NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | stage | program | type | subtype | item_count |
469486 | 1agg | cing | recoord | 4-filtered-FRED | STAR | entry | full | 452 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1agg # This FRED archive file contains, for PDB entry <1agg>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.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_1agg _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1agg _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 5273.02 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 $OMEGA_AGATOXIN_IVB A . 1 1 stop_ save_ save_OMEGA_AGATOXIN_IVB _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "OMEGA AGATOXIN IVB" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code EDNCIAEDYGKCTWGGTKCCRGRPCRCSMIGTNCECTPRLIMEGLSFA _Entity.Number_of_monomers 48 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 GLU . 1 1 2 ASP . 1 1 3 ASN . 1 1 4 CYS . 1 1 5 ILE . 1 1 6 ALA . 1 1 7 GLU . 1 1 8 ASP . 1 1 9 TYR . 1 1 10 GLY . 1 1 11 LYS . 1 1 12 CYS . 1 1 13 THR . 1 1 14 TRP . 1 1 15 GLY . 1 1 16 GLY . 1 1 17 THR . 1 1 18 LYS . 1 1 19 CYS . 1 1 20 CYS . 1 1 21 ARG . 1 1 22 GLY . 1 1 23 ARG . 1 1 24 PRO . 1 1 25 CYS . 1 1 26 ARG . 1 1 27 CYS . 1 1 28 SER . 1 1 29 MET . 1 1 30 ILE . 1 1 31 GLY . 1 1 32 THR . 1 1 33 ASN . 1 1 34 CYS . 1 1 35 GLU . 1 1 36 CYS . 1 1 37 THR . 1 1 38 PRO . 1 1 39 ARG . 1 1 40 LEU . 1 1 41 ILE . 1 1 42 MET . 1 1 43 GLU . 1 1 44 GLY . 1 1 45 LEU . 1 1 46 SER . 1 1 47 PHE . 1 1 48 ALA . 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 GLU 1 1 1 1 ASP 2 2 1 1 ASN 3 3 1 1 CYS 4 4 1 1 ILE 5 5 1 1 ALA 6 6 1 1 GLU 7 7 1 1 ASP 8 8 1 1 TYR 9 9 1 1 GLY 10 10 1 1 LYS 11 11 1 1 CYS 12 12 1 1 THR 13 13 1 1 TRP 14 14 1 1 GLY 15 15 1 1 GLY 16 16 1 1 THR 17 17 1 1 LYS 18 18 1 1 CYS 19 19 1 1 CYS 20 20 1 1 ARG 21 21 1 1 GLY 22 22 1 1 ARG 23 23 1 1 PRO 24 24 1 1 CYS 25 25 1 1 ARG 26 26 1 1 CYS 27 27 1 1 SER 28 28 1 1 MET 29 29 1 1 ILE 30 30 1 1 GLY 31 31 1 1 THR 32 32 1 1 ASN 33 33 1 1 CYS 34 34 1 1 GLU 35 35 1 1 CYS 36 36 1 1 THR 37 37 1 1 PRO 