 1 15 6435 1 1 19 GLU OE1 O -11.010 6.953 -0.148 1.00 . A A . 19 GLU OE1 1 1 15 6436 1 1 19 GLU OE2 O -9.918 8.124 1.359 1.00 . A A . 19 GLU OE2 1 1 15 6437 1 1 20 CYS C C -2.909 3.924 0.362 1.00 . A A . 20 CYS C 1 1 15 6438 1 1 20 CYS CA C -4.262 3.329 0.722 1.00 . A A . 20 CYS CA 1 1 15 6439 1 1 20 CYS CB C -4.179 1.801 0.763 1.00 . A A . 20 CYS CB 1 1 15 6440 1 1 20 CYS H H -5.090 3.628 -1.198 1.00 . A A . 20 CYS H 1 1 15 6441 1 1 20 CYS HA H -4.556 3.694 1.694 1.00 . A A . 20 CYS HA 1 1 15 6442 1 1 20 CYS HB2 H -4.528 1.404 -0.178 1.00 . A A . 20 CYS HB2 1 1 15 6443 1 1 20 CYS HB3 H -3.150 1.507 0.912 1.00 . A A . 20 CYS HB3 1 1 15 6444 1 1 20 CYS N N -5.265 3.757 -0.240 1.00 . A A . 20 CYS N 1 1 15 6445 1 1 20 CYS O O -2.812 4.753 -0.544 1.00 . A A . 20 CYS O 1 1 15 6446 1 1 20 CYS SG S -5.174 1.042 2.088 1.00 . A A . 20 CYS SG 1 1 15 6447 1 1 21 VAL C C 0.487 2.902 0.655 1.00 . A A . 21 VAL C 1 1 15 6448 1 1 21 VAL CA C -0.535 4.024 0.803 1.00 . A A . 21 VAL CA 1 1 15 6449 1 1 21 VAL CB C -0.071 4.994 1.910 1.00 . A A . 21 VAL CB 1 1 15 6450 1 1 21 VAL CG1 C -1.074 6.125 2.082 1.00 . A A . 21 VAL CG1 1 1 15 6451 1 1 21 VAL CG2 C 0.138 4.256 3.225 1.00 . A A . 21 VAL CG2 1 1 15 6452 1 1 21 VAL H H -1.999 2.851 1.783 1.00 . A A . 21 VAL H 1 1 15 6453 1 1 21 VAL HA H -0.576 4.575 -0.126 1.00 . A A . 21 VAL HA 1 1 15 6454 1 1 21 VAL HB H 0.874 5.426 1.608 1.00 . A A . 21 VAL HB 1 1 15 6455 1 1 21 VAL HG11 H -1.265 6.584 1.123 1.00 . A A . 21 VAL HG11 1 1 15 6456 1 1 21 VAL HG12 H -1.995 5.731 2.483 1.00 . A A . 21 VAL HG12 1 1 15 6457 1 1 21 VAL HG13 H -0.671 6.863 2.761 1.00 . A A . 21 VAL HG13 1 1 15 6458 1 1 21 VAL HG21 H -0.475 3.367 3.240 1.00 . A A . 21 VAL HG21 1 1 15 6459 1 1 21 VAL HG22 H 1.177 3.978 3.321 1.00 . A A . 21 VAL HG22 1 1 15 6460 1 1 21 VAL HG23 H -0.139 4.899 4.047 1.00 . A A . 21 VAL HG23 1 1 15 6461 1 1 21 VAL N N -1.868 3.509 1.069 1.00 . A A . 21 VAL N 1 1 15 6462 1 1 21 VAL O O 0.284 1.784 1.128 1.00 . A A . 21 VAL O 1 1 15 6463 1 1 22 CYS C C 3.789 2.521 0.789 1.00 . A A . 22 CYS C 1 1 15 6464 1 1 22 CYS CA C 2.678 2.289 -0.230 1.00 . A A . 22 CYS CA 1 1 15 6465 1 1 22 CYS CB C 3.228 2.445 -1.655 1.00 . A A . 22 CYS CB 1 1 15 6466 1 1 22 CYS H H 1.668 4.141 -0.338 1.00 . A A . 22 CYS H 1 1 15 6467 1 1 22 CYS HA H 2.289 1.289 -0.105 1.00 . A A . 22 CYS HA 1 1 15 6468 1 1 22 CYS HB2 H 3.234 3.488 -1.917 1.00 . A A . 22 CYS HB2 1 1 15 6469 1 1 22 CYS HB3 H 4.238 2.071 -1.694 1.00 . A A . 22 CYS HB3 1 1 15 6470 1 1 22 CYS N N 1.588 3.232 -0.001 1.00 . A A . 22 CYS N 1 1 15 6471 1 1 22 CYS O O 4.167 3.661 1.059 1.00 . A A . 22 CYS O 1 1 15 6472 1 1 22 CYS SG S 2.263 1.570 -2.925 1.00 . A A . 22 CYS SG 1 1 15 6473 1 1 23 LEU C C 6.722 1.247 1.770 1.00 . A A . 23 LEU C 1 1 15 6474 1 1 23 LEU CA C 5.350 1.532 2.371 1.00 . A A . 23 LEU CA 1 1 15 6475 1 1 23 LEU CB C 5.068 0.563 3.520 1.00 . A A . 23 LEU CB 1 1 15 6476 1 1 23 LEU CD1 C 3.242 -0.785 4.594 1.00 . A A . 23 LEU CD1 1 1 15 6477 1 1 23 LEU CD2 C 3.460 1.657 5.102 1.00 . A A . 23 LEU CD2 1 1 15 6478 1 1 23 LEU CG C 3.629 0.579 4.041 1.00 . A A . 23 LEU CG 1 1 15 6479 1 1 23 LEU H H 3.947 0.556 1.122 1.00 . A A . 23 LEU H 1 1 15 6480 1 1 23 LEU HA H 5.345 2.540 2.758 1.00 . A A . 23 LEU HA 1 1 15 6481 1 1 23 LEU HB2 H 5.298 -0.438 3.184 1.00 . A A . 23 LEU HB2 1 1 15 6482 1 1 23 LEU HB3 H 5.726 0.810 4.339 1.00 . A A . 23 LEU HB3 1 1 15 6483 1 1 23 LEU HD11 H 4.103 -1.437 4.587 1.00 . A A . 23 LEU HD11 1 1 15 6484 1 1 23 LEU HD12 H 2.883 -0.676 5.608 1.00 . A A . 23 LEU HD12 1 1 15 6485 1 1 23 LEU HD13 H 2.463 -1.214 3.981 1.00 . A A . 23 LEU HD13 1 1 15 6486 1 1 23 LEU HD21 H 3.977 2.552 4.792 1.00 . A A . 23 LEU HD21 1 1 15 6487 1 1 23 LEU HD22 H 2.409 1.873 5.231 1.00 . A A . 23 LEU HD22 1 1 15 6488 1 1 23 LEU HD23 H 3.872 1.308 6.037 1.00 . A A . 23 LEU HD23 1 1 15 6489 1 1 23 LEU HG H 2.961 0.808 3.223 1.00 . A A . 23 LEU HG 1 1 15 6490 1 1 23 LEU N N 4.296 1.438 1.367 1.00 . A A . 23 LEU N 1 1 15 6491 1 1 23 LEU O O 6.858 0.415 0.873 1.00 . A A . 23 LEU O 1 1 15 6492 1 1 24 GLU C C 9.565 0.344 1.891 1.00 . A A . 24 GLU C 1 1 15 6493 1 1 24 GLU CA C 9.101 1.794 1.792 1.00 . A A . 24 GLU CA 1 1 15 6494 1 1 24 GLU CB C 10.048 2.697 2.586 1.00 . A A . 24 GLU CB 1 1 15 6495 1 1 24 GLU CD C 10.802 3.490 4.862 1.00 . A A . 24 GLU CD 1 1 15 6496 1 1 24 GLU CG C 9.976 2.482 4.090 1.00 . A A . 24 GLU CG 1 1 15 6497 1 1 24 GLU H H 7.550 2.601 2.984 1.00 . A A . 24 GLU H 1 1 15 6498 1 1 24 GLU HA H 9.123 2.094 0.755 1.00 . A A . 24 GLU HA 1 1 15 6499 1 1 24 GLU HB2 H 11.061 2.506 2.266 1.00 . A A . 24 GLU HB2 1 1 15 6500 1 1 24 GLU HB3 H 9.802 3.727 2.380 1.00 . A A . 24 GLU HB3 1 1 15 6501 1 1 24 GLU HG2 H 8.946 2.566 4.405 1.00 . A A . 24 GLU HG2 1 1 15 6502 1 1 24 GLU HG3 H 10.340 1.491 4.316 1.00 . A A . 24 GLU HG3 1 1 15 6503 1 1 24 GLU N N 7.732 1.952 2.272 1.00 . A A . 24 GLU N 1 1 15 6504 1 1 24 GLU O O 10.111 -0.205 0.935 1.00 . A A . 24 GLU O 1 1 15 6505 1 1 24 GLU OE1 O 12.042 3.479 4.717 1.00 . A A . 24 GLU OE1 1 1 15 6506 1 1 24 GLU OE2 O 10.209 4.293 5.613 1.00 . A A . 24 GLU OE2 1 1 15 6507 1 1 25 HIS C C 9.190 -2.552 2.153 1.00 . A A . 25 HIS C 1 1 15 6508 1 1 25 HIS CA C 9.753 -1.664 3.255 1.00 . A A . 25 HIS CA 1 1 15 6509 1 1 25 HIS CB C 9.315 -2.187 4.631 1.00 . A A . 25 HIS CB 1 1 15 6510 1 1 25 HIS CD2 C 6.804 -1.831 5.187 1.00 . A A . 25 HIS CD2 1 1 15 6511 1 1 25 HIS CE1 C 6.991 0.030 6.330 1.00 . A A . 25 HIS CE1 1 1 15 6512 1 1 25 HIS CG C 8.117 -1.499 5.211 1.00 . A A . 25 HIS CG 1 1 15 6513 1 1 25 HIS H H 8.909 0.213 3.775 1.00 . A A . 25 HIS H 1 1 15 6514 1 1 25 HIS HA H 10.831 -1.696 3.198 1.00 . A A . 25 HIS HA 1 1 15 6515 1 1 25 HIS HB2 H 9.080 -3.236 4.547 1.00 . A A . 25 HIS HB2 1 1 15 6516 1 1 25 HIS HB3 H 10.134 -2.067 5.326 1.00 . A A . 25 HIS HB3 1 1 15 6517 1 1 25 HIS HD1 H 9.022 0.168 6.128 1.00 . A A . 25 HIS HD1 1 1 15 6518 1 1 25 HIS HD2 H 6.371 -2.695 4.703 1.00 . A A . 25 HIS HD2 1 1 15 6519 1 1 25 HIS HE1 H 6.751 0.907 6.914 1.00 . A A . 25 HIS HE1 1 1 15 6520 1 1 25 HIS HE2 H 5.184 -0.913 6.153 1.00 . A A . 25 HIS HE2 1 1 15 6521 1 1 25 HIS N N 9.348 -0.274 3.050 1.00 . A A . 25 HIS N 1 1 15 6522 1 1 25 HIS ND1 N 8.199 -0.327 5.933 1.00 . A A . 25 HIS ND1 1 1 15 6523 1 1 25 HIS NE2 N 6.126 -0.865 5.889 1.00 . A A . 25 HIS NE2 1 1 15 6524 1 1 25 HIS O O 9.762 -3.593 1.827 1.00 . A A . 25 HIS O 1 1 15 6525 1 1 26 GLY C C 6.133 -3.488 0.881 1.00 . A A . 26 GLY C 1 1 15 6526 1 1 26 GLY CA C 7.466 -2.880 0.499 1.00 . A A . 26 GLY CA 1 1 15 6527 1 1 26 GLY H H 7.673 -1.281 1.865 1.00 . A A . 26 GLY H 1 1 15 6528 1 1 26 GLY HA2 H 8.140 -3.672 0.205 1.00 . A A . 26 GLY HA2 1 1 15 6529 1 1 26 GLY HA3 H 7.319 -2.220 -0.341 1.00 . A A . 26 GLY HA3 1 1 15 6530 1 1 26 GLY N N 8.076 -2.124 1.572 1.00 . A A . 26 GLY N 1 1 15 6531 1 1 26 GLY O O 5.999 -4.710 0.944 1.00 . A A . 26 GLY O 1 1 15 6532 1 1 27 TYR C C 2.790 -1.960 1.406 1.00 . A A . 27 TYR C 1 1 15 6533 1 1 27 TYR CA C 3.804 -3.099 1.492 1.00 . A A . 27 TYR CA 1 1 15 6534 1 1 27 TYR CB C 3.807 -3.679 2.907 1.00 . A A . 27 TYR CB 1 1 15 6535 1 1 27 TYR CD1 C 3.912 -6.060 2.070 1.00 . A A . 27 TYR CD1 1 1 15 6536 1 1 27 TYR CD2 C 5.202 -5.482 3.989 1.00 . A A . 27 TYR CD2 1 1 15 6537 1 1 27 TYR CE1 C 4.378 -7.360 2.144 1.00 . A A . 27 TYR CE1 1 1 15 6538 1 1 27 TYR CE2 C 5.673 -6.779 4.070 1.00 . A A . 27 TYR CE2 1 1 15 6539 1 1 27 TYR CG C 4.317 -5.100 2.990 1.00 . A A . 27 TYR CG 1 1 15 6540 1 1 27 TYR CZ C 5.257 -7.714 3.145 1.00 . A A . 27 TYR CZ 1 1 15 6541 1 1 27 TYR H H 5.309 -1.674 1.048 1.00 . A A . 27 TYR H 1 1 15 6542 1 1 27 TYR HA H 3.519 -3.873 0.796 1.00 . A A . 27 TYR HA 1 1 15 6543 1 1 27 TYR HB2 H 4.435 -3.069 3.534 1.00 . A A . 27 TYR HB2 1 1 15 6544 1 1 27 TYR HB3 H 2.799 -3.665 3.295 1.00 . A A . 27 TYR HB3 1 1 15 6545 1 1 27 TYR HD1 H 3.224 -5.780 1.286 1.00 . A A . 27 TYR HD1 1 1 15 6546 1 1 27 TYR HD2 H 5.526 -4.748 4.712 1.00 . A A . 27 TYR HD2 1 1 15 6547 1 1 27 TYR HE1 H 4.053 -8.092 1.419 1.00 . A A . 27 TYR HE1 1 1 15 6548 1 1 27 TYR HE2 H 6.361 -7.056 4.854 1.00 . A A . 27 TYR HE2 1 1 15 6549 1 1 27 TYR HH H 6.100 -9.262 2.378 1.00 . A A . 27 TYR HH 1 1 15 6550 1 1 27 TYR N N 5.140 -2.636 1.125 1.00 . A A . 27 TYR N 1 1 15 6551 1 1 27 TYR O O 3.112 -0.807 1.693 1.00 . A A . 27 TYR O 1 1 15 6552 1 1 27 TYR OH O 5.723 -9.007 3.223 1.00 . A A . 27 TYR OH 1 1 15 6553 1 1 28 CYS C C -0.400 -1.323 2.126 1.00 . A A . 28 CYS C 1 1 15 6554 1 1 28 CYS CA C 0.501 -1.297 0.895 1.00 . A A . 28 CYS CA 1 1 15 6555 1 1 28 CYS CB C -0.340 -1.555 -0.361 1.00 . A A . 28 CYS CB 1 1 15 6556 1 1 28 CYS H H 1.371 -3.227 0.798 1.00 . A A . 28 CYS H 1 1 15 6557 1 1 28 CYS HA H 0.961 -0.324 0.817 1.00 . A A . 28 CYS HA 1 1 15 6558 1 1 28 CYS HB2 H -0.085 -2.526 -0.759 1.00 . A A . 28 CYS HB2 1 1 15 6559 1 1 28 CYS HB3 H -1.386 -1.546 -0.094 1.00 . A A . 28 CYS HB3 1 1 15 6560 1 1 28 CYS N N 1.565 -2.292 1.014 1.00 . A A . 28 CYS N 1 1 15 6561 1 1 28 CYS O O -1.084 -2.312 2.387 1.00 . A A . 28 CYS O 1 1 15 6562 1 1 28 CYS SG S -0.096 -0.335 -1.693 1.00 . A A . 28 CYS SG 1 1 15 6563 1 1 29 GLY C C -1.757 1.248 4.311 1.00 . A A . 29 GLY C 1 1 15 6564 1 1 29 GLY CA C -1.208 -0.146 4.077 1.00 . A A . 29 GLY CA 1 1 15 6565 1 1 29 GLY H H 0.177 0.528 2.625 1.00 . A A . 29 GLY H 1 1 15 6566 1 1 29 GLY HA2 H -0.610 -0.432 4.929 1.00 . A A . 29 GLY HA2 1 1 15 6567 1 1 29 GLY HA3 H -2.034 -0.835 3.984 1.00 . A A . 29 GLY HA3 1 1 15 6568 1 1 29 GLY N N -0.390 -0.229 2.881 1.00 . A A . 29 GLY N 1 1 15 6569 1 1 29 GLY O O -1.068 2.054 4.969 1.00 . A A . 29 GLY O 1 1 15 6570 1 1 29 GLY OXT O -2.877 1.531 3.834 1.00 . A A . 29 GLY OXT 1 1 16 6571 1 1 1 ARG C C -8.366 1.678 4.226 1.00 . A A . 1 ARG C 1 1 16 6572 1 1 1 ARG CA C -7.418 2.711 4.828 1.00 . A A . 1 ARG CA 1 1 16 6573 1 1 1 ARG CB C -7.244 2.457 6.327 1.00 . A A . 1 ARG CB 1 1 16 6574 1 1 1 ARG CD C -6.819 0.170 7.287 1.00 . A A . 1 ARG CD 1 1 16 6575 1 1 1 ARG CG C -6.197 1.402 6.648 1.00 . A A . 1 ARG CG 1 1 16 6576 1 1 1 ARG CZ C -6.233 -2.187 7.699 1.00 . A A . 1 ARG CZ 1 1 16 6577 1 1 1 ARG H1 H -8.951 4.083 4.869 1.00 . A A . 1 ARG H1 1 1 16 6578 1 1 1 ARG H2 H -7.411 4.718 5.283 1.00 . A A . 1 ARG H2 1 1 16 6579 1 1 1 ARG H3 H -7.777 4.358 3.648 1.00 . A A . 1 ARG H3 1 1 16 6580 1 1 1 ARG HA H -6.458 2.635 4.341 1.00 . A A . 1 ARG HA 1 1 16 6581 1 1 1 ARG HB2 H -6.951 3.380 6.805 1.00 . A A . 1 ARG HB2 1 1 16 6582 1 1 1 ARG HB3 H -8.190 2.134 6.737 1.00 . A A . 1 ARG HB3 1 1 16 6583 1 1 1 ARG HD2 H -7.112 0.415 8.298 1.00 . A A . 1 ARG HD2 1 1 16 6584 1 1 1 ARG HD3 H -7.693 -0.112 6.718 1.00 . A A . 1 ARG HD3 1 1 16 6585 1 1 1 ARG HE H -4.965 -0.788 7.052 1.00 . A A . 1 ARG HE 1 1 16 6586 1 1 1 ARG HG2 H -5.704 1.108 5.732 1.00 . A A . 1 ARG HG2 1 1 16 6587 1 1 1 ARG HG3 H -5.473 1.823 7.329 1.00 . A A . 1 ARG HG3 1 1 16 6588 1 1 1 ARG HH11 H -8.167 -1.727 8.072 1.00 . A A . 1 ARG HH11 1 1 16 6589 1 1 1 ARG HH12 H -7.730 -3.379 8.354 1.00 . A A . 1 ARG HH12 1 1 16 6590 1 1 1 ARG HH21 H -4.387 -2.960 7.423 1.00 . A A . 1 ARG HH21 1 1 16 6591 1 1 1 ARG HH22 H -5.583 -4.079 7.986 1.00 . A A . 1 ARG HH22 1 1 16 6592 1 1 1 ARG N N -7.935 4.092 4.640 1.00 . A A . 1 ARG N 1 1 16 6593 1 1 1 ARG NE N -5.891 -0.957 7.323 1.00 . A A . 1 ARG NE 1 1 16 6594 1 1 1 ARG NH1 N -7.479 -2.452 8.072 1.00 . A A . 1 ARG NH1 1 1 16 6595 1 1 1 ARG NH2 N -5.328 -3.155 7.703 1.00 . A A . 1 ARG NH2 1 1 16 6596 1 1 1 ARG O O -8.441 0.543 4.696 1.00 . A A . 1 ARG O 1 1 16 6597 1 1 2 VAL C C -9.386 0.513 1.310 1.00 . A A . 2 VAL C 1 1 16 6598 1 1 2 VAL CA C -10.028 1.189 2.518 1.00 . A A . 2 VAL CA 1 1 16 6599 1 1 2 VAL CB C -11.288 1.946 2.058 1.00 . A A . 2 VAL CB 1 1 16 6600 1 1 2 VAL CG1 C -12.156 2.314 3.252 1.00 . A A . 2 VAL CG1 1 1 16 6601 1 1 2 VAL CG2 C -10.905 3.187 1.265 1.00 . A A . 2 VAL CG2 1 1 16 6602 1 1 2 VAL H H -8.981 2.997 2.854 1.00 . A A . 2 VAL H 1 1 16 6603 1 1 2 VAL HA H -10.328 0.430 3.226 1.00 . A A . 2 VAL HA 1 1 16 6604 1 1 2 VAL HB H -11.860 1.295 1.414 1.00 . A A . 2 VAL HB 1 1 16 6605 1 1 2 VAL HG11 H -12.124 1.517 3.980 1.00 . A A . 2 VAL HG11 1 1 16 6606 1 1 2 VAL HG12 H -11.786 3.225 3.698 1.00 . A A . 2 VAL HG12 1 1 16 6607 1 1 2 VAL HG13 H -13.175 2.461 2.924 1.00 . A A . 2 VAL HG13 1 1 16 6608 1 1 2 VAL HG21 H -9.879 3.102 0.937 1.00 . A A . 2 VAL HG21 1 1 16 6609 1 1 2 VAL HG22 H -11.552 3.278 0.404 1.00 . A A . 2 VAL HG22 1 1 16 6610 1 1 2 VAL HG23 H -11.013 4.061 1.889 1.00 . A A . 2 VAL HG23 1 1 16 6611 1 1 2 VAL N N -9.086 2.080 3.184 1.00 . A A . 2 VAL N 1 1 16 6612 1 1 2 VAL O O -9.632 0.895 0.167 1.00 . A A . 2 VAL O 1 1 16 6613 1 1 3 CYS C C -7.768 -2.708 0.855 1.00 . A A . 3 CYS C 1 1 16 6614 1 1 3 CYS CA C -7.879 -1.223 0.510 1.00 . A A . 3 CYS CA 1 1 16 6615 1 1 3 CYS CB C -6.486 -0.636 0.268 1.00 . A A . 3 CYS CB 1 1 16 6616 1 1 3 CYS H H -8.401 -0.751 2.506 1.00 . A A . 3 CYS H 1 1 16 6617 1 1 3 CYS HA H -8.467 -1.114 -0.389 1.00 . A A . 3 CYS HA 1 1 16 6618 1 1 3 CYS HB2 H -6.053 -1.105 -0.603 1.00 . A A . 3 CYS HB2 1 1 16 6619 1 1 3 CYS HB3 H -6.578 0.425 0.089 1.00 . A A . 3 CYS HB3 1 1 16 6620 1 1 3 CYS N N -8.559 -0.493 1.574 1.00 . A A . 3 CYS N 1 1 16 6621 1 1 3 CYS O O -7.333 -3.065 1.950 1.00 . A A . 3 CYS O 1 1 16 6622 1 1 3 CYS SG S -5.327 -0.867 1.654 1.00 . A A . 3 CYS SG 1 1 16 6623 1 1 4 PRO C C -6.794 -5.490 0.790 1.00 . A A . 4 PRO C 1 1 16 6624 1 1 4 PRO CA C -8.100 -5.047 0.139 1.00 . A A . 4 PRO CA 1 1 16 6625 1 1 4 PRO CB C -8.205 -5.607 -1.276 1.00 . A A . 4 PRO CB 1 1 16 6626 1 1 4 PRO CD C -8.692 -3.266 -1.415 1.00 . A A . 4 PRO CD 1 1 16 6627 1 1 4 PRO CG C -9.032 -4.609 -2.009 1.00 . A A . 4 PRO CG 1 1 16 6628 1 1 4 PRO HA H -8.934 -5.396 0.731 1.00 . A A . 4 PRO HA 1 1 16 6629 1 1 4 PRO HB2 H -7.216 -5.696 -1.705 1.00 . A A . 4 PRO HB2 1 1 16 6630 1 1 4 PRO HB3 H -8.681 -6.574 -1.250 1.00 . A A . 4 PRO HB3 1 1 16 6631 1 1 4 PRO HD2 H -7.943 -2.768 -2.014 1.00 . A A . 4 PRO HD2 1 1 16 6632 1 1 4 PRO HD3 H -9.579 -2.654 -1.335 1.00 . A A . 4 PRO HD3 1 1 16 6633 1 1 4 PRO HG2 H -8.783 -4.627 -3.060 1.00 . A A . 4 PRO HG2 1 1 16 6634 1 1 4 PRO HG3 H -10.080 -4.827 -1.868 1.00 . A A . 4 PRO HG3 1 1 16 6635 1 1 4 PRO N N -8.161 -3.598 -0.077 1.00 . A A . 4 PRO N 1 1 16 6636 1 1 4 PRO O O -5.725 -4.973 0.470 1.00 . A A . 4 PRO O 1 1 16 6637 1 1 5 ARG C C -4.830 -7.754 1.427 1.00 . A A . 5 ARG C 1 1 16 6638 1 1 5 ARG CA C -5.711 -6.964 2.387 1.00 . A A . 5 ARG CA 1 1 16 6639 1 1 5 ARG CB C -6.123 -7.847 3.566 1.00 . A A . 5 ARG CB 1 1 16 6640 1 1 5 ARG CD C -8.321 -7.740 4.788 1.00 . A A . 5 ARG CD 1 1 16 6641 1 1 5 ARG CG C -6.945 -7.114 4.616 1.00 . A A . 5 ARG CG 1 1 16 6642 1 1 5 ARG CZ C -10.573 -6.980 5.440 1.00 . A A . 5 ARG CZ 1 1 16 6643 1 1 5 ARG H H -7.768 -6.830 1.911 1.00 . A A . 5 ARG H 1 1 16 6644 1 1 5 ARG HA H -5.151 -6.119 2.759 1.00 . A A . 5 ARG HA 1 1 16 6645 1 1 5 ARG HB2 H -6.707 -8.676 3.194 1.00 . A A . 5 ARG HB2 1 1 16 6646 1 1 5 ARG HB3 H -5.232 -8.231 4.042 1.00 . A A . 5 ARG HB3 1 1 16 6647 1 1 5 ARG HD2 H -8.539 -8.345 3.921 1.00 . A A . 5 ARG HD2 1 1 16 6648 1 1 5 ARG HD3 H -8.310 -8.365 5.669 1.00 . A A . 5 ARG HD3 1 1 16 6649 1 1 5 ARG HE H -9.159 -5.818 4.643 1.00 . A A . 5 ARG HE 1 1 16 6650 1 1 5 ARG HG2 H -6.423 -7.154 5.561 1.00 . A A . 5 ARG HG2 1 1 16 6651 1 1 5 ARG HG3 H -7.063 -6.085 4.311 1.00 . A A . 5 ARG HG3 1 1 16 6652 1 1 5 ARG HH11 H -10.222 -8.945 5.774 1.00 . A A . 5 ARG HH11 1 1 16 6653 1 1 5 ARG HH12 H -11.798 -8.385 6.224 1.00 . A A . 5 ARG HH12 1 1 16 6654 1 1 5 ARG HH21 H -11.232 -5.081 5.233 1.00 . A A . 5 ARG HH21 1 1 16 6655 1 1 5 ARG HH22 H -12.372 -6.192 5.916 1.00 . A A . 5 ARG HH22 1 1 16 6656 1 1 5 ARG N N -6.889 -6.453 1.700 1.00 . A A . 5 ARG N 1 1 16 6657 1 1 5 ARG NE N -9.367 -6.730 4.935 1.00 . A A . 5 ARG NE 1 1 16 6658 1 1 5 ARG NH1 N -10.890 -8.204 5.845 1.00 . A A . 5 ARG NH1 1 1 16 6659 1 1 5 ARG NH2 N -11.465 -6.004 5.538 1.00 . A A . 5 ARG NH2 1 1 16 6660 1 1 5 ARG O O -4.858 -8.986 1.411 1.00 . A A . 5 ARG O 1 1 16 6661 1 1 6 ILE C C -1.776 -7.022 -0.307 1.00 . A A . 6 ILE C 1 1 16 6662 1 1 6 ILE CA C -3.160 -7.665 -0.340 1.00 . A A . 6 ILE CA 1 1 16 6663 1 1 6 ILE CB C -3.729 -7.571 -1.771 1.00 . A A . 6 ILE CB 1 1 16 6664 1 1 6 ILE CD1 C -3.412 -9.655 -3.201 1.00 . A A . 6 ILE CD1 1 1 16 6665 1 1 6 ILE CG1 C -2.834 -8.329 -2.756 1.00 . A A . 6 ILE CG1 1 1 16 6666 1 1 6 ILE CG2 C -3.879 -6.116 -2.191 1.00 . A A . 6 ILE CG2 1 1 16 6667 1 1 6 ILE H H -4.077 -6.059 0.686 1.00 . A A . 6 ILE H 1 1 16 6668 1 1 6 ILE HA H -3.066 -8.710 -0.079 1.00 . A A . 6 ILE HA 1 1 16 6669 1 1 6 ILE HB H -4.711 -8.022 -1.771 1.00 . A A . 6 ILE HB 1 1 16 6670 1 1 6 ILE HD11 H -4.344 -9.833 -2.684 1.00 . A A . 6 ILE HD11 1 1 16 6671 1 1 6 ILE HD12 H -3.590 -9.632 -4.265 1.00 . A A . 6 ILE HD12 1 1 16 6672 1 1 6 ILE HD13 H -2.716 -10.447 -2.969 1.00 . A A . 6 ILE HD13 1 1 16 6673 1 1 6 ILE HG12 H -2.683 -7.723 -3.637 1.00 . A A . 6 ILE HG12 1 1 16 6674 1 1 6 ILE HG13 H -1.879 -8.523 -2.290 1.00 . A A . 6 ILE HG13 1 1 16 6675 1 1 6 ILE HG21 H -4.329 -5.554 -1.386 1.00 . A A . 6 ILE HG21 1 1 16 6676 1 1 6 ILE HG22 H -2.907 -5.705 -2.417 1.00 . A A . 6 ILE HG22 1 1 16 6677 1 1 6 ILE HG23 H -4.508 -6.057 -3.066 1.00 . A A . 6 ILE HG23 1 1 16 6678 1 1 6 ILE N N -4.051 -7.037 0.627 1.00 . A A . 6 ILE N 1 1 16 6679 1 1 6 ILE O O -1.648 -5.799 -0.373 1.00 . A A . 6 ILE O 1 1 16 6680 1 1 7 LEU C C 0.956 -6.547 -1.407 1.00 . A A . 7 LEU C 1 1 16 6681 1 1 7 LEU CA C 0.630 -7.364 -0.162 1.00 . A A . 7 LEU CA 1 1 16 6682 1 1 7 LEU CB C 1.606 -8.535 -0.040 1.00 . A A . 7 LEU CB 1 1 16 6683 1 1 7 LEU CD1 C 2.443 -10.532 1.222 1.00 . A A . 7 LEU CD1 1 1 16 6684 1 1 7 LEU CD2 C 1.445 -8.599 2.464 1.00 . A A . 7 LEU CD2 1 1 16 6685 1 1 7 LEU CG C 1.398 -9.427 1.186 1.00 . A A . 7 LEU CG 1 1 16 6686 1 1 7 LEU H H -0.910 -8.817 -0.155 1.00 . A A . 7 LEU H 1 1 16 6687 1 1 7 LEU HA H 0.730 -6.730 0.706 1.00 . A A . 7 LEU HA 1 1 16 6688 1 1 7 LEU HB2 H 1.512 -9.148 -0.924 1.00 . A A . 7 LEU HB2 1 1 16 6689 1 1 7 LEU HB3 H 2.608 -8.139 -0.001 1.00 . A A . 7 LEU HB3 1 1 16 6690 1 1 7 LEU HD11 H 2.827 -10.697 0.227 1.00 . A A . 7 LEU HD11 1 1 16 6691 1 1 7 LEU HD12 H 3.251 -10.241 1.876 1.00 . A A . 7 LEU HD12 1 1 16 6692 1 1 7 LEU HD13 H 1.992 -11.442 1.590 1.00 . A A . 7 LEU HD13 1 1 16 6693 1 1 7 LEU HD21 H 1.693 -7.576 2.221 1.00 . A A . 7 LEU HD21 1 1 16 6694 1 1 7 LEU HD22 H 0.480 -8.630 2.947 1.00 . A A . 7 LEU HD22 1 1 16 6695 1 1 7 LEU HD23 H 2.193 -9.003 3.129 1.00 . A A . 7 LEU HD23 1 1 16 6696 1 1 7 LEU HG H 0.425 -9.891 1.123 1.00 . A A . 7 LEU HG 1 1 16 6697 1 1 7 LEU N N -0.744 -7.853 -0.205 1.00 . A A . 7 LEU N 1 1 16 6698 1 1 7 LEU O O 0.552 -6.899 -2.515 1.00 . A A . 7 LEU O 1 1 16 6699 1 1 8 LEU C C 3.232 -3.686 -1.937 1.00 . A A . 8 LEU C 1 1 16 6700 1 1 8 LEU CA C 2.072 -4.593 -2.330 1.00 . A A . 8 LEU CA 1 1 16 6701 1 1 8 LEU CB C 0.875 -3.753 -2.785 1.00 . A A . 8 LEU CB 1 1 16 6702 1 1 8 LEU CD1 C -0.842 -4.528 -4.446 1.00 . A A . 8 LEU CD1 1 1 16 6703 1 1 8 LEU CD2 C 0.554 -2.515 -4.946 1.00 . A A . 8 LEU CD2 1 1 16 6704 1 1 8 LEU CG C 0.522 -3.878 -4.271 1.00 . A A . 8 LEU CG 1 1 16 6705 1 1 8 LEU H H 1.987 -5.226 -0.310 1.00 . A A . 8 LEU H 1 1 16 6706 1 1 8 LEU HA H 2.387 -5.226 -3.146 1.00 . A A . 8 LEU HA 1 1 16 6707 1 1 8 LEU HB2 H 0.014 -4.050 -2.203 1.00 . A A . 8 LEU HB2 1 1 16 6708 1 1 8 LEU HB3 H 1.088 -2.715 -2.574 1.00 . A A . 8 LEU HB3 1 1 16 6709 1 1 8 LEU HD11 H -1.565 -4.021 -3.824 1.00 . A A . 8 LEU HD11 1 1 16 6710 1 1 8 LEU HD12 H -1.145 -4.459 -5.479 1.00 . A A . 8 LEU HD12 1 1 16 6711 1 1 8 LEU HD13 H -0.786 -5.568 -4.157 1.00 . A A . 8 LEU HD13 1 1 16 6712 1 1 8 LEU HD21 H 1.512 -2.049 -4.771 1.00 . A A . 8 LEU HD21 1 1 16 6713 1 1 8 LEU HD22 H 0.401 -2.636 -6.008 1.00 . A A . 8 LEU HD22 1 1 16 6714 1 1 8 LEU HD23 H -0.229 -1.893 -4.537 1.00 . A A . 8 LEU HD23 1 1 16 6715 1 1 8 LEU HG H 1.254 -4.509 -4.755 1.00 . A A . 8 LEU HG 1 1 16 6716 1 1 8 LEU N N 1.692 -5.456 -1.219 1.00 . A A . 8 LEU N 1 1 16 6717 1 1 8 LEU O O 3.077 -2.796 -1.101 1.00 . A A . 8 LEU O 1 1 16 6718 1 1 9 GLU C C 5.808 -2.061 -3.317 1.00 . A A . 9 GLU C 1 1 16 6719 1 1 9 GLU CA C 5.584 -3.127 -2.251 1.00 . A A . 9 GLU CA 1 1 16 6720 1 1 9 GLU CB C 6.812 -4.034 -2.156 1.00 . A A . 9 GLU CB 1 1 16 6721 1 1 9 GLU CD C 7.446 -6.246 -3.197 1.00 . A A . 9 GLU CD 1 1 16 6722 1 1 9 GLU CG C 7.110 -4.789 -3.442 1.00 . A A . 9 GLU CG 1 1 16 6723 1 1 9 GLU H H 4.452 -4.645 -3.198 1.00 . A A . 9 GLU H 1 1 16 6724 1 1 9 GLU HA H 5.432 -2.640 -1.299 1.00 . A A . 9 GLU HA 1 1 16 6725 1 1 9 GLU HB2 H 7.672 -3.429 -1.911 1.00 . A A . 9 GLU HB2 1 1 16 6726 1 1 9 GLU HB3 H 6.652 -4.755 -1.369 1.00 . A A . 