38 38 1 1 ARG 39 39 1 1 LEU 40 40 1 1 ILE 41 41 1 1 MET 42 42 1 1 GLU 43 43 1 1 GLY 44 44 1 1 LEU 45 45 1 1 SER 46 46 1 1 PHE 47 47 1 1 ALA 48 48 1 1 stop_ save_ save_Discover_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 5 ILE HG12 1 5 ILE HG11 1 1 1 1 2 1 1 12 CYS HA 1 12 CYS HA 1 1 2 1 1 1 1 5 ILE MG 1 5 ILE HG2* 1 1 2 1 2 1 1 12 CYS HA 1 12 CYS HA 1 1 3 1 1 1 1 5 ILE MD 1 5 ILE HD1* 1 1 3 1 2 1 1 12 CYS HA 1 12 CYS HA 1 1 4 1 1 1 1 5 ILE MG 1 5 ILE HG2* 1 1 4 1 2 1 1 19 CYS HA 1 19 CYS HA 1 1 5 1 1 1 1 5 ILE HG13 1 5 ILE HG12 1 1 5 1 2 1 1 19 CYS HA 1 19 CYS HA 1 1 6 1 1 1 1 5 ILE MD 1 5 ILE HD1* 1 1 6 1 2 1 1 19 CYS HA 1 19 CYS HA 1 1 7 1 1 1 1 11 LYS HA 1 11 LYS HA 1 1 7 1 2 1 1 35 GLU QG 1 35 GLU HG* 1 1 8 1 1 1 1 13 THR MG 1 13 THR HG2* 1 1 8 1 2 1 1 16 GLY HA3 1 16 GLY HA2 1 1 9 1 1 1 1 9 TYR HA 1 9 TYR HA 1 1 9 1 2 1 1 35 GLU QG 1 35 GLU HG* 1 1 10 1 1 1 1 5 ILE MD 1 5 ILE HD1* 1 1 10 1 2 1 1 17 THR HA 1 17 THR HA 1 1 11 1 1 1 1 7 GLU HB2 1 7 GLU HB1 1 1 11 1 2 1 1 10 GLY HA3 1 10 GLY HA2 1 1 12 1 1 1 1 5 ILE MG 1 5 ILE HG2* 1 1 12 1 2 1 1 10 GLY HA3 1 10 GLY HA2 1 1 13 1 1 1 1 5 ILE HG13 1 5 ILE HG12 1 1 13 1 2 1 1 17 THR HB 1 17 THR HB 1 1 14 1 1 1 1 5 ILE HG12 1 5 ILE HG11 1 1 14 1 2 1 1 17 THR HB 1 17 THR HB 1 1 15 1 1 1 1 5 ILE MG 1 5 ILE HG2* 1 1 15 1 2 1 1 17 THR HB 1 17 THR HB 1 1 16 1 1 1 1 5 ILE MD 1 5 ILE HD1* 1 1 16 1 2 1 1 17 THR HB 1 17 THR HB 1 1 17 1 1 1 1 13 THR MG 1 13 THR HG2* 1 1 17 1 2 1 1 16 GLY HA2 1 16 GLY HA1 1 1 18 1 1 1 1 19 CYS HB2 1 19 CYS HBS 1 1 18 1 2 1 1 23 ARG HB2 1 23 ARG HB1 1 1 19 1 1 1 1 19 CYS HB2 1 19 CYS HBS 1 1 19 1 2 1 1 23 ARG HB3 1 23 ARG HB2 1 1 20 1 1 1 1 19 CYS HB2 1 19 CYS HBS 1 1 20 1 2 1 1 23 ARG QG 1 23 ARG HG* 1 1 21 1 1 1 1 6 ALA MB 1 6 ALA HB* 1 1 21 1 2 1 1 20 CYS HB2 1 20 CYS HB1 1 1 22 1 1 1 1 19 CYS HB3 1 19 CYS HBR 1 1 22 1 2 1 1 23 ARG HB3 1 23 ARG HB2 1 1 23 1 1 1 1 19 CYS HB3 1 19 CYS HBR 1 1 23 1 2 1 1 23 ARG QG 1 23 ARG HG* 1 1 24 1 1 1 1 19 CYS HB3 1 19 CYS HBR 1 1 24 1 2 1 1 23 ARG HB2 1 23 ARG HB1 1 1 25 1 1 1 1 27 CYS HA 1 27 CYS HA 1 1 25 1 2 1 1 34 CYS HA 1 34 CYS HA 1 1 26 1 1 1 1 27 CYS HB3 1 27 CYS HB2 1 1 26 1 2 1 1 34 CYS HA 1 34 CYS HA 1 1 27 1 1 1 1 27 CYS HB2 1 27 CYS HB1 1 1 27 1 2 1 1 34 CYS HA 1 34 CYS HA 1 1 28 1 1 1 1 25 CYS HB3 1 25 CYS HBR 1 1 28 1 2 1 1 36 CYS HA 1 36 CYS HA 1 1 29 1 1 1 1 25 CYS HB2 1 25 CYS HBS 1 1 29 1 2 1 1 36 CYS HA 1 36 CYS HA 1 1 30 1 1 1 1 27 CYS HA 1 27 CYS HA 1 1 30 1 2 1 1 34 CYS HB2 1 34 CYS HBS 1 1 31 1 1 1 1 4 CYS HB2 1 4 CYS HB1 1 1 31 1 2 1 1 20 CYS HA 1 20 CYS HA 1 1 32 1 1 1 1 37 THR HB 1 37 THR HB 1 1 32 1 2 1 1 38 PRO HD3 1 38 PRO HD2 1 1 33 1 1 1 1 37 THR HB 1 37 THR HB 1 1 33 1 2 1 1 38 PRO HD2 1 38 PRO HD1 1 1 34 1 1 1 1 6 ALA HA 1 6 ALA HA 1 1 34 1 2 1 1 20 CYS HB3 1 20 CYS HB2 1 1 35 1 1 1 1 11 LYS HA 1 11 LYS HA 1 1 35 1 2 1 1 35 GLU HA 1 35 GLU HA 1 1 36 1 1 1 1 4 CYS HA 1 4 CYS HA 1 1 36 1 2 1 1 20 CYS HA 1 20 CYS HA 1 1 37 1 1 1 1 13 THR HA 1 13 THR HA 1 1 37 1 2 1 1 34 CYS HB2 1 34 CYS HBS 1 1 38 1 1 1 1 6 ALA HA 1 6 ALA HA 1 1 38 1 2 1 1 20 CYS HA 1 20 CYS HA 1 1 39 1 1 1 1 5 ILE HA 1 5 ILE HA 1 1 39 1 2 1 1 19 CYS HA 1 19 CYS HA 1 1 40 1 1 1 1 27 CYS HA 1 27 CYS HA 1 1 40 1 2 1 1 34 CYS HB3 1 34 CYS HBR 1 1 41 1 1 1 1 25 CYS HA 1 25 CYS HA 1 1 41 1 2 1 1 36 CYS HA 1 36 CYS HA 1 1 42 1 1 1 1 35 GLU HA 1 35 GLU HA 1 1 42 1 2 1 1 35 GLU QG 1 35 GLU HG* 1 1 43 1 1 1 1 37 THR HA 1 37 THR HA 1 1 43 1 2 1 1 38 PRO HD2 1 38 PRO HD1 1 1 44 1 1 1 1 37 THR HA 1 37 THR HA 1 1 44 1 2 1 1 38 PRO HD3 1 38 PRO HD2 1 1 45 1 1 1 1 6 ALA HA 1 6 ALA HA 1 1 45 1 2 1 1 20 CYS HB2 1 20 CYS HB1 1 1 46 1 1 1 1 7 GLU HB3 1 7 GLU HB2 1 1 46 1 2 1 1 10 GLY HA3 1 10 GLY HA2 1 1 47 1 1 1 1 5 ILE HG12 1 5 ILE HG11 1 1 47 1 2 1 1 19 CYS HA 1 19 CYS HA 1 1 48 1 1 1 1 5 ILE MG 1 5 ILE HG2* 1 1 48 1 2 1 1 10 GLY HA2 1 10 GLY HA1 1 1 49 1 1 1 1 34 CYS HA 1 34 CYS HA 1 1 49 1 2 1 1 35 GLU QG 1 35 GLU HG* 1 1 50 1 1 1 1 12 CYS HB3 1 12 CYS HB2 1 1 50 1 2 1 1 25 CYS HB2 1 25 CYS HBS 1 1 51 1 1 1 1 13 THR HA 1 13 THR HA 1 1 51 1 2 1 1 34 CYS HA 1 34 CYS HA 1 1 52 1 1 1 1 12 CYS H 1 12 CYS HN 1 1 52 1 2 1 1 35 GLU HA 1 35 GLU HA 1 1 53 1 1 1 1 36 CYS HA 1 36 CYS HA 1 1 53 