9 GLU HB3 1 1 16 6727 1 1 9 GLU HG2 H 6.242 -4.738 -4.083 1.00 . A A . 9 GLU HG2 1 1 16 6728 1 1 9 GLU HG3 H 7.948 -4.317 -3.935 1.00 . A A . 9 GLU HG3 1 1 16 6729 1 1 9 GLU N N 4.393 -3.920 -2.542 1.00 . A A . 9 GLU N 1 1 16 6730 1 1 9 GLU O O 5.776 -2.349 -4.513 1.00 . A A . 9 GLU O 1 1 16 6731 1 1 9 GLU OE1 O 6.602 -6.962 -2.618 1.00 . A A . 9 GLU OE1 1 1 16 6732 1 1 9 GLU OE2 O 8.554 -6.673 -3.586 1.00 . A A . 9 GLU OE2 1 1 16 6733 1 1 10 CYS C C 7.087 1.379 -3.140 1.00 . A A . 10 CYS C 1 1 16 6734 1 1 10 CYS CA C 6.250 0.285 -3.795 1.00 . A A . 10 CYS CA 1 1 16 6735 1 1 10 CYS CB C 4.909 0.862 -4.268 1.00 . A A . 10 CYS CB 1 1 16 6736 1 1 10 CYS H H 6.034 -0.655 -1.910 1.00 . A A . 10 CYS H 1 1 16 6737 1 1 10 CYS HA H 6.787 -0.097 -4.650 1.00 . A A . 10 CYS HA 1 1 16 6738 1 1 10 CYS HB2 H 4.871 1.914 -4.025 1.00 . A A . 10 CYS HB2 1 1 16 6739 1 1 10 CYS HB3 H 4.835 0.745 -5.340 1.00 . A A . 10 CYS HB3 1 1 16 6740 1 1 10 CYS N N 6.028 -0.825 -2.875 1.00 . A A . 10 CYS N 1 1 16 6741 1 1 10 CYS O O 7.298 1.372 -1.927 1.00 . A A . 10 CYS O 1 1 16 6742 1 1 10 CYS SG S 3.444 0.072 -3.522 1.00 . A A . 10 CYS SG 1 1 16 6743 1 1 11 LYS C C 7.485 4.583 -2.998 1.00 . A A . 11 LYS C 1 1 16 6744 1 1 11 LYS CA C 8.370 3.426 -3.452 1.00 . A A . 11 LYS CA 1 1 16 6745 1 1 11 LYS CB C 9.343 3.901 -4.534 1.00 . A A . 11 LYS CB 1 1 16 6746 1 1 11 LYS CD C 11.690 3.023 -4.758 1.00 . A A . 11 LYS CD 1 1 16 6747 1 1 11 LYS CE C 13.151 3.423 -4.635 1.00 . A A . 11 LYS CE 1 1 16 6748 1 1 11 LYS CG C 10.781 4.016 -4.050 1.00 . A A . 11 LYS CG 1 1 16 6749 1 1 11 LYS H H 7.354 2.274 -4.908 1.00 . A A . 11 LYS H 1 1 16 6750 1 1 11 LYS HA H 8.934 3.066 -2.605 1.00 . A A . 11 LYS HA 1 1 16 6751 1 1 11 LYS HB2 H 9.317 3.203 -5.357 1.00 . A A . 11 LYS HB2 1 1 16 6752 1 1 11 LYS HB3 H 9.027 4.873 -4.888 1.00 . A A . 11 LYS HB3 1 1 16 6753 1 1 11 LYS HD2 H 11.556 2.048 -4.315 1.00 . A A . 11 LYS HD2 1 1 16 6754 1 1 11 LYS HD3 H 11.422 2.986 -5.803 1.00 . A A . 11 LYS HD3 1 1 16 6755 1 1 11 LYS HE2 H 13.645 3.227 -5.576 1.00 . A A . 11 LYS HE2 1 1 16 6756 1 1 11 LYS HE3 H 13.206 4.479 -4.414 1.00 . A A . 11 LYS HE3 1 1 16 6757 1 1 11 LYS HG2 H 11.137 5.017 -4.245 1.00 . A A . 11 LYS HG2 1 1 16 6758 1 1 11 LYS HG3 H 10.808 3.823 -2.987 1.00 . A A . 11 LYS HG3 1 1 16 6759 1 1 11 LYS HZ1 H 13.157 2.329 -2.855 1.00 . A A . 11 LYS HZ1 1 1 16 6760 1 1 11 LYS HZ2 H 14.343 1.846 -3.961 1.00 . A A . 11 LYS HZ2 1 1 16 6761 1 1 11 LYS HZ3 H 14.540 3.277 -3.081 1.00 . A A . 11 LYS HZ3 1 1 16 6762 1 1 11 LYS N N 7.558 2.322 -3.951 1.00 . A A . 11 LYS N 1 1 16 6763 1 1 11 LYS NZ N 13.846 2.665 -3.557 1.00 . A A . 11 LYS NZ 1 1 16 6764 1 1 11 LYS O O 7.404 4.886 -1.808 1.00 . A A . 11 LYS O 1 1 16 6765 1 1 12 LYS C C 4.579 5.838 -3.173 1.00 . A A . 12 LYS C 1 1 16 6766 1 1 12 LYS CA C 5.935 6.343 -3.653 1.00 . A A . 12 LYS CA 1 1 16 6767 1 1 12 LYS CB C 5.756 7.228 -4.888 1.00 . A A . 12 LYS CB 1 1 16 6768 1 1 12 LYS CD C 5.610 9.737 -4.781 1.00 . A A . 12 LYS CD 1 1 16 6769 1 1 12 LYS CE C 4.961 10.840 -3.960 1.00 . A A . 12 LYS CE 1 1 16 6770 1 1 12 LYS CG C 4.850 8.426 -4.652 1.00 . A A . 12 LYS CG 1 1 16 6771 1 1 12 LYS H H 6.922 4.932 -4.885 1.00 . A A . 12 LYS H 1 1 16 6772 1 1 12 LYS HA H 6.391 6.923 -2.865 1.00 . A A . 12 LYS HA 1 1 16 6773 1 1 12 LYS HB2 H 6.724 7.589 -5.201 1.00 . A A . 12 LYS HB2 1 1 16 6774 1 1 12 LYS HB3 H 5.330 6.633 -5.684 1.00 . A A . 12 LYS HB3 1 1 16 6775 1 1 12 LYS HD2 H 6.622 9.591 -4.432 1.00 . A A . 12 LYS HD2 1 1 16 6776 1 1 12 LYS HD3 H 5.623 10.033 -5.820 1.00 . A A . 12 LYS HD3 1 1 16 6777 1 1 12 LYS HE2 H 5.019 11.765 -4.515 1.00 . A A . 12 LYS HE2 1 1 16 6778 1 1 12 LYS HE3 H 3.925 10.584 -3.793 1.00 . A A . 12 LYS HE3 1 1 16 6779 1 1 12 LYS HG2 H 4.053 8.412 -5.381 1.00 . A A . 12 LYS HG2 1 1 16 6780 1 1 12 LYS HG3 H 4.432 8.358 -3.658 1.00 . A A . 12 LYS HG3 1 1 16 6781 1 1 12 LYS HZ1 H 5.654 10.122 -2.125 1.00 . A A . 12 LYS HZ1 1 1 16 6782 1 1 12 LYS HZ2 H 6.610 11.352 -2.785 1.00 . A A . 12 LYS HZ2 1 1 16 6783 1 1 12 LYS HZ3 H 5.121 11.727 -2.076 1.00 . A A . 12 LYS HZ3 1 1 16 6784 1 1 12 LYS N N 6.819 5.223 -3.955 1.00 . A A . 12 LYS N 1 1 16 6785 1 1 12 LYS NZ N 5.634 11.023 -2.645 1.00 . A A . 12 LYS NZ 1 1 16 6786 1 1 12 LYS O O 3.998 4.931 -3.770 1.00 . A A . 12 LYS O 1 1 16 6787 1 1 13 ASP C C 1.692 6.088 -2.571 1.00 . A A . 13 ASP C 1 1 16 6788 1 1 13 ASP CA C 2.799 6.017 -1.527 1.00 . A A . 13 ASP CA 1 1 16 6789 1 1 13 ASP CB C 2.437 6.876 -0.312 1.00 . A A . 13 ASP CB 1 1 16 6790 1 1 13 ASP CG C 3.554 6.934 0.712 1.00 . A A . 13 ASP CG 1 1 16 6791 1 1 13 ASP H H 4.593 7.131 -1.648 1.00 . A A . 13 ASP H 1 1 16 6792 1 1 13 ASP HA H 2.897 4.997 -1.212 1.00 . A A . 13 ASP HA 1 1 16 6793 1 1 13 ASP HB2 H 2.220 7.879 -0.638 1.00 . A A . 13 ASP HB2 1 1 16 6794 1 1 13 ASP HB3 H 1.562 6.462 0.162 1.00 . A A . 13 ASP HB3 1 1 16 6795 1 1 13 ASP N N 4.083 6.421 -2.087 1.00 . A A . 13 ASP N 1 1 16 6796 1 1 13 ASP O O 0.778 5.264 -2.574 1.00 . A A . 13 ASP O 1 1 16 6797 1 1 13 ASP OD1 O 4.638 6.372 0.445 1.00 . A A . 13 ASP OD1 1 1 16 6798 1 1 13 ASP OD2 O 3.346 7.542 1.782 1.00 . A A . 13 ASP OD2 1 1 16 6799 1 1 14 SER C C 0.641 5.963 -5.328 1.00 . A A . 14 SER C 1 1 16 6800 1 1 14 SER CA C 0.803 7.246 -4.517 1.00 . A A . 14 SER CA 1 1 16 6801 1 1 14 SER CB C 1.213 8.396 -5.438 1.00 . A A . 14 SER CB 1 1 16 6802 1 1 14 SER H H 2.546 7.688 -3.404 1.00 . A A . 14 SER H 1 1 16 6803 1 1 14 SER HA H -0.142 7.487 -4.053 1.00 . A A . 14 SER HA 1 1 16 6804 1 1 14 SER HB2 H 2.147 8.152 -5.922 1.00 . A A . 14 SER HB2 1 1 16 6805 1 1 14 SER HB3 H 0.448 8.545 -6.186 1.00 . A A . 14 SER HB3 1 1 16 6806 1 1 14 SER N N 1.788 7.069 -3.458 1.00 . A A . 14 SER N 1 1 16 6807 1 1 14 SER O O -0.449 5.653 -5.810 1.00 . A A . 14 SER O 1 1 16 6808 1 1 14 SER OG O 1.380 9.600 -4.709 1.00 . A A . 14 SER OG 1 1 16 6809 1 1 15 ASP C C 0.620 3.043 -5.780 1.00 . A A . 15 ASP C 1 1 16 6810 1 1 15 ASP CA C 1.732 3.980 -6.242 1.00 . A A . 15 ASP CA 1 1 16 6811 1 1 15 ASP CB C 3.087 3.280 -6.118 1.00 . A A . 15 ASP CB 1 1 16 6812 1 1 15 ASP CG C 3.541 2.663 -7.426 1.00 . A A . 15 ASP CG 1 1 16 6813 1 1 15 ASP H H 2.578 5.529 -5.073 1.00 . A A . 15 ASP H 1 1 16 6814 1 1 15 ASP HA H 1.565 4.230 -7.279 1.00 . A A . 15 ASP HA 1 1 16 6815 1 1 15 ASP HB2 H 3.830 3.999 -5.805 1.00 . A A . 15 ASP HB2 1 1 16 6816 1 1 15 ASP HB3 H 3.015 2.498 -5.377 1.00 . A A . 15 ASP HB3 1 1 16 6817 1 1 15 ASP N N 1.739 5.226 -5.482 1.00 . A A . 15 ASP N 1 1 16 6818 1 1 15 ASP O O 0.052 2.301 -6.582 1.00 . A A . 15 ASP O 1 1 16 6819 1 1 15 ASP OD1 O 2.673 2.358 -8.271 1.00 . A A . 15 ASP OD1 1 1 16 6820 1 1 15 ASP OD2 O 4.763 2.483 -7.605 1.00 . A A . 15 ASP OD2 1 1 16 6821 1 1 16 CYS C C -1.989 2.257 -4.738 1.00 . A A . 16 CYS C 1 1 16 6822 1 1 16 CYS CA C -0.707 2.193 -3.920 1.00 . A A . 16 CYS CA 1 1 16 6823 1 1 16 CYS CB C -0.991 2.558 -2.458 1.00 . A A . 16 CYS CB 1 1 16 6824 1 1 16 CYS H H 0.821 3.664 -3.889 1.00 . A A . 16 CYS H 1 1 16 6825 1 1 16 CYS HA H -0.330 1.182 -3.956 1.00 . A A . 16 CYS HA 1 1 16 6826 1 1 16 CYS HB2 H -0.100 2.952 -2.021 1.00 . A A . 16 CYS HB2 1 1 16 6827 1 1 16 CYS HB3 H -1.757 3.315 -2.423 1.00 . A A . 16 CYS HB3 1 1 16 6828 1 1 16 CYS N N 0.325 3.062 -4.483 1.00 . A A . 16 CYS N 1 1 16 6829 1 1 16 CYS O O -2.119 3.068 -5.656 1.00 . A A . 16 CYS O 1 1 16 6830 1 1 16 CYS SG S -1.533 1.157 -1.421 1.00 . A A . 16 CYS SG 1 1 16 6831 1 1 17 LEU C C -5.354 1.730 -4.190 1.00 . A A . 17 LEU C 1 1 16 6832 1 1 17 LEU CA C -4.205 1.323 -5.104 1.00 . A A . 17 LEU CA 1 1 16 6833 1 1 17 LEU CB C -4.443 -0.089 -5.642 1.00 . A A . 17 LEU CB 1 1 16 6834 1 1 17 LEU CD1 C -6.004 -1.493 -4.270 1.00 . A A . 17 LEU CD1 1 1 16 6835 1 1 17 LEU CD2 C -3.812 -2.436 -5.019 1.00 . A A . 17 LEU CD2 1 1 16 6836 1 1 17 LEU CG C -4.547 -1.180 -4.574 1.00 . A A . 17 LEU CG 1 1 16 6837 1 1 17 LEU H H -2.753 0.768 -3.663 1.00 . A A . 17 LEU H 1 1 16 6838 1 1 17 LEU HA H -4.161 2.011 -5.934 1.00 . A A . 17 LEU HA 1 1 16 6839 1 1 17 LEU HB2 H -5.360 -0.083 -6.214 1.00 . A A . 17 LEU HB2 1 1 16 6840 1 1 17 LEU HB3 H -3.628 -0.341 -6.304 1.00 . A A . 17 LEU HB3 1 1 16 6841 1 1 17 LEU HD11 H -6.621 -0.659 -4.565 1.00 . A A . 17 LEU HD11 1 1 16 6842 1 1 17 LEU HD12 H -6.304 -2.375 -4.817 1.00 . A A . 17 LEU HD12 1 1 16 6843 1 1 17 LEU HD13 H -6.121 -1.671 -3.210 1.00 . A A . 17 LEU HD13 1 1 16 6844 1 1 17 LEU HD21 H -4.191 -2.753 -5.980 1.00 . A A . 17 LEU HD21 1 1 16 6845 1 1 17 LEU HD22 H -2.756 -2.225 -5.100 1.00 . A A . 17 LEU HD22 1 1 16 6846 1 1 17 LEU HD23 H -3.968 -3.221 -4.294 1.00 . A A . 17 LEU HD23 1 1 16 6847 1 1 17 LEU HG H -4.085 -0.827 -3.662 1.00 . A A . 17 LEU HG 1 1 16 6848 1 1 17 LEU N N -2.928 1.387 -4.401 1.00 . A A . 17 LEU N 1 1 16 6849 1 1 17 LEU O O -5.174 1.896 -2.983 1.00 . A A . 17 LEU O 1 1 16 6850 1 1 18 ALA C C -7.434 3.526 -3.167 1.00 . A A . 18 ALA C 1 1 16 6851 1 1 18 ALA CA C -7.719 2.281 -4.015 1.00 . A A . 18 ALA CA 1 1 16 6852 1 1 18 ALA CB C -8.193 1.115 -3.156 1.00 . A A . 18 ALA CB 1 1 16 6853 1 1 18 ALA H H -6.618 1.746 -5.741 1.00 . A A . 18 ALA H 1 1 16 6854 1 1 18 ALA HA H -8.503 2.516 -4.722 1.00 . A A . 18 ALA HA 1 1 16 6855 1 1 18 ALA HB1 H -8.352 0.248 -3.781 1.00 . A A . 18 ALA HB1 1 1 16 6856 1 1 18 ALA HB2 H -9.119 1.381 -2.667 1.00 . A A . 18 ALA HB2 1 1 16 6857 1 1 18 ALA HB3 H -7.444 0.889 -2.412 1.00 . A A . 18 ALA HB3 1 1 16 6858 1 1 18 ALA N N -6.538 1.892 -4.775 1.00 . A A . 18 ALA N 1 1 16 6859 1 1 18 ALA O O -7.001 4.550 -3.696 1.00 . A A . 18 ALA O 1 1 16 6860 1 1 19 GLU C C -6.454 4.178 0.144 1.00 . A A . 19 GLU C 1 1 16 6861 1 1 19 GLU CA C -7.422 4.569 -0.971 1.00 . A A . 19 GLU CA 1 1 16 6862 1 1 19 GLU CB C -8.742 5.075 -0.379 1.00 . A A . 19 GLU CB 1 1 16 6863 1 1 19 GLU CD C -8.301 7.554 -0.586 1.00 . A A . 19 GLU CD 1 1 16 6864 1 1 19 GLU CG C -9.205 6.398 -0.969 1.00 . A A . 19 GLU CG 1 1 16 6865 1 1 19 GLU H H -8.009 2.606 -1.481 1.00 . A A . 19 GLU H 1 1 16 6866 1 1 19 GLU HA H -6.976 5.359 -1.556 1.00 . A A . 19 GLU HA 1 1 16 6867 1 1 19 GLU HB2 H -9.510 4.338 -0.563 1.00 . A A . 19 GLU HB2 1 1 16 6868 1 1 19 GLU HB3 H -8.626 5.202 0.686 1.00 . A A . 19 GLU HB3 1 1 16 6869 1 1 19 GLU HG2 H -9.217 6.313 -2.045 1.00 . A A . 19 GLU HG2 1 1 16 6870 1 1 19 GLU HG3 H -10.203 6.606 -0.614 1.00 . A A . 19 GLU HG3 1 1 16 6871 1 1 19 GLU N N -7.667 3.442 -1.858 1.00 . A A . 19 GLU N 1 1 16 6872 1 1 19 GLU O O -6.768 4.300 1.328 1.00 . A A . 19 GLU O 1 1 16 6873 1 1 19 GLU OE1 O -7.108 7.523 -0.952 1.00 . A A . 19 GLU OE1 1 1 16 6874 1 1 19 GLU OE2 O -8.788 8.491 0.082 1.00 . A A . 19 GLU OE2 1 1 16 6875 1 1 20 CYS C C -2.918 3.930 0.360 1.00 . A A . 20 CYS C 1 1 16 6876 1 1 20 CYS CA C -4.258 3.309 0.721 1.00 . A A . 20 CYS CA 1 1 16 6877 1 1 20 CYS CB C -4.140 1.783 0.768 1.00 . A A . 20 CYS CB 1 1 16 6878 1 1 20 CYS H H -5.068 3.639 -1.202 1.00 . A A . 20 CYS H 1 1 16 6879 1 1 20 CYS HA H -4.562 3.670 1.693 1.00 . A A . 20 CYS HA 1 1 16 6880 1 1 20 CYS HB2 H -4.629 1.365 -0.100 1.00 . A A . 20 CYS HB2 1 1 16 6881 1 1 20 CYS HB3 H -3.096 1.507 0.754 1.00 . A A . 20 CYS HB3 1 1 16 6882 1 1 20 CYS N N -5.270 3.710 -0.243 1.00 . A A . 20 CYS N 1 1 16 6883 1 1 20 CYS O O -2.842 4.786 -0.522 1.00 . A A . 20 CYS O 1 1 16 6884 1 1 20 CYS SG S -4.894 1.027 2.245 1.00 . A A . 20 CYS SG 1 1 16 6885 1 1 21 VAL C C 0.495 2.924 0.622 1.00 . A A . 21 VAL C 1 1 16 6886 1 1 21 VAL CA C -0.537 4.036 0.768 1.00 . A A . 21 VAL CA 1 1 16 6887 1 1 21 VAL CB C -0.082 5.016 1.871 1.00 . A A . 21 VAL CB 1 1 16 6888 1 1 21 VAL CG1 C -1.085 6.150 2.019 1.00 . A A . 21 VAL CG1 1 1 16 6889 1 1 21 VAL CG2 C 0.113 4.290 3.196 1.00 . A A . 21 VAL CG2 1 1 16 6890 1 1 21 VAL H H -1.977 2.821 1.731 1.00 . A A . 21 VAL H 1 1 16 6891 1 1 21 VAL HA H -0.587 4.583 -0.163 1.00 . A A . 21 VAL HA 1 1 16 6892 1 1 21 VAL HB H 0.867 5.444 1.574 1.00 . A A . 21 VAL HB 1 1 16 6893 1 1 21 VAL HG11 H -2.080 5.778 1.830 1.00 . A A . 21 VAL HG11 1 1 16 6894 1 1 21 VAL HG12 H -1.033 6.547 3.023 1.00 . A A . 21 VAL HG12 1 1 16 6895 1 1 21 VAL HG13 H -0.851 6.932 1.311 1.00 . A A . 21 VAL HG13 1 1 16 6896 1 1 21 VAL HG21 H 0.016 3.226 3.043 1.00 . A A . 21 VAL HG21 1 1 16 6897 1 1 21 VAL HG22 H 1.097 4.509 3.584 1.00 . A A . 21 VAL HG22 1 1 16 6898 1 1 21 VAL HG23 H -0.634 4.622 3.903 1.00 . A A . 21 VAL HG23 1 1 16 6899 1 1 21 VAL N N -1.862 3.504 1.038 1.00 . A A . 21 VAL N 1 1 16 6900 1 1 21 VAL O O 0.297 1.804 1.088 1.00 . A A . 21 VAL O 1 1 16 6901 1 1 22 CYS C C 3.801 2.552 0.766 1.00 . A A . 22 CYS C 1 1 16 6902 1 1 22 CYS CA C 2.693 2.325 -0.258 1.00 . A A . 22 CYS CA 1 1 16 6903 1 1 22 CYS CB C 3.247 2.491 -1.680 1.00 . A A . 22 CYS CB 1 1 16 6904 1 1 22 CYS H H 1.674 4.172 -0.364 1.00 . A A . 22 CYS H 1 1 16 6905 1 1 22 CYS HA H 2.307 1.323 -0.141 1.00 . A A . 22 CYS HA 1 1 16 6906 1 1 22 CYS HB2 H 3.258 3.537 -1.934 1.00 . A A . 22 CYS HB2 1 1 16 6907 1 1 22 CYS HB3 H 4.255 2.114 -1.721 1.00 . A A . 22 CYS HB3 1 1 16 6908 1 1 22 CYS N N 1.597 3.262 -0.028 1.00 . A A . 22 CYS N 1 1 16 6909 1 1 22 CYS O O 4.199 3.689 1.021 1.00 . A A . 22 CYS O 1 1 16 6910 1 1 22 CYS SG S 2.279 1.633 -2.960 1.00 . A A . 22 CYS SG 1 1 16 6911 1 1 23 LEU C C 6.703 1.232 1.780 1.00 . A A . 23 LEU C 1 1 16 6912 1 1 23 LEU CA C 5.333 1.553 2.370 1.00 . A A . 23 LEU CA 1 1 16 6913 1 1 23 LEU CB C 5.025 0.607 3.530 1.00 . A A . 23 LEU CB 1 1 16 6914 1 1 23 LEU CD1 C 3.167 -0.705 4.595 1.00 . A A . 23 LEU CD1 1 1 16 6915 1 1 23 LEU CD2 C 3.404 1.742 5.067 1.00 . A A . 23 LEU CD2 1 1 16 6916 1 1 23 LEU CG C 3.578 0.646 4.027 1.00 . A A . 23 LEU CG 1 1 16 6917 1 1 23 LEU H H 3.920 0.589 1.124 1.00 . A A . 23 LEU H 1 1 16 6918 1 1 23 LEU HA H 5.348 2.567 2.742 1.00 . A A . 23 LEU HA 1 1 16 6919 1 1 23 LEU HB2 H 5.250 -0.402 3.213 1.00 . A A . 23 LEU HB2 1 1 16 6920 1 1 23 LEU HB3 H 5.671 0.861 4.354 1.00 . A A . 23 LEU HB3 1 1 16 6921 1 1 23 LEU HD11 H 4.017 -1.371 4.593 1.00 . A A . 23 LEU HD11 1 1 16 6922 1 1 23 LEU HD12 H 2.811 -0.578 5.607 1.00 . A A . 23 LEU HD12 1 1 16 6923 1 1 23 LEU HD13 H 2.379 -1.125 3.988 1.00 . A A . 23 LEU HD13 1 1 16 6924 1 1 23 LEU HD21 H 3.768 2.678 4.668 1.00 . A A . 23 LEU HD21 1 1 16 6925 1 1 23 LEU HD22 H 2.358 1.840 5.316 1.00 . A A . 23 LEU HD22 1 1 16 6926 1 1 23 LEU HD23 H 3.963 1.488 5.955 1.00 . A A . 23 LEU HD23 1 1 16 6927 1 1 23 LEU HG H 2.925 0.869 3.194 1.00 . A A . 23 LEU HG 1 1 16 6928 1 1 23 LEU N N 4.284 1.467 1.360 1.00 . A A . 23 LEU N 1 1 16 6929 1 1 23 LEU O O 6.826 0.388 0.891 1.00 . A A . 23 LEU O 1 1 16 6930 1 1 24 GLU C C 9.527 0.266 1.931 1.00 . A A . 24 GLU C 1 1 16 6931 1 1 24 GLU CA C 9.095 1.725 1.814 1.00 . A A . 24 GLU CA 1 1 16 6932 1 1 24 GLU CB C 10.053 2.616 2.607 1.00 . A A . 24 GLU CB 1 1 16 6933 1 1 24 GLU CD C 10.901 3.314 4.882 1.00 . A A . 24 GLU CD 1 1 16 6934 1 1 24 GLU CG C 10.056 2.327 4.099 1.00 . A A . 24 GLU CG 1 1 16 6935 1 1 24 GLU H H 7.554 2.578 2.987 1.00 . A A . 24 GLU H 1 1 16 6936 1 1 24 GLU HA H 9.130 2.014 0.774 1.00 . A A . 24 GLU HA 1 1 16 6937 1 1 24 GLU HB2 H 11.055 2.470 2.232 1.00 . A A . 24 GLU HB2 1 1 16 6938 1 1 24 GLU HB3 H 9.771 3.648 2.463 1.00 . A A . 24 GLU HB3 1 1 16 6939 1 1 24 GLU HG2 H 9.042 2.377 4.465 1.00 . A A . 24 GLU HG2 1 1 16 6940 1 1 24 GLU HG3 H 10.448 1.333 4.259 1.00 . A A . 24 GLU HG3 1 1 16 6941 1 1 24 GLU N N 7.725 1.918 2.283 1.00 . A A . 24 GLU N 1 1 16 6942 1 1 24 GLU O O 10.076 -0.301 0.988 1.00 . A A . 24 GLU O 1 1 16 6943 1 1 24 GLU OE1 O 12.031 3.609 4.440 1.00 . A A . 24 GLU OE1 1 1 16 6944 1 1 24 GLU OE2 O 10.431 3.792 5.936 1.00 . A A . 24 GLU OE2 1 1 16 6945 1 1 25 HIS C C 9.089 -2.622 2.212 1.00 . A A . 25 HIS C 1 1 16 6946 1 1 25 HIS CA C 9.658 -1.734 3.312 1.00 . A A . 25 HIS CA 1 1 16 6947 1 1 25 HIS CB C 9.195 -2.238 4.689 1.00 . A A . 25 HIS CB 1 1 16 6948 1 1 25 HIS CD2 C 6.688 -1.819 5.220 1.00 . A A . 25 HIS CD2 1 1 16 6949 1 1 25 HIS CE1 C 6.909 0.046 6.350 1.00 . A A . 25 HIS CE1 1 1 16 6950 1 1 25 HIS CG C 8.007 -1.517 5.253 1.00 . A A . 25 HIS CG 1 1 16 6951 1 1 25 HIS H H 8.843 0.162 3.806 1.00 . A A . 25 HIS H 1 1 16 6952 1 1 25 HIS HA H 10.735 -1.788 3.267 1.00 . A A . 25 HIS HA 1 1 16 6953 1 1 25 HIS HB2 H 8.935 -3.282 4.609 1.00 . A A . 25 HIS HB2 1 1 16 6954 1 1 25 HIS HB3 H 10.010 -2.132 5.390 1.00 . A A . 25 HIS HB3 1 1 16 6955 1 1 25 HIS HD1 H 8.944 0.135 6.164 1.00 . A A . 25 HIS HD1 1 1 16 6956 1 1 25 HIS HD2 H 6.239 -2.677 4.740 1.00 . A A . 25 HIS HD2 1 1 16 6957 1 1 25 HIS HE1 H 6.684 0.932 6.924 1.00 . A A . 25 HIS HE1 1 1 16 6958 1 1 25 HIS HE2 H 5.083 -0.861 6.173 1.00 . A A . 25 HIS HE2 1 1 16 6959 1 1 25 HIS N N 9.282 -0.338 3.091 1.00 . A A . 25 HIS N 1 1 16 6960 1 1 25 HIS ND1 N 8.112 -0.342 5.966 1.00 . A A . 25 HIS ND1 1 1 16 6961 1 1 25 HIS NE2 N 6.027 -0.833 5.909 1.00 . A A . 25 HIS NE2 1 1 16 6962 1 1 25 HIS O O 9.643 -3.679 1.906 1.00 . A A . 25 HIS O 1 1 16 6963 1 1 26 GLY C C 6.032 -3.511 0.914 1.00 . A A . 26 GLY C 1 1 16 6964 1 1 26 GLY CA C 7.382 -2.932 0.538 1.00 . A A . 26 GLY CA 1 1 16 6965 1 1 26 GLY H H 7.604 -1.322 1.887 1.00 . A A . 26 GLY H 1 1 16 6966 1 1 26 GLY HA2 H 8.043 -3.740 0.260 1.00 . A A . 26 GLY HA2 1 1 16 6967 1 1 26 GLY HA3 H 7.255 -2.277 -0.309 1.00 . A A . 26 GLY HA3 1 1 16 6968 1 1 26 GLY N N 7.994 -2.177 1.610 1.00 . A A . 26 GLY N 1 1 16 6969 1 1 26 GLY O O 5.871 -4.730 0.972 1.00 . A A . 26 GLY O 1 1 16 6970 1 1 27 TYR C C 2.719 -1.919 1.412 1.00 . A A . 27 TYR C 1 1 16 6971 1 1 27 TYR CA C 3.713 -3.073 1.517 1.00 . A A . 27 TYR CA 1 1 16 6972 1 1 27 TYR CB C 3.697 -3.640 2.938 1.00 . A A . 27 TYR CB 1 1 16 6973 1 1 27 TYR CD1 C 3.714 -6.051 2.188 1.00 . A A . 27 TYR CD1 1 1 16 6974 1 1 27 TYR CD2 C 5.156 -5.418 3.977 1.00 . A A . 27 TYR CD2 1 1 16 6975 1 1 27 TYR CE1 C 4.171 -7.353 2.276 1.00 . A A . 27 TYR CE1 1 1 16 6976 1 1 27 TYR CE2 C 5.619 -6.717 4.070 1.00 . A A . 27 TYR CE2 1 1 16 6977 1 1 27 TYR CG C 4.197 -5.064 3.036 1.00 . A A . 27 TYR CG 1 1 16 6978 1 1 27 TYR CZ C 5.122 -7.681 3.217 1.00 . A A . 27 TYR CZ 1 1 16 6979 1 1 27 TYR H H 5.249 -1.679 1.084 1.00 . A A . 27 TYR H 1 1 16 6980 1 1 27 TYR HA H 3.419 -3.849 0.827 1.00 . A A . 27 TYR HA 1 1 16 6981 1 1 27 TYR HB2 H 4.322 -3.027 3.565 1.00 . A A . 27 TYR HB2 1 1 16 6982 1 1 27 TYR HB3 H 2.685 -3.616 3.315 1.00 . A A . 27 TYR HB3 1 1 16 6983 1 1 27 TYR HD1 H 2.967 -5.793 1.451 1.00 . A A . 27 TYR HD1 1 1 16 6984 1 1 27 TYR HD2 H 5.542 -4.662 4.643 1.00 . A A . 27 TYR HD2 1 1 16 6985 1 1 27 TYR HE1 H 3.782 -8.108 1.607 1.00 . A A . 27 TYR HE1 1 1 16 6986 1 1 27 TYR HE2 H 6.364 -6.973 4.808 1.00 . A A . 27 TYR HE2 1 1 16 6987 1 1 27 TYR HH H 6.500 -9.010 3.030 1.00 . A A . 27 TYR HH 1 1 16 6988 1 1 27 TYR N N 5.059 -2.638 1.155 1.00 . A A . 27 TYR N 1 1 16 6989 1 1 27 TYR O O 3.057 -0.770 1.692 1.00 . A A . 27 TYR O 1 1 16 6990 1 1 27 TYR OH O 5.581 -8.975 3.308 1.00 . A A . 27 TYR OH 1 1 16 6991 1 1 28 CYS C C -0.470 -1.223 2.087 1.00 . A A . 28 CYS C 1 1 16 6992 1 1 28 CYS CA C 0.448 -1.223 0.868 1.00 . A A . 28 CYS CA 1 1 16 6993 1 1 28 CYS CB C -0.378 -1.475 -0.398 1.00 . A A . 28 CYS CB 1 1 16 6994 1 1 28 CYS H H 1.286 -3.168 0.797 1.00 . A A . 28 CYS H 1 1 16 6995 1 1 28 CYS HA H 0.928 -0.260 0.790 1.00 . A A . 28 CYS HA 1 1 16 6996 1 1 28 CYS HB2 H -0.129 -2.449 -0.792 1.00 . A A . 28 CYS HB2 1 1 16 6997 1 1 28 CYS HB3 H -1.429 -1.455 -0.145 1.00 . A A . 28 CYS HB3 1 1 16 6998 1 1 28 CYS N N 1.492 -2.235 1.008 1.00 . A A . 28 CYS N 1 1 16 6999 1 1 28 CYS O O -1.183 -2.194 2.340 1.00 . A A . 28 CYS O 1 1 16 7000 1 1 28 CYS SG S -0.107 -0.258 -1.728 1.00 . A A . 28 CYS SG 1 1 16 7001 1 1 29 GLY C C -1.782 1.390 4.255 1.00 . A A . 29 GLY C 1 1 16 7002 1 1 29 GLY CA C -1.278 -0.022 4.023 1.00 . A A . 29 GLY CA 1 1 16 7003 1 1 29 GLY H H 0.144 0.615 2.589 1.00 . A A . 29 GLY H 1 1 16 7004 1 1 29 GLY HA2 H -0.703 -0.333 4.883 1.00 . A A . 29 GLY HA2 1 1 16 7005 1 1 29 GLY HA3 H -2.125 -0.681 3.913 1.00 . A A . 29 GLY HA3 1 1 16 7006 1 1 29 GLY N N -0.445 -0.128 2.839 1.00 . A A . 29 GLY N 1 1 16 7007 1 1 29 GLY O O -1.987 1.762 5.429 1.00 . A A . 29 GLY O 1 1 16 7008 1 1 29 GLY OXT O -1.971 2.123 3.262 1.00 . A A . 29 GLY OXT 1 1 17 7009 1 1 1 ARG C C -10.559 2.924 2.188 1.00 . A A . 1 ARG C 1 1 17 7010 1 1 1 ARG CA C -11.429 4.121 1.817 1.00 . A A . 1 ARG CA 1 1 17 7011 1 1 1 ARG CB C -11.389 4.360 0.307 1.00 . A A . 1 ARG CB 1 1 17 7012 1 1 1 ARG CD C -12.392 3.744 -1.914 1.00 . A A . 1 ARG CD 1 1 17 7013 1 1 1 ARG CG C -12.632 3.867 -0.418 1.00 . A A . 1 ARG CG 1 1 17 7014 1 1 1 ARG CZ C -12.963 2.212 -3.757 1.00 . A A . 1 ARG CZ 1 1 17 7015 1 1 1 ARG H1 H -10.780 5.115 3.498 1.00 . A A . 1 ARG H1 1 1 17 7016 1 1 1 ARG H2 H -10.095 5.674 2.028 1.00 . A A . 1 ARG H2 1 1 17 7017 1 1 1 ARG H3 H -11.719 6.066 2.425 1.00 . A A . 1 ARG H3 1 1 17 7018 1 1 1 ARG HA H -12.446 3.924 2.120 1.00 . A A . 1 ARG HA 1 1 17 7019 1 1 1 ARG HB2 H -11.289 5.419 0.124 1.00 . A A . 1 ARG HB2 1 1 17 7020 1 1 1 ARG HB3 H -10.532 3.850 -0.106 1.00 . A A . 1 ARG HB3 1 1 17 7021 1 1 1 ARG HD2 H -12.756 4.638 -2.398 1.00 . A A . 1 ARG HD2 1 1 17 7022 1 1 1 ARG HD3 H -11.330 3.648 -2.088 1.00 . A A . 1 ARG HD3 1 1 17 7023 1 1 1 ARG HE H -13.643 2.056 -1.887 1.00 . A A . 1 ARG HE 1 1 17 7024 1 1 1 ARG HG2 H -12.904 2.899 -0.027 1.00 . A A . 1 ARG HG2 1 1 17 7025 1 1 1 ARG HG3 H -13.436 4.567 -0.247 1.00 . A A . 1 ARG HG3 1 1 17 7026 1 1 1 ARG HH11 H -11.705 3.710 -4.272 1.00 . A A . 1 ARG HH11 1 1 17 7027 1 1 1 ARG HH12 H -12.123 2.619 -5.549 1.00 . A A . 1 ARG HH12 1 1 17 7028 1 1 1 ARG HH21 H -14.192 0.620 -3.566 1.00 . A A . 1 ARG HH21 1 1 17 7029 1 1 1 ARG HH22 H -13.534 0.864 -5.149 1.00 . A A . 1 ARG HH22 1 1 17 7030 1 1 1 ARG N N -10.964 5.355 2.505 1.00 . A A . 1 ARG N 1 1 17 7031 1 1 1 ARG NE N -13.073 2.585 -2.484 1.00 . A A . 1 ARG NE 1 1 17 7032 1 1 1 ARG NH1 N -12.201 2.904 -4.594 1.00 . A A . 1 ARG NH1 1 1 17 7033 1 1 1 ARG NH2 N -13.617 1.144 -4.193 1.00 . A A . 1 ARG NH2 1 1 17 7034 1 1 1 ARG O O -9.338 3.041 2.298 1.00 . A A . 1 ARG O 1 1 17 7035 1 1 2 VAL C C -9.932 -0.149 1.502 1.00 . A A . 2 VAL C 1 1 17 7036 1 1 2 VAL CA C -10.482 0.555 2.739 1.00 . A A . 2 VAL CA 1 1 17 7037 1 1 2 VAL CB C -11.391 -0.421 3.510 1.00 . A A . 2 VAL CB 1 1 17 7038 1 1 2 VAL CG1 C -11.840 0.197 4.827 1.00 . A A . 2 VAL CG1 1 1 17 7039 1 1 2 VAL CG2 C -12.591 -0.819 2.662 1.00 . A A . 2 VAL CG2 1 1 17 7040 1 1 2 VAL H H -12.170 1.745 2.278 1.00 . A A . 2 VAL H 1 1 17 7041 1 1 2 VAL HA H -9.657 0.828 3.381 1.00 . A A . 2 VAL HA 1 1 17 7042 1 1 2 VAL HB H -10.823 -1.312 3.733 1.00 . A A . 2 VAL HB 1 1 17 7043 1 1 2 VAL HG11 H -11.152 0.978 5.111 1.00 . A A . 2 VAL HG11 1 1 17 7044 1 1 2 VAL HG12 H -12.830 0.613 4.710 1.00 . A A . 2 VAL HG12 1 1 17 7045 1 1 2 VAL HG13 H -11.859 -0.564 5.593 1.00 . A A . 2 VAL HG13 1 1 17 7046 1 1 2 VAL HG21 H -12.697 -0.127 1.840 1.00 . A A . 2 VAL HG21 1 1 17 7047 1 1 2 VAL HG22 H -12.443 -1.817 2.276 1.00 . A A . 2 VAL HG22 1 1 17 7048 1 1 2 VAL HG23 H -13.486 -0.797 3.269 1.00 . A A . 2 VAL HG23 1 1 17 7049 1 1 2 VAL N N -11.196 1.774 2.379 1.00 . A A . 2 VAL N 1 1 17 7050 1 1 2 VAL O O -10.640 -0.326 0.510 1.00 . A A . 2 VAL O 1 1 17 7051 1 1 3 CYS C C -7.824 -2.717 0.771 1.00 . A A . 3 CYS C 1 1 17 7052 1 1 3 CYS CA C -8.021 -1.235 0.454 1.00 . A A . 3 CYS CA 1 1 17 7053 1 1 3 CYS CB C -6.674 -0.584 0.134 1.00 . A A . 3 CYS CB 1 1 17 7054 1 1 3 CYS H H -8.154 -0.381 2.386 1.00 . A A . 3 CYS H 1 1 17 7055 1 1 3 CYS HA H -8.667 -1.144 -0.405 1.00 . A A . 3 CYS HA 1 1 17 7056 1 1 3 CYS HB2 H -6.276 -1.023 -0.769 1.00 . A A . 3 CYS HB2 1 1 17 7057 1 1 3 CYS HB3 H -6.824 0.474 -0.024 1.00 . A A . 3 CYS HB3 1 1 17 7058 1 1 3 CYS N N -8.667 -0.549 1.567 1.00 . A A . 3 CYS N 1 1 17 7059 1 1 3 CYS O O -7.310 -3.065 1.834 1.00 . A A . 3 CYS O 1 1 17 7060 1 1 3 CYS SG S -5.420 -0.779 1.442 1.00 . A A . 3 CYS SG 1 1 17 7061 1 1 4 PRO C C -6.763 -5.456 0.668 1.00 . A A . 4 PRO C 1 1 17 7062 1 1 4 PRO CA C -8.097 -5.062 0.040 1.00 . A A . 4 PRO CA 1 1 17 7063 1 1 4 PRO CB C -8.194 -5.596 -1.385 1.00 . A A . 4 PRO CB 1 1 17 7064 1 1 4 PRO CD C -8.856 -3.291 -1.448 1.00 . A A . 4 PRO CD 1 1 17 7065 1 1 4 PRO CG C -9.101 -4.640 -2.078 1.00 . A A . 4 PRO CG 1 1 17 7066 1 1 4 PRO HA H -8.906 -5.462 0.633 1.00 . A A . 4 PRO HA 1 1 17 7067 1 1 4 PRO HB2 H -7.211 -5.609 -1.835 1.00 . A A . 4 PRO HB2 1 1 17 7068 1 1 4 PRO HB3 H -8.605 -6.594 -1.373 1.00 . A A . 4 PRO HB3 1 1 17 7069 1 1 4 PRO HD2 H -8.186 -2.706 -2.061 1.00 . A A . 4 PRO HD2 1 1 17 7070 1 1 4 PRO HD3 H -9.790 -2.767 -1.305 1.00 . A A . 4 PRO HD3 1 1 17 7071 1 1 4 PRO HG2 H -8.867 -4.609 -3.131 1.00 . A A . 4 PRO HG2 1 1 17 7072 1 1 4 PRO HG3 H -10.130 -4.938 -1.931 1.00 . A A . 4 PRO HG3 1 1 17 7073 1 1 4 PRO N N -8.232 -3.615 -0.148 1.00 . A A . 4 PRO N 1 1 17 7074 1 1 4 PRO O O -5.707 -4.967 0.266 1.00 . A A . 4 PRO O 1 1 17 7075 1 1 5 ARG C C -4.737 -7.619 1.395 1.00 . A A . 5 ARG C 1 1 17 7076 1 1 5 ARG CA C -5.616 -6.802 2.336 1.00 . A A . 5 ARG CA 1 1 17 7077 1 1 5 ARG CB C -5.986 -7.639 3.562 1.00 . A A . 5 ARG CB 1 1 17 7078 1 1 5 ARG CD C -5.682 -6.643 5.852 1.00 . A A . 5 ARG CD 1 1 17 7079 1 1 5 ARG CG C -6.630 -6.832 4.679 1.00 . A A . 5 ARG CG 1 1 17 7080 1 1 5 ARG CZ C -5.264 -7.663 8.057 1.00 . A A . 5 ARG CZ 1 1 17 7081 1 1 5 ARG H H -7.691 -6.698 1.931 1.00 . A A . 5 ARG H 1 1 17 7082 1 1 5 ARG HA H -5.066 -5.932 2.659 1.00 . A A . 5 ARG HA 1 1 17 7083 1 1 5 ARG HB2 H -6.679 -8.411 3.260 1.00 . A A . 5 ARG HB2 1 1 17 7084 1 1 5 ARG HB3 H -5.092 -8.103 3.950 1.00 . A A . 5 ARG HB3 1 1 17 7085 1 1 5 ARG HD2 H -4.679 -6.882 5.532 1.00 . A A . 5 ARG HD2 1 1 17 7086 1 1 5 ARG HD3 H -5.722 -5.611 6.168 1.00 . A A . 5 ARG HD3 1 1 17 7087 1 1 5 ARG HE H -6.888 -7.977 6.940 1.00 . A A . 5 ARG HE 1 1 17 7088 1 1 5 ARG HG2 H -6.907 -5.862 4.294 1.00 . A A . 5 ARG HG2 1 1 17 7089 1 1 5 ARG HG3 H -7.514 -7.351 5.021 1.00 . A A . 5 ARG HG3 1 1 17 7090 1 1 5 ARG HH11 H -3.796 -6.429 7.412 1.00 . A A . 5 ARG HH11 1 1 17 7091 1 1 5 ARG HH12 H -3.527 -7.158 8.960 1.00 . A A . 5 ARG HH12 1 1 17 7092 1 1 5 ARG HH21 H -6.537 -8.937 8.975 1.00 . A A . 5 ARG HH21 1 1 17 7093 1 1 5 ARG HH22 H -5.083 -8.581 9.847 1.00 . A A . 5 ARG HH22 1 1 17 7094 1 1 5 ARG N N -6.820 -6.344 1.655 1.00 . A A . 5 ARG N 1 1 17 7095 1 1 5 ARG NE N -6.034 -7.498 6.983 1.00 . A A . 5 ARG NE 1 1 17 7096 1 1 5 ARG NH1 N -4.101 -7.031 8.150 1.00 . A A . 5 ARG NH1 1 1 17 7097 1 1 5 ARG NH2 N -5.660 -8.458 9.040 1.00 . A A . 5 ARG NH2 1 1 17 7098 1 1 5 ARG O O -4.742 -8.849 1.434 1.00 . A A . 5 ARG O 1 1 17 7099 1 1 6 ILE C C -1.703 -6.961 -0.364 1.00 . A A . 6 ILE C 1 1 17 7100 1 1 6 ILE CA C -3.097 -7.579 -0.402 1.00 . A A . 6 ILE CA 1 1 17 7101 1 1 6 ILE CB C -3.654 -7.493 -1.838 1.00 . A A . 6 ILE CB 1 1 17 7102 1 1 6 ILE CD1 C -3.044 -9.786 -2.763 1.00 . A A . 6 ILE CD1 1 1 17 7103 1 1 6 ILE CG1 C -2.777 -8.296 -2.801 1.00 . A A . 6 ILE CG1 1 1 17 7104 1 1 6 ILE CG2 C -3.752 -6.042 -2.288 1.00 . A A . 6 ILE CG2 1 1 17 7105 1 1 6 ILE H H -4.027 -5.944 0.569 1.00 . A A . 6 ILE H 1 1 17 7106 1 1 6 ILE HA H -3.026 -8.621 -0.128 1.00 . A A . 6 ILE HA 1 1 17 7107 1 1 6 ILE HB H -4.650 -7.910 -1.839 1.00 . A A . 6 ILE HB 1 1 17 7108 1 1 6 ILE HD11 H -3.468 -10.051 -1.805 1.00 . A A . 6 ILE HD11 1 1 17 7109 1 1 6 ILE HD12 H -3.738 -10.048 -3.548 1.00 . A A . 6 ILE HD12 1 1 17 7110 1 1 6 ILE HD13 H -2.118 -10.322 -2.906 1.00 . A A . 6 ILE HD13 1 1 17 7111 1 1 6 ILE HG12 H -2.955 -7.955 -3.810 1.00 . A A . 6 ILE HG12 1 1 17 7112 1 1 6 ILE HG13 H -1.739 -8.138 -2.550 1.00 . A A . 6 ILE HG13 1 1 17 7113 1 1 6 ILE HG21 H -4.312 -5.477 -1.557 1.00 . A A . 6 ILE HG21 1 1 17 7114 1 1 6 ILE HG22 H -2.760 -5.626 -2.381 1.00 . A A . 6 ILE HG22 1 1 17 7115 1 1 6 ILE HG23 H -4.254 -5.994 -3.242 1.00 . A A . 6 ILE HG23 1 1 17 7116 1 1 6 ILE N N -3.984 -6.923 0.551 1.00 . A A . 6 ILE N 1 1 17 7117 1 1 6 ILE O O -1.549 -5.745 -0.476 1.00 . A A . 6 ILE O 1 1 17 7118 1 1 7 LEU C C 1.046 -6.532 -1.394 1.00 . A A . 7 LEU C 1 1 17 7119 1 1 7 LEU CA C 0.693 -7.342 -0.151 1.00 . A A . 7 LEU CA 1 1 17 7120 1 1 7 LEU CB C 1.646 -8.531 -0.016 1.00 . A A . 7 LEU CB 1 1 17 7121 1 1 7 LEU CD1 C 2.515 -10.462 1.324 1.00 . A A . 7 LEU CD1 1 1 17 7122 1 1 7 LEU CD2 C 1.419 -8.533 2.483 1.00 . A A . 7 LEU CD2 1 1 17 7123 1 1 7 LEU CG C 1.435 -9.396 1.228 1.00 . A A . 7 LEU CG 1 1 17 7124 1 1 7 LEU H H -0.876 -8.764 -0.120 1.00 . A A . 7 LEU H 1 1 17 7125 1 1 7 LEU HA H 0.797 -6.710 0.718 1.00 . A A . 7 LEU HA 1 1 17 7126 1 1 7 LEU HB2 H 1.530 -9.158 -0.889 1.00 . A A . 7 LEU HB2 1 1 17 7127 1 1 7 LEU HB3 H 2.657 -8.154 0.003 1.00 . A A . 7 LEU HB3 1 1 17 7128 1 1 7 LEU HD11 H 3.424 -10.097 0.869 1.00 . A A . 7 LEU HD11 1 1 17 7129 1 1 7 LEU HD12 H 2.701 -10.694 2.363 1.00 . A A . 7 LEU HD12 1 1 17 7130 1 1 7 LEU HD13 H 2.189 -11.353 0.809 1.00 . A A . 7 LEU HD13 1 1 17 7131 1 1 7 LEU HD21 H 1.778 -7.543 2.244 1.00 . A A . 7 LEU HD21 1 1 17 7132 1 1 7 LEU HD22 H 0.410 -8.468 2.861 1.00 . A A . 7 LEU HD22 1 1 17 7133 1 1 7 LEU HD23 H 2.057 -8.975 3.235 1.00 . A A . 7 LEU HD23 1 1 17 7134 1 1 7 LEU HG H 0.480 -9.896 1.153 1.00 . A A . 7 LEU HG 1 1 17 7135 1 1 7 LEU N N -0.689 -7.806 -0.204 1.00 . A A . 7 LEU N 1 1 17 7136 1 1 7 LEU O O 0.684 -6.903 -2.511 1.00 . A A . 7 LEU O 1 1 17 7137 1 1 8 LEU C C 3.316 -3.668 -1.898 1.00 . A A . 8 LEU C 1 1 17 7138 1 1 8 LEU CA C 2.152 -4.565 -2.303 1.00 . A A . 8 LEU CA 1 1 17 7139 1 1 8 LEU CB C 0.968 -3.713 -2.766 1.00 . A A . 8 LEU CB 1 1 17 7140 1 1 8 LEU CD1 C -0.220 -4.681 -4.750 1.00 . A A . 8 LEU CD1 1 1 17 7141 1 1 8 LEU CD2 C 0.329 -2.242 -4.693 1.00 . A A . 8 LEU CD2 1 1 17 7142 1 1 8 LEU CG C 0.780 -3.635 -4.282 1.00 . A A . 8 LEU CG 1 1 17 7143 1 1 8 LEU H H 2.013 -5.179 -0.279 1.00 . A A . 8 LEU H 1 1 17 7144 1 1 8 LEU HA H 2.468 -5.200 -3.116 1.00 . A A . 8 LEU HA 1 1 17 7145 1 1 8 LEU HB2 H 0.066 -4.123 -2.333 1.00 . A A . 8 LEU HB2 1 1 17 7146 1 1 8 LEU HB3 H 1.103 -2.710 -2.390 1.00 . A A . 8 LEU HB3 1 1 17 7147 1 1 8 LEU HD11 H -0.960 -4.840 -3.981 1.00 . A A . 8 LEU HD11 1 1 17 7148 1 1 8 LEU HD12 H -0.706 -4.336 -5.651 1.00 . A A . 8 LEU HD12 1 1 17 7149 1 1 8 LEU HD13 H 0.296 -5.608 -4.951 1.00 . A A . 8 LEU HD13 1 1 17 7150 1 1 8 LEU HD21 H 1.025 -1.510 -4.311 1.00 . A A . 8 LEU HD21 1 1 17 7151 1 1 8 LEU HD22 H 0.294 -2.177 -5.770 1.00 . A A . 8 LEU HD22 1 1 17 7152 1 1 8 LEU HD23 H -0.654 -2.048 -4.289 1.00 . A A . 8 LEU HD23 1 1 17 7153 1 1 8 LEU HG H 1.726 -3.837 -4.766 1.00 . A A . 8 LEU HG 1 1 17 7154 1 1 8 LEU N N 1.753 -5.425 -1.194 1.00 . A A . 8 LEU N 1 1 17 7155 1 1 8 LEU O O 3.170 -2.800 -1.040 1.00 . A A . 8 LEU O 1 1 17 7156 1 1 9 GLU C C 5.885 -2.019 -3.273 1.00 . A A . 9 GLU C 1 1 17 7157 1 1 9 GLU CA C 5.666 -3.107 -2.226 1.00 . A A . 9 GLU CA 1 1 17 7158 1 1 9 GLU CB C 6.892 -4.019 -2.164 1.00 . A A . 9 GLU CB 1 1 17 7159 1 1 9 GLU CD C 6.445 -6.320 -3.104 1.00 . A A . 9 GLU CD 1 1 17 7160 1 1 9 GLU CG C 7.023 -4.943 -3.364 1.00 . A A . 9 GLU CG 1 1 17 7161 1 1 9 GLU H H 4.520 -4.601 -3.194 1.00 . A A . 9 GLU H 1 1 17 7162 1 1 9 GLU HA H 5.526 -2.639 -1.263 1.00 . A A . 9 GLU HA 1 1 17 7163 1 1 9 GLU HB2 H 7.780 -3.407 -2.111 1.00 . A A . 9 GLU HB2 1 1 17 7164 1 1 9 GLU HB3 H 6.829 -4.627 -1.274 1.00 . A A . 9 GLU HB3 1 1 17 7165 1 1 9 GLU HG2 H 6.501 -4.503 -4.201 1.00 . A A . 9 GLU HG2 1 1 17 7166 1 1 9 GLU HG3 H 8.070 -5.048 -3.608 1.00 . A A . 9 GLU HG3 1 1 17 7167 1 1 9 GLU N N 4.470 -3.890 -2.522 1.00 . A A . 9 GLU N 1 1 17 7168 1 1 9 GLU O O 5.876 -2.289 -4.474 1.00 . A A . 9 GLU O 1 1 17 7169 1 1 9 GLU OE1 O 6.395 -6.731 -1.925 1.00 . A A . 9 GLU OE1 1 1 17 7170 1 1 9 GLU OE2 O 6.042 -6.989 -4.079 1.00 . A A . 9 GLU OE2 1 1 17 7171 1 1 10 CYS C C 7.048 1.465 -3.003 1.00 . A A . 10 CYS C 1 1 17 7172 1 1 10 CYS CA C 6.295 0.341 -3.709 1.00 . A A . 10 CYS CA 1 1 17 7173 1 1 10 CYS CB C 4.957 0.867 -4.247 1.00 . A A . 10 CYS CB 1 1 17 7174 1 1 10 CYS H H 6.069 -0.631 -1.841 1.00 . A A . 10 CYS H 1 1 17 7175 1 1 10 CYS HA H 6.892 -0.009 -4.538 1.00 . A A . 10 CYS HA 1 1 17 7176 1 1 10 CYS HB2 H 4.871 1.917 -4.013 1.00 . A A . 10 CYS HB2 1 1 17 7177 1 1 10 CYS HB3 H 4.938 0.742 -5.320 1.00 . A A . 10 CYS HB3 1 1 17 7178 1 1 10 CYS N N 6.077 -0.786 -2.809 1.00 . A A . 10 CYS N 1 1 17 7179 1 1 10 CYS O O 7.042 1.554 -1.776 1.00 . A A . 10 CYS O 1 1 17 7180 1 1 10 CYS SG S 3.487 0.030 -3.565 1.00 . A A . 10 CYS SG 1 1 17 7181 1 1 11 LYS C C 7.519 4.611 -2.920 1.00 . A A . 11 LYS C 1 1 17 7182 1 1 11 LYS CA C 8.447 3.443 -3.238 1.00 . A A . 11 LYS CA 1 1 17 7183 1 1 11 LYS CB C 9.530 3.888 -4.222 1.00 . A A . 11 LYS CB 1 1 17 7184 1 1 11 LYS CD C 11.879 3.457 -5.010 1.00 . A A . 11 LYS CD 1 1 17 7185 1 1 11 LYS CE C 13.106 2.654 -4.609 1.00 . A A . 11 LYS CE 1 1 17 7186 1 1 11 LYS CG C 10.603 2.838 -4.461 1.00 . A A . 11 LYS CG 1 1 17 7187 1 1 11 LYS H H 7.658 2.200 -4.759 1.00 . A A . 11 LYS H 1 1 17 7188 1 1 11 LYS HA H 8.916 3.111 -2.325 1.00 . A A . 11 LYS HA 1 1 17 7189 1 1 11 LYS HB2 H 9.067 4.120 -5.170 1.00 . A A . 11 LYS HB2 1 1 17 7190 1 1 11 LYS HB3 H 10.007 4.777 -3.837 1.00 . A A . 11 LYS HB3 1 1 17 7191 1 1 11 LYS HD2 H 11.817 3.489 -6.087 1.00 . A A . 11 LYS HD2 1 1 17 7192 1 1 11 LYS HD3 H 11.974 4.461 -4.622 1.00 . A A . 11 LYS HD3 1 1 17 7193 1 1 11 LYS HE2 H 13.978 3.106 -5.057 1.00 . A A . 11 LYS HE2 1 1 17 7194 1 1 11 LYS HE3 H 13.200 2.676 -3.534 1.00 . A A . 11 LYS HE3 1 1 17 7195 1 1 11 LYS HG2 H 10.828 2.347 -3.525 1.00 . A A . 11 LYS HG2 1 1 17 7196 1 1 11 LYS HG3 H 10.232 2.112 -5.169 1.00 . A A . 11 LYS HG3 1 1 17 7197 1 1 11 LYS HZ1 H 12.154 0.794 -4.670 1.00 . A A . 11 LYS HZ1 1 1 17 7198 1 1 11 LYS HZ2 H 12.972 1.192 -6.096 1.00 . A A . 11 LYS HZ2 1 1 17 7199 1 1 11 LYS HZ3 H 13.842 0.702 -4.730 1.00 . A A . 11 LYS HZ3 1 1 17 7200 1 1 11 LYS N N 7.693 2.322 -3.788 1.00 . A A . 11 LYS N 1 1 17 7201 1 1 11 LYS NZ N 13.012 1.237 -5.058 1.00 . A A . 11 LYS NZ 1 1 17 7202 1 1 11 LYS O O 7.426 5.049 -1.773 1.00 . A A . 11 LYS O 1 1 17 7203 1 1 12 LYS C C 4.558 5.719 -3.250 1.00 . A A . 12 LYS C 1 1 17 7204 1 1 12 LYS CA C 5.901 6.219 -3.771 1.00 . A A . 12 LYS CA 1 1 17 7205 1 1 12 LYS CB C 5.706 6.958 -5.095 1.00 . A A . 12 LYS CB 1 1 17 7206 1 1 12 LYS CD C 5.241 9.221 -6.083 1.00 . A A . 12 LYS CD 1 1 17 7207 1 1 12 LYS CE C 4.450 10.512 -5.949 1.00 . A A . 12 LYS CE 1 1 17 7208 1 1 12 LYS CG C 4.917 8.250 -4.959 1.00 . A A . 12 LYS CG 1 1 17 7209 1 1 12 LYS H H 6.941 4.711 -4.831 1.00 . A A . 12 LYS H 1 1 17 7210 1 1 12 LYS HA H 6.326 6.897 -3.047 1.00 . A A . 12 LYS HA 1 1 17 7211 1 1 12 LYS HB2 H 6.675 7.195 -5.509 1.00 . A A . 12 LYS HB2 1 1 17 7212 1 1 12 LYS HB3 H 5.180 6.310 -5.782 1.00 . A A . 12 LYS HB3 1 1 17 7213 1 1 12 LYS HD2 H 6.296 9.452 -6.054 1.00 . A A . 12 LYS HD2 1 1 17 7214 1 1 12 LYS HD3 H 4.999 8.757 -7.027 1.00 . A A . 12 LYS HD3 1 1 17 7215 1 1 12 LYS HE2 H 4.860 11.242 -6.631 1.00 . A A . 12 LYS HE2 1 1 17 7216 1 1 12 LYS HE3 H 3.420 10.316 -6.208 1.00 . A A . 12 LYS HE3 1 1 17 7217 1 1 12 LYS HG2 H 3.863 8.020 -4.989 1.00 . A A . 12 LYS HG2 1 1 17 7218 1 1 12 LYS HG3 H 5.161 8.711 -4.015 1.00 . A A . 12 LYS HG3 1 1 17 7219 1 1 12 LYS HZ1 H 5.496 11.220 -4.285 1.00 . A A . 12 LYS HZ1 1 1 17 7220 1 1 12 LYS HZ2 H 3.990 11.958 -4.514 1.00 . A A . 12 LYS HZ2 1 1 17 7221 1 1 12 LYS HZ3 H 4.077 10.386 -3.898 1.00 . A A . 12 LYS HZ3 1 1 17 7222 1 1 12 LYS N N 6.829 5.106 -3.942 1.00 . A A . 12 LYS N 1 1 17 7223 1 1 12 LYS NZ N 4.507 11.057 -4.564 1.00 . A A . 12 LYS NZ 1 1 17 7224 1 1 12 LYS O O 3.994 4.761 -3.781 1.00 . A A . 12 LYS O 1 1 17 7225 1 1 13 ASP C C 1.651 6.037 -2.629 1.00 . A A . 13 ASP C 1 1 17 7226 1 1 13 ASP CA C 2.781 5.968 -1.610 1.00 . A A . 13 ASP CA 1 1 17 7227 1 1 13 ASP CB C 2.451 6.837 -0.395 1.00 . A A . 13 ASP CB 1 1 17 7228 1 1 13 ASP CG C 3.592 6.895 0.602 1.00 . A A . 13 ASP CG 1 1 17 7229 1 1 13 ASP H H 4.550 7.112 -1.816 1.00 . A A . 13 ASP H 1 1 17 7230 1 1 13 ASP HA H 2.882 4.950 -1.291 1.00 . A A . 13 ASP HA 1 1 17 7231 1 1 13 ASP HB2 H 2.231 7.838 -0.722 1.00 . A A . 13 ASP HB2 1 1 17 7232 1 1 13 ASP HB3 H 1.585 6.429 0.102 1.00 . A A . 13 ASP HB3 1 1 17 7233 1 1 13 ASP N N 4.052 6.362 -2.202 1.00 . A A . 13 ASP N 1 1 17 7234 1 1 13 ASP O O 0.732 5.217 -2.605 1.00 . A A . 13 ASP O 1 1 17 7235 1 1 13 ASP OD1 O 4.739 7.146 0.176 1.00 . A A . 13 ASP OD1 1 1 17 7236 1 1 13 ASP OD2 O 3.339 6.689 1.807 1.00 . A A . 13 ASP OD2 1 1 17 7237 1 1 14 SER C C 0.531 5.898 -5.358 1.00 . A A . 14 SER C 1 1 17 7238 1 1 14 SER CA C 0.717 7.185 -4.559 1.00 . A A . 14 SER CA 1 1 17 7239 1 1 14 SER CB C 1.103 8.330 -5.497 1.00 . A A . 14 SER CB 1 1 17 7240 1 1 14 SER H H 2.489 7.630 -3.493 1.00 . A A . 14 SER H 1 1 17 7241 1 1 14 SER HA H -0.215 7.429 -4.073 1.00 . A A . 14 SER HA 1 1 17 7242 1 1 14 SER HB2 H 2.099 8.162 -5.878 1.00 . A A . 14 SER HB2 1 1 17 7243 1 1 14 SER HB3 H 0.405 8.369 -6.321 1.00 . A A . 14 SER HB3 1 1 17 7244 1 1 14 SER N N 1.728 7.013 -3.524 1.00 . A A . 14 SER N 1 1 17 7245 1 1 14 SER O O -0.571 5.589 -5.812 1.00 . A A . 14 SER O 1 1 17 7246 1 1 14 SER OG O 1.078 9.575 -4.820 1.00 . A A . 14 SER OG 1 1 17 7247 1 1 15 ASP C C 0.506 2.965 -5.772 1.00 . A A . 15 ASP C 1 1 17 7248 1 1 15 ASP CA C 1.592 3.907 -6.285 1.00 . A A . 15 ASP CA 1 1 17 7249 1 1 15 ASP CB C 2.955 3.217 -6.217 1.00 . A A . 15 ASP CB 1 1 17 7250 1 1 15 ASP CG C 3.213 2.327 -7.417 1.00 . A A . 15 ASP CG 1 1 17 7251 1 1 15 ASP H H 2.473 5.457 -5.146 1.00 . A A . 15 ASP H 1 1 17 7252 1 1 15 ASP HA H 1.379 4.151 -7.315 1.00 . A A . 15 ASP HA 1 1 17 7253 1 1 15 ASP HB2 H 3.731 3.967 -6.176 1.00 . A A . 15 ASP HB2 1 1 17 7254 1 1 15 ASP HB3 H 3.001 2.610 -5.325 1.00 . A A . 15 ASP HB3 1 1 17 7255 1 1 15 ASP N N 1.622 5.156 -5.534 1.00 . A A . 15 ASP N 1 1 17 7256 1 1 15 ASP O O -0.087 2.213 -6.547 1.00 . A A . 15 ASP O 1 1 17 7257 1 1 15 ASP OD1 O 2.233 1.910 -8.068 1.00 . A A . 15 ASP OD1 1 1 17 7258 1 1 15 ASP OD2 O 4.396 2.048 -7.706 1.00 . A A . 15 ASP OD2 1 1 17 7259 1 1 16 CYS C C -2.043 2.128 -4.638 1.00 . A A . 16 CYS C 1 1 17 7260 1 1 16 CYS CA C -0.739 2.118 -3.852 1.00 . A A . 16 CYS CA 1 1 17 7261 1 1 16 CYS CB C -1.009 2.521 -2.397 1.00 . A A . 16 CYS CB 1 1 17 7262 1 1 16 CYS H H 0.778 3.600 -3.894 1.00 . A A . 16 CYS H 1 1 17 7263 1 1 16 CYS HA H -0.343 1.114 -3.865 1.00 . A A . 16 CYS HA 1 1 17 7264 1 1 16 CYS HB2 H -0.126 2.959 -1.989 1.00 . A A . 16 CYS HB2 1 1 17 7265 1 1 16 CYS HB3 H -1.799 3.252 -2.373 1.00 . A A . 16 CYS HB3 1 1 17 7266 1 1 16 CYS N N 0.263 2.991 -4.463 1.00 . A A . 16 CYS N 1 1 17 7267 1 1 16 CYS O O -2.231 2.930 -5.552 1.00 . A A . 16 CYS O 1 1 17 7268 1 1 16 CYS SG S -1.488 1.138 -1.306 1.00 . A A . 16 CYS SG 1 1 17 7269 1 1 17 LEU C C -5.334 1.650 -4.019 1.00 . A A . 17 LEU C 1 1 17 7270 1 1 17 LEU CA C -4.232 1.108 -4.918 1.00 . A A . 17 LEU CA 1 1 17 7271 1 1 17 LEU CB C -4.517 -0.352 -5.275 1.00 . A A . 17 LEU CB 1 1 17 7272 1 1 17 LEU CD1 C -5.916 -1.821 -3.794 1.00 . A A . 17 LEU CD1 1 1 17 7273 1 1 17 LEU CD2 C -3.574 -2.492 -4.361 1.00 . A A . 17 LEU CD2 1 1 17 7274 1 1 17 LEU CG C -4.509 -1.322 -4.089 1.00 . A A . 17 LEU CG 1 1 17 7275 1 1 17 LEU H H -2.714 0.623 -3.525 1.00 . A A . 17 LEU H 1 1 17 7276 1 1 17 LEU HA H -4.201 1.693 -5.825 1.00 . A A . 17 LEU HA 1 1 17 7277 1 1 17 LEU HB2 H -5.488 -0.400 -5.750 1.00 . A A . 17 LEU HB2 1 1 17 7278 1 1 17 LEU HB3 H -3.773 -0.679 -5.985 1.00 . A A . 17 LEU HB3 1 1 17 7279 1 1 17 LEU HD11 H -6.387 -2.133 -4.715 1.00 . A A . 17 LEU HD11 1 1 17 7280 1 1 17 LEU HD12 H -5.866 -2.657 -3.114 1.00 . A A . 17 LEU HD12 1 1 17 7281 1 1 17 LEU HD13 H -6.494 -1.026 -3.346 1.00 . A A . 17 LEU HD13 1 1 17 7282 1 1 17 LEU HD21 H -2.614 -2.117 -4.684 1.00 . A A . 17 LEU HD21 1 1 17 7283 1 1 17 LEU HD22 H -3.450 -3.070 -3.457 1.00 . A A . 17 LEU HD22 1 1 17 7284 1 1 17 LEU HD23 H -3.996 -3.117 -5.132 1.00 . A A . 17 LEU HD23 1 1 17 7285 1 1 17 LEU HG H -4.151 -0.803 -3.213 1.00 . A A . 17 LEU HG 1 1 17 7286 1 1 17 LEU N N -2.935 1.226 -4.265 1.00 . A A . 17 LEU N 1 1 17 7287 1 1 17 LEU O O -5.144 1.798 -2.811 1.00 . A A . 17 LEU O 1 1 17 7288 1 1 18 ALA C C -7.165 3.659 -2.986 1.00 . A A . 18 ALA C 1 1 17 7289 1 1 18 ALA CA C -7.611 2.478 -3.850 1.00 . A A . 18 ALA CA 1 1 17 7290 1 1 18 ALA CB C -8.227 1.374 -2.999 1.00 . A A . 18 ALA CB 1 1 17 7291 1 1 18 ALA H H -6.580 1.812 -5.575 1.00 . A A . 18 ALA H 1 1 17 7292 1 1 18 ALA HA H -8.357 2.819 -4.553 1.00 . A A . 18 ALA HA 1 1 17 7293 1 1 18 ALA HB1 H -8.073 0.420 -3.480 1.00 . A A . 18 ALA HB1 1 1 17 7294 1 1 18 ALA HB2 H -7.758 1.366 -2.026 1.00 . A A . 18 ALA HB2 1 1 17 7295 1 1 18 ALA HB3 H -9.286 1.555 -2.886 1.00 . A A . 18 ALA HB3 1 1 17 7296 1 1 18 ALA N N -6.486 1.948 -4.610 1.00 . A A . 18 ALA N 1 1 17 7297 1 1 18 ALA O O -6.282 4.421 -3.383 1.00 . A A . 18 ALA O 1 1 17 7298 1 1 19 GLU C C -6.441 4.426 0.166 1.00 . A A . 19 GLU C 1 1 17 7299 1 1 19 GLU CA C -7.407 4.903 -0.915 1.00 . A A . 19 GLU CA 1 1 17 7300 1 1 19 GLU CB C -8.662 5.497 -0.273 1.00 . A A . 19 GLU CB 1 1 17 7301 1 1 19 GLU CD C -8.810 7.938 -0.911 1.00 . A A . 19 GLU CD 1 1 17 7302 1 1 19 GLU CG C -8.490 6.937 0.182 1.00 . A A . 19 GLU CG 1 1 17 7303 1 1 19 GLU H H -8.461 3.179 -1.537 1.00 . A A . 19 GLU H 1 1 17 7304 1 1 19 GLU HA H -6.920 5.666 -1.504 1.00 . A A . 19 GLU HA 1 1 17 7305 1 1 19 GLU HB2 H -9.470 5.464 -0.990 1.00 . A A . 19 GLU HB2 1 1 17 7306 1 1 19 GLU HB3 H -8.931 4.900 0.586 1.00 . A A . 19 GLU HB3 1 1 17 7307 1 1 19 GLU HG2 H -9.149 7.118 1.018 1.00 . A A . 