1 2 1 1 37 THR H 1 37 THR HN 1 1 54 1 1 1 1 34 CYS HA 1 34 CYS HA 1 1 54 1 2 1 1 35 GLU H 1 35 GLU HN 1 1 55 1 1 1 1 12 CYS HA 1 12 CYS HA 1 1 55 1 2 1 1 13 THR H 1 13 THR HN 1 1 56 1 1 1 1 4 CYS HA 1 4 CYS HA 1 1 56 1 2 1 1 5 ILE H 1 5 ILE HN 1 1 57 1 1 1 1 27 CYS HA 1 27 CYS HA 1 1 57 1 2 1 1 28 SER H 1 28 SER HN 1 1 58 1 1 1 1 3 ASN HA 1 3 ASN HA 1 1 58 1 2 1 1 4 CYS H 1 4 CYS HN 1 1 59 1 1 1 1 13 THR HB 1 13 THR HB 1 1 59 1 2 1 1 14 TRP H 1 14 TRP HN 1 1 60 1 1 1 1 5 ILE HA 1 5 ILE HA 1 1 60 1 2 1 1 6 ALA H 1 6 ALA HN 1 1 61 1 1 1 1 18 LYS HA 1 18 LYS HA 1 1 61 1 2 1 1 19 CYS H 1 19 CYS HN 1 1 62 1 1 1 1 32 THR HB 1 32 THR HB 1 1 62 1 2 1 1 33 ASN H 1 33 ASN HN 1 1 63 1 1 1 1 32 THR HA 1 32 THR HA 1 1 63 1 2 1 1 33 ASN H 1 33 ASN HN 1 1 64 1 1 1 1 28 SER HA 1 28 SER HA 1 1 64 1 2 1 1 29 MET H 1 29 MET HN 1 1 65 1 1 1 1 14 TRP HA 1 14 TRP HA 1 1 65 1 2 1 1 15 GLY H 1 15 GLY HN 1 1 66 1 1 1 1 43 GLU HA 1 43 GLU HA 1 1 66 1 2 1 1 44 GLY H 1 44 GLY HN 1 1 67 1 1 1 1 41 ILE HA 1 41 ILE HA 1 1 67 1 2 1 1 42 MET H 1 42 MET HN 1 1 68 1 1 1 1 11 LYS HA 1 11 LYS HA 1 1 68 1 2 1 1 12 CYS H 1 12 CYS HN 1 1 69 1 1 1 1 6 ALA HA 1 6 ALA HA 1 1 69 1 2 1 1 7 GLU H 1 7 GLU HN 1 1 70 1 1 1 1 7 GLU HA 1 7 GLU HA 1 1 70 1 2 1 1 8 ASP H 1 8 ASP HN 1 1 71 1 1 1 1 16 GLY HA2 1 16 GLY HA1 1 1 71 1 2 1 1 17 THR H 1 17 THR HN 1 1 72 1 1 1 1 16 GLY HA3 1 16 GLY HA2 1 1 72 1 2 1 1 17 THR H 1 17 THR HN 1 1 73 1 1 1 1 10 GLY HA3 1 10 GLY HA2 1 1 73 1 2 1 1 11 LYS H 1 11 LYS HN 1 1 74 1 1 1 1 17 THR HA 1 17 THR HA 1 1 74 1 2 1 1 18 LYS H 1 18 LYS HN 1 1 75 1 1 1 1 13 THR HA 1 13 THR HA 1 1 75 1 2 1 1 14 TRP H 1 14 TRP HN 1 1 76 1 1 1 1 22 GLY HA3 1 22 GLY HA2 1 1 76 1 2 1 1 23 ARG H 1 23 ARG HN 1 1 77 1 1 1 1 22 GLY HA2 1 22 GLY HA1 1 1 77 1 2 1 1 23 ARG H 1 23 ARG HN 1 1 78 1 1 1 1 9 TYR HA 1 9 TYR HA 1 1 78 1 2 1 1 10 GLY H 1 10 GLY HN 1 1 79 1 1 1 1 8 ASP HA 1 8 ASP HA 1 1 79 1 2 1 1 9 TYR H 1 9 TYR HN 1 1 80 1 1 1 1 6 ALA MB 1 6 ALA HB* 1 1 80 1 2 1 1 7 GLU H 1 7 GLU HN 1 1 81 1 1 1 1 6 ALA H 1 6 ALA HN 1 1 81 1 2 1 1 7 GLU H 1 7 GLU HN 1 1 82 1 1 1 1 21 ARG HA 1 21 