19 GLU HG2 1 1 17 7308 1 1 19 GLU HG3 H -7.465 7.082 0.494 1.00 . A A . 19 GLU HG3 1 1 17 7309 1 1 19 GLU N N -7.766 3.812 -1.810 1.00 . A A . 19 GLU N 1 1 17 7310 1 1 19 GLU O O -6.730 4.529 1.359 1.00 . A A . 19 GLU O 1 1 17 7311 1 1 19 GLU OE1 O -10.006 8.239 -1.107 1.00 . A A . 19 GLU OE1 1 1 17 7312 1 1 19 GLU OE2 O -7.865 8.418 -1.572 1.00 . A A . 19 GLU OE2 1 1 17 7313 1 1 20 CYS C C -2.924 4.020 0.334 1.00 . A A . 20 CYS C 1 1 17 7314 1 1 20 CYS CA C -4.282 3.433 0.685 1.00 . A A . 20 CYS CA 1 1 17 7315 1 1 20 CYS CB C -4.223 1.903 0.673 1.00 . A A . 20 CYS CB 1 1 17 7316 1 1 20 CYS H H -5.096 3.859 -1.217 1.00 . A A . 20 CYS H 1 1 17 7317 1 1 20 CYS HA H -4.564 3.768 1.672 1.00 . A A . 20 CYS HA 1 1 17 7318 1 1 20 CYS HB2 H -4.679 1.540 -0.236 1.00 . A A . 20 CYS HB2 1 1 17 7319 1 1 20 CYS HB3 H -3.190 1.589 0.702 1.00 . A A . 20 CYS HB3 1 1 17 7320 1 1 20 CYS N N -5.285 3.912 -0.253 1.00 . A A . 20 CYS N 1 1 17 7321 1 1 20 CYS O O -2.826 4.904 -0.517 1.00 . A A . 20 CYS O 1 1 17 7322 1 1 20 CYS SG S -5.083 1.119 2.075 1.00 . A A . 20 CYS SG 1 1 17 7323 1 1 21 VAL C C 0.472 2.909 0.571 1.00 . A A . 21 VAL C 1 1 17 7324 1 1 21 VAL CA C -0.539 4.040 0.724 1.00 . A A . 21 VAL CA 1 1 17 7325 1 1 21 VAL CB C -0.067 5.003 1.834 1.00 . A A . 21 VAL CB 1 1 17 7326 1 1 21 VAL CG1 C -1.070 6.130 2.022 1.00 . A A . 21 VAL CG1 1 1 17 7327 1 1 21 VAL CG2 C 0.155 4.257 3.142 1.00 . A A . 21 VAL CG2 1 1 17 7328 1 1 21 VAL H H -2.007 2.836 1.661 1.00 . A A . 21 VAL H 1 1 17 7329 1 1 21 VAL HA H -0.577 4.593 -0.202 1.00 . A A . 21 VAL HA 1 1 17 7330 1 1 21 VAL HB H 0.875 5.439 1.527 1.00 . A A . 21 VAL HB 1 1 17 7331 1 1 21 VAL HG11 H -1.670 6.231 1.129 1.00 . A A . 21 VAL HG11 1 1 17 7332 1 1 21 VAL HG12 H -1.711 5.905 2.861 1.00 . A A . 21 VAL HG12 1 1 17 7333 1 1 21 VAL HG13 H -0.543 7.054 2.208 1.00 . A A . 21 VAL HG13 1 1 17 7334 1 1 21 VAL HG21 H -0.507 3.404 3.186 1.00 . A A . 21 VAL HG21 1 1 17 7335 1 1 21 VAL HG22 H 1.179 3.921 3.196 1.00 . A A . 21 VAL HG22 1 1 17 7336 1 1 21 VAL HG23 H -0.052 4.917 3.972 1.00 . A A . 21 VAL HG23 1 1 17 7337 1 1 21 VAL N N -1.878 3.537 0.989 1.00 . A A . 21 VAL N 1 1 17 7338 1 1 21 VAL O O 0.256 1.789 1.033 1.00 . A A . 21 VAL O 1 1 17 7339 1 1 22 CYS C C 3.770 2.502 0.713 1.00 . A A . 22 CYS C 1 1 17 7340 1 1 22 CYS CA C 2.661 2.286 -0.312 1.00 . A A . 22 CYS CA 1 1 17 7341 1 1 22 CYS CB C 3.215 2.450 -1.736 1.00 . A A . 22 CYS CB 1 1 17 7342 1 1 22 CYS H H 1.668 4.146 -0.405 1.00 . A A . 22 CYS H 1 1 17 7343 1 1 22 CYS HA H 2.265 1.288 -0.197 1.00 . A A . 22 CYS HA 1 1 17 7344 1 1 22 CYS HB2 H 3.201 3.493 -1.999 1.00 . A A . 22 CYS HB2 1 1 17 7345 1 1 22 CYS HB3 H 4.232 2.098 -1.770 1.00 . A A . 22 CYS HB3 1 1 17 7346 1 1 22 CYS N N 1.578 3.235 -0.078 1.00 . A A . 22 CYS N 1 1 17 7347 1 1 22 CYS O O 4.156 3.637 0.991 1.00 . A A . 22 CYS O 1 1 17 7348 1 1 22 CYS SG S 2.273 1.555 -3.009 1.00 . A A . 22 CYS SG 1 1 17 7349 1 1 23 LEU C C 6.688 1.204 1.705 1.00 . A A . 23 LEU C 1 1 17 7350 1 1 23 LEU CA C 5.314 1.495 2.298 1.00 . A A . 23 LEU CA 1 1 17 7351 1 1 23 LEU CB C 5.020 0.523 3.440 1.00 . A A . 23 LEU CB 1 1 17 7352 1 1 23 LEU CD1 C 3.154 -0.702 4.588 1.00 . A A . 23 LEU CD1 1 1 17 7353 1 1 23 LEU CD2 C 3.595 1.700 5.135 1.00 . A A . 23 LEU CD2 1 1 17 7354 1 1 23 LEU CG C 3.618 0.640 4.042 1.00 . A A . 23 LEU CG 1 1 17 7355 1 1 23 LEU H H 3.911 0.534 1.037 1.00 . A A . 23 LEU H 1 1 17 7356 1 1 23 LEU HA H 5.313 2.502 2.690 1.00 . A A . 23 LEU HA 1 1 17 7357 1 1 23 LEU HB2 H 5.150 -0.484 3.071 1.00 . A A . 23 LEU HB2 1 1 17 7358 1 1 23 LEU HB3 H 5.740 0.698 4.225 1.00 . A A . 23 LEU HB3 1 1 17 7359 1 1 23 LEU HD11 H 3.971 -1.408 4.555 1.00 . A A . 23 LEU HD11 1 1 17 7360 1 1 23 LEU HD12 H 2.824 -0.583 5.611 1.00 . A A . 23 LEU HD12 1 1 17 7361 1 1 23 LEU HD13 H 2.335 -1.071 3.988 1.00 . A A . 23 LEU HD13 1 1 17 7362 1 1 23 LEU HD21 H 4.152 2.565 4.808 1.00 . A A . 23 LEU HD21 1 1 17 7363 1 1 23 LEU HD22 H 2.574 1.986 5.338 1.00 . A A . 23 LEU HD22 1 1 17 7364 1 1 23 LEU HD23 H 4.043 1.302 6.033 1.00 . A A . 23 LEU HD23 1 1 17 7365 1 1 23 LEU HG H 2.926 0.941 3.269 1.00 . A A . 23 LEU HG 1 1 17 7366 1 1 23 LEU N N 4.267 1.413 1.287 1.00 . A A . 23 LEU N 1 1 17 7367 1 1 23 LEU O O 6.832 0.359 0.821 1.00 . A A . 23 LEU O 1 1 17 7368 1 1 24 GLU C C 9.539 0.317 1.860 1.00 . A A . 24 GLU C 1 1 17 7369 1 1 24 GLU CA C 9.066 1.762 1.728 1.00 . A A . 24 GLU CA 1 1 17 7370 1 1 24 GLU CB C 10.004 2.690 2.504 1.00 . A A . 24 GLU CB 1 1 17 7371 1 1 24 GLU CD C 9.615 4.065 4.589 1.00 . A A . 24 GLU CD 1 1 17 7372 1 1 24 GLU CG C 9.776 2.674 4.008 1.00 . A A . 24 GLU CG 1 1 17 7373 1 1 24 GLU H H 7.506 2.582 2.900 1.00 . A A . 24 GLU H 1 1 17 7374 1 1 24 GLU HA H 9.087 2.039 0.685 1.00 . A A . 24 GLU HA 1 1 17 7375 1 1 24 GLU HB2 H 11.024 2.391 2.314 1.00 . A A . 24 GLU HB2 1 1 17 7376 1 1 24 GLU HB3 H 9.864 3.701 2.151 1.00 . A A . 24 GLU HB3 1 1 17 7377 1 1 24 GLU HG2 H 8.881 2.108 4.218 1.00 . A A . 24 GLU HG2 1 1 17 7378 1 1 24 GLU HG3 H 10.620 2.196 4.481 1.00 . A A . 24 GLU HG3 1 1 17 7379 1 1 24 GLU N N 7.694 1.922 2.199 1.00 . A A . 24 GLU N 1 1 17 7380 1 1 24 GLU O O 10.111 -0.241 0.924 1.00 . A A . 24 GLU O 1 1 17 7381 1 1 24 GLU OE1 O 8.994 4.919 3.923 1.00 . A A . 24 GLU OE1 1 1 17 7382 1 1 24 GLU OE2 O 10.111 4.300 5.712 1.00 . A A . 24 GLU OE2 1 1 17 7383 1 1 25 HIS C C 9.150 -2.587 2.180 1.00 . A A . 25 HIS C 1 1 17 7384 1 1 25 HIS CA C 9.718 -1.670 3.254 1.00 . A A . 25 HIS CA 1 1 17 7385 1 1 25 HIS CB C 9.297 -2.163 4.647 1.00 . A A . 25 HIS CB 1 1 17 7386 1 1 25 HIS CD2 C 6.771 -1.857 5.158 1.00 . A A . 25 HIS CD2 1 1 17 7387 1 1 25 HIS CE1 C 6.903 0.007 6.305 1.00 . A A . 25 HIS CE1 1 1 17 7388 1 1 25 HIS CG C 8.076 -1.498 5.204 1.00 . A A . 25 HIS CG 1 1 17 7389 1 1 25 HIS H H 8.846 0.205 3.733 1.00 . A A . 25 HIS H 1 1 17 7390 1 1 25 HIS HA H 10.796 -1.698 3.188 1.00 . A A . 25 HIS HA 1 1 17 7391 1 1 25 HIS HB2 H 9.097 -3.222 4.595 1.00 . A A . 25 HIS HB2 1 1 17 7392 1 1 25 HIS HB3 H 10.112 -1.993 5.337 1.00 . A A . 25 HIS HB3 1 1 17 7393 1 1 25 HIS HD1 H 8.933 0.186 6.135 1.00 . A A . 25 HIS HD1 1 1 17 7394 1 1 25 HIS HD2 H 6.363 -2.730 4.668 1.00 . A A . 25 HIS HD2 1 1 17 7395 1 1 25 HIS HE1 H 6.636 0.878 6.884 1.00 . A A . 25 HIS HE1 1 1 17 7396 1 1 25 HIS HE2 H 5.118 -0.972 6.100 1.00 . A A . 25 HIS HE2 1 1 17 7397 1 1 25 HIS N N 9.303 -0.287 3.023 1.00 . A A . 25 HIS N 1 1 17 7398 1 1 25 HIS ND1 N 8.124 -0.326 5.928 1.00 . A A . 25 HIS ND1 1 1 17 7399 1 1 25 HIS NE2 N 6.063 -0.905 5.851 1.00 . A A . 25 HIS NE2 1 1 17 7400 1 1 25 HIS O O 9.718 -3.638 1.882 1.00 . A A . 25 HIS O 1 1 17 7401 1 1 26 GLY C C 6.079 -3.546 0.941 1.00 . A A . 26 GLY C 1 1 17 7402 1 1 26 GLY CA C 7.419 -2.962 0.540 1.00 . A A . 26 GLY CA 1 1 17 7403 1 1 26 GLY H H 7.630 -1.324 1.858 1.00 . A A . 26 GLY H 1 1 17 7404 1 1 26 GLY HA2 H 8.086 -3.770 0.275 1.00 . A A . 26 GLY HA2 1 1 17 7405 1 1 26 GLY HA3 H 7.279 -2.330 -0.323 1.00 . A A . 26 GLY HA3 1 1 17 7406 1 1 26 GLY N N 8.033 -2.175 1.589 1.00 . A A . 26 GLY N 1 1 17 7407 1 1 26 GLY O O 5.928 -4.765 1.017 1.00 . A A . 26 GLY O 1 1 17 7408 1 1 27 TYR C C 2.764 -1.965 1.488 1.00 . A A . 27 TYR C 1 1 17 7409 1 1 27 TYR CA C 3.765 -3.114 1.572 1.00 . A A . 27 TYR CA 1 1 17 7410 1 1 27 TYR CB C 3.777 -3.684 2.992 1.00 . A A . 27 TYR CB 1 1 17 7411 1 1 27 TYR CD1 C 3.818 -6.073 2.175 1.00 . A A . 27 TYR CD1 1 1 17 7412 1 1 27 TYR CD2 C 5.167 -5.502 4.056 1.00 . A A . 27 TYR CD2 1 1 17 7413 1 1 27 TYR CE1 C 4.262 -7.381 2.250 1.00 . A A . 27 TYR CE1 1 1 17 7414 1 1 27 TYR CE2 C 5.615 -6.807 4.136 1.00 . A A . 27 TYR CE2 1 1 17 7415 1 1 27 TYR CG C 4.263 -5.113 3.076 1.00 . A A . 27 TYR CG 1 1 17 7416 1 1 27 TYR CZ C 5.160 -7.742 3.231 1.00 . A A . 27 TYR CZ 1 1 17 7417 1 1 27 TYR H H 5.285 -1.716 1.100 1.00 . A A . 27 TYR H 1 1 17 7418 1 1 27 TYR HA H 3.461 -3.891 0.887 1.00 . A A . 27 TYR HA 1 1 17 7419 1 1 27 TYR HB2 H 4.426 -3.080 3.604 1.00 . A A . 27 TYR HB2 1 1 17 7420 1 1 27 TYR HB3 H 2.775 -3.648 3.394 1.00 . A A . 27 TYR HB3 1 1 17 7421 1 1 27 TYR HD1 H 3.116 -5.787 1.408 1.00 . A A . 27 TYR HD1 1 1 17 7422 1 1 27 TYR HD2 H 5.522 -4.767 4.764 1.00 . A A . 27 TYR HD2 1 1 17 7423 1 1 27 TYR HE1 H 3.905 -8.112 1.541 1.00 . A A . 27 TYR HE1 1 1 17 7424 1 1 27 TYR HE2 H 6.319 -7.088 4.906 1.00 . A A . 27 TYR HE2 1 1 17 7425 1 1 27 TYR HH H 4.874 -9.640 3.136 1.00 . A A . 27 TYR HH 1 1 17 7426 1 1 27 TYR N N 5.103 -2.675 1.186 1.00 . A A . 27 TYR N 1 1 17 7427 1 1 27 TYR O O 3.091 -0.819 1.798 1.00 . A A . 27 TYR O 1 1 17 7428 1 1 27 TYR OH O 5.604 -9.042 3.308 1.00 . A A . 27 TYR OH 1 1 17 7429 1 1 28 CYS C C -0.436 -1.315 2.161 1.00 . A A . 28 CYS C 1 1 17 7430 1 1 28 CYS CA C 0.488 -1.277 0.947 1.00 . A A . 28 CYS CA 1 1 17 7431 1 1 28 CYS CB C -0.329 -1.509 -0.328 1.00 . A A . 28 CYS CB 1 1 17 7432 1 1 28 CYS H H 1.346 -3.211 0.836 1.00 . A A . 28 CYS H 1 1 17 7433 1 1 28 CYS HA H 0.957 -0.306 0.895 1.00 . A A . 28 CYS HA 1 1 17 7434 1 1 28 CYS HB2 H -0.072 -2.474 -0.738 1.00 . A A . 28 CYS HB2 1 1 17 7435 1 1 28 CYS HB3 H -1.381 -1.500 -0.081 1.00 . A A . 28 CYS HB3 1 1 17 7436 1 1 28 CYS N N 1.542 -2.281 1.070 1.00 . A A . 28 CYS N 1 1 17 7437 1 1 28 CYS O O -1.099 -2.321 2.418 1.00 . A A . 28 CYS O 1 1 17 7438 1 1 28 CYS SG S -0.055 -0.267 -1.632 1.00 . A A . 28 CYS SG 1 1 17 7439 1 1 29 GLY C C -2.496 0.795 3.895 1.00 . A A . 29 GLY C 1 1 17 7440 1 1 29 GLY CA C -1.319 -0.142 4.082 1.00 . A A . 29 GLY CA 1 1 17 7441 1 1 29 GLY H H 0.076 0.556 2.650 1.00 . A A . 29 GLY H 1 1 17 7442 1 1 29 GLY HA2 H -0.726 0.205 4.916 1.00 . A A . 29 GLY HA2 1 1 17 7443 1 1 29 GLY HA3 H -1.691 -1.130 4.305 1.00 . A A . 29 GLY HA3 1 1 17 7444 1 1 29 GLY N N -0.474 -0.214 2.904 1.00 . A A . 29 GLY N 1 1 17 7445 1 1 29 GLY O O -3.555 0.548 4.509 1.00 . A A . 29 GLY O 1 1 17 7446 1 1 29 GLY OXT O -2.359 1.776 3.134 1.00 . A A . 29 GLY OXT 1 1 18 7447 1 1 1 ARG C C -9.458 3.009 3.415 1.00 . A A . 1 ARG C 1 1 18 7448 1 1 1 ARG CA C -9.128 4.496 3.323 1.00 . A A . 1 ARG CA 1 1 18 7449 1 1 1 ARG CB C -8.226 4.913 4.487 1.00 . A A . 1 ARG CB 1 1 18 7450 1 1 1 ARG CD C -8.022 5.427 6.939 1.00 . A A . 1 ARG CD 1 1 18 7451 1 1 1 ARG CG C -8.937 4.932 5.830 1.00 . A A . 1 ARG CG 1 1 18 7452 1 1 1 ARG CZ C -7.953 5.343 9.400 1.00 . A A . 1 ARG CZ 1 1 18 7453 1 1 1 ARG H1 H -10.965 4.956 4.127 1.00 . A A . 1 ARG H1 1 1 18 7454 1 1 1 ARG H2 H -10.079 6.306 3.546 1.00 . A A . 1 ARG H2 1 1 18 7455 1 1 1 ARG H3 H -10.834 5.233 2.441 1.00 . A A . 1 ARG H3 1 1 18 7456 1 1 1 ARG HA H -8.617 4.687 2.392 1.00 . A A . 1 ARG HA 1 1 18 7457 1 1 1 ARG HB2 H -7.399 4.221 4.552 1.00 . A A . 1 ARG HB2 1 1 18 7458 1 1 1 ARG HB3 H -7.843 5.904 4.293 1.00 . A A . 1 ARG HB3 1 1 18 7459 1 1 1 ARG HD2 H -7.107 4.855 6.913 1.00 . A A . 1 ARG HD2 1 1 18 7460 1 1 1 ARG HD3 H -7.800 6.469 6.765 1.00 . A A . 1 ARG HD3 1 1 18 7461 1 1 1 ARG HE H -9.602 5.135 8.294 1.00 . A A . 1 ARG HE 1 1 18 7462 1 1 1 ARG HG2 H -9.794 5.587 5.765 1.00 . A A . 1 ARG HG2 1 1 18 7463 1 1 1 ARG HG3 H -9.266 3.930 6.066 1.00 . A A . 1 ARG HG3 1 1 18 7464 1 1 1 ARG HH11 H -6.158 5.649 8.521 1.00 . A A . 1 ARG HH11 1 1 18 7465 1 1 1 ARG HH12 H -6.137 5.587 10.251 1.00 . A A . 1 ARG HH12 1 1 18 7466 1 1 1 ARG HH21 H -9.576 5.053 10.570 1.00 . A A . 1 ARG HH21 1 1 18 7467 1 1 1 ARG HH22 H -8.077 5.248 11.415 1.00 . A A . 1 ARG HH22 1 1 18 7468 1 1 1 ARG N N -10.363 5.323 3.363 1.00 . A A . 1 ARG N 1 1 18 7469 1 1 1 ARG NE N -8.634 5.283 8.258 1.00 . A A . 1 ARG NE 1 1 18 7470 1 1 1 ARG NH1 N -6.642 5.543 9.390 1.00 . A A . 1 ARG NH1 1 1 18 7471 1 1 1 ARG NH2 N -8.587 5.203 10.557 1.00 . A A . 1 ARG NH2 1 1 18 7472 1 1 1 ARG O O -9.022 2.319 4.337 1.00 . A A . 1 ARG O 1 1 18 7473 1 1 2 VAL C C -9.940 0.377 1.277 1.00 . A A . 2 VAL C 1 1 18 7474 1 1 2 VAL CA C -10.623 1.117 2.423 1.00 . A A . 2 VAL CA 1 1 18 7475 1 1 2 VAL CB C -12.149 0.962 2.279 1.00 . A A . 2 VAL CB 1 1 18 7476 1 1 2 VAL CG1 C -12.559 -0.491 2.463 1.00 . A A . 2 VAL CG1 1 1 18 7477 1 1 2 VAL CG2 C -12.873 1.858 3.273 1.00 . A A . 2 VAL CG2 1 1 18 7478 1 1 2 VAL H H -10.550 3.120 1.744 1.00 . A A . 2 VAL H 1 1 18 7479 1 1 2 VAL HA H -10.323 0.667 3.358 1.00 . A A . 2 VAL HA 1 1 18 7480 1 1 2 VAL HB H -12.430 1.267 1.282 1.00 . A A . 2 VAL HB 1 1 18 7481 1 1 2 VAL HG11 H -11.823 -1.134 2.004 1.00 . A A . 2 VAL HG11 1 1 18 7482 1 1 2 VAL HG12 H -12.626 -0.716 3.518 1.00 . A A . 2 VAL HG12 1 1 18 7483 1 1 2 VAL HG13 H -13.521 -0.655 1.999 1.00 . A A . 2 VAL HG13 1 1 18 7484 1 1 2 VAL HG21 H -12.330 1.870 4.207 1.00 . A A . 2 VAL HG21 1 1 18 7485 1 1 2 VAL HG22 H -12.930 2.861 2.877 1.00 . A A . 2 VAL HG22 1 1 18 7486 1 1 2 VAL HG23 H -13.869 1.478 3.441 1.00 . A A . 2 VAL HG23 1 1 18 7487 1 1 2 VAL N N -10.233 2.521 2.452 1.00 . A A . 2 VAL N 1 1 18 7488 1 1 2 VAL O O -10.396 0.428 0.134 1.00 . A A . 2 VAL O 1 1 18 7489 1 1 3 CYS C C -7.971 -2.530 0.987 1.00 . A A . 3 CYS C 1 1 18 7490 1 1 3 CYS CA C -8.103 -1.061 0.582 1.00 . A A . 3 CYS CA 1 1 18 7491 1 1 3 CYS CB C -6.715 -0.445 0.374 1.00 . A A . 3 CYS CB 1 1 18 7492 1 1 3 CYS H H -8.532 -0.315 2.517 1.00 . A A . 3 CYS H 1 1 18 7493 1 1 3 CYS HA H -8.654 -1.002 -0.344 1.00 . A A . 3 CYS HA 1 1 18 7494 1 1 3 CYS HB2 H -6.280 -0.855 -0.524 1.00 . A A . 3 CYS HB2 1 1 18 7495 1 1 3 CYS HB3 H -6.820 0.624 0.261 1.00 . A A . 3 CYS HB3 1 1 18 7496 1 1 3 CYS N N -8.846 -0.310 1.589 1.00 . A A . 3 CYS N 1 1 18 7497 1 1 3 CYS O O -7.571 -2.836 2.110 1.00 . A A . 3 CYS O 1 1 18 7498 1 1 3 CYS SG S -5.544 -0.745 1.741 1.00 . A A . 3 CYS SG 1 1 18 7499 1 1 4 PRO C C -6.881 -5.295 0.974 1.00 . A A . 4 PRO C 1 1 18 7500 1 1 4 PRO CA C -8.216 -4.902 0.353 1.00 . A A . 4 PRO CA 1 1 18 7501 1 1 4 PRO CB C -8.360 -5.531 -1.032 1.00 . A A . 4 PRO CB 1 1 18 7502 1 1 4 PRO CD C -8.791 -3.196 -1.293 1.00 . A A . 4 PRO CD 1 1 18 7503 1 1 4 PRO CG C -9.184 -4.557 -1.799 1.00 . A A . 4 PRO CG 1 1 18 7504 1 1 4 PRO HA H -9.023 -5.235 0.989 1.00 . A A . 4 PRO HA 1 1 18 7505 1 1 4 PRO HB2 H -7.384 -5.661 -1.475 1.00 . A A . 4 PRO HB2 1 1 18 7506 1 1 4 PRO HB3 H -8.854 -6.487 -0.948 1.00 . A A . 4 PRO HB3 1 1 18 7507 1 1 4 PRO HD2 H -8.005 -2.778 -1.905 1.00 . A A . 4 PRO HD2 1 1 18 7508 1 1 4 PRO HD3 H -9.647 -2.538 -1.274 1.00 . A A . 4 PRO HD3 1 1 18 7509 1 1 4 PRO HG2 H -8.967 -4.643 -2.854 1.00 . A A . 4 PRO HG2 1 1 18 7510 1 1 4 PRO HG3 H -10.233 -4.737 -1.614 1.00 . A A . 4 PRO HG3 1 1 18 7511 1 1 4 PRO N N -8.304 -3.465 0.076 1.00 . A A . 4 PRO N 1 1 18 7512 1 1 4 PRO O O -5.877 -4.605 0.800 1.00 . A A . 4 PRO O 1 1 18 7513 1 1 5 ARG C C -4.785 -7.645 1.340 1.00 . A A . 5 ARG C 1 1 18 7514 1 1 5 ARG CA C -5.657 -6.890 2.338 1.00 . A A . 5 ARG CA 1 1 18 7515 1 1 5 ARG CB C -5.995 -7.792 3.529 1.00 . A A . 5 ARG CB 1 1 18 7516 1 1 5 ARG CD C -7.525 -9.602 4.368 1.00 . A A . 5 ARG CD 1 1 18 7517 1 1 5 ARG CG C -6.803 -9.027 3.160 1.00 . A A . 5 ARG CG 1 1 18 7518 1 1 5 ARG CZ C -9.919 -9.146 3.997 1.00 . A A . 5 ARG CZ 1 1 18 7519 1 1 5 ARG H H -7.704 -6.921 1.800 1.00 . A A . 5 ARG H 1 1 18 7520 1 1 5 ARG HA H -5.111 -6.030 2.694 1.00 . A A . 5 ARG HA 1 1 18 7521 1 1 5 ARG HB2 H -5.075 -8.117 3.992 1.00 . A A . 5 ARG HB2 1 1 18 7522 1 1 5 ARG HB3 H -6.563 -7.219 4.248 1.00 . A A . 5 ARG HB3 1 1 18 7523 1 1 5 ARG HD2 H -6.984 -10.469 4.715 1.00 . A A . 5 ARG HD2 1 1 18 7524 1 1 5 ARG HD3 H -7.547 -8.856 5.149 1.00 . A A . 5 ARG HD3 1 1 18 7525 1 1 5 ARG HE H -9.064 -10.944 3.868 1.00 . A A . 5 ARG HE 1 1 18 7526 1 1 5 ARG HG2 H -7.533 -8.759 2.411 1.00 . A A . 5 ARG HG2 1 1 18 7527 1 1 5 ARG HG3 H -6.135 -9.777 2.762 1.00 . A A . 5 ARG HG3 1 1 18 7528 1 1 5 ARG HH11 H -8.820 -7.513 4.457 1.00 . A A . 5 ARG HH11 1 1 18 7529 1 1 5 ARG HH12 H -10.506 -7.222 4.195 1.00 . A A . 5 ARG HH12 1 1 18 7530 1 1 5 ARG HH21 H -11.282 -10.562 3.523 1.00 . A A . 5 ARG HH21 1 1 18 7531 1 1 5 ARG HH22 H -11.904 -8.952 3.665 1.00 . A A . 5 ARG HH22 1 1 18 7532 1 1 5 ARG N N -6.875 -6.410 1.698 1.00 . A A . 5 ARG N 1 1 18 7533 1 1 5 ARG NE N -8.897 -9.996 4.050 1.00 . A A . 5 ARG NE 1 1 18 7534 1 1 5 ARG NH1 N -9.732 -7.854 4.235 1.00 . A A . 5 ARG NH1 1 1 18 7535 1 1 5 ARG NH2 N -11.135 -9.590 3.704 1.00 . A A . 5 ARG NH2 1 1 18 7536 1 1 5 ARG O O -4.773 -8.874 1.310 1.00 . A A . 5 ARG O 1 1 18 7537 1 1 6 ILE C C -1.782 -6.877 -0.417 1.00 . A A . 6 ILE C 1 1 18 7538 1 1 6 ILE CA C -3.178 -7.486 -0.482 1.00 . A A . 6 ILE CA 1 1 18 7539 1 1 6 ILE CB C -3.743 -7.299 -1.903 1.00 . A A . 6 ILE CB 1 1 18 7540 1 1 6 ILE CD1 C -5.437 -9.185 -1.684 1.00 . A A . 6 ILE CD1 1 1 18 7541 1 1 6 ILE CG1 C -5.214 -7.712 -1.948 1.00 . A A . 6 ILE CG1 1 1 18 7542 1 1 6 ILE CG2 C -2.929 -8.101 -2.908 1.00 . A A . 6 ILE CG2 1 1 18 7543 1 1 6 ILE H H -4.110 -5.919 0.593 1.00 . A A . 6 ILE H 1 1 18 7544 1 1 6 ILE HA H -3.107 -8.545 -0.281 1.00 . A A . 6 ILE HA 1 1 18 7545 1 1 6 ILE HB H -3.661 -6.255 -2.164 1.00 . A A . 6 ILE HB 1 1 18 7546 1 1 6 ILE HD11 H -4.644 -9.561 -1.056 1.00 . A A . 6 ILE HD11 1 1 18 7547 1 1 6 ILE HD12 H -6.387 -9.322 -1.185 1.00 . A A . 6 ILE HD12 1 1 18 7548 1 1 6 ILE HD13 H -5.442 -9.722 -2.620 1.00 . A A . 6 ILE HD13 1 1 18 7549 1 1 6 ILE HG12 H -5.762 -7.155 -1.203 1.00 . A A . 6 ILE HG12 1 1 18 7550 1 1 6 ILE HG13 H -5.615 -7.485 -2.926 1.00 . A A . 6 ILE HG13 1 1 18 7551 1 1 6 ILE HG21 H -1.880 -8.025 -2.664 1.00 . A A . 6 ILE HG21 1 1 18 7552 1 1 6 ILE HG22 H -3.233 -9.137 -2.870 1.00 . A A . 6 ILE HG22 1 1 18 7553 1 1 6 ILE HG23 H -3.098 -7.712 -3.900 1.00 . A A . 6 ILE HG23 1 1 18 7554 1 1 6 ILE N N -4.055 -6.894 0.521 1.00 . A A . 6 ILE N 1 1 18 7555 1 1 6 ILE O O -1.615 -5.664 -0.555 1.00 . A A . 6 ILE O 1 1 18 7556 1 1 7 LEU C C 1.016 -6.541 -1.396 1.00 . A A . 7 LEU C 1 1 18 7557 1 1 7 LEU CA C 0.602 -7.271 -0.121 1.00 . A A . 7 LEU CA 1 1 18 7558 1 1 7 LEU CB C 1.535 -8.458 0.123 1.00 . A A . 7 LEU CB 1 1 18 7559 1 1 7 LEU CD1 C 2.055 -10.543 1.414 1.00 . A A . 7 LEU CD1 1 1 18 7560 1 1 7 LEU CD2 C 1.569 -8.409 2.630 1.00 . A A . 7 LEU CD2 1 1 18 7561 1 1 7 LEU CG C 1.253 -9.250 1.401 1.00 . A A . 7 LEU CG 1 1 18 7562 1 1 7 LEU H H -0.978 -8.679 -0.103 1.00 . A A . 7 LEU H 1 1 18 7563 1 1 7 LEU HA H 0.678 -6.588 0.711 1.00 . A A . 7 LEU HA 1 1 18 7564 1 1 7 LEU HB2 H 1.454 -9.131 -0.718 1.00 . A A . 7 LEU HB2 1 1 18 7565 1 1 7 LEU HB3 H 2.549 -8.090 0.171 1.00 . A A . 7 LEU HB3 1 1 18 7566 1 1 7 LEU HD11 H 2.930 -10.429 0.792 1.00 . A A . 7 LEU HD11 1 1 18 7567 1 1 7 LEU HD12 H 2.359 -10.767 2.427 1.00 . A A . 7 LEU HD12 1 1 18 7568 1 1 7 LEU HD13 H 1.444 -11.348 1.035 1.00 . A A . 7 LEU HD13 1 1 18 7569 1 1 7 LEU HD21 H 1.692 -7.377 2.338 1.00 . A A . 7 LEU HD21 1 1 18 7570 1 1 7 LEU HD22 H 0.758 -8.489 3.338 1.00 . A A . 7 LEU HD22 1 1 18 7571 1 1 7 LEU HD23 H 2.481 -8.765 3.087 1.00 . A A . 7 LEU HD23 1 1 18 7572 1 1 7 LEU HG H 0.205 -9.509 1.432 1.00 . A A . 7 LEU HG 1 1 18 7573 1 1 7 LEU N N -0.782 -7.725 -0.206 1.00 . A A . 7 LEU N 1 1 18 7574 1 1 7 LEU O O 0.658 -6.949 -2.500 1.00 . A A . 7 LEU O 1 1 18 7575 1 1 8 LEU C C 3.369 -3.745 -1.966 1.00 . A A . 8 LEU C 1 1 18 7576 1 1 8 LEU CA C 2.234 -4.677 -2.375 1.00 . A A . 8 LEU CA 1 1 18 7577 1 1 8 LEU CB C 1.078 -3.867 -2.967 1.00 . A A . 8 LEU CB 1 1 18 7578 1 1 8 LEU CD1 C 0.050 -4.801 -5.056 1.00 . A A . 8 LEU CD1 1 1 18 7579 1 1 8 LEU CD2 C 0.717 -2.394 -4.965 1.00 . A A . 8 LEU CD2 1 1 18 7580 1 1 8 LEU CG C 1.050 -3.802 -4.497 1.00 . A A . 8 LEU CG 1 1 18 7581 1 1 8 LEU H H 2.030 -5.184 -0.327 1.00 . A A . 8 LEU H 1 1 18 7582 1 1 8 LEU HA H 2.600 -5.365 -3.121 1.00 . A A . 8 LEU HA 1 1 18 7583 1 1 8 LEU HB2 H 0.150 -4.306 -2.628 1.00 . A A . 8 LEU HB2 1 1 18 7584 1 1 8 LEU HB3 H 1.139 -2.859 -2.586 1.00 . A A . 8 LEU HB3 1 1 18 7585 1 1 8 LEU HD11 H -0.775 -4.911 -4.366 1.00 . A A . 8 LEU HD11 1 1 18 7586 1 1 8 LEU HD12 H -0.322 -4.445 -6.006 1.00 . A A . 8 LEU HD12 1 1 18 7587 1 1 8 LEU HD13 H 0.533 -5.757 -5.194 1.00 . A A . 8 LEU HD13 1 1 18 7588 1 1 8 LEU HD21 H -0.217 -2.079 -4.524 1.00 . A A . 8 LEU HD21 1 1 18 7589 1 1 8 LEU HD22 H 1.504 -1.718 -4.662 1.00 . A A . 8 LEU HD22 1 1 18 7590 1 1 8 LEU HD23 H 0.629 -2.383 -6.041 1.00 . A A . 8 LEU HD23 1 1 18 7591 1 1 8 LEU HG H 2.027 -4.060 -4.878 1.00 . A A . 8 LEU HG 1 1 18 7592 1 1 8 LEU N N 1.773 -5.461 -1.234 1.00 . A A . 8 LEU N 1 1 18 7593 1 1 8 LEU O O 3.190 -2.874 -1.114 1.00 . A A . 8 LEU O 1 1 18 7594 1 1 9 GLU C C 5.900 -2.028 -3.324 1.00 . A A . 9 GLU C 1 1 18 7595 1 1 9 GLU CA C 5.704 -3.118 -2.275 1.00 . A A . 9 GLU CA 1 1 18 7596 1 1 9 GLU CB C 6.956 -3.994 -2.199 1.00 . A A . 9 GLU CB 1 1 18 7597 1 1 9 GLU CD C 8.661 -4.815 -3.872 1.00 . A A . 9 GLU CD 1 1 18 7598 1 1 9 GLU CG C 7.204 -4.812 -3.456 1.00 . A A . 9 GLU CG 1 1 18 7599 1 1 9 GLU H H 4.612 -4.650 -3.245 1.00 . A A . 9 GLU H 1 1 18 7600 1 1 9 GLU HA H 5.543 -2.651 -1.316 1.00 . A A . 9 GLU HA 1 1 18 7601 1 1 9 GLU HB2 H 7.816 -3.361 -2.032 1.00 . A A . 9 GLU HB2 1 1 18 7602 1 1 9 GLU HB3 H 6.854 -4.674 -1.366 1.00 . A A . 9 GLU HB3 1 1 18 7603 1 1 9 GLU HG2 H 6.897 -5.831 -3.272 1.00 . A A . 9 GLU HG2 1 1 18 7604 1 1 9 GLU HG3 H 6.615 -4.399 -4.261 1.00 . A A . 9 GLU HG3 1 1 18 7605 1 1 9 GLU N N 4.535 -3.937 -2.578 1.00 . A A . 9 GLU N 1 1 18 7606 1 1 9 GLU O O 5.876 -2.298 -4.524 1.00 . A A . 9 GLU O 1 1 18 7607 1 1 9 GLU OE1 O 9.184 -3.732 -4.210 1.00 . A A . 9 GLU OE1 1 1 18 7608 1 1 9 GLU OE2 O 9.281 -5.899 -3.861 1.00 . A A . 9 GLU OE2 1 1 18 7609 1 1 10 CYS C C 7.075 1.446 -3.088 1.00 . A A . 10 CYS C 1 1 18 7610 1 1 10 CYS CA C 6.278 0.335 -3.765 1.00 . A A . 10 CYS CA 1 1 18 7611 1 1 10 CYS CB C 4.924 0.877 -4.239 1.00 . A A . 10 CYS CB 1 1 18 7612 1 1 10 CYS H H 6.086 -0.640 -1.895 1.00 . A A . 10 CYS H 1 1 18 7613 1 1 10 CYS HA H 6.833 -0.017 -4.621 1.00 . A A . 10 CYS HA 1 1 18 7614 1 1 10 CYS HB2 H 4.858 1.927 -3.994 1.00 . A A . 10 CYS HB2 1 1 18 7615 1 1 10 CYS HB3 H 4.855 0.760 -5.311 1.00 . A A . 10 CYS HB3 1 1 18 7616 1 1 10 CYS N N 6.086 -0.795 -2.863 1.00 . A A . 10 CYS N 1 1 18 7617 1 1 10 CYS O O 7.208 1.473 -1.864 1.00 . A A . 10 CYS O 1 1 18 7618 1 1 10 CYS SG S 3.479 0.048 -3.497 1.00 . A A . 10 CYS SG 1 1 18 7619 1 1 11 LYS C C 7.470 4.623 -2.944 1.00 . A A . 11 LYS C 1 1 18 7620 1 1 11 LYS CA C 8.383 3.480 -3.376 1.00 . A A . 11 LYS CA 1 1 18 7621 1 1 11 LYS CB C 9.371 3.972 -4.435 1.00 . A A . 11 LYS CB 1 1 18 7622 1 1 11 LYS CD C 11.101 2.753 -5.794 1.00 . A A . 11 LYS CD 1 1 18 7623 1 1 11 LYS CE C 10.394 1.455 -6.154 1.00 . A A . 11 LYS CE 1 1 18 7624 1 1 11 LYS CG C 10.703 3.238 -4.410 1.00 . A A . 11 LYS CG 1 1 18 7625 1 1 11 LYS H H 7.457 2.287 -4.860 1.00 . A A . 11 LYS H 1 1 18 7626 1 1 11 LYS HA H 8.934 3.130 -2.516 1.00 . A A . 11 LYS HA 1 1 18 7627 1 1 11 LYS HB2 H 8.928 3.840 -5.411 1.00 . A A . 11 LYS HB2 1 1 18 7628 1 1 11 LYS HB3 H 9.560 5.023 -4.273 1.00 . A A . 11 LYS HB3 1 1 18 7629 1 1 11 LYS HD2 H 10.836 3.507 -6.519 1.00 . A A . 11 LYS HD2 1 1 18 7630 1 1 11 LYS HD3 H 12.168 2.589 -5.814 1.00 . A A . 11 LYS HD3 1 1 18 7631 1 1 11 LYS HE2 H 9.518 1.353 -5.531 1.00 . A A . 11 LYS HE2 1 1 18 7632 1 1 11 LYS HE3 H 10.096 1.498 -7.190 1.00 . A A . 11 LYS HE3 1 1 18 7633 1 1 11 LYS HG2 H 11.465 3.910 -4.043 1.00 . A A . 11 LYS HG2 1 1 18 7634 1 1 11 LYS HG3 H 10.622 2.388 -3.749 1.00 . A A . 11 LYS HG3 1 1 18 7635 1 1 11 LYS HZ1 H 11.646 0.264 -4.979 1.00 . A A . 11 LYS HZ1 1 1 18 7636 1 1 11 LYS HZ2 H 10.734 -0.606 -6.107 1.00 . A A . 11 LYS HZ2 1 1 18 7637 1 1 11 LYS HZ3 H 12.070 0.297 -6.615 1.00 . A A . 11 LYS HZ3 1 1 18 7638 1 1 11 LYS N N 7.601 2.363 -3.893 1.00 . A A . 11 LYS N 1 1 18 7639 1 1 11 LYS NZ N 11.273 0.270 -5.949 1.00 . A A . 11 LYS NZ 1 1 18 7640 1 1 11 LYS O O 7.380 4.944 -1.759 1.00 . A A . 11 LYS O 1 1 18 7641 1 1 12 LYS C C 4.537 5.807 -3.145 1.00 . A A . 12 LYS C 1 1 18 7642 1 1 12 LYS CA C 5.882 6.333 -3.634 1.00 . A A . 12 LYS CA 1 1 18 7643 1 1 12 LYS CB C 5.685 7.192 -4.885 1.00 . A A . 12 LYS CB 1 1 18 7644 1 1 12 LYS CD C 5.568 9.702 -4.709 1.00 . A A . 12 LYS CD 1 1 18 7645 1 1 12 LYS CE C 5.327 10.545 -3.467 1.00 . A A . 12 LYS CE 1 1 18 7646 1 1 12 LYS CG C 4.785 8.397 -4.660 1.00 . A A . 12 LYS CG 1 1 18 7647 1 1 12 LYS H H 6.905 4.925 -4.837 1.00 . A A . 12 LYS H 1 1 18 7648 1 1 12 LYS HA H 6.323 6.940 -2.856 1.00 . A A . 12 LYS HA 1 1 18 7649 1 1 12 LYS HB2 H 6.649 7.544 -5.221 1.00 . A A . 12 LYS HB2 1 1 18 7650 1 1 12 LYS HB3 H 5.246 6.581 -5.660 1.00 . A A . 12 LYS HB3 1 1 18 7651 1 1 12 LYS HD2 H 6.622 9.477 -4.780 1.00 . A A . 12 LYS HD2 1 1 18 7652 1 1 12 LYS HD3 H 5.259 10.262 -5.579 1.00 . A A . 12 LYS HD3 1 1 18 7653 1 1 12 LYS HE2 H 5.889 11.462 -3.555 1.00 . A A . 12 LYS HE2 1 1 18 7654 1 1 12 LYS HE3 H 4.274 10.774 -3.402 1.00 . A A . 12 LYS HE3 1 1 18 7655 1 1 12 LYS HG2 H 4.028 8.416 -5.428 1.00 . A A . 12 LYS HG2 1 1 18 7656 1 1 12 LYS HG3 H 4.315 8.306 -3.691 1.00 . A A . 12 LYS HG3 1 1 18 7657 1 1 12 LYS HZ1 H 6.528 9.183 -2.434 1.00 . A A . 12 LYS HZ1 1 1 18 7658 1 1 12 LYS HZ2 H 6.067 10.526 -1.514 1.00 . A A . 12 LYS HZ2 1 1 18 7659 1 1 12 LYS HZ3 H 4.951 9.296 -1.834 1.00 . A A . 12 LYS HZ3 1 1 18 7660 1 1 12 LYS N N 6.793 5.230 -3.913 1.00 . A A . 12 LYS N 1 1 18 7661 1 1 12 LYS NZ N 5.747 9.838 -2.226 1.00 . A A . 12 LYS NZ 1 1 18 7662 1 1 12 LYS O O 3.973 4.885 -3.733 1.00 . A A . 12 LYS O 1 1 18 7663 1 1 13 ASP C C 1.645 6.023 -2.532 1.00 . A A . 13 ASP C 1 1 18 7664 1 1 13 ASP CA C 2.758 5.966 -1.496 1.00 . A A . 13 ASP CA 1 1 18 7665 1 1 13 ASP CB C 2.391 6.819 -0.279 1.00 . A A . 13 ASP CB 1 1 18 7666 1 1 13 ASP CG C 3.512 6.892 0.737 1.00 . A A . 13 ASP CG 1 1 18 7667 1 1 13 ASP H H 4.531 7.114 -1.631 1.00 . A A . 13 ASP H 1 1 18 7668 1 1 13 ASP HA H 2.873 4.947 -1.182 1.00 . A A . 13 ASP HA 1 1 18 7669 1 1 13 ASP HB2 H 2.157 7.819 -0.602 1.00 . A A . 13 ASP HB2 1 1 18 7670 1 1 13 ASP HB3 H 1.523 6.392 0.199 1.00 . A A . 13 ASP HB3 1 1 18 7671 1 1 13 ASP N N 4.032 6.390 -2.062 1.00 . A A . 13 ASP N 1 1 18 7672 1 1 13 ASP O O 0.743 5.185 -2.533 1.00 . A A . 13 ASP O 1 1 18 7673 1 1 13 ASP OD1 O 4.655 7.203 0.340 1.00 . A A . 13 ASP OD1 1 1 18 7674 1 1 13 ASP OD2 O 3.249 6.638 1.931 1.00 . A A . 13 ASP OD2 1 1 18 7675 1 1 14 SER C C 0.586 5.887 -5.288 1.00 . A A . 14 SER C 1 1 18 7676 1 1 14 SER CA C 0.728 7.170 -4.472 1.00 . A A . 14 SER CA 1 1 18 7677 1 1 14 SER CB C 1.112 8.332 -5.389 1.00 . A A . 14 SER CB 1 1 18 7678 1 1 14 SER H H 2.470 7.636 -3.368 1.00 . A A . 14 SER H 1 1 18 7679 1 1 14 SER HA H -0.220 7.391 -4.004 1.00 . A A . 14 SER HA 1 1 18 7680 1 1 14 SER HB2 H 1.420 9.175 -4.789 1.00 . A A . 14 SER HB2 1 1 18 7681 1 1 14 SER HB3 H 1.928 8.028 -6.029 1.00 . A A . 14 SER HB3 1 1 18 7682 1 1 14 SER N N 1.721 7.006 -3.418 1.00 . A A . 14 SER N 1 1 18 7683 1 1 14 SER O O -0.500 5.559 -5.767 1.00 . A A . 14 SER O 1 1 18 7684 1 1 14 SER OG O 0.019 8.725 -6.201 1.00 . A A . 14 SER OG 1 1 18 7685 1 1 15 ASP C C 0.613 2.974 -5.759 1.00 . A A . 15 ASP C 1 1 18 7686 1 1 15 ASP CA C 1.711 3.931 -6.216 1.00 . A A . 15 ASP CA 1 1 18 7687 1 1 15 ASP CB C 3.076 3.251 -6.094 1.00 . A A . 15 ASP CB 1 1 18 7688 1 1 15 ASP CG C 3.520 2.608 -7.392 1.00 . A A . 15 ASP CG 1 1 18 7689 1 1 15 ASP H H 2.533 5.489 -5.044 1.00 . A A . 15 ASP H 1 1 18 7690 1 1 15 ASP HA H 1.540 4.181 -7.251 1.00 . A A . 15 ASP HA 1 1 18 7691 1 1 15 ASP HB2 H 3.813 3.987 -5.808 1.00 . A A . 15 ASP HB2 1 1 18 7692 1 1 15 ASP HB3 H 3.023 2.486 -5.333 1.00 . A A . 15 ASP HB3 1 1 18 7693 1 1 15 ASP N N 1.697 5.172 -5.450 1.00 . A A . 15 ASP N 1 1 18 7694 1 1 15 ASP O O 0.057 2.226 -6.563 1.00 . A A . 15 ASP O 1 1 18 7695 1 1 15 ASP OD1 O 2.649 2.117 -8.140 1.00 . A A . 15 ASP OD1 1 1 18 7696 1 1 15 ASP OD2 O 4.740 2.594 -7.662 1.00 . A A . 15 ASP OD2 1 1 18 7697 1 1 16 CYS C C -1.985 2.147 -4.717 1.00 . A A . 16 CYS C 1 1 18 7698 1 1 16 CYS CA C -0.700 2.099 -3.902 1.00 . A A . 16 CYS CA 1 1 18 7699 1 1 16 CYS CB C -0.985 2.452 -2.437 1.00 . A A . 16 CYS CB 1 1 18 7700 1 1 16 CYS H H 0.804 3.592 -3.865 1.00 . A A . 16 CYS H 1 1 18 7701 1 1 16 CYS HA H -0.309 1.093 -3.944 1.00 . A A . 16 CYS HA 1 1 18 7702 1 1 16 CYS HB2 H -0.096 2.852 -1.999 1.00 . A A . 16 CYS HB2 1 1 18 7703 1 1 16 CYS HB3 H -1.758 3.200 -2.395 1.00 . A A . 16 CYS HB3 1 1 18 7704 1 1 16 CYS N N 0.319 2.984 -4.461 1.00 . A A . 16 CYS N 1 1 18 7705 1 1 16 CYS O O -2.127 2.960 -5.631 1.00 . A A . 16 CYS O 1 1 18 7706 1 1 16 CYS SG S -1.509 1.038 -1.406 1.00 . A A . 16 CYS SG 1 1 18 7707 1 1 17 LEU C C -5.331 1.648 -4.189 1.00 . A A . 17 LEU C 1 1 18 7708 1 1 17 LEU CA C -4.187 1.182 -5.080 1.00 . A A . 17 LEU CA 1 1 18 7709 1 1 17 LEU CB C -4.443 -0.250 -5.551 1.00 . A A . 17 LEU CB 1 1 18 7710 1 1 17 LEU CD1 C -5.974 -1.421 -3.946 1.00 . A A . 17 LEU CD1 1 1 18 7711 1 1 17 LEU CD2 C -4.012 -2.635 -4.912 1.00 . A A . 17 LEU CD2 1 1 18 7712 1 1 17 LEU CG C -4.538 -1.290 -4.434 1.00 . A A . 17 LEU CG 1 1 18 7713 1 1 17 LEU H H -2.724 0.643 -3.646 1.00 . A A . 17 LEU H 1 1 18 7714 1 1 17 LEU HA H -4.133 1.829 -5.943 1.00 . A A . 17 LEU HA 1 1 18 7715 1 1 17 LEU HB2 H -5.369 -0.263 -6.108 1.00 . A A . 17 LEU HB2 1 1 18 7716 1 1 17 LEU HB3 H -3.640 -0.539 -6.213 1.00 . A A . 17 LEU HB3 1 1 18 7717 1 1 17 LEU HD11 H -6.633 -1.531 -4.795 1.00 . A A . 17 LEU HD11 1 1 18 7718 1 1 17 LEU HD12 H -6.060 -2.288 -3.310 1.00 . A A . 17 LEU HD12 1 1 18 7719 1 1 17 LEU HD13 H -6.247 -0.536 -3.391 1.00 . A A . 17 LEU HD13 1 1 18 7720 1 1 17 LEU HD21 H -4.431 -2.863 -5.880 1.00 . A A . 17 LEU HD21 1 1 18 7721 1 1 17 LEU HD22 H -2.935 -2.594 -4.985 1.00 . A A . 17 LEU HD22 1 1 18 7722 1 1 17 LEU HD23 H -4.295 -3.403 -4.207 1.00 . A A . 17 LEU HD23 1 1 18 7723 1 1 17 LEU HG H -3.932 -0.969 -3.599 1.00 . A A . 17 LEU HG 1 1 18 7724 1 1 17 LEU N N -2.909 1.262 -4.381 1.00 . A A . 17 LEU N 1 1 18 7725 1 1 17 LEU O O -5.150 1.864 -2.991 1.00 . A A . 17 LEU O 1 1 18 7726 1 1 18 ALA C C -7.382 3.519 -3.253 1.00 . A A . 18 ALA C 1 1 18 7727 1 1 18 ALA CA C -7.686 2.243 -4.044 1.00 . A A . 18 ALA CA 1 1 18 7728 1 1 18 ALA CB C -8.180 1.124 -3.136 1.00 . A A . 18 ALA CB 1 1 18 7729 1 1 18 ALA H H -6.592 1.615 -5.742 1.00 . A A . 18 ALA H 1 1 18 7730 1 1 18 ALA HA H -8.466 2.459 -4.763 1.00 . A A . 18 ALA HA 1 1 18 7731 1 1 18 ALA HB1 H -8.367 0.237 -3.724 1.00 . A A . 18 ALA HB1 1 1 18 7732 1 1 18 ALA HB2 H -9.095 1.431 -2.649 1.00 . A A . 18 ALA HB2 1 1 18 7733 1 1 18 ALA HB3 H -7.430 0.908 -2.389 1.00 . A A . 18 ALA HB3 1 1 18 7734 1 1 18 ALA N N -6.511 1.801 -4.784 1.00 . A A . 18 ALA N 1 1 18 7735 1 1 18 ALA O O -6.932 4.511 -3.825 1.00 . A A . 18 ALA O 1 1 18 7736 1 1 19 GLU C C -6.418 4.295 0.044 1.00 . A A . 19 GLU C 1 1 18 7737 1 1 19 GLU CA C -7.357 4.658 -1.104 1.00 . A A . 19 GLU CA 1 1 18 7738 1 1 19 GLU CB C -8.668 5.224 -0.553 1.00 . A A . 19 GLU CB 1 1 18 7739 1 1 19 GLU CD C -9.244 7.202 0.908 1.00 . A A . 19 GLU CD 1 1 18 7740 1 1 19 GLU CG C -8.666 6.737 -0.414 1.00 . A A . 19 GLU CG 1 1 18 7741 1 1 19 GLU H H -7.975 2.684 -1.529 1.00 . A A . 19 GLU H 1 1 18 7742 1 1 19 GLU HA H -6.881 5.408 -1.718 1.00 . A A . 19 GLU HA 1 1 18 7743 1 1 19 GLU HB2 H -9.473 4.945 -1.217 1.00 . A A . 19 GLU HB2 1 1 18 7744 1 1 19 GLU HB3 H -8.851 4.794 0.420 1.00 . A A . 19 GLU HB3 1 1 18 7745 1 1 19 GLU HG2 H -7.648 7.091 -0.488 1.00 . A A . 19 GLU HG2 1 1 18 7746 1 1 19 GLU HG3 H -9.252 7.160 -1.216 1.00 . A A . 19 GLU HG3 1 1 18 7747 1 1 19 GLU N N -7.620 3.497 -1.942 1.00 . A A . 19 GLU N 1 1 18 7748 1 1 19 GLU O O -6.726 4.536 1.210 1.00 . A A . 19 GLU O 1 1 18 7749 1 1 19 GLU OE1 O -8.537 7.105 1.933 1.00 . A A . 19 GLU OE1 1 1 18 7750 1 1 19 GLU OE2 O -10.404 7.664 0.919 1.00 . A A . 19 GLU OE2 1 1 18 7751 1 1 20 CYS C C -2.929 3.932 0.367 1.00 . A A . 20 CYS C 1 1 18 7752 1 1 20 CYS CA C -4.287 3.334 0.706 1.00 . A A . 20 CYS CA 1 1 18 7753 1 1 20 CYS CB C -4.194 1.809 0.803 1.00 . A A . 20 CYS CB 1 1 18 7754 1 1 20 CYS H H -5.068 3.557 -1.243 1.00 . A A . 20 CYS H 1 1 18 7755 1 1 20 CYS HA H -4.612 3.728 1.658 1.00 . A A . 20 CYS HA 1 1 18 7756 1 1 20 CYS HB2 H -4.689 1.371 -0.051 1.00 . A A . 20 CYS HB2 1 1 18 7757 1 1 20 CYS HB3 H -3.154 1.515 0.798 1.00 . A A . 20 CYS HB3 1 1 18 7758 1 1 20 CYS N N -5.267 3.721 -0.295 1.00 . A A . 20 CYS N 1 1 18 7759 1 1 20 CYS O O -2.826 4.792 -0.509 1.00 . A A . 20 CYS O 1 1 18 7760 1 1 20 CYS SG S -4.961 1.116 2.304 1.00 . A A . 20 CYS SG 1 1 18 7761 1 1 21 VAL C C 0.470 2.878 0.655 1.00 . A A . 21 VAL C 1 1 18 7762 1 1 21 VAL CA C -0.553 3.998 0.809 1.00 . A A . 21 VAL CA 1 1 18 7763 1 1 21 VAL CB C -0.098 4.955 1.931 1.00 . A A . 21 VAL CB 1 1 18 7764 1 1 21 VAL CG1 C -1.104 6.080 2.111 1.00 . A A . 21 VAL CG1 1 1 18 7765 1 1 21 VAL CG2 C 0.103 4.199 3.237 1.00 . A A . 21 VAL CG2 1 1 18 7766 1 1 21 VAL H H -2.024 2.801 1.748 1.00 . A A . 21 VAL H 1 1 18 7767 1 1 21 VAL HA H -0.586 4.561 -0.113 1.00 . A A . 21 VAL HA 1 1 18 7768 1 1 21 VAL HB H 0.849 5.393 1.642 1.00 . A A . 21 VAL HB 1 1 18 7769 1 1 21 VAL HG11 H -2.085 5.663 2.281 1.00 . A A . 21 VAL HG11 1 1 18 7770 1 1 21 VAL HG12 H -0.819 6.686 2.959 1.00 . A A . 21 VAL HG12 1 1 18 7771 1 1 21 VAL HG13 H -1.123 6.692 1.221 1.00 . A A . 21 VAL HG13 1 1 18 7772 1 1 21 VAL HG21 H 0.800 3.389 3.081 1.00 . A A . 21 VAL HG21 1 1 18 7773 1 1 21 VAL HG22 H 0.495 4.872 3.985 1.00 . A A . 21 VAL HG22 1 1 18 7774 1 1 21 VAL HG23 H -0.843 3.800 3.571 1.00 . A A . 21 VAL HG23 1 1 18 7775 1 1 21 VAL N N -1.889 3.484 1.057 1.00 . A A . 21 VAL N 1 1 18 7776 1 1 21 VAL O O 0.263 1.753 1.111 1.00 . A A . 21 VAL O 1 1 18 7777 1 1 22 CYS C C 3.776 2.499 0.804 1.00 . A A . 22 CYS C 1 1 18 7778 1 1 22 CYS CA C 2.670 2.278 -0.224 1.00 . A A . 22 CYS CA 1 1 18 7779 1 1 22 CYS CB C 3.226 2.453 -1.645 1.00 . A A . 22 CYS CB 1 1 18 7780 1 1 22 CYS H H 1.658 4.129 -0.313 1.00 . A A . 22 CYS H 1 1 18 7781 1 1 22 CYS HA H 2.283 1.276 -0.114 1.00 . A A . 22 CYS HA 1 1 18 7782 1 1 22 CYS HB2 H 3.221 3.498 -1.898 1.00 . A A . 22 CYS HB2 1 1 18 7783 1 1 22 CYS HB3 H 4.241 2.094 -1.682 1.00 . A A . 22 CYS HB3 1 1 18 7784 1 1 22 CYS N N 1.576 3.216 0.010 1.00 . A A . 22 CYS N 1 1 18 7785 1 1 22 CYS O O 4.148 3.637 1.092 1.00 . A A . 22 CYS O 1 1 18 7786 1 1 22 CYS SG S 2.278 1.578 -2.928 1.00 . A A . 22 CYS SG 1 1 18 7787 1 1 23 LEU C C 6.711 1.223 1.771 1.00 . A A . 23 LEU C 1 1 18 7788 1 1 23 LEU CA C 5.337 1.493 2.374 1.00 . A A . 23 LEU CA 1 1 18 7789 1 1 23 LEU CB C 5.057 0.504 3.506 1.00 . A A . 23 LEU CB 1 1 18 7790 1 1 23 LEU CD1 C 3.229 -0.848 4.571 1.00 . A A . 23 LEU CD1 1 1 18 7791 1 1 23 LEU CD2 C 3.477 1.579 5.129 1.00 . A A . 23 LEU CD2 1 1 18 7792 1 1 23 LEU CG C 3.624 0.524 4.042 1.00 . A A . 23 LEU CG 1 1 18 7793 1 1 23 LEU H H 3.943 0.530 1.104 1.00 . A A . 23 LEU H 1 1 18 7794 1 1 23 LEU HA H 5.327 2.495 2.777 1.00 . A A . 23 LEU HA 1 1 18 7795 1 1 23 LEU HB2 H 5.273 -0.492 3.147 1.00 . A A . 23 LEU HB2 1 1 18 7796 1 1 23 LEU HB3 H 5.726 0.727 4.322 1.00 . A A . 23 LEU HB3 1 1 18 7797 1 1 23 LEU HD11 H 4.110 -1.465 4.666 1.00 . A A . 23 LEU HD11 1 1 18 7798 1 1 23 LEU HD12 H 2.758 -0.741 5.536 1.00 . A A . 23 LEU HD12 1 1 18 7799 1 1 23 LEU HD13 H 2.538 -1.312 3.883 1.00 . A A . 23 LEU HD13 1 1 18 7800 1 1 23 LEU HD21 H 4.167 1.366 5.932 1.00 . A A . 23 LEU HD21 1 1 18 7801 1 1 23 LEU HD22 H 3.695 2.553 4.716 1.00 . A A . 23 LEU HD22 1 1 18 7802 1 1 23 LEU HD23 H 2.467 1.567 5.509 1.00 . A A . 23 LEU HD23 1 1 18 7803 1 1 23 LEU HG H 2.949 0.778 3.237 1.00 . A A . 23 LEU HG 1 1 18 7804 1 1 23 LEU N N 4.287 1.410 1.366 1.00 . A A . 23 LEU N 1 1 18 7805 1 1 23 LEU O O 6.857 0.387 0.879 1.00 . A A . 23 LEU O 1 1 18 7806 1 1 24 GLU C C 9.565 0.357 1.888 1.00 . A A . 24 GLU C 1 1 18 7807 1 1 24 GLU CA C 9.084 1.802 1.785 1.00 . A A . 24 GLU CA 1 1 18 7808 1 1 24 GLU CB C 10.021 2.721 2.570 1.00 . A A . 24 GLU CB 1 1 18 7809 1 1 24 GLU CD C 9.506 4.096 4.628 1.00 . A A . 24 GLU CD 1 1 18 7810 1 1 24 GLU CG C 9.773 2.711 4.072 1.00 . A A . 24 GLU CG 1 1 18 7811 1 1 24 GLU H H 7.525 2.596 2.975 1.00 . A A . 24 GLU H 1 1 18 7812 1 1 24 GLU HA H 9.098 2.096 0.747 1.00 . A A . 24 GLU HA 1 1 18 7813 1 1 24 GLU HB2 H 11.041 2.410 2.395 1.00 . A A . 24 GLU HB2 1 1 18 7814 1 1 24 GLU HB3 H 9.897 3.732 2.214 1.00 . A A . 24 GLU HB3 1 1 18 7815 1 1 24 GLU HG2 H 8.917 2.087 4.278 1.00 . A A . 24 GLU HG2 1 1 18 7816 1 1 24 GLU HG3 H 10.643 2.302 4.564 1.00 . A A . 24 GLU HG3 1 1 18 7817 1 1 24 GLU N N 7.714 1.945 2.267 1.00 . A A . 24 GLU N 1 1 18 7818 1 1 24 GLU O O 10.150 -0.178 0.946 1.00 . A A . 24 GLU O 1 1 18 7819 1 1 24 GLU OE1 O 10.418 4.946 4.569 1.00 . A A . 24 GLU OE1 1 1 18 7820 1 1 24 GLU OE2 O 8.383 4.330 5.123 1.00 . A A . 24 GLU OE2 1 1 18 7821 1 1 25 HIS C C 9.177 -2.560 2.152 1.00 . A A . 25 HIS C 1 1 18 7822 1 1 25 HIS CA C 9.745 -1.657 3.242 1.00 . A A . 25 HIS CA 1 1 18 7823 1 1 25 HIS CB C 9.332 -2.177 4.628 1.00 . A A . 25 HIS CB 1 1 18 7824 1 1 25 HIS CD2 C 6.824 -1.864 5.224 1.00 . A A . 25 HIS CD2 1 1 18 7825 1 1 25 HIS CE1 C 6.993 0.019 6.332 1.00 . A A . 25 HIS CE1 1 1 18 7826 1 1 25 HIS CG C 8.129 -1.505 5.218 1.00 . A A . 25 HIS CG 1 1 18 7827 1 1 25 HIS H H 8.856 0.201 3.751 1.00 . A A . 25 HIS H 1 1 18 7828 1 1 25 HIS HA H 10.822 -1.680 3.171 1.00 . A A . 25 HIS HA 1 1 18 7829 1 1 25 HIS HB2 H 9.111 -3.232 4.554 1.00 . A A . 25 HIS HB2 1 1 18 7830 1 1 25 HIS HB3 H 10.157 -2.039 5.312 1.00 . A A . 25 HIS HB3 1 1 18 7831 1 1 25 HIS HD1 H 9.015 0.198 6.089 1.00 . A A . 25 HIS HD1 1 1 18 7832 1 1 25 HIS HD2 H 6.400 -2.746 4.764 1.00 . A A . 25 HIS HD2 1 1 18 7833 1 1 25 HIS HE1 H 6.745 0.901 6.905 1.00 . A A . 25 HIS HE1 1 1 18 7834 1 1 25 HIS HE2 H 5.206 -0.969 6.215 1.00 . A A . 25 HIS HE2 1 1 18 7835 1 1 25 HIS N N 9.323 -0.273 3.035 1.00 . A A . 25 HIS N 1 1 18 7836 1 1 25 HIS ND1 N 8.200 -0.319 5.919 1.00 . A A . 25 HIS ND1 1 1 18 7837 1 1 25 HIS NE2 N 6.139 -0.901 5.923 1.00 . A A . 25 HIS NE2 1 1 18 7838 1 1 25 HIS O O 9.745 -3.606 1.842 1.00 . A A . 25 HIS O 1 1 18 7839 1 1 26 GLY C C 6.115 -3.512 0.898 1.00 . A A . 26 GLY C 1 1 18 7840 1 1 26 GLY CA C 7.450 -2.912 0.505 1.00 . A A . 26 GLY CA 1 1 18 7841 1 1 26 GLY H H 7.659 -1.292 1.846 1.00 . A A . 26 GLY H 1 1 18 7842 1 1 26 GLY HA2 H 8.121 -3.710 0.224 1.00 . A A . 26 GLY HA2 1 1 18 7843 1 1 26 GLY HA3 H 7.303 -2.267 -0.347 1.00 . A A . 26 GLY HA3 1 1 18 7844 1 1 26 GLY N N 8.062 -2.139 1.565 1.00 . A A . 26 GLY N 1 1 18 7845 1 1 26 GLY O O 5.980 -4.732 0.979 1.00 . A A . 26 GLY O 1 1 18 7846 1 1 27 TYR C C 2.772 -1.977 1.405 1.00 . A A . 27 TYR C 1 1 18 7847 1 1 27 TYR CA C 3.790 -3.112 1.508 1.00 . A A . 27 TYR CA 1 1 18 7848 1 1 27 TYR CB C 3.796 -3.671 2.931 1.00 . A A . 27 TYR CB 1 1 18 7849 1 1 27 TYR CD1 C 3.886 -6.065 2.130 1.00 . A A . 27 TYR CD1 1 1 18 7850 1 1 27 TYR CD2 C 5.204 -5.460 4.022 1.00 . A A . 27 TYR CD2 1 1 18 7851 1 1 27 TYR CE1 C 4.348 -7.364 2.216 1.00 . A A . 27 TYR CE1 1 1 18 7852 1 1 27 TYR CE2 C 5.672 -6.758 4.114 1.00 . A A . 27 TYR CE2 1 1 18 7853 1 1 27 TYR CG C 4.304 -5.092 3.029 1.00 . A A . 27 TYR CG 1 1 18 7854 1 1 27 TYR CZ C 5.241 -7.705 3.210 1.00 . A A . 27 TYR CZ 1 1 18 7855 1 1 27 TYR H H 5.293 -1.694 1.040 1.00 . A A . 27 TYR H 1 1 18 7856 1 1 27 TYR HA H 3.504 -3.898 0.824 1.00 . A A . 27 TYR HA 1 1 18 7857 1 1 27 TYR HB2 H 4.429 -3.053 3.546 1.00 . A A . 27 TYR HB2 1 1 18 7858 1 1 27 TYR HB3 H 2.789 -3.650 3.323 1.00 . A A . 27 TYR HB3 1 1 18 7859 1 1 27 TYR HD1 H 3.185 -5.794 1.352 1.00 . A A . 27 TYR HD1 1 1 18 7860 1 1 27 TYR HD2 H 5.538 -4.716 4.729 1.00 . A A . 27 TYR HD2 1 1 18 7861 1 1 27 TYR HE1 H 4.012 -8.105 1.508 1.00 . A A . 27 TYR HE1 1 1 18 7862 1 1 27 TYR HE2 H 6.371 -7.024 4.894 1.00 . A A . 27 TYR HE2 1 1 18 7863 1 1 27 TYR HH H 5.768 -9.253 4.223 1.00 . A A . 27 TYR HH 1 1 18 7864 1 1 27 TYR N N 5.124 -2.655 1.130 1.00 . A A . 27 TYR N 1 1 18 7865 1 1 27 TYR O O 3.083 -0.825 1.699 1.00 . A A . 27 TYR O 1 1 18 7866 1 1 27 TYR OH O 5.706 -8.997 3.299 1.00 . A A . 27 TYR OH 1 1 18 7867 1 1 28 CYS C C -0.436 -1.365 2.067 1.00 . A A . 28 CYS C 1 1 18 7868 1 1 28 CYS CA C 0.487 -1.330 0.852 1.00 . A A . 28 CYS CA 1 1 18 7869 1 1 28 CYS CB C -0.327 -1.595 -0.419 1.00 . A A . 28 CYS CB 1 1 18 7870 1 1 28 CYS H H 1.373 -3.254 0.769 1.00 . A A . 28 CYS H 1 1 18 7871 1 1 28 CYS HA H 0.942 -0.353 0.785 1.00 . A A . 28 CYS HA 1 1 18 7872 1 1 28 CYS HB2 H -0.053 -2.560 -0.817 1.00 . A A . 28 CYS HB2 1 1 18 7873 1 1 28 CYS HB3 H -1.379 -1.601 -0.172 1.00 . A A . 28 CYS HB3 1 1 18 7874 1 1 28 CYS N N 1.556 -2.318 0.990 1.00 . A A . 28 CYS N 1 1 18 7875 1 1 28 CYS O O -1.136 -2.352 2.299 1.00 . A A . 28 CYS O 1 1 18 7876 1 1 28 CYS SG S -0.077 -0.365 -1.741 1.00 . A A . 28 CYS SG 1 1 18 7877 1 1 29 GLY C C -2.092 1.063 4.072 1.00 . A A . 29 GLY C 1 1 18 7878 1 1 29 GLY CA C -1.271 -0.211 4.020 1.00 . A A . 29 GLY CA 1 1 18 7879 1 1 29 GLY H H 0.147 0.473 2.603 1.00 . A A . 29 GLY H 1 1 18 7880 1 1 29 GLY HA2 H -0.642 -0.256 4.898 1.00 . A A . 29 GLY HA2 1 1 18 7881 1 1 29 GLY HA3 H -1.941 -1.057 4.026 1.00 . A A . 29 GLY HA3 1 1 18 7882 1 1 29 GLY N N -0.432 -0.283 2.838 1.00 . A A . 29 GLY N 1 1 18 7883 1 1 29 GLY O O -2.867 1.231 5.038 1.00 . A A . 29 GLY O 1 1 18 7884 1 1 29 GLY OXT O -1.959 1.893 3.149 1.00 . A A . 29 GLY OXT 1 1 19 7885 1 1 1 ARG C C -11.607 2.738 1.928 1.00 . A A . 1 ARG C 1 1 19 7886 1 1 1 ARG CA C -12.721 3.658 1.438 1.00 . A A . 1 ARG CA 1 1 19 7887 1 1 1 ARG CB C -14.054 3.271 2.084 1.00 . A A . 1 ARG CB 1 1 19 7888 1 1 1 ARG CD C -15.798 3.860 3.796 1.00 . A A . 1 ARG CD 1 1 19 7889 1 1 1 ARG CG C -14.670 4.381 2.918 1.00 . A A . 