ARG HA 1 1 82 1 2 1 1 22 GLY H 1 22 GLY HN 1 1 83 1 1 1 1 21 ARG HB2 1 21 ARG HB1 1 1 83 1 2 1 1 22 GLY H 1 22 GLY HN 1 1 84 1 1 1 1 21 ARG HB3 1 21 ARG HB2 1 1 84 1 2 1 1 22 GLY H 1 22 GLY HN 1 1 85 1 1 1 1 21 ARG H 1 21 ARG HN 1 1 85 1 2 1 1 22 GLY H 1 22 GLY HN 1 1 86 1 1 1 1 23 ARG HA 1 23 ARG HA 1 1 86 1 2 1 1 24 PRO HD2 1 24 PRO HD1 1 1 87 1 1 1 1 23 ARG HA 1 23 ARG HA 1 1 87 1 2 1 1 24 PRO HD3 1 24 PRO HD2 1 1 88 1 1 1 1 26 ARG HA 1 26 ARG HA 1 1 88 1 2 1 1 27 CYS H 1 27 CYS HN 1 1 89 1 1 1 1 26 ARG H 1 26 ARG HN 1 1 89 1 2 1 1 37 THR MG 1 37 THR HG2* 1 1 90 1 1 1 1 26 ARG HB2 1 26 ARG HB1 1 1 90 1 2 1 1 27 CYS H 1 27 CYS HN 1 1 91 1 1 1 1 26 ARG HB3 1 26 ARG HB2 1 1 91 1 2 1 1 27 CYS H 1 27 CYS HN 1 1 92 1 1 1 1 33 ASN HA 1 33 ASN HA 1 1 92 1 2 1 1 34 CYS H 1 34 CYS HN 1 1 93 1 1 1 1 33 ASN HB2 1 33 ASN HB1 1 1 93 1 2 1 1 34 CYS H 1 34 CYS HN 1 1 94 1 1 1 1 33 ASN HB3 1 33 ASN HB2 1 1 94 1 2 1 1 34 CYS H 1 34 CYS HN 1 1 95 1 1 1 1 33 ASN H 1 33 ASN HN 1 1 95 1 2 1 1 34 CYS H 1 34 CYS HN 1 1 96 1 1 1 1 3 ASN HA 1 3 ASN HA 1 1 96 1 2 1 1 17 THR MG 1 17 THR HG2* 1 1 97 1 1 1 1 3 ASN HB2 1 3 ASN HB1 1 1 97 1 2 1 1 4 CYS H 1 4 CYS HN 1 1 98 1 1 1 1 3 ASN HB3 1 3 ASN HB2 1 1 98 1 2 1 1 4 CYS H 1 4 CYS HN 1 1 99 1 1 1 1 2 ASP HA 1 2 ASP HA 1 1 99 1 2 1 1 3 ASN H 1 3 ASN HN 1 1 100 1 1 1 1 2 ASP HB2 1 2 ASP HB1 1 1 100 1 2 1 1 3 ASN H 1 3 ASN HN 1 1 101 1 1 1 1 2 ASP HB3 1 2 ASP HB2 1 1 101 1 2 1 1 3 ASN H 1 3 ASN HN 1 1 102 1 1 1 1 8 ASP HA 1 8 ASP HA 1 1 102 1 2 1 1 10 GLY H 1 10 GLY HN 1 1 103 1 1 1 1 8 ASP HB3 1 8 ASP HBR 1 1 103 1 2 1 1 9 TYR H 1 9 TYR HN 1 1 104 1 1 1 1 8 ASP HB2 1 8 ASP HBS 1 1 104 1 2 1 1 9 TYR H 1 9 TYR HN 1 1 105 1 1 1 1 8 ASP HA 1 8 ASP HA 1 1 105 1 2 1 1 38 PRO HD2 1 38 PRO HD1 1 1 106 1 1 1 1 12 CYS HB2 1 12 CYS HB1 1 1 106 1 2 1 1 25 CYS HB3 1 25 CYS HBR 1 1 107 1 1 1 1 12 CYS HB2 1 12 CYS HB1 1 1 107 1 2 1 1 25 CYS HB2 1 25 CYS HBS 1 1 108 1 1 1 1 5 ILE HG13 1 5 ILE HG12 1 1 108 1 2 1 1 12 CYS HA 1 12 CYS HA 1 1 109 1 1 1 1 5 ILE MD 1 5 ILE HD1* 1 1 109 1 2 1 1 12 CYS HB2 1 12 CYS HB1 1 1 110 1 1 1 1 5 ILE MG 1 