1 ARG CG 1 1 19 7890 1 1 1 ARG CZ C -18.135 4.462 4.287 1.00 . A A . 1 ARG CZ 1 1 19 7891 1 1 1 ARG H1 H -11.926 3.692 -0.459 1.00 . A A . 1 ARG H1 1 1 19 7892 1 1 1 ARG H2 H -13.277 2.651 -0.267 1.00 . A A . 1 ARG H2 1 1 19 7893 1 1 1 ARG H3 H -13.506 4.348 -0.334 1.00 . A A . 1 ARG H3 1 1 19 7894 1 1 1 ARG HA H -12.479 4.677 1.705 1.00 . A A . 1 ARG HA 1 1 19 7895 1 1 1 ARG HB2 H -14.753 3.005 1.305 1.00 . A A . 1 ARG HB2 1 1 19 7896 1 1 1 ARG HB3 H -13.898 2.414 2.723 1.00 . A A . 1 ARG HB3 1 1 19 7897 1 1 1 ARG HD2 H -16.144 2.920 3.393 1.00 . A A . 1 ARG HD2 1 1 19 7898 1 1 1 ARG HD3 H -15.416 3.704 4.793 1.00 . A A . 1 ARG HD3 1 1 19 7899 1 1 1 ARG HE H -16.760 5.714 3.563 1.00 . A A . 1 ARG HE 1 1 19 7900 1 1 1 ARG HG2 H -13.906 4.812 3.548 1.00 . A A . 1 ARG HG2 1 1 19 7901 1 1 1 ARG HG3 H -15.062 5.140 2.257 1.00 . A A . 1 ARG HG3 1 1 19 7902 1 1 1 ARG HH11 H -17.667 2.534 4.679 1.00 . A A . 1 ARG HH11 1 1 19 7903 1 1 1 ARG HH12 H -19.305 2.984 5.016 1.00 . A A . 1 ARG HH12 1 1 19 7904 1 1 1 ARG HH21 H -18.914 6.306 4.006 1.00 . A A . 1 ARG HH21 1 1 19 7905 1 1 1 ARG HH22 H -20.013 5.125 4.633 1.00 . A A . 1 ARG HH22 1 1 19 7906 1 1 1 ARG N N -12.871 3.580 -0.038 1.00 . A A . 1 ARG N 1 1 19 7907 1 1 1 ARG NE N -16.920 4.793 3.857 1.00 . A A . 1 ARG NE 1 1 19 7908 1 1 1 ARG NH1 N -18.390 3.225 4.694 1.00 . A A . 1 ARG NH1 1 1 19 7909 1 1 1 ARG NH2 N -19.100 5.373 4.310 1.00 . A A . 1 ARG NH2 1 1 19 7910 1 1 1 ARG O O -10.566 3.200 2.393 1.00 . A A . 1 ARG O 1 1 19 7911 1 1 2 VAL C C -10.241 -0.280 1.060 1.00 . A A . 2 VAL C 1 1 19 7912 1 1 2 VAL CA C -10.854 0.447 2.254 1.00 . A A . 2 VAL CA 1 1 19 7913 1 1 2 VAL CB C -11.480 -0.591 3.204 1.00 . A A . 2 VAL CB 1 1 19 7914 1 1 2 VAL CG1 C -11.869 0.058 4.524 1.00 . A A . 2 VAL CG1 1 1 19 7915 1 1 2 VAL CG2 C -12.684 -1.255 2.553 1.00 . A A . 2 VAL CG2 1 1 19 7916 1 1 2 VAL H H -12.687 1.127 1.443 1.00 . A A . 2 VAL H 1 1 19 7917 1 1 2 VAL HA H -10.071 0.967 2.787 1.00 . A A . 2 VAL HA 1 1 19 7918 1 1 2 VAL HB H -10.742 -1.354 3.408 1.00 . A A . 2 VAL HB 1 1 19 7919 1 1 2 VAL HG11 H -10.990 0.478 4.991 1.00 . A A . 2 VAL HG11 1 1 19 7920 1 1 2 VAL HG12 H -12.588 0.842 4.341 1.00 . A A . 2 VAL HG12 1 1 19 7921 1 1 2 VAL HG13 H -12.303 -0.685 5.176 1.00 . A A . 2 VAL HG13 1 1 19 7922 1 1 2 VAL HG21 H -12.626 -1.134 1.481 1.00 . A A . 2 VAL HG21 1 1 19 7923 1 1 2 VAL HG22 H -12.691 -2.306 2.796 1.00 . A A . 2 VAL HG22 1 1 19 7924 1 1 2 VAL HG23 H -13.590 -0.794 2.919 1.00 . A A . 2 VAL HG23 1 1 19 7925 1 1 2 VAL N N -11.836 1.433 1.821 1.00 . A A . 2 VAL N 1 1 19 7926 1 1 2 VAL O O -10.935 -0.613 0.100 1.00 . A A . 2 VAL O 1 1 19 7927 1 1 3 CYS C C -8.022 -2.686 0.404 1.00 . A A . 3 CYS C 1 1 19 7928 1 1 3 CYS CA C -8.230 -1.212 0.055 1.00 . A A . 3 CYS CA 1 1 19 7929 1 1 3 CYS CB C -6.881 -0.537 -0.218 1.00 . A A . 3 CYS CB 1 1 19 7930 1 1 3 CYS H H -8.437 -0.234 1.921 1.00 . A A . 3 CYS H 1 1 19 7931 1 1 3 CYS HA H -8.840 -1.145 -0.832 1.00 . A A . 3 CYS HA 1 1 19 7932 1 1 3 CYS HB2 H -6.486 -0.907 -1.152 1.00 . A A . 3 CYS HB2 1 1 19 7933 1 1 3 CYS HB3 H -7.033 0.530 -0.296 1.00 . A A . 3 CYS HB3 1 1 19 7934 1 1 3 CYS N N -8.936 -0.523 1.129 1.00 . A A . 3 CYS N 1 1 19 7935 1 1 3 CYS O O -7.553 -3.010 1.494 1.00 . A A . 3 CYS O 1 1 19 7936 1 1 3 CYS SG S -5.618 -0.824 1.067 1.00 . A A . 3 CYS SG 1 1 19 7937 1 1 4 PRO C C -6.915 -5.404 0.397 1.00 . A A . 4 PRO C 1 1 19 7938 1 1 4 PRO CA C -8.222 -5.045 -0.302 1.00 . A A . 4 PRO CA 1 1 19 7939 1 1 4 PRO CB C -8.237 -5.601 -1.722 1.00 . A A . 4 PRO CB 1 1 19 7940 1 1 4 PRO CD C -8.940 -3.310 -1.852 1.00 . A A . 4 PRO CD 1 1 19 7941 1 1 4 PRO CG C -9.128 -4.673 -2.472 1.00 . A A . 4 PRO CG 1 1 19 7942 1 1 4 PRO HA H -9.052 -5.451 0.256 1.00 . A A . 4 PRO HA 1 1 19 7943 1 1 4 PRO HB2 H -7.233 -5.600 -2.123 1.00 . A A . 4 PRO HB2 1 1 19 7944 1 1 4 PRO HB3 H -8.628 -6.606 -1.715 1.00 . A A . 4 PRO HB3 1 1 19 7945 1 1 4 PRO HD2 H -8.254 -2.720 -2.441 1.00 . A A . 4 PRO HD2 1 1 19 7946 1 1 4 PRO HD3 H -9.890 -2.803 -1.761 1.00 . A A . 4 PRO HD3 1 1 19 7947 1 1 4 PRO HG2 H -8.843 -4.652 -3.514 1.00 . A A . 4 PRO HG2 1 1 19 7948 1 1 4 PRO HG3 H -10.156 -4.990 -2.371 1.00 . A A . 4 PRO HG3 1 1 19 7949 1 1 4 PRO N N -8.372 -3.603 -0.520 1.00 . A A . 4 PRO N 1 1 19 7950 1 1 4 PRO O O -5.844 -4.934 0.013 1.00 . A A . 4 PRO O 1 1 19 7951 1 1 5 ARG C C -4.904 -7.490 1.305 1.00 . A A . 5 ARG C 1 1 19 7952 1 1 5 ARG CA C -5.836 -6.659 2.179 1.00 . A A . 5 ARG CA 1 1 19 7953 1 1 5 ARG CB C -6.254 -7.466 3.411 1.00 . A A . 5 ARG CB 1 1 19 7954 1 1 5 ARG CD C -7.001 -9.781 4.047 1.00 . A A . 5 ARG CD 1 1 19 7955 1 1 5 ARG CG C -7.198 -8.613 3.093 1.00 . A A . 5 ARG CG 1 1 19 7956 1 1 5 ARG CZ C -4.632 -10.128 4.655 1.00 . A A . 5 ARG CZ 1 1 19 7957 1 1 5 ARG H H -7.893 -6.579 1.687 1.00 . A A . 5 ARG H 1 1 19 7958 1 1 5 ARG HA H -5.313 -5.771 2.501 1.00 . A A . 5 ARG HA 1 1 19 7959 1 1 5 ARG HB2 H -5.369 -7.873 3.875 1.00 . A A . 5 ARG HB2 1 1 19 7960 1 1 5 ARG HB3 H -6.745 -6.806 4.109 1.00 . A A . 5 ARG HB3 1 1 19 7961 1 1 5 ARG HD2 H -7.103 -9.425 5.060 1.00 . A A . 5 ARG HD2 1 1 19 7962 1 1 5 ARG HD3 H -7.763 -10.521 3.850 1.00 . A A . 5 ARG HD3 1 1 19 7963 1 1 5 ARG HE H -5.586 -11.066 3.173 1.00 . A A . 5 ARG HE 1 1 19 7964 1 1 5 ARG HG2 H -8.216 -8.263 3.177 1.00 . A A . 5 ARG HG2 1 1 19 7965 1 1 5 ARG HG3 H -7.013 -8.950 2.083 1.00 . A A . 5 ARG HG3 1 1 19 7966 1 1 5 ARG HH11 H -5.580 -8.757 5.801 1.00 . A A . 5 ARG HH11 1 1 19 7967 1 1 5 ARG HH12 H -3.920 -9.037 6.200 1.00 . A A . 5 ARG HH12 1 1 19 7968 1 1 5 ARG HH21 H -3.406 -11.424 3.704 1.00 . A A . 5 ARG HH21 1 1 19 7969 1 1 5 ARG HH22 H -2.687 -10.546 5.013 1.00 . A A . 5 ARG HH22 1 1 19 7970 1 1 5 ARG N N -7.011 -6.239 1.427 1.00 . A A . 5 ARG N 1 1 19 7971 1 1 5 ARG NE N -5.687 -10.404 3.889 1.00 . A A . 5 ARG NE 1 1 19 7972 1 1 5 ARG NH1 N -4.719 -9.234 5.632 1.00 . A A . 5 ARG NH1 1 1 19 7973 1 1 5 ARG NH2 N -3.481 -10.750 4.440 1.00 . A A . 5 ARG NH2 1 1 19 7974 1 1 5 ARG O O -4.894 -8.719 1.382 1.00 . A A . 5 ARG O 1 1 19 7975 1 1 6 ILE C C -1.802 -6.834 -0.339 1.00 . A A . 6 ILE C 1 1 19 7976 1 1 6 ILE CA C -3.181 -7.482 -0.413 1.00 . A A . 6 ILE CA 1 1 19 7977 1 1 6 ILE CB C -3.677 -7.460 -1.872 1.00 . A A . 6 ILE CB 1 1 19 7978 1 1 6 ILE CD1 C -2.800 -9.754 -2.540 1.00 . A A . 6 ILE CD1 1 1 19 7979 1 1 6 ILE CG1 C -2.731 -8.261 -2.770 1.00 . A A . 6 ILE CG1 1 1 19 7980 1 1 6 ILE CG2 C -3.806 -6.028 -2.372 1.00 . A A . 6 ILE CG2 1 1 19 7981 1 1 6 ILE H H -4.176 -5.831 0.462 1.00 . A A . 6 ILE H 1 1 19 7982 1 1 6 ILE HA H -3.102 -8.511 -0.096 1.00 . A A . 6 ILE HA 1 1 19 7983 1 1 6 ILE HB H -4.657 -7.912 -1.901 1.00 . A A . 6 ILE HB 1 1 19 7984 1 1 6 ILE HD11 H -3.516 -9.966 -1.760 1.00 . A A . 6 ILE HD11 1 1 19 7985 1 1 6 ILE HD12 H -3.105 -10.246 -3.452 1.00 . A A . 6 ILE HD12 1 1 19 7986 1 1 6 ILE HD13 H -1.827 -10.119 -2.243 1.00 . A A . 6 ILE HD13 1 1 19 7987 1 1 6 ILE HG12 H -2.981 -8.074 -3.803 1.00 . A A . 6 ILE HG12 1 1 19 7988 1 1 6 ILE HG13 H -1.715 -7.942 -2.587 1.00 . A A . 6 ILE HG13 1 1 19 7989 1 1 6 ILE HG21 H -4.067 -5.382 -1.546 1.00 . A A . 6 ILE HG21 1 1 19 7990 1 1 6 ILE HG22 H -2.866 -5.708 -2.796 1.00 . A A . 6 ILE HG22 1 1 19 7991 1 1 6 ILE HG23 H -4.577 -5.977 -3.126 1.00 . A A . 6 ILE HG23 1 1 19 7992 1 1 6 ILE N N -4.120 -6.809 0.477 1.00 . A A . 6 ILE N 1 1 19 7993 1 1 6 ILE O O -1.649 -5.642 -0.607 1.00 . A A . 6 ILE O 1 1 19 7994 1 1 7 LEU C C 1.012 -6.457 -1.160 1.00 . A A . 7 LEU C 1 1 19 7995 1 1 7 LEU CA C 0.571 -7.134 0.133 1.00 . A A . 7 LEU CA 1 1 19 7996 1 1 7 LEU CB C 1.522 -8.284 0.470 1.00 . A A . 7 LEU CB 1 1 19 7997 1 1 7 LEU CD1 C 2.306 -10.041 2.075 1.00 . A A . 7 LEU CD1 1 1 19 7998 1 1 7 LEU CD2 C 1.201 -7.968 2.935 1.00 . A A . 7 LEU CD2 1 1 19 7999 1 1 7 LEU CG C 1.249 -8.982 1.803 1.00 . A A . 7 LEU CG 1 1 19 8000 1 1 7 LEU H H -0.984 -8.568 0.225 1.00 . A A . 7 LEU H 1 1 19 8001 1 1 7 LEU HA H 0.599 -6.409 0.933 1.00 . A A . 7 LEU HA 1 1 19 8002 1 1 7 LEU HB2 H 1.456 -9.018 -0.319 1.00 . A A . 7 LEU HB2 1 1 19 8003 1 1 7 LEU HB3 H 2.529 -7.894 0.493 1.00 . A A . 7 LEU HB3 1 1 19 8004 1 1 7 LEU HD11 H 3.185 -9.835 1.482 1.00 . A A . 7 LEU HD11 1 1 19 8005 1 1 7 LEU HD12 H 2.568 -10.029 3.123 1.00 . A A . 7 LEU HD12 1 1 19 8006 1 1 7 LEU HD13 H 1.916 -11.014 1.815 1.00 . A A . 7 LEU HD13 1 1 19 8007 1 1 7 LEU HD21 H 0.420 -7.246 2.739 1.00 . A A . 7 LEU HD21 1 1 19 8008 1 1 7 LEU HD22 H 0.997 -8.475 3.866 1.00 . A A . 7 LEU HD22 1 1 19 8009 1 1 7 LEU HD23 H 2.151 -7.459 3.003 1.00 . A A . 7 LEU HD23 1 1 19 8010 1 1 7 LEU HG H 0.288 -9.475 1.753 1.00 . A A . 7 LEU HG 1 1 19 8011 1 1 7 LEU N N -0.799 -7.628 0.025 1.00 . A A . 7 LEU N 1 1 19 8012 1 1 7 LEU O O 0.701 -6.930 -2.254 1.00 . A A . 7 LEU O 1 1 19 8013 1 1 8 LEU C C 3.383 -3.709 -1.826 1.00 . A A . 8 LEU C 1 1 19 8014 1 1 8 LEU CA C 2.216 -4.616 -2.196 1.00 . A A . 8 LEU CA 1 1 19 8015 1 1 8 LEU CB C 1.080 -3.792 -2.808 1.00 . A A . 8 LEU CB 1 1 19 8016 1 1 8 LEU CD1 C -0.104 -5.026 -4.640 1.00 . A A . 8 LEU CD1 1 1 19 8017 1 1 8 LEU CD2 C 0.500 -2.619 -4.948 1.00 . A A . 8 LEU CD2 1 1 19 8018 1 1 8 LEU CG C 0.914 -3.943 -4.322 1.00 . A A . 8 LEU CG 1 1 19 8019 1 1 8 LEU H H 1.954 -5.021 -0.133 1.00 . A A . 8 LEU H 1 1 19 8020 1 1 8 LEU HA H 2.555 -5.339 -2.923 1.00 . A A . 8 LEU HA 1 1 19 8021 1 1 8 LEU HB2 H 0.156 -4.086 -2.334 1.00 . A A . 8 LEU HB2 1 1 19 8022 1 1 8 LEU HB3 H 1.261 -2.749 -2.591 1.00 . A A . 8 LEU HB3 1 1 19 8023 1 1 8 LEU HD11 H -1.038 -4.797 -4.149 1.00 . A A . 8 LEU HD11 1 1 19 8024 1 1 8 LEU HD12 H -0.261 -5.070 -5.708 1.00 . A A . 8 LEU HD12 1 1 19 8025 1 1 8 LEU HD13 H 0.262 -5.980 -4.290 1.00 . A A . 8 LEU HD13 1 1 19 8026 1 1 8 LEU HD21 H -0.003 -2.013 -4.208 1.00 . A A . 8 LEU HD21 1 1 19 8027 1 1 8 LEU HD22 H 1.378 -2.100 -5.303 1.00 . A A . 8 LEU HD22 1 1 19 8028 1 1 8 LEU HD23 H -0.168 -2.805 -5.776 1.00 . A A . 8 LEU HD23 1 1 19 8029 1 1 8 LEU HG H 1.859 -4.237 -4.754 1.00 . A A . 8 LEU HG 1 1 19 8030 1 1 8 LEU N N 1.736 -5.351 -1.031 1.00 . A A . 8 LEU N 1 1 19 8031 1 1 8 LEU O O 3.252 -2.829 -0.976 1.00 . A A . 8 LEU O 1 1 19 8032 1 1 9 GLU C C 5.911 -2.065 -3.285 1.00 . A A . 9 GLU C 1 1 19 8033 1 1 9 GLU CA C 5.723 -3.137 -2.216 1.00 . A A . 9 GLU CA 1 1 19 8034 1 1 9 GLU CB C 6.955 -4.041 -2.166 1.00 . A A . 9 GLU CB 1 1 19 8035 1 1 9 GLU CD C 7.642 -6.217 -3.250 1.00 . A A . 9 GLU CD 1 1 19 8036 1 1 9 GLU CG C 7.224 -4.776 -3.469 1.00 . A A . 9 GLU CG 1 1 19 8037 1 1 9 GLU H H 4.564 -4.647 -3.140 1.00 . A A . 9 GLU H 1 1 19 8038 1 1 9 GLU HA H 5.601 -2.654 -1.259 1.00 . A A . 9 GLU HA 1 1 19 8039 1 1 9 GLU HB2 H 7.820 -3.439 -1.933 1.00 . A A . 9 GLU HB2 1 1 19 8040 1 1 9 GLU HB3 H 6.817 -4.775 -1.385 1.00 . A A . 9 GLU HB3 1 1 19 8041 1 1 9 GLU HG2 H 6.324 -4.766 -4.066 1.00 . A A . 9 GLU HG2 1 1 19 8042 1 1 9 GLU HG3 H 8.013 -4.264 -3.999 1.00 . A A . 9 GLU HG3 1 1 19 8043 1 1 9 GLU N N 4.525 -3.930 -2.473 1.00 . A A . 9 GLU N 1 1 19 8044 1 1 9 GLU O O 5.868 -2.354 -4.481 1.00 . A A . 9 GLU O 1 1 19 8045 1 1 9 GLU OE1 O 8.454 -6.467 -2.334 1.00 . A A . 9 GLU OE1 1 1 19 8046 1 1 9 GLU OE2 O 7.157 -7.096 -3.995 1.00 . A A . 9 GLU OE2 1 1 19 8047 1 1 10 CYS C C 7.092 1.418 -3.117 1.00 . A A . 10 CYS C 1 1 19 8048 1 1 10 CYS CA C 6.306 0.287 -3.773 1.00 . A A . 10 CYS CA 1 1 19 8049 1 1 10 CYS CB C 4.952 0.809 -4.269 1.00 . A A . 10 CYS CB 1 1 19 8050 1 1 10 CYS H H 6.134 -0.654 -1.881 1.00 . A A . 10 CYS H 1 1 19 8051 1 1 10 CYS HA H 6.870 -0.081 -4.618 1.00 . A A . 10 CYS HA 1 1 19 8052 1 1 10 CYS HB2 H 4.874 1.861 -4.040 1.00 . A A . 10 CYS HB2 1 1 19 8053 1 1 10 CYS HB3 H 4.897 0.677 -5.341 1.00 . A A . 10 CYS HB3 1 1 19 8054 1 1 10 CYS N N 6.117 -0.826 -2.848 1.00 . A A . 10 CYS N 1 1 19 8055 1 1 10 CYS O O 7.239 1.461 -1.896 1.00 . A A . 10 CYS O 1 1 19 8056 1 1 10 CYS SG S 3.506 -0.023 -3.534 1.00 . A A . 10 CYS SG 1 1 19 8057 1 1 11 LYS C C 7.439 4.617 -3.042 1.00 . A A . 11 LYS C 1 1 19 8058 1 1 11 LYS CA C 8.363 3.471 -3.445 1.00 . A A . 11 LYS CA 1 1 19 8059 1 1 11 LYS CB C 9.350 3.950 -4.512 1.00 . A A . 11 LYS CB 1 1 19 8060 1 1 11 LYS CD C 10.808 2.326 -5.762 1.00 . A A . 11 LYS CD 1 1 19 8061 1 1 11 LYS CE C 11.689 1.113 -5.503 1.00 . A A . 11 LYS CE 1 1 19 8062 1 1 11 LYS CG C 10.662 3.184 -4.514 1.00 . A A . 11 LYS CG 1 1 19 8063 1 1 11 LYS H H 7.440 2.247 -4.904 1.00 . A A . 11 LYS H 1 1 19 8064 1 1 11 LYS HA H 8.915 3.146 -2.576 1.00 . A A . 11 LYS HA 1 1 19 8065 1 1 11 LYS HB2 H 8.890 3.842 -5.485 1.00 . A A . 11 LYS HB2 1 1 19 8066 1 1 11 LYS HB3 H 9.567 4.994 -4.342 1.00 . A A . 11 LYS HB3 1 1 19 8067 1 1 11 LYS HD2 H 9.830 1.988 -6.071 1.00 . A A . 11 LYS HD2 1 1 19 8068 1 1 11 LYS HD3 H 11.251 2.920 -6.546 1.00 . A A . 11 LYS HD3 1 1 19 8069 1 1 11 LYS HE2 H 12.504 1.407 -4.859 1.00 . A A . 11 LYS HE2 1 1 19 8070 1 1 11 LYS HE3 H 11.098 0.355 -5.011 1.00 . A A . 11 LYS HE3 1 1 19 8071 1 1 11 LYS HG2 H 11.479 3.889 -4.479 1.00 . A A . 11 LYS HG2 1 1 19 8072 1 1 11 LYS HG3 H 10.697 2.546 -3.643 1.00 . A A . 11 LYS HG3 1 1 19 8073 1 1 11 LYS HZ1 H 11.645 0.818 -7.571 1.00 . A A . 11 LYS HZ1 1 1 19 8074 1 1 11 LYS HZ2 H 13.206 0.919 -6.925 1.00 . A A . 11 LYS HZ2 1 1 19 8075 1 1 11 LYS HZ3 H 12.289 -0.486 -6.706 1.00 . A A . 11 LYS HZ3 1 1 19 8076 1 1 11 LYS N N 7.593 2.335 -3.940 1.00 . A A . 11 LYS N 1 1 19 8077 1 1 11 LYS NZ N 12.246 0.552 -6.765 1.00 . A A . 11 LYS NZ 1 1 19 8078 1 1 11 LYS O O 7.341 4.963 -1.864 1.00 . A A . 11 LYS O 1 1 19 8079 1 1 12 LYS C C 4.502 5.777 -3.270 1.00 . A A . 12 LYS C 1 1 19 8080 1 1 12 LYS CA C 5.841 6.302 -3.774 1.00 . A A . 12 LYS CA 1 1 19 8081 1 1 12 LYS CB C 5.637 7.126 -5.046 1.00 . A A . 12 LYS CB 1 1 19 8082 1 1 12 LYS CD C 5.270 9.567 -5.525 1.00 . A A . 12 LYS CD 1 1 19 8083 1 1 12 LYS CE C 4.160 10.528 -5.920 1.00 . A A . 12 LYS CE 1 1 19 8084 1 1 12 LYS CG C 4.714 8.320 -4.856 1.00 . A A . 12 LYS CG 1 1 19 8085 1 1 12 LYS H H 6.879 4.874 -4.944 1.00 . A A . 12 LYS H 1 1 19 8086 1 1 12 LYS HA H 6.278 6.930 -3.013 1.00 . A A . 12 LYS HA 1 1 19 8087 1 1 12 LYS HB2 H 6.596 7.488 -5.385 1.00 . A A . 12 LYS HB2 1 1 19 8088 1 1 12 LYS HB3 H 5.214 6.489 -5.810 1.00 . A A . 12 LYS HB3 1 1 19 8089 1 1 12 LYS HD2 H 5.936 10.066 -4.837 1.00 . A A . 12 LYS HD2 1 1 19 8090 1 1 12 LYS HD3 H 5.816 9.277 -6.410 1.00 . A A . 12 LYS HD3 1 1 19 8091 1 1 12 LYS HE2 H 3.513 10.038 -6.632 1.00 . A A . 12 LYS HE2 1 1 19 8092 1 1 12 LYS HE3 H 3.593 10.785 -5.037 1.00 . A A . 12 LYS HE3 1 1 19 8093 1 1 12 LYS HG2 H 3.752 8.090 -5.289 1.00 . A A . 12 LYS HG2 1 1 19 8094 1 1 12 LYS HG3 H 4.600 8.508 -3.799 1.00 . A A . 12 LYS HG3 1 1 19 8095 1 1 12 LYS HZ1 H 5.407 12.203 -5.906 1.00 . A A . 12 LYS HZ1 1 1 19 8096 1 1 12 LYS HZ2 H 5.142 11.561 -7.448 1.00 . A A . 12 LYS HZ2 1 1 19 8097 1 1 12 LYS HZ3 H 3.928 12.458 -6.684 1.00 . A A . 12 LYS HZ3 1 1 19 8098 1 1 12 LYS N N 6.761 5.198 -4.027 1.00 . A A . 12 LYS N 1 1 19 8099 1 1 12 LYS NZ N 4.697 11.775 -6.532 1.00 . A A . 12 LYS NZ 1 1 19 8100 1 1 12 LYS O O 3.924 4.861 -3.856 1.00 . A A . 12 LYS O 1 1 19 8101 1 1 13 ASP C C 1.620 5.977 -2.614 1.00 . A A . 13 ASP C 1 1 19 8102 1 1 13 ASP CA C 2.749 5.932 -1.592 1.00 . A A . 13 ASP CA 1 1 19 8103 1 1 13 ASP CB C 2.396 6.792 -0.377 1.00 . A A . 13 ASP CB 1 1 19 8104 1 1 13 ASP CG C 3.532 6.871 0.625 1.00 . A A . 13 ASP CG 1 1 19 8105 1 1 13 ASP H H 4.524 7.071 -1.747 1.00 . A A . 13 ASP H 1 1 19 8106 1 1 13 ASP HA H 2.871 4.916 -1.272 1.00 . A A . 13 ASP HA 1 1 19 8107 1 1 13 ASP HB2 H 2.157 7.790 -0.703 1.00 . A A . 13 ASP HB2 1 1 19 8108 1 1 13 ASP HB3 H 1.536 6.367 0.117 1.00 . A A . 13 ASP HB3 1 1 19 8109 1 1 13 ASP N N 4.015 6.354 -2.176 1.00 . A A . 13 ASP N 1 1 19 8110 1 1 13 ASP O O 0.721 5.138 -2.592 1.00 . A A . 13 ASP O 1 1 19 8111 1 1 13 ASP OD1 O 4.674 7.151 0.206 1.00 . A A . 13 ASP OD1 1 1 19 8112 1 1 13 ASP OD2 O 3.278 6.656 1.829 1.00 . A A . 13 ASP OD2 1 1 19 8113 1 1 14 SER C C 0.481 5.804 -5.324 1.00 . A A . 14 SER C 1 1 19 8114 1 1 14 SER CA C 0.668 7.105 -4.549 1.00 . A A . 14 SER CA 1 1 19 8115 1 1 14 SER CB C 1.057 8.232 -5.507 1.00 . A A . 14 SER CB 1 1 19 8116 1 1 14 SER H H 2.427 7.587 -3.475 1.00 . A A . 14 SER H 1 1 19 8117 1 1 14 SER HA H -0.265 7.361 -4.067 1.00 . A A . 14 SER HA 1 1 19 8118 1 1 14 SER HB2 H 1.385 9.089 -4.939 1.00 . A A . 14 SER HB2 1 1 19 8119 1 1 14 SER HB3 H 1.858 7.896 -6.148 1.00 . A A . 14 SER HB3 1 1 19 8120 1 1 14 SER N N 1.680 6.954 -3.509 1.00 . A A . 14 SER N 1 1 19 8121 1 1 14 SER O O -0.621 5.486 -5.770 1.00 . A A . 14 SER O 1 1 19 8122 1 1 14 SER OG O -0.043 8.617 -6.315 1.00 . A A . 14 SER OG 1 1 19 8123 1 1 15 ASP C C 0.469 2.856 -5.681 1.00 . A A . 15 ASP C 1 1 19 8124 1 1 15 ASP CA C 1.544 3.798 -6.220 1.00 . A A . 15 ASP CA 1 1 19 8125 1 1 15 ASP CB C 2.913 3.118 -6.154 1.00 . A A . 15 ASP CB 1 1 19 8126 1 1 15 ASP CG C 3.356 2.580 -7.499 1.00 . A A . 15 ASP CG 1 1 19 8127 1 1 15 ASP H H 2.424 5.369 -5.110 1.00 . A A . 15 ASP H 1 1 19 8128 1 1 15 ASP HA H 1.318 4.022 -7.251 1.00 . A A . 15 ASP HA 1 1 19 8129 1 1 15 ASP HB2 H 3.647 3.833 -5.814 1.00 . A A . 15 ASP HB2 1 1 19 8130 1 1 15 ASP HB3 H 2.868 2.296 -5.454 1.00 . A A . 15 ASP HB3 1 1 19 8131 1 1 15 ASP N N 1.573 5.061 -5.489 1.00 . A A . 15 ASP N 1 1 19 8132 1 1 15 ASP O O -0.124 2.086 -6.437 1.00 . A A . 15 ASP O 1 1 19 8133 1 1 15 ASP OD1 O 3.067 3.232 -8.525 1.00 . A A . 15 ASP OD1 1 1 19 8134 1 1 15 ASP OD2 O 3.992 1.505 -7.528 1.00 . A A . 15 ASP OD2 1 1 19 8135 1 1 16 CYS C C -2.064 2.017 -4.509 1.00 . A A . 16 CYS C 1 1 19 8136 1 1 16 CYS CA C -0.752 2.030 -3.736 1.00 . A A . 16 CYS CA 1 1 19 8137 1 1 16 CYS CB C -1.011 2.451 -2.286 1.00 . A A . 16 CYS CB 1 1 19 8138 1 1 16 CYS H H 0.751 3.524 -3.815 1.00 . A A . 16 CYS H 1 1 19 8139 1 1 16 CYS HA H -0.347 1.029 -3.738 1.00 . A A . 16 CYS HA 1 1 19 8140 1 1 16 CYS HB2 H -0.131 2.912 -1.895 1.00 . A A . 16 CYS HB2 1 1 19 8141 1 1 16 CYS HB3 H -1.813 3.168 -2.261 1.00 . A A . 16 CYS HB3 1 1 19 8142 1 1 16 CYS N N 0.236 2.902 -4.370 1.00 . A A . 16 CYS N 1 1 19 8143 1 1 16 CYS O O -2.267 2.801 -5.436 1.00 . A A . 16 CYS O 1 1 19 8144 1 1 16 CYS SG S -1.450 1.075 -1.168 1.00 . A A . 16 CYS SG 1 1 19 8145 1 1 17 LEU C C -5.339 1.572 -3.873 1.00 . A A . 17 LEU C 1 1 19 8146 1 1 17 LEU CA C -4.247 0.976 -4.750 1.00 . A A . 17 LEU CA 1 1 19 8147 1 1 17 LEU CB C -4.548 -0.498 -5.031 1.00 . A A . 17 LEU CB 1 1 19 8148 1 1 17 LEU CD1 C -6.180 -1.772 -3.610 1.00 . A A . 17 LEU CD1 1 1 19 8149 1 1 17 LEU CD2 C -3.836 -2.606 -3.869 1.00 . A A . 17 LEU CD2 1 1 19 8150 1 1 17 LEU CG C -4.722 -1.371 -3.786 1.00 . A A . 17 LEU CG 1 1 19 8151 1 1 17 LEU H H -2.713 0.527 -3.364 1.00 . A A . 17 LEU H 1 1 19 8152 1 1 17 LEU HA H -4.218 1.515 -5.685 1.00 . A A . 17 LEU HA 1 1 19 8153 1 1 17 LEU HB2 H -5.455 -0.551 -5.616 1.00 . A A . 17 LEU HB2 1 1 19 8154 1 1 17 LEU HB3 H -3.738 -0.902 -5.618 1.00 . A A . 17 LEU HB3 1 1 19 8155 1 1 17 LEU HD11 H -6.614 -1.980 -4.577 1.00 . A A . 17 LEU HD11 1 1 19 8156 1 1 17 LEU HD12 H -6.239 -2.656 -2.992 1.00 . A A . 17 LEU HD12 1 1 19 8157 1 1 17 LEU HD13 H -6.720 -0.966 -3.137 1.00 . A A . 17 LEU HD13 1 1 19 8158 1 1 17 LEU HD21 H -3.002 -2.406 -4.526 1.00 . A A . 17 LEU HD21 1 1 19 8159 1 1 17 LEU HD22 H -3.467 -2.852 -2.885 1.00 . A A . 17 LEU HD22 1 1 19 8160 1 1 17 LEU HD23 H -4.409 -3.435 -4.257 1.00 . A A . 17 LEU HD23 1 1 19 8161 1 1 17 LEU HG H -4.426 -0.805 -2.913 1.00 . A A . 17 LEU HG 1 1 19 8162 1 1 17 LEU N N -2.946 1.115 -4.111 1.00 . A A . 17 LEU N 1 1 19 8163 1 1 17 LEU O O -5.169 1.703 -2.660 1.00 . A A . 17 LEU O 1 1 19 8164 1 1 18 ALA C C -7.077 3.663 -2.854 1.00 . A A . 18 ALA C 1 1 19 8165 1 1 18 ALA CA C -7.570 2.527 -3.751 1.00 . A A . 18 ALA CA 1 1 19 8166 1 1 18 ALA CB C -8.279 1.454 -2.936 1.00 . A A . 18 ALA CB 1 1 19 8167 1 1 18 ALA H H -6.536 1.816 -5.458 1.00 . A A . 18 ALA H 1 1 19 8168 1 1 18 ALA HA H -8.272 2.927 -4.470 1.00 . A A . 18 ALA HA 1 1 19 8169 1 1 18 ALA HB1 H -8.317 0.536 -3.505 1.00 . A A . 18 ALA HB1 1 1 19 8170 1 1 18 ALA HB2 H -7.740 1.285 -2.016 1.00 . A A . 18 ALA HB2 1 1 19 8171 1 1 18 ALA HB3 H -9.284 1.778 -2.711 1.00 . A A . 18 ALA HB3 1 1 19 8172 1 1 18 ALA N N -6.459 1.940 -4.488 1.00 . A A . 18 ALA N 1 1 19 8173 1 1 18 ALA O O -6.079 4.314 -3.164 1.00 . A A . 18 ALA O 1 1 19 8174 1 1 19 GLU C C -6.404 4.427 0.232 1.00 . A A . 19 GLU C 1 1 19 8175 1 1 19 GLU CA C -7.377 4.954 -0.821 1.00 . A A . 19 GLU CA 1 1 19 8176 1 1 19 GLU CB C -8.613 5.551 -0.143 1.00 . A A . 19 GLU CB 1 1 19 8177 1 1 19 GLU CD C -8.277 7.814 -1.214 1.00 . A A . 19 GLU CD 1 1 19 8178 1 1 19 GLU CG C -8.522 7.052 0.075 1.00 . A A . 19 GLU CG 1 1 19 8179 1 1 19 GLU H H -8.554 3.351 -1.539 1.00 . A A . 19 GLU H 1 1 19 8180 1 1 19 GLU HA H -6.885 5.727 -1.393 1.00 . A A . 19 GLU HA 1 1 19 8181 1 1 19 GLU HB2 H -9.478 5.349 -0.757 1.00 . A A . 19 GLU HB2 1 1 19 8182 1 1 19 GLU HB3 H -8.746 5.077 0.818 1.00 . A A . 19 GLU HB3 1 1 19 8183 1 1 19 GLU HG2 H -9.449 7.398 0.507 1.00 . A A . 19 GLU HG2 1 1 19 8184 1 1 19 GLU HG3 H -7.710 7.257 0.756 1.00 . A A . 19 GLU HG3 1 1 19 8185 1 1 19 GLU N N -7.768 3.898 -1.744 1.00 . A A . 19 GLU N 1 1 19 8186 1 1 19 GLU O O -6.668 4.513 1.432 1.00 . A A . 19 GLU O 1 1 19 8187 1 1 19 GLU OE1 O -7.099 7.953 -1.606 1.00 . A A . 19 GLU OE1 1 1 19 8188 1 1 19 GLU OE2 O -9.262 8.271 -1.831 1.00 . A A . 19 GLU OE2 1 1 19 8189 1 1 20 CYS C C -2.902 3.950 0.347 1.00 . A A . 20 CYS C 1 1 19 8190 1 1 20 CYS CA C -4.264 3.367 0.690 1.00 . A A . 20 CYS CA 1 1 19 8191 1 1 20 CYS CB C -4.225 1.838 0.623 1.00 . A A . 20 CYS CB 1 1 19 8192 1 1 20 CYS H H -5.100 3.854 -1.186 1.00 . A A . 20 CYS H 1 1 19 8193 1 1 20 CYS HA H -4.531 3.669 1.692 1.00 . A A . 20 CYS HA 1 1 19 8194 1 1 20 CYS HB2 H -4.548 1.519 -0.357 1.00 . A A . 20 CYS HB2 1 1 19 8195 1 1 20 CYS HB3 H -3.213 1.502 0.790 1.00 . A A . 20 CYS HB3 1 1 19 8196 1 1 20 CYS N N -5.270 3.891 -0.220 1.00 . A A . 20 CYS N 1 1 19 8197 1 1 20 CYS O O -2.798 4.831 -0.506 1.00 . A A . 20 CYS O 1 1 19 8198 1 1 20 CYS SG S -5.292 1.018 1.852 1.00 . A A . 20 CYS SG 1 1 19 8199 1 1 21 VAL C C 0.499 2.849 0.606 1.00 . A A . 21 VAL C 1 1 19 8200 1 1 21 VAL CA C -0.520 3.974 0.752 1.00 . A A . 21 VAL CA 1 1 19 8201 1 1 21 VAL CB C -0.056 4.939 1.864 1.00 . A A . 21 VAL CB 1 1 19 8202 1 1 21 VAL CG1 C -1.053 6.074 2.032 1.00 . A A . 21 VAL CG1 1 1 19 8203 1 1 21 VAL CG2 C 0.141 4.196 3.178 1.00 . A A . 21 VAL CG2 1 1 19 8204 1 1 21 VAL H H -1.993 2.771 1.685 1.00 . A A . 21 VAL H 1 1 19 8205 1 1 21 VAL HA H -0.553 4.528 -0.175 1.00 . A A . 21 VAL HA 1 1 19 8206 1 1 21 VAL HB H 0.894 5.367 1.568 1.00 . A A . 21 VAL HB 1 1 19 8207 1 1 21 VAL HG11 H -1.561 6.249 1.095 1.00 . A A . 21 VAL HG11 1 1 19 8208 1 1 21 VAL HG12 H -1.777 5.809 2.789 1.00 . A A . 21 VAL HG12 1 1 19 8209 1 1 21 VAL HG13 H -0.531 6.971 2.331 1.00 . A A . 21 VAL HG13 1 1 19 8210 1 1 21 VAL HG21 H 0.882 3.422 3.046 1.00 . A A . 21 VAL HG21 1 1 19 8211 1 1 21 VAL HG22 H 0.476 4.889 3.937 1.00 . A A . 21 VAL HG22 1 1 19 8212 1 1 21 VAL HG23 H -0.795 3.751 3.484 1.00 . A A . 21 VAL HG23 1 1 19 8213 1 1 21 VAL N N -1.859 3.469 1.010 1.00 . A A . 21 VAL N 1 1 19 8214 1 1 21 VAL O O 0.296 1.732 1.080 1.00 . A A . 21 VAL O 1 1 19 8215 1 1 22 CYS C C 3.805 2.474 0.732 1.00 . A A . 22 CYS C 1 1 19 8216 1 1 22 CYS CA C 2.692 2.238 -0.285 1.00 . A A . 22 CYS CA 1 1 19 8217 1 1 22 CYS CB C 3.240 2.401 -1.711 1.00 . A A . 22 CYS CB 1 1 19 8218 1 1 22 CYS H H 1.679 4.087 -0.389 1.00 . A A . 22 CYS H 1 1 19 8219 1 1 22 CYS HA H 2.308 1.236 -0.163 1.00 . A A . 22 CYS HA 1 1 19 8220 1 1 22 CYS HB2 H 3.225 3.443 -1.976 1.00 . A A . 22 CYS HB2 1 1 19 8221 1 1 22 CYS HB3 H 4.257 2.050 -1.749 1.00 . A A . 22 CYS HB3 1 1 19 8222 1 1 22 CYS N N 1.599 3.178 -0.053 1.00 . A A . 22 CYS N 1 1 19 8223 1 1 22 CYS O O 4.164 3.617 1.015 1.00 . A A . 22 CYS O 1 1 19 8224 1 1 22 CYS SG S 2.294 1.504 -2.982 1.00 . A A . 22 CYS SG 1 1 19 8225 1 1 23 LEU C C 6.766 1.245 1.683 1.00 . A A . 23 LEU C 1 1 19 8226 1 1 23 LEU CA C 5.392 1.497 2.293 1.00 . A A . 23 LEU CA 1 1 19 8227 1 1 23 LEU CB C 5.133 0.516 3.435 1.00 . A A . 23 LEU CB 1 1 19 8228 1 1 23 LEU CD1 C 3.316 -0.649 4.713 1.00 . A A . 23 LEU CD1 1 1 19 8229 1 1 23 LEU CD2 C 3.850 1.742 5.206 1.00 . A A . 23 LEU CD2 1 1 19 8230 1 1 23 LEU CG C 3.776 0.675 4.126 1.00 . A A . 23 LEU CG 1 1 19 8231 1 1 23 LEU H H 4.001 0.508 1.038 1.00 . A A . 23 LEU H 1 1 19 8232 1 1 23 LEU HA H 5.370 2.502 2.687 1.00 . A A . 23 LEU HA 1 1 19 8233 1 1 23 LEU HB2 H 5.201 -0.489 3.043 1.00 . A A . 23 LEU HB2 1 1 19 8234 1 1 23 LEU HB3 H 5.907 0.649 4.176 1.00 . A A . 23 LEU HB3 1 1 19 8235 1 1 23 LEU HD11 H 3.592 -1.454 4.047 1.00 . A A . 23 LEU HD11 1 1 19 8236 1 1 23 LEU HD12 H 3.785 -0.799 5.674 1.00 . A A . 23 LEU HD12 1 1 19 8237 1 1 23 LEU HD13 H 2.243 -0.636 4.834 1.00 . A A . 23 LEU HD13 1 1 19 8238 1 1 23 LEU HD21 H 4.812 1.694 5.695 1.00 . A A . 23 LEU HD21 1 1 19 8239 1 1 23 LEU HD22 H 3.722 2.717 4.759 1.00 . A A . 23 LEU HD22 1 1 19 8240 1 1 23 LEU HD23 H 3.069 1.573 5.932 1.00 . A A . 23 LEU HD23 1 1 19 8241 1 1 23 LEU HG H 3.044 0.987 3.394 1.00 . A A . 23 LEU HG 1 1 19 8242 1 1 23 LEU N N 4.336 1.393 1.293 1.00 . A A . 23 LEU N 1 1 19 8243 1 1 23 LEU O O 6.924 0.404 0.796 1.00 . A A . 23 LEU O 1 1 19 8244 1 1 24 GLU C C 9.648 0.447 1.787 1.00 . A A . 24 GLU C 1 1 19 8245 1 1 24 GLU CA C 9.127 1.876 1.677 1.00 . A A . 24 GLU CA 1 1 19 8246 1 1 24 GLU CB C 10.044 2.824 2.450 1.00 . A A . 24 GLU CB 1 1 19 8247 1 1 24 GLU CD C 9.570 4.179 4.531 1.00 . A A . 24 GLU CD 1 1 19 8248 1 1 24 GLU CG C 9.821 2.800 3.954 1.00 . A A . 24 GLU CG 1 1 19 8249 1 1 24 GLU H H 7.557 2.647 2.867 1.00 . A A . 24 GLU H 1 1 19 8250 1 1 24 GLU HA H 9.128 2.165 0.636 1.00 . A A . 24 GLU HA 1 1 19 8251 1 1 24 GLU HB2 H 11.071 2.550 2.257 1.00 . A A . 24 GLU HB2 1 1 19 8252 1 1 24 GLU HB3 H 9.879 3.832 2.100 1.00 . A A . 24 GLU HB3 1 1 19 8253 1 1 24 GLU HG2 H 8.966 2.176 4.169 1.00 . A A . 24 GLU HG2 1 1 19 8254 1 1 24 GLU HG3 H 10.697 2.381 4.428 1.00 . A A . 24 GLU HG3 1 1 19 8255 1 1 24 GLU N N 7.756 1.992 2.165 1.00 . A A . 24 GLU N 1 1 19 8256 1 1 24 GLU O O 10.246 -0.076 0.844 1.00 . A A . 24 GLU O 1 1 19 8257 1 1 24 GLU OE1 O 10.466 5.042 4.418 1.00 . A A . 24 GLU OE1 1 1 19 8258 1 1 24 GLU OE2 O 8.477 4.397 5.096 1.00 . A A . 24 GLU OE2 1 1 19 8259 1 1 25 HIS C C 9.303 -2.492 2.101 1.00 . A A . 25 HIS C 1 1 19 8260 1 1 25 HIS CA C 9.896 -1.553 3.144 1.00 . A A . 25 HIS CA 1 1 19 8261 1 1 25 HIS CB C 9.558 -2.041 4.557 1.00 . A A . 25 HIS CB 1 1 19 8262 1 1 25 HIS CD2 C 7.006 -2.503 4.614 1.00 . A A . 25 HIS CD2 1 1 19 8263 1 1 25 HIS CE1 C 6.425 -0.911 6.004 1.00 . A A . 25 HIS CE1 1 1 19 8264 1 1 25 HIS CG C 8.130 -1.830 4.954 1.00 . A A . 25 HIS CG 1 1 19 8265 1 1 25 HIS H H 8.952 0.274 3.656 1.00 . A A . 25 HIS H 1 1 19 8266 1 1 25 HIS HA H 10.969 -1.551 3.027 1.00 . A A . 25 HIS HA 1 1 19 8267 1 1 25 HIS HB2 H 9.764 -3.098 4.621 1.00 . A A . 25 HIS HB2 1 1 19 8268 1 1 25 HIS HB3 H 10.181 -1.515 5.266 1.00 . A A . 25 HIS HB3 1 1 19 8269 1 1 25 HIS HD1 H 8.319 -0.178 6.247 1.00 . A A . 25 HIS HD1 1 1 19 8270 1 1 25 HIS HD2 H 6.943 -3.347 3.943 1.00 . A A . 25 HIS HD2 1 1 19 8271 1 1 25 HIS HE1 H 5.838 -0.261 6.634 1.00 . A A . 25 HIS HE1 1 1 19 8272 1 1 25 HIS HE2 H 5.060 -2.292 5.365 1.00 . A A . 25 HIS HE2 1 1 19 8273 1 1 25 HIS N N 9.431 -0.186 2.936 1.00 . A A . 25 HIS N 1 1 19 8274 1 1 25 HIS ND1 N 7.732 -0.838 5.824 1.00 . A A . 25 HIS ND1 1 1 19 8275 1 1 25 HIS NE2 N 5.960 -1.913 5.281 1.00 . A A . 25 HIS NE2 1 1 19 8276 1 1 25 HIS O O 9.855 -3.557 1.823 1.00 . A A . 25 HIS O 1 1 19 8277 1 1 26 GLY C C 6.237 -3.504 0.937 1.00 . A A . 26 GLY C 1 1 19 8278 1 1 26 GLY CA C 7.550 -2.894 0.490 1.00 . A A . 26 GLY CA 1 1 19 8279 1 1 26 GLY H H 7.792 -1.223 1.759 1.00 . A A . 26 GLY H 1 1 19 8280 1 1 26 GLY HA2 H 8.225 -3.690 0.209 1.00 . A A . 26 GLY HA2 1 1 19 8281 1 1 26 GLY HA3 H 7.367 -2.275 -0.374 1.00 . A A . 26 GLY HA3 1 1 19 8282 1 1 26 GLY N N 8.183 -2.085 1.510 1.00 . A A . 26 GLY N 1 1 19 8283 1 1 26 GLY O O 6.117 -4.724 1.034 1.00 . A A . 26 GLY O 1 1 19 8284 1 1 27 TYR C C 2.911 -1.981 1.584 1.00 . A A . 27 TYR C 1 1 19 8285 1 1 27 TYR CA C 3.930 -3.117 1.628 1.00 . A A . 27 TYR CA 1 1 19 8286 1 1 27 TYR CB C 3.998 -3.691 3.044 1.00 . A A . 27 TYR CB 1 1 19 8287 1 1 27 TYR CD1 C 4.065 -6.076 2.213 1.00 . A A . 27 TYR CD1 1 1 19 8288 1 1 27 TYR CD2 C 5.442 -5.490 4.068 1.00 . A A . 27 TYR CD2 1 1 19 8289 1 1 27 TYR CE1 C 4.534 -7.375 2.270 1.00 . A A . 27 TYR CE1 1 1 19 8290 1 1 27 TYR CE2 C 5.915 -6.787 4.131 1.00 . A A . 27 TYR CE2 1 1 19 8291 1 1 27 TYR CG C 4.510 -5.113 3.110 1.00 . A A . 27 TYR CG 1 1 19 8292 1 1 27 TYR CZ C 5.458 -7.725 3.231 1.00 . A A . 27 TYR CZ 1 1 19 8293 1 1 27 TYR H H 5.404 -1.692 1.093 1.00 . A A . 27 TYR H 1 1 19 8294 1 1 27 TYR HA H 3.614 -3.894 0.949 1.00 . A A . 27 TYR HA 1 1 19 8295 1 1 27 TYR HB2 H 4.655 -3.079 3.638 1.00 . A A . 27 TYR HB2 1 1 19 8296 1 1 27 TYR HB3 H 3.009 -3.674 3.479 1.00 . A A . 27 TYR HB3 1 1 19 8297 1 1 27 TYR HD1 H 3.340 -5.799 1.462 1.00 . A A . 27 TYR HD1 1 1 19 8298 1 1 27 TYR HD2 H 5.798 -4.754 4.773 1.00 . A A . 27 TYR HD2 1 1 19 8299 1 1 27 TYR HE1 H 4.176 -8.109 1.564 1.00 . A A . 27 TYR HE1 1 1 19 8300 1 1 27 TYR HE2 H 6.640 -7.061 4.884 1.00 . A A . 27 TYR HE2 1 1 19 8301 1 1 27 TYR HH H 5.846 -9.346 4.188 1.00 . A A . 27 TYR HH 1 1 19 8302 1 1 27 TYR N N 5.247 -2.653 1.199 1.00 . A A . 27 TYR N 1 1 19 8303 1 1 27 TYR O O 3.229 -0.837 1.906 1.00 . A A . 27 TYR O 1 1 19 8304 1 1 27 TYR OH O 5.927 -9.017 3.291 1.00 . A A . 27 TYR OH 1 1 19 8305 1 1 28 CYS C C -0.278 -1.382 2.344 1.00 . A A . 28 CYS C 1 1 19 8306 1 1 28 CYS CA C 0.616 -1.312 1.110 1.00 . A A . 28 CYS CA 1 1 19 8307 1 1 28 CYS CB C -0.228 -1.531 -0.151 1.00 . A A . 28 CYS CB 1 1 19 8308 1 1 28 CYS H H 1.492 -3.235 0.946 1.00 . A A . 28 CYS H 1 1 19 8309 1 1 28 CYS HA H 1.073 -0.336 1.063 1.00 . A A . 28 CYS HA 1 1 19 8310 1 1 28 CYS HB2 H 0.011 -2.496 -0.571 1.00 . A A . 28 CYS HB2 1 1 19 8311 1 1 28 CYS HB3 H -1.275 -1.510 0.116 1.00 . A A . 28 CYS HB3 1 1 19 8312 1 1 28 CYS N N 1.683 -2.306 1.190 1.00 . A A . 28 CYS N 1 1 19 8313 1 1 28 CYS O O -0.864 -2.423 2.640 1.00 . A A . 28 CYS O 1 1 19 8314 1 1 28 CYS SG S 0.034 -0.284 -1.455 1.00 . A A . 28 CYS SG 1 1 19 8315 1 1 29 GLY C C -2.550 0.421 4.005 1.00 . A A . 29 GLY C 1 1 19 8316 1 1 29 GLY CA C -1.200 -0.223 4.254 1.00 . A A . 29 GLY CA 1 1 19 8317 1 1 29 GLY H H 0.113 0.532 2.775 1.00 . A A . 29 GLY H 1 1 19 8318 1 1 29 GLY HA2 H -0.680 0.341 5.015 1.00 . A A . 29 GLY HA2 1 1 19 8319 1 1 29 GLY HA3 H -1.353 -1.230 4.610 1.00 . A A . 29 GLY HA3 1 1 19 8320 1 1 29 GLY N N -0.377 -0.267 3.060 1.00 . A A . 29 GLY N 1 1 19 8321 1 1 29 GLY O O -3.527 -0.321 3.771 1.00 . A A . 29 GLY O 1 1 19 8322 1 1 29 GLY OXT O -2.630 1.666 4.046 1.00 . A A . 29 GLY OXT 1 1 20 8323 1 1 1 ARG C C -8.514 2.862 4.262 1.00 . A A . 1 ARG C 1 1 20 8324 1 1 1 ARG CA C -8.114 4.312 4.512 1.00 . A A . 1 ARG CA 1 1 20 8325 1 1 1 ARG CB C -6.643 4.391 4.925 1.00 . A A . 1 ARG CB 1 1 20 8326 1 1 1 ARG CD C -5.041 3.138 6.401 1.00 . A A . 1 ARG CD 1 1 20 8327 1 1 1 ARG CG C -6.375 3.862 6.325 1.00 . A A . 1 ARG CG 1 1 20 8328 1 1 1 ARG CZ C -3.937 4.426 8.188 1.00 . A A . 1 ARG CZ 1 1 20 8329 1 1 1 ARG H1 H -8.833 4.335 6.439 1.00 . A A . 1 ARG H1 1 1 20 8330 1 1 1 ARG H2 H -8.592 5.887 5.747 1.00 . A A . 1 ARG H2 1 1 20 8331 1 1 1 ARG H3 H -9.929 4.927 5.262 1.00 . A A . 1 ARG H3 1 1 20 8332 1 1 1 ARG HA H -8.260 4.878 3.604 1.00 . A A . 1 ARG HA 1 1 20 8333 1 1 1 ARG HB2 H -6.054 3.816 4.227 1.00 . A A . 1 ARG HB2 1 1 20 8334 1 1 1 ARG HB3 H -6.326 5.422 4.888 1.00 . A A . 1 ARG HB3 1 1 20 8335 1 1 1 ARG HD2 H -5.149 2.277 7.045 1.00 . A A . 1 ARG HD2 1 1 20 8336 1 1 1 ARG HD3 H -4.766 2.812 5.409 1.00 . A A . 1 ARG HD3 1 1 20 8337 1 1 1 ARG HE H -3.267 4.261 6.315 1.00 . A A . 1 ARG HE 1 1 20 8338 1 1 1 ARG HG2 H -6.364 4.691 7.018 1.00 . A A . 1 ARG HG2 1 1 20 8339 1 1 1 ARG HG3 H -7.164 3.175 6.597 1.00 . A A . 1 ARG HG3 1 1 20 8340 1 1 1 ARG HH11 H -5.646 3.504 8.753 1.00 . A A . 1 ARG HH11 1 1 20 8341 1 1 1 ARG HH12 H -4.849 4.414 9.992 1.00 . A A . 1 ARG HH12 1 1 20 8342 1 1 1 ARG HH21 H -2.217 5.458 7.944 1.00 . A A . 1 ARG HH21 1 1 20 8343 1 1 1 ARG HH22 H -2.903 5.525 9.533 1.00 . A A . 1 ARG HH22 1 1 20 8344 1 1 1 ARG N N -8.942 4.920 5.587 1.00 . A A . 1 ARG N 1 1 20 8345 1 1 1 ARG NE N -3.982 3.994 6.929 1.00 . A A . 1 ARG NE 1 1 20 8346 1 1 1 ARG NH1 N -4.889 4.087 9.048 1.00 . A A . 1 ARG NH1 1 1 20 8347 1 1 1 ARG NH2 N -2.937 5.200 8.588 1.00 . A A . 1 ARG NH2 1 1 20 8348 1 1 1 ARG O O -8.028 1.949 4.930 1.00 . A A . 1 ARG O 1 1 20 8349 1 1 2 VAL C C -9.155 0.784 1.718 1.00 . A A . 2 VAL C 1 1 20 8350 1 1 2 VAL CA C -9.868 1.317 2.958 1.00 . A A . 2 VAL CA 1 1 20 8351 1 1 2 VAL CB C -11.391 1.294 2.718 1.00 . A A . 2 VAL CB 1 1 20 8352 1 1 2 VAL CG1 C -11.764 2.193 1.548 1.00 . A A . 2 VAL CG1 1 1 20 8353 1 1 2 VAL CG2 C -11.876 -0.130 2.484 1.00 . A A . 2 VAL CG2 1 1 20 8354 1 1 2 VAL H H -9.755 3.424 2.798 1.00 . A A . 2 VAL H 1 1 20 8355 1 1 2 VAL HA H -9.647 0.667 3.794 1.00 . A A . 2 VAL HA 1 1 20 8356 1 1 2 VAL HB H -11.879 1.675 3.604 1.00 . A A . 2 VAL HB 1 1 20 8357 1 1 2 VAL HG11 H -11.207 1.894 0.673 1.00 . A A . 2 VAL HG11 1 1 20 8358 1 1 2 VAL HG12 H -12.822 2.104 1.350 1.00 . A A . 2 VAL HG12 1 1 20 8359 1 1 2 VAL HG13 H -11.529 3.218 1.793 1.00 . A A . 2 VAL HG13 1 1 20 8360 1 1 2 VAL HG21 H -11.206 -0.823 2.968 1.00 . A A . 2 VAL HG21 1 1 20 8361 1 1 2 VAL HG22 H -12.869 -0.243 2.893 1.00 . A A . 2 VAL HG22 1 1 20 8362 1 1 2 VAL HG23 H -11.899 -0.332 1.424 1.00 . A A . 2 VAL HG23 1 1 20 8363 1 1 2 VAL N N -9.403 2.656 3.296 1.00 . A A . 2 VAL N 1 1 20 8364 1 1 2 VAL O O -8.947 1.513 0.749 1.00 . A A . 2 VAL O 1 1 20 8365 1 1 3 CYS C C -7.925 -2.623 0.886 1.00 . A A . 3 CYS C 1 1 20 8366 1 1 3 CYS CA C -8.094 -1.124 0.641 1.00 . A A . 3 CYS CA 1 1 20 8367 1 1 3 CYS CB C -6.727 -0.470 0.419 1.00 . A A . 3 CYS CB 1 1 20 8368 1 1 3 CYS H H -8.977 -1.020 2.561 1.00 . A A . 3 CYS H 1 1 20 8369 1 1 3 CYS HA H -8.699 -0.979 -0.241 1.00 . A A . 3 CYS HA 1 1 20 8370 1 1 3 CYS HB2 H -6.302 -0.846 -0.499 1.00 . A A . 3 CYS HB2 1 1 20 8371 1 1 3 CYS HB3 H -6.858 0.599 0.336 1.00 . A A . 3 CYS HB3 1 1 20 8372 1 1 3 CYS N N -8.783 -0.491 1.760 1.00 . A A . 3 CYS N 1 1 20 8373 1 1 3 CYS O O -7.460 -3.033 1.950 1.00 . A A . 3 CYS O 1 1 20 8374 1 1 3 CYS SG S -5.524 -0.780 1.752 1.00 . A A . 3 CYS SG 1 1 20 8375 1 1 4 PRO C C -6.861 -5.357 0.648 1.00 . A A . 4 PRO C 1 1 20 8376 1 1 4 PRO CA C -8.183 -4.921 0.024 1.00 . A A . 4 PRO CA 1 1 20 8377 1 1 4 PRO CB C -8.269 -5.389 -1.426 1.00 . A A . 4 PRO CB 1 1 20 8378 1 1 4 PRO CD C -8.861 -3.067 -1.404 1.00 . A A . 4 PRO CD 1 1 20 8379 1 1 4 PRO CG C -9.143 -4.380 -2.088 1.00 . A A . 4 PRO CG 1 1 20 8380 1 1 4 PRO HA H -9.002 -5.340 0.589 1.00 . A A . 4 PRO HA 1 1 20 8381 1 1 4 PRO HB2 H -7.280 -5.405 -1.861 1.00 . A A . 4 PRO HB2 1 1 20 8382 1 1 4 PRO HB3 H -8.703 -6.376 -1.465 1.00 . A A . 4 PRO HB3 1 1 20 8383 1 1 4 PRO HD2 H -8.143 -2.493 -1.971 1.00 . A A . 4 PRO HD2 1 1 20 8384 1 1 4 PRO HD3 H -9.774 -2.506 -1.274 1.00 . A A . 4 PRO HD3 1 1 20 8385 1 1 4 PRO HG2 H -8.898 -4.316 -3.138 1.00 . A A . 4 PRO HG2 1 1 20 8386 1 1 4 PRO HG3 H -10.179 -4.654 -1.960 1.00 . A A . 4 PRO HG3 1 1 20 8387 1 1 4 PRO N N -8.298 -3.465 -0.097 1.00 . A A . 4 PRO N 1 1 20 8388 1 1 4 PRO O O -5.797 -4.851 0.288 1.00 . A A . 4 PRO O 1 1 20 8389 1 1 5 ARG C C -4.867 -7.587 1.291 1.00 . A A . 5 ARG C 1 1 20 8390 1 1 5 ARG CA C -5.743 -6.797 2.257 1.00 . A A . 5 ARG CA 1 1 20 8391 1 1 5 ARG CB C -6.133 -7.675 3.448 1.00 . A A . 5 ARG CB 1 1 20 8392 1 1 5 ARG CD C -5.822 -8.075 5.909 1.00 . A A . 5 ARG CD 1 1 20 8393 1 1 5 ARG CG C -5.188 -7.548 4.631 1.00 . A A . 5 ARG CG 1 1 20 8394 1 1 5 ARG CZ C -4.394 -7.219 7.724 1.00 . A A . 5 ARG CZ 1 1 20 8395 1 1 5 ARG H H -7.811 -6.661 1.828 1.00 . A A . 5 ARG H 1 1 20 8396 1 1 5 ARG HA H -5.184 -5.947 2.617 1.00 . A A . 5 ARG HA 1 1 20 8397 1 1 5 ARG HB2 H -7.124 -7.399 3.774 1.00 . A A . 5 ARG HB2 1 1 20 8398 1 1 5 ARG HB3 H -6.142 -8.708 3.131 1.00 . A A . 5 ARG HB3 1 1 20 8399 1 1 5 ARG HD2 H -6.588 -7.383 6.227 1.00 . A A . 5 ARG HD2 1 1 20 8400 1 1 5 ARG HD3 H -6.270 -9.036 5.702 1.00 . A A . 5 ARG HD3 1 1 20 8401 1 1 5 ARG HE H -4.505 -9.130 7.162 1.00 . A A . 5 ARG HE 1 1 20 8402 1 1 5 ARG HG2 H -4.291 -8.114 4.427 1.00 . A A . 5 ARG HG2 1 1 20 8403 1 1 5 ARG HG3 H -4.936 -6.507 4.768 1.00 . A A . 5 ARG HG3 1 1 20 8404 1 1 5 ARG HH11 H -5.500 -5.805 6.791 1.00 . A A . 5 ARG HH11 1 1 20 8405 1 1 5 ARG HH12 H -4.487 -5.229 8.072 1.00 . A A . 5 ARG HH12 1 1 20 8406 1 1 5 ARG HH21 H -3.173 -8.374 8.846 1.00 . A A . 5 ARG HH21 1 1 20 8407 1 1 5 ARG HH22 H -3.166 -6.687 9.238 1.00 . A A . 5 ARG HH22 1 1 20 8408 1 1 5 ARG N N -6.935 -6.297 1.585 1.00 . A A . 5 ARG N 1 1 20 8409 1 1 5 ARG NE N -4.845 -8.228 6.983 1.00 . A A . 5 ARG NE 1 1 20 8410 1 1 5 ARG NH1 N -4.829 -5.983 7.512 1.00 . A A . 5 ARG NH1 1 1 20 8411 1 1 5 ARG NH2 N -3.505 -7.445 8.682 1.00 . A A . 5 ARG NH2 1 1 20 8412 1 1 5 ARG O O -4.886 -8.817 1.283 1.00 . A A . 5 ARG O 1 1 20 8413 1 1 6 ILE C C -1.816 -6.891 -0.429 1.00 . A A . 6 ILE C 1 1 20 8414 1 1 6 ILE CA C -3.213 -7.498 -0.491 1.00 . A A . 6 ILE CA 1 1 20 8415 1 1 6 ILE CB C -3.757 -7.358 -1.925 1.00 . A A . 6 ILE CB 1 1 20 8416 1 1 6 ILE CD1 C -5.458 -9.235 -1.660 1.00 . A A . 6 ILE CD1 1 1 20 8417 1 1 6 ILE CG1 C -5.229 -7.774 -1.979 1.00 . A A . 6 ILE CG1 1 1 20 8418 1 1 6 ILE CG2 C -2.929 -8.191 -2.890 1.00 . A A . 6 ILE CG2 1 1 20 8419 1 1 6 ILE H H -4.130 -5.891 0.535 1.00 . A A . 6 ILE H 1 1 20 8420 1 1 6 ILE HA H -3.150 -8.550 -0.253 1.00 . A A . 6 ILE HA 1 1 20 8421 1 1 6 ILE HB H -3.673 -6.322 -2.218 1.00 . A A . 6 ILE HB 1 1 20 8422 1 1 6 ILE HD11 H -4.607 -9.622 -1.118 1.00 . A A . 6 ILE HD11 1 1 20 8423 1 1 6 ILE HD12 H -6.347 -9.337 -1.054 1.00 . A A . 6 ILE HD12 1 1 20 8424 1 1 6 ILE HD13 H -5.583 -9.789 -2.579 1.00 . A A . 6 ILE HD13 1 1 20 8425 1 1 6 ILE HG12 H -5.789 -7.188 -1.267 1.00 . A A . 6 ILE HG12 1 1 20 8426 1 1 6 ILE HG13 H -5.613 -7.587 -2.972 1.00 . A A . 6 ILE HG13 1 1 20 8427 1 1 6 ILE HG21 H -2.581 -9.082 -2.389 1.00 . A A . 6 ILE HG21 1 1 20 8428 1 1 6 ILE HG22 H -3.535 -8.469 -3.739 1.00 . A A . 6 ILE HG22 1 1 20 8429 1 1 6 ILE HG23 H -2.080 -7.614 -3.228 1.00 . A A . 6 ILE HG23 1 1 20 8430 1 1 6 ILE N N -4.100 -6.869 0.479 1.00 . A A . 6 ILE N 1 1 20 8431 1 1 6 ILE O O -1.647 -5.681 -0.583 1.00 . A A . 6 ILE O 1 1 20 8432 1 1 7 LEU C C 0.979 -6.555 -1.392 1.00 . A A . 7 LEU C 1 1 20 8433 1 1 7 LEU CA C 0.568 -7.284 -0.118 1.00 . A A . 7 LEU CA 1 1 20 8434 1 1 7 LEU CB C 1.500 -8.471 0.124 1.00 . A A . 7 LEU CB 1 1 20 8435 1 1 7 LEU CD1 C 2.086 -10.511 1.457 1.00 . A A . 7 LEU CD1 1 1 20 8436 1 1 7 LEU CD2 C 1.500 -8.379 2.630 1.00 . A A . 7 LEU CD2 1 1 20 8437 1 1 7 LEU CG C 1.234 -9.252 1.412 1.00 . A A . 7 LEU CG 1 1 20 8438 1 1 7 LEU H H -1.015 -8.691 -0.087 1.00 . A A . 7 LEU H 1 1 20 8439 1 1 7 LEU HA H 0.644 -6.601 0.715 1.00 . A A . 7 LEU HA 1 1 20 8440 1 1 7 LEU HB2 H 1.409 -9.151 -0.711 1.00 . A A . 7 LEU HB2 1 1 20 8441 1 1 7 LEU HB3 H 2.515 -8.104 0.157 1.00 . A A . 7 LEU HB3 1 1 20 8442 1 1 7 LEU HD11 H 2.376 -10.786 0.453 1.00 . A A . 7 LEU HD11 1 1 20 8443 1 1 7 LEU HD12 H 2.971 -10.326 2.048 1.00 . A A . 7 LEU HD12 1 1 20 8444 1 1 7 LEU HD13 H 1.517 -11.315 1.900 1.00 . A A . 7 LEU HD13 1 1 20 8445 1 1 7 LEU HD21 H 1.573 -7.346 2.324 1.00 . A A . 7 LEU HD21 1 1 20 8446 1 1 7 LEU HD22 H 0.690 -8.490 3.335 1.00 . A A . 7 LEU HD22 1 1 20 8447 1 1 7 LEU HD23 H 2.427 -8.681 3.095 1.00 . A A . 7 LEU HD23 1 1 20 8448 1 1 7 LEU HG H 0.196 -9.552 1.435 1.00 . A A . 7 LEU HG 1 1 20 8449 1 1 7 LEU N N -0.817 -7.737 -0.201 1.00 . A A . 7 LEU N 1 1 20 8450 1 1 7 LEU O O 0.622 -6.966 -2.496 1.00 . A A . 7 LEU O 1 1 20 8451 1 1 8 LEU C C 3.322 -3.754 -1.972 1.00 . A A . 8 LEU C 1 1 20 8452 1 1 8 LEU CA C 2.191 -4.690 -2.377 1.00 . A A . 8 LEU CA 1 1 20 8453 1 1 8 LEU CB C 1.033 -3.887 -2.971 1.00 . A A . 8 LEU CB 1 1 20 8454 1 1 8 LEU CD1 C -0.287 -3.520 -5.070 1.00 . A A . 8 LEU CD1 1 1 20 8455 1 1 8 LEU CD2 C 1.950 -2.436 -4.796 1.00 . A A . 8 LEU CD2 1 1 20 8456 1 1 8 LEU CG C 1.108 -3.663 -4.482 1.00 . A A . 8 LEU CG 1 1 20 8457 1 1 8 LEU H H 1.988 -5.190 -0.327 1.00 . A A . 8 LEU H 1 1 20 8458 1 1 8 LEU HA H 2.559 -5.379 -3.122 1.00 . A A . 8 LEU HA 1 1 20 8459 1 1 8 LEU HB2 H 0.111 -4.405 -2.750 1.00 . A A . 8 LEU HB2 1 1 20 8460 1 1 8 LEU HB3 H 1.007 -2.920 -2.488 1.00 . A A . 8 LEU HB3 1 1 20 8461 1 1 8 LEU HD11 H -0.912 -4.326 -4.714 1.00 . A A . 8 LEU HD11 1 1 20 8462 1 1 8 LEU HD12 H -0.710 -2.574 -4.766 1.00 . A A . 8 LEU HD12 1 1 20 8463 1 1 8 LEU HD13 H -0.229 -3.559 -6.148 1.00 . A A . 8 LEU HD13 1 1 20 8464 1 1 8 LEU HD21 H 2.917 -2.532 -4.326 1.00 . A A . 8 LEU HD21 1 1 20 8465 1 1 8 LEU HD22 H 2.077 -2.351 -5.865 1.00 . A A . 8 LEU HD22 1 1 20 8466 1 1 8 LEU HD23 H 1.454 -1.553 -4.421 1.00 . A A . 8 LEU HD23 1 1 20 8467 1 1 8 LEU HG H 1.578 -4.519 -4.943 1.00 . A A . 8 LEU HG 1 1 20 8468 1 1 8 LEU N N 1.732 -5.471 -1.234 1.00 . A A . 8 LEU N 1 1 20 8469 1 1 8 LEU O O 3.139 -2.879 -1.126 1.00 . A A . 8 LEU O 1 1 20 8470 1 1 9 GLU C C 5.850 -2.038 -3.330 1.00 . A A . 9 GLU C 1 1 20 8471 1 1 9 GLU CA C 5.656 -3.124 -2.279 1.00 . A A . 9 GLU CA 1 1 20 8472 1 1 9 GLU CB C 6.909 -3.997 -2.202 1.00 . A A . 9 GLU CB 1 1 20 8473 1 1 9 GLU CD C 8.379 -4.045 -4.256 1.00 . A A . 9 GLU CD 1 1 20 8474 1 1 9 GLU CG C 7.238 -4.704 -3.506 1.00 . A A . 9 GLU CG 1 1 20 8475 1 1 9 GLU H H 4.568 -4.663 -3.243 1.00 . A A . 9 GLU H 1 1 20 8476 1 1 9 GLU HA H 5.493 -2.656 -1.322 1.00 . A A . 9 GLU HA 1 1 20 8477 1 1 9 GLU HB2 H 7.750 -3.376 -1.932 1.00 . A A . 9 GLU HB2 1 1 20 8478 1 1 9 GLU HB3 H 6.765 -4.746 -1.437 1.00 . A A . 9 GLU HB3 1 1 20 8479 1 1 9 GLU HG2 H 7.515 -5.725 -3.287 1.00 . A A . 9 GLU HG2 1 1 20 8480 1 1 9 GLU HG3 H 6.361 -4.697 -4.136 1.00 . A A . 9 GLU HG3 1 1 20 8481 1 1 9 GLU N N 4.488 -3.946 -2.580 1.00 . A A . 9 GLU N 1 1 20 8482 1 1 9 GLU O O 5.799 -2.303 -4.531 1.00 . A A . 9 GLU O 1 1 20 8483 1 1 9 GLU OE1 O 8.521 -2.808 -4.152 1.00 . A A . 9 GLU OE1 1 1 20 8484 1 1 9 GLU OE2 O 9.129 -4.764 -4.949 1.00 . A A . 9 GLU OE2 1 1 20 8485 1 1 10 CYS C C 7.073 1.422 -3.089 1.00 . A A . 10 CYS C 1 1 20 8486 1 1 10 CYS CA C 6.260 0.322 -3.766 1.00 . A A . 10 CYS CA 1 1 20 8487 1 1 10 CYS CB C 4.906 0.878 -4.226 1.00 . A A . 10 CYS CB 1 1 20 8488 1 1 10 CYS H H 6.087 -0.661 -1.898 1.00 . A A . 10 CYS H 1 1 20 8489 1 1 10 CYS HA H 6.805 -0.031 -4.628 1.00 . A A . 10 CYS HA 1 1 20 8490 1 1 10 CYS HB2 H 4.845 1.923 -3.962 1.00 . A A . 10 CYS HB2 1 1 20 8491 1 1 10 CYS HB3 H 4.834 0.780 -5.300 1.00 . A A . 10 CYS HB3 1 1 20 8492 1 1 10 CYS N N 6.065 -0.811 -2.867 1.00 . A A . 10 CYS N 1 1 20 8493 1 1 10 CYS O O 7.197 1.451 -1.864 1.00 . A A . 10 CYS O 1 1 20 8494 1 1 10 CYS SG S 3.460 0.041 -3.494 1.00 . A A . 10 CYS SG 1 1 20 8495 1 1 11 LYS C C 7.520 4.592 -2.953 1.00 . A A . 11 LYS C 1 1 20 8496 1 1 11 LYS CA C 8.417 3.432 -3.374 1.00 . A A . 11 LYS CA 1 1 20 8497 1 1 11 LYS CB C 9.422 3.905 -4.426 1.00 . A A . 11 LYS CB 1 1 20 8498 1 1 11 LYS CD C 11.268 2.870 -5.784 1.00 . A A . 11 LYS CD 1 1 20 8499 1 1 11 LYS CE C 12.782 2.727 -5.793 1.00 . A A . 11 LYS CE 1 1 20 8500 1 1 11 LYS CG C 10.744 3.155 -4.385 1.00 . A A . 11 LYS CG 1 1 20 8501 1 1 11 LYS H H 7.482 2.252 -4.862 1.00 . A A . 11 LYS H 1 1 20 8502 1 1 11 LYS HA H 8.955 3.075 -2.509 1.00 . A A . 11 LYS HA 1 1 20 8503 1 1 11 LYS HB2 H 8.988 3.772 -5.407 1.00 . A A . 11 LYS HB2 1 1 20 8504 1 1 11 LYS HB3 H 9.622 4.954 -4.271 1.00 . A A . 11 LYS HB3 1 1 20 8505 1 1 11 LYS HD2 H 10.828 1.953 -6.143 1.00 . A A . 11 LYS HD2 1 1 20 8506 1 1 11 LYS HD3 H 10.988 3.685 -6.436 1.00 . A A . 11 LYS HD3 1 1 20 8507 1 1 11 LYS HE2 H 13.081 2.146 -4.934 1.00 . A A . 11 LYS HE2 1 1 20 8508 1 1 11 LYS HE3 H 13.076 2.212 -6.697 1.00 . A A . 11 LYS HE3 1 1 20 8509 1 1 11 LYS HG2 H 11.470 3.755 -3.856 1.00 . A A . 11 LYS HG2 1 1 20 8510 1 1 11 LYS HG3 H 10.600 2.219 -3.866 1.00 . A A . 11 LYS HG3 1 1 20 8511 1 1 11 LYS HZ1 H 12.839 4.760 -5.314 1.00 . A A . 11 LYS HZ1 1 1 20 8512 1 1 11 LYS HZ2 H 14.336 3.981 -5.180 1.00 . A A . 11 LYS HZ2 1 1 20 8513 1 1 11 LYS HZ3 H 13.712 4.359 -6.706 1.00 . A A . 11 LYS HZ3 1 1 20 8514 1 1 11 LYS N N 7.620 2.327 -3.894 1.00 . A A . 11 LYS N 1 1 20 8515 1 1 11 LYS NZ N 13.465 4.050 -5.745 1.00 . A A . 11 LYS NZ 1 1 20 8516 1 1 11 LYS O O 7.471 4.958 -1.779 1.00 . A A . 11 LYS O 1 1 20 8517 1 1 12 LYS C C 4.552 5.768 -3.172 1.00 . A A . 12 LYS C 1 1 20 8518 1 1 12 LYS CA C 5.908 6.277 -3.650 1.00 . A A . 12 LYS CA 1 1 20 8519 1 1 12 LYS CB C 5.731 7.134 -4.906 1.00 . A A . 12 LYS CB 1 1 20 8520 1 1 12 LYS CD C 5.205 9.480 -5.634 1.00 . A A . 12 LYS CD 1 1 20 8521 1 1 12 LYS CE C 4.621 9.271 -7.022 1.00 . A A . 12 LYS CE 1 1 20 8522 1 1 12 LYS CG C 4.834 8.342 -4.696 1.00 . A A . 12 LYS CG 1 1 20 8523 1 1 12 LYS H H 6.888 4.824 -4.836 1.00 . A A . 12 LYS H 1 1 20 8524 1 1 12 LYS HA H 6.349 6.880 -2.871 1.00 . A A . 12 LYS HA 1 1 20 8525 1 1 12 LYS HB2 H 6.701 7.484 -5.227 1.00 . A A . 12 LYS HB2 1 1 20 8526 1 1 12 LYS HB3 H 5.301 6.524 -5.686 1.00 . A A . 12 LYS HB3 1 1 20 8527 1 1 12 LYS HD2 H 4.823 10.405 -5.230 1.00 . A A . 12 LYS HD2 1 1 20 8528 1 1 12 LYS HD3 H 6.280 9.534 -5.709 1.00 . A A . 12 LYS HD3 1 1 20 8529 1 1 12 LYS HE2 H 3.689 8.734 -6.930 1.00 . A A . 12 LYS HE2 1 1 20 8530 1 1 12 LYS HE3 H 4.437 10.236 -7.470 1.00 . A A . 12 LYS HE3 1 1 20 8531 1 1 12 LYS HG2 H 3.810 8.055 -4.883 1.00 . A A . 12 LYS HG2 1 1 20 8532 1 1 12 LYS HG3 H 4.935 8.681 -3.676 1.00 . A A . 12 LYS HG3 1 1 20 8533 1 1 12 LYS HZ1 H 6.187 7.922 -7.324 1.00 . A A . 12 LYS HZ1 1 1 20 8534 1 1 12 LYS HZ2 H 4.994 7.864 -8.521 1.00 . A A . 12 LYS HZ2 1 1 20 8535 1 1 12 LYS HZ3 H 6.101 9.143 -8.490 1.00 . A A . 12 LYS HZ3 1 1 20 8536 1 1 12 LYS N N 6.808 5.163 -3.919 1.00 . A A . 12 LYS N 1 1 20 8537 1 1 12 LYS NZ N 5.540 8.496 -7.901 1.00 . A A . 12 LYS NZ 1 1 20 8538 1 1 12 LYS O O 3.976 4.860 -3.770 1.00 . A A . 12 LYS O 1 1 20 8539 1 1 13 ASP C C 1.666 5.992 -2.579 1.00 . A A . 13 ASP C 1 1 20 8540 1 1 13 ASP CA C 2.766 5.944 -1.529 1.00 . A A . 13 ASP CA 1 1 20 8541 1 1 13 ASP CB C 2.391 6.817 -0.330 1.00 . A A . 13 ASP CB 1 1 20 8542 1 1 13 ASP CG C 3.501 6.899 0.700 1.00 . A A . 13 ASP CG 1 1 20 8543 1 1 13 ASP H H 4.559 7.064 -1.649 1.00 . A A . 13 ASP H 1 1 20 8544 1 1 13 ASP HA H 2.870 4.929 -1.199 1.00 . A A . 13 ASP HA 1 1 20 8545 1 1 13 ASP HB2 H 2.169 7.814 -0.671 1.00 . A A . 13 ASP HB2 1 1 20 8546 1 1 13 ASP HB3 H 1.515 6.404 0.145 1.00 . A A . 13 ASP HB3 1 1 20 8547 1 1 13 ASP N N 4.051 6.351 -2.087 1.00 . A A . 13 ASP N 1 1 20 8548 1 1 13 ASP O O 0.756 5.162 -2.576 1.00 . A A . 13 ASP O 1 1 20 8549 1 1 13 ASP OD1 O 4.590 6.338 0.449 1.00 . A A . 13 ASP OD1 1 1 20 8550 1 1 13 ASP OD2 O 3.282 7.524 1.759 1.00 . A A . 13 ASP OD2 1 1 20 8551 1 1 14 SER C C 0.628 5.825 -5.343 1.00 . A A . 14 SER C 1 1 20 8552 1 1 14 SER CA C 0.778 7.118 -4.547 1.00 . A A . 14 SER CA 1 1 20 8553 1 1 14 SER CB C 1.186 8.260 -5.481 1.00 . A A . 14 SER CB 1 1 20 8554 1 1 14 SER H H 2.513 7.588 -3.430 1.00 . A A . 14 SER H 1 1 20 8555 1 1 14 SER HA H -0.170 7.360 -4.092 1.00 . A A . 14 SER HA 1 1 20 8556 1 1 14 SER HB2 H 1.631 9.055 -4.901 1.00 . A A . 14 SER HB2 1 1 20 8557 1 1 14 SER HB3 H 1.903 7.895 -6.201 1.00 . A A . 14 SER HB3 1 1 20 8558 1 1 14 SER N N 1.760 6.962 -3.480 1.00 . A A . 14 SER N 1 1 20 8559 1 1 14 SER O O -0.458 5.504 -5.826 1.00 . A A . 14 SER O 1 1 20 8560 1 1 14 SER OG O 0.063 8.776 -6.174 1.00 . A A . 14 SER OG 1 1 20 8561 1 1 15 ASP C C 0.616 2.904 -5.765 1.00 . A A . 15 ASP C 1 1 20 8562 1 1 15 ASP CA C 1.731 3.837 -6.229 1.00 . A A . 15 ASP CA 1 1 20 8563 1 1 15 ASP CB C 3.086 3.139 -6.088 1.00 . A A . 15 ASP CB 1 1 20 8564 1 1 15 ASP CG C 3.525 2.464 -7.372 1.00 . A A . 15 ASP CG 1 1 20 8565 1 1 15 ASP H H 2.567 5.401 -5.075 1.00 . A A . 15 ASP H 1 1 20 8566 1 1 15 ASP HA H 1.571 4.074 -7.270 1.00 . A A . 15 ASP HA 1 1 20 8567 1 1 15 ASP HB2 H 3.833 3.869 -5.812 1.00 . A A . 15 ASP HB2 1 1 20 8568 1 1 15 ASP HB3 H 3.018 2.389 -5.313 1.00 . A A . 15 ASP HB3 1 1 20 8569 1 1 15 ASP N N 1.730 5.091 -5.483 1.00 . A A . 15 ASP N 1 1 20 8570 1 1 15 ASP O O 0.056 2.151 -6.562 1.00 . A A . 15 ASP O 1 1 20 8571 1 1 15 ASP OD1 O 3.500 3.127 -8.430 1.00 . A A . 15 ASP OD1 1 1 20 8572 1 1 15 ASP OD2 O 3.896 1.273 -7.319 1.00 . A A . 15 ASP OD2 1 1 20 8573 1 1 16 CYS C C -2.006 2.142 -4.724 1.00 . A A . 16 CYS C 1 1 20 8574 1 1 16 CYS CA C -0.723 2.080 -3.904 1.00 . A A . 16 CYS CA 1 1 20 8575 1 1 16 CYS CB C -1.008 2.456 -2.443 1.00 . A A . 16 CYS CB 1 1 20 8576 1 1 16 CYS H H 0.802 3.553 -3.881 1.00 . A A . 16 CYS H 1 1 20 8577 1 1 16 CYS HA H -0.351 1.068 -3.933 1.00 . A A . 16 CYS HA 1 1 20 8578 1 1 16 CYS HB2 H -0.118 2.860 -2.011 1.00 . A A . 16 CYS HB2 1 1 20 8579 1 1 16 CYS HB3 H -1.778 3.208 -2.412 1.00 . A A . 16 CYS HB3 1 1 20 8580 1 1 16 CYS N N 0.311 2.942 -4.471 1.00 . A A . 16 CYS N 1 1 20 8581 1 1 16 CYS O O -2.125 2.934 -5.658 1.00 . A A . 16 CYS O 1 1 20 8582 1 1 16 CYS SG S -1.537 1.059 -1.393 1.00 . A A . 16 CYS SG 1 1 20 8583 1 1 17 LEU C C -5.376 1.669 -4.170 1.00 . A A . 17 LEU C 1 1 20 8584 1 1 17 LEU CA C -4.231 1.225 -5.071 1.00 . A A . 17 LEU CA 1 1 20 8585 1 1 17 LEU CB C -4.487 -0.197 -5.575 1.00 . A A . 17 LEU CB 1 1 20 8586 1 1 17 LEU CD1 C -6.068 -1.234 -3.926 1.00 . A A . 17 LEU CD1 1 1 20 8587 1 1 17 LEU CD2 C -4.305 -2.635 -5.014 1.00 . A A . 17 LEU CD2 1 1 20 8588 1 1 17 LEU CG C -4.651 -1.253 -4.479 1.00 . A A . 17 LEU CG 1 1 20 8589 1 1 17 LEU H H -2.788 0.683 -3.619 1.00 . A A . 17 LEU H 1 1 20 8590 1 1 17 LEU HA H -4.178 1.890 -5.919 1.00 . A A . 17 LEU HA 1 1 20 8591 1 1 17 LEU HB2 H -5.387 -0.189 -6.174 1.00 . A A . 17 LEU HB2 1 1 20 8592 1 1 17 LEU HB3 H -3.660 -0.490 -6.203 1.00 . A A . 17 LEU HB3 1 1 20 8593 1 1 17 LEU HD11 H -6.758 -0.978 -4.716 1.00 . A A . 17 LEU HD11 1 1 20 8594 1 1 17 LEU HD12 H -6.315 -2.209 -3.534 1.00 . A A . 17 LEU HD12 1 1 20 8595 1 1 17 LEU HD13 H -6.136 -0.500 -3.137 1.00 . A A . 17 LEU HD13 1 1 20 8596 1 1 17 LEU HD21 H -3.658 -2.536 -5.874 1.00 . A A . 17 LEU HD21 1 1 20 8597 1 1 17 LEU HD22 H -3.799 -3.201 -4.247 1.00 . A A . 17 LEU HD22 1 1 20 8598 1 1 17 LEU HD23 H -5.211 -3.147 -5.301 1.00 . A A . 17 LEU HD23 1 1 20 8599 1 1 17 LEU HG H -3.974 -1.029 -3.668 1.00 . A A . 17 LEU HG 1 1 20 8600 1 1 17 LEU N N -2.954 1.289 -4.369 1.00 . A A . 17 LEU N 1 1 20 8601 1 1 17 LEU O O -5.191 1.873 -2.970 1.00 . A A . 17 LEU O 1 1 20 8602 1 1 18 ALA C C -7.438 3.502 -3.194 1.00 . A A . 18 ALA C 1 1 20 8603 1 1 18 ALA CA C -7.737 2.238 -4.007 1.00 . A A . 18 ALA CA 1 1 20 8604 1 1 18 ALA CB C -8.222 1.099 -3.116 1.00 . A A . 18 ALA CB 1 1 20 8605 1 1 18 ALA H H -6.644 1.638 -5.716 1.00 . A A . 18 ALA H 1 1 20 8606 1 1 18 ALA HA H -8.519 2.461 -4.720 1.00 . A A . 18 ALA HA 1 1 20 8607 1 1 18 ALA HB1 H -8.370 0.212 -3.714 1.00 . A A . 18 ALA HB1 1 1 20 8608 1 1 18 ALA HB2 H -9.155 1.380 -2.650 1.00 . A A . 18 ALA HB2 1 1 20 8609 1 1 18 ALA HB3 H -7.484 0.901 -2.353 1.00 . A A . 18 ALA HB3 1 1 20 8610 1 1 18 ALA N N -6.561 1.816 -4.757 1.00 . A A . 18 ALA N 1 1 20 8611 1 1 18 ALA O O -6.999 4.508 -3.752 1.00 . A A . 18 ALA O 1 1 20 8612 1 1 19 GLU C C -6.462 4.235 0.108 1.00 . A A . 19 GLU C 1 1 20 8613 1 1 19 GLU CA C -7.412 4.606 -1.028 1.00 . A A . 19 GLU CA 1 1 20 8614 1 1 19 GLU CB C -8.726 5.152 -0.465 1.00 . A A . 19 GLU CB 1 1 20 8615 1 1 19 GLU CD C -8.556 7.305 0.847 1.00 . A A . 19 GLU CD 1 1 20 8616 1 1 19 GLU CG C -8.819 6.669 -0.504 1.00 . A A . 19 GLU CG 1 1 20 8617 1 1 19 GLU H H -8.017 2.634 -1.482 1.00 . A A . 19 GLU H 1 1 20 8618 1 1 19 GLU HA H -6.946 5.370 -1.633 1.00 . A A . 19 GLU HA 1 1 20 8619 1 1 19 GLU HB2 H -9.546 4.749 -1.040 1.00 . A A . 19 GLU HB2 1 1 20 8620 1 1 19 GLU HB3 H -8.827 4.834 0.562 1.00 . A A . 19 GLU HB3 1 1 20 8621 1 1 19 GLU HG2 H -8.091 7.043 -1.208 1.00 . A A . 19 GLU HG2 1 1 20 8622 1 1 19 GLU HG3 H -9.811 6.948 -0.830 1.00 . A A . 19 GLU HG3 1 1 20 8623 1 1 19 GLU N N -7.670 3.456 -1.883 1.00 . A A . 19 GLU N 1 1 20 8624 1 1 19 GLU O O -6.775 4.433 1.282 1.00 . A A . 19 GLU O 1 1 20 8625 1 1 19 GLU OE1 O -7.885 6.665 1.684 1.00 . A A . 19 GLU OE1 1 1 20 8626 1 1 19 GLU OE2 O -9.020 8.443 1.068 1.00 . A A . 19 GLU OE2 1 1 20 8627 1 1 20 CYS C C -2.952 3.921 0.383 1.00 . A A . 20 CYS C 1 1 20 8628 1 1 20 CYS CA C -4.301 3.315 0.739 1.00 . A A . 20 CYS CA 1 1 20 8629 1 1 20 CYS CB C -4.199 1.790 0.822 1.00 . A A . 20 CYS CB 1 1 20 8630 1 1 20 CYS H H -5.092 3.574 -1.202 1.00 . A A . 20 CYS H 1 1 20 8631 1 1 20 CYS HA H -4.616 3.702 1.697 1.00 . A A . 20 CYS HA 1 1 20 8632 1 1 20 CYS HB2 H -4.701 1.356 -0.029 1.00 . A A . 20 CYS HB2 1 1 20 8633 1 1 20 CYS HB3 H -3.158 1.502 0.804 1.00 . A A . 20 CYS HB3 1 1 20 8634 1 1 20 CYS N N -5.295 3.703 -0.250 1.00 . A A . 20 CYS N 1 1 20 8635 1 1 20 CYS O O -2.866 4.787 -0.489 1.00 . A A . 20 CYS O 1 1 20 8636 1 1 20 CYS SG S -4.944 1.080 2.326 1.00 . A A . 20 CYS SG 1 1 20 8637 1 1 21 VAL C C 0.460 2.881 0.656 1.00 . A A . 21 VAL C 1 1 20 8638 1 1 21 VAL CA C -0.570 3.996 0.786 1.00 . A A . 21 VAL CA 1 1 20 8639 1 1 21 VAL CB C -0.117 4.983 1.881 1.00 . A A . 21 VAL CB 1 1 20 8640 1 1 21 VAL CG1 C -1.122 6.115 2.027 1.00 . A A . 21 VAL CG1 1 1 20 8641 1 1 21 VAL CG2 C 0.083 4.265 3.209 1.00 . A A . 21 VAL CG2 1 1 20 8642 1 1 21 VAL H H -2.021 2.787 1.741 1.00 . A A . 21 VAL H 1 1 20 8643 1 1 21 VAL HA H -0.613 4.534 -0.151 1.00 . A A . 21 VAL HA 1 1 20 8644 1 1 21 VAL HB H 0.829 5.413 1.580 1.00 . A A . 21 VAL HB 1 1 20 8645 1 1 21 VAL HG11 H -1.287 6.576 1.065 1.00 . A A . 21 VAL HG11 1 1 20 8646 1 1 21 VAL HG12 H -2.056 5.720 2.401 1.00 . A A . 21 VAL HG12 1 1 20 8647 1 1 21 VAL HG13 H -0.739 6.849 2.718 1.00 . A A . 21 VAL HG13 1 1 20 8648 1 1 21 VAL HG21 H 0.825 3.490 3.091 1.00 . A A . 21 VAL HG21 1 1 20 8649 1 1 21 VAL HG22 H 0.417 4.973 3.954 1.00 . A A . 21 VAL HG22 1 1 20 8650 1 1 21 VAL HG23 H -0.851 3.825 3.524 1.00 . A A . 21 VAL HG23 1 1 20 8651 1 1 21 VAL N N -1.901 3.474 1.054 1.00 . A A . 21 VAL N 1 1 20 8652 1 1 21 VAL O O 0.258 1.763 1.130 1.00 . A A . 21 VAL O 1 1 20 8653 1 1 22 CYS C C 3.761 2.522 0.835 1.00 . A A . 22 CYS C 1 1 20 8654 1 1 22 CYS CA C 2.666 2.279 -0.198 1.00 . A A . 22 CYS CA 1 1 20 8655 1 1 22 CYS CB C 3.229 2.430 -1.618 1.00 . A A . 22 CYS CB 1 1 20 8656 1 1 22 CYS H H 1.645 4.124 -0.327 1.00 . A A . 22 CYS H 1 1 20 8657 1 1 22 CYS HA H 2.281 1.277 -0.073 1.00 . A A . 22 CYS HA 1 1 20 8658 1 1 22 CYS HB2 H 3.246 3.474 -1.880 1.00 . A A . 22 CYS HB2 1 1 20 8659 1 1 22 CYS HB3 H 4.235 2.048 -1.649 1.00 . A A . 22 CYS HB3 1 1 20 8660 1 1 22 CYS N N 1.567 3.216 0.013 1.00 . A A . 22 CYS N 1 1 20 8661 1 1 22 CYS O O 4.125 3.665 1.110 1.00 . A A . 22 CYS O 1 1 20 8662 1 1 22 CYS SG S 2.264 1.565 -2.895 1.00 . A A . 22 CYS SG 1 1 20 8663 1 1 23 LEU C C 6.688 1.267 1.860 1.00 . A A . 23 LEU C 1 1 20 8664 1 1 23 LEU CA C 5.304 1.542 2.440 1.00 . A A . 23 LEU CA 1 1 20 8665 1 1 23 LEU CB C 4.997 0.576 3.587 1.00 . A A . 23 LEU CB 1 1 20 8666 1 1 23 LEU CD1 C 3.230 -0.556 4.969 1.00 . A A . 23 LEU CD1 1 1 20 8667 1 1 23 LEU CD2 C 3.378 1.939 4.934 1.00 . A A . 23 LEU CD2 1 1 20 8668 1 1 23 LEU CG C 3.566 0.664 4.126 1.00 . A A . 23 LEU CG 1 1 20 8669 1 1 23 LEU H H 3.927 0.558 1.171 1.00 . A A . 23 LEU H 1 1 20 8670 1 1 23 LEU HA H 5.288 2.551 2.825 1.00 . A A . 23 LEU HA 1 1 20 8671 1 1 23 LEU HB2 H 5.170 -0.431 3.239 1.00 . A A . 23 LEU HB2 1 1 20 8672 1 1 23 LEU HB3 H 5.678 0.782 4.399 1.00 . A A . 23 LEU HB3 1 1 20 8673 1 1 23 LEU HD11 H 3.394 -1.451 4.389 1.00 . A A . 23 LEU HD11 1 1 20 8674 1 1 23 LEU HD12 H 3.862 -0.573 5.845 1.00 . A A . 23 LEU HD12 1 1 20 8675 1 1 23 LEU HD13 H 2.196 -0.509 5.273 1.00 . A A . 23 LEU HD13 1 1 20 8676 1 1 23 LEU HD21 H 3.749 2.782 4.367 1.00 . A A . 23 LEU HD21 1 1 20 8677 1 1 23 LEU HD22 H 2.327 2.081 5.143 1.00 . A A . 23 LEU HD22 1 1 20 8678 1 1 23 LEU HD23 H 3.924 1.862 5.862 1.00 . A A . 23 LEU HD23 1 1 20 8679 1 1 23 LEU HG H 2.878 0.692 3.294 1.00 . A A . 23 LEU HG 1 1 20 8680 1 1 23 LEU N N 4.269 1.442 1.420 1.00 . A A . 23 LEU N 1 1 20 8681 1 1 23 LEU O O 6.852 0.418 0.983 1.00 . A A . 23 LEU O 1 1 20 8682 1 1 24 GLU C C 9.561 0.445 1.944 1.00 . A A . 24 GLU C 1 1 20 8683 1 1 24 GLU CA C 9.056 1.886 1.886 1.00 . A A . 24 GLU CA 1 1 20 8684 1 1 24 GLU CB C 9.978 2.791 2.708 1.00 . A A . 24 GLU CB 1 1 20 8685 1 1 24 GLU CD C 10.887 2.764 5.065 1.00 . A A . 24 GLU CD 1 1 20 8686 1 1 24 GLU CG C 9.650 2.823 4.193 1.00 . A A . 24 GLU CG 1 1 20 8687 1 1 24 GLU H H 7.468 2.677 3.039 1.00 . A A . 24 GLU H 1 1 20 8688 1 1 24 GLU HA H 9.081 2.213 0.859 1.00 . A A . 24 GLU HA 1 1 20 8689 1 1 24 GLU HB2 H 10.996 2.446 2.595 1.00 . A A . 24 GLU HB2 1 1 20 8690 1 1 24 GLU HB3 H 9.907 3.799 2.324 1.00 . A A . 24 GLU HB3 1 1 20 8691 1 1 24 GLU HG2 H 9.119 3.738 4.411 1.00 . A A . 24 GLU HG2 1 1 20 8692 1 1 24 GLU HG3 H 9.019 1.980 4.428 1.00 . A A . 24 GLU HG3 1 1 20 8693 1 1 24 GLU N N 7.676 2.011 2.351 1.00 . A A . 24 GLU N 1 1 20 8694 1 1 24 GLU O O 10.176 -0.038 0.994 1.00 . A A . 24 GLU O 1 1 20 8695 1 1 24 GLU OE1 O 11.876 2.124 4.650 1.00 . A A . 24 GLU OE1 1 1 20 8696 1 1 24 GLU OE2 O 10.868 3.356 6.165 1.00 . A A . 24 GLU OE2 1 1 20 8697 1 1 25 HIS C C 9.192 -2.507 2.118 1.00 . A A . 25 HIS C 1 1 20 8698 1 1 25 HIS CA C 9.770 -1.617 3.211 1.00 . A A . 25 HIS CA 1 1 20 8699 1 1 25 HIS CB C 9.407 -2.165 4.594 1.00 . A A . 25 HIS CB 1 1 20 8700 1 1 25 HIS CD2 C 6.844 -2.555 4.613 1.00 . A A . 25 HIS CD2 1 1 20 8701 1 1 25 HIS CE1 C 6.295 -0.997 6.052 1.00 . A A . 25 HIS CE1 1 1 20 8702 1 1 25 HIS CG C 7.984 -1.928 4.988 1.00 . A A . 25 HIS CG 1 1 20 8703 1 1 25 HIS H H 8.827 0.191 3.790 1.00 . A A . 25 HIS H 1 1 20 8704 1 1 25 HIS HA H 10.846 -1.615 3.114 1.00 . A A . 25 HIS HA 1 1 20 8705 1 1 25 HIS HB2 H 9.577 -3.231 4.605 1.00 . A A . 25 HIS HB2 1 1 20 8706 1 1 25 HIS HB3 H 10.039 -1.699 5.335 1.00 . A A . 25 HIS HB3 1 1 20 8707 1 1 25 HIS HD1 H 8.207 -0.330 6.342 1.00 . A A . 25 HIS HD1 1 1 20 8708 1 1 25 HIS HD2 H 6.765 -3.373 3.911 1.00 . A A . 25 HIS HD2 1 1 20 8709 1 1 25 HIS HE1 H 5.719 -0.351 6.699 1.00 . A A . 25 HIS HE1 1 1 20 8710 1 1 25 HIS HE2 H 4.898 -2.313 5.350 1.00 . A A . 25 HIS HE2 1 1 20 8711 1 1 25 HIS N N 9.315 -0.239 3.059 1.00 . A A . 25 HIS N 1 1 20 8712 1 1 25 HIS ND1 N 7.605 -0.956 5.889 1.00 . A A . 25 HIS ND1 1 1 20 8713 1 1 25 HIS NE2 N 5.809 -1.958 5.289 1.00 . A A . 25 HIS NE2 1 1 20 8714 1 1 25 HIS O O 9.766 -3.542 1.778 1.00 . A A . 25 HIS O 1 1 20 8715 1 1 26 GLY C C 6.111 -3.468 0.898 1.00 . A A . 26 GLY C 1 1 20 8716 1 1 26 GLY CA C 7.439 -2.857 0.495 1.00 . A A . 26 GLY CA 1 1 20 8717 1 1 26 GLY H H 7.652 -1.253 1.858 1.00 . A A . 26 GLY H 1 1 20 8718 1 1 26 GLY HA2 H 8.110 -3.649 0.199 1.00 . A A . 26 GLY HA2 1 1 20 8719 1 1 26 GLY HA3 H 7.278 -2.205 -0.348 1.00 . A A . 26 GLY HA3 1 1 20 8720 1 1 26 GLY N N 8.060 -2.092 1.557 1.00 . A A . 26 GLY N 1 1 20 8721 1 1 26 GLY O O 5.993 -4.686 1.012 1.00 . A A . 26 GLY O 1 1 20 8722 1 1 27 TYR C C 2.757 -1.944 1.378 1.00 . A A . 27 TYR C 1 1 20 8723 1 1 27 TYR CA C 3.774 -3.077 1.482 1.00 . A A . 27 TYR CA 1 1 20 8724 1 1 27 TYR CB C 3.781 -3.630 2.908 1.00 . A A . 27 TYR CB 1 1 20 8725 1 1 27 TYR CD1 C 3.876 -6.026 2.113 1.00 . A A . 27 TYR CD1 1 1 20 8726 1 1 27 TYR CD2 C 5.184 -5.416 4.011 1.00 . A A . 27 TYR CD2 1 1 20 8727 1 1 27 TYR CE1 C 4.339 -7.325 2.206 1.00 . A A . 27 TYR CE1 1 1 20 8728 1 1 27 TYR CE2 C 5.652 -6.712 4.110 1.00 . A A . 27 TYR CE2 1 1 20 8729 1 1 27 TYR CG C 4.289 -5.050 3.012 1.00 . A A . 27 TYR CG 1 1 20 8730 1 1 27 TYR CZ C 5.227 -7.662 3.206 1.00 . A A . 27 TYR CZ 1 1 20 8731 1 1 27 TYR H H 5.266 -1.657 0.982 1.00 . A A . 27 TYR H 1 1 20 8732 1 1 27 TYR HA H 3.489 -3.864 0.801 1.00 . A A . 27 TYR HA 1 1 20 8733 1 1 27 TYR HB2 H 4.412 -3.010 3.520 1.00 . A A . 27 TYR HB2 1 1 20 8734 1 1 27 TYR HB3 H 2.774 -3.608 3.299 1.00 . A A . 27 TYR HB3 1 1 20 8735 1 1 27 TYR HD1 H 3.180 -5.759 1.331 1.00 . A A . 27 TYR HD1 1 1 20 8736 1 1 27 TYR HD2 H 5.514 -4.670 4.718 1.00 . A A . 27 TYR HD2 1 1 20 8737 1 1 27 TYR HE1 H 4.006 -8.068 1.498 1.00 . A A . 27 TYR HE1 1 1 20 8738 1 1 27 TYR HE2 H 6.347 -6.976 4.893 1.00 . A A . 27 TYR HE2 1 1 20 8739 1 1 27 TYR HH H 6.136 -9.195 2.486 1.00 . A A . 27 TYR HH 1 1 20 8740 1 1 27 TYR N N 5.108 -2.617 1.100 1.00 . A A . 27 TYR N 1 1 20 8741 1 1 27 TYR O O 3.075 -0.787 1.647 1.00 . A A . 27 TYR O 1 1 20 8742 1 1 27 TYR OH O 5.691 -8.953 3.301 1.00 . A A . 27 TYR OH 1 1 20 8743 1 1 28 CYS C C -0.430 -1.305 2.090 1.00 . A A . 28 CYS C 1 1 20 8744 1 1 28 CYS CA C 0.468 -1.296 0.857 1.00 . A A . 28 CYS CA 1 1 20 8745 1 1 28 CYS CB C -0.372 -1.576 -0.395 1.00 . A A . 28 CYS CB 1 1 20 8746 1 1 28 CYS H H 1.344 -3.225 0.789 1.00 . A A . 28 CYS H 1 1 20 8747 1 1 28 CYS HA H 0.927 -0.323 0.764 1.00 . A A . 28 CYS HA 1 1 20 8748 1 1 28 CYS HB2 H -0.113 -2.550 -0.781 1.00 . A A . 28 CYS HB2 1 1 20 8749 1 1 28 CYS HB3 H -1.419 -1.569 -0.127 1.00 . A A . 28 CYS HB3 1 1 20 8750 1 1 28 CYS N N 1.534 -2.286 0.991 1.00 . A A . 28 CYS N 1 1 20 8751 1 1 28 CYS O O -1.139 -2.278 2.348 1.00 . A A . 28 CYS O 1 1 20 8752 1 1 28 CYS SG S -0.135 -0.370 -1.740 1.00 . A A . 28 CYS SG 1 1 20 8753 1 1 29 GLY C C -1.169 1.272 4.657 1.00 . A A . 29 GLY C 1 1 20 8754 1 1 29 GLY CA C -1.204 -0.115 4.047 1.00 . A A . 29 GLY CA 1 1 20 8755 1 1 29 GLY H H 0.192 0.529 2.592 1.00 . A A . 29 GLY H 1 1 20 8756 1 1 29 GLY HA2 H -0.839 -0.825 4.775 1.00 . A A . 29 GLY HA2 1 1 20 8757 1 1 29 GLY HA3 H -2.224 -0.363 3.799 1.00 . A A . 29 GLY HA3 1 1 20 8758 1 1 29 GLY N N -0.393 -0.215 2.848 1.00 . A A . 29 GLY N 1 1 20 8759 1 1 29 GLY O O -2.214 1.717 5.178 1.00 . A A . 29 GLY O 1 1 20 8760 1 1 29 GLY OXT O -0.098 1.913 4.614 1.00 . A A . 29 GLY OXT 1 1 stop_ save_
Contact the webmaster for help, if required. Sunday, May 19, 2024 1:04:40 PM GMT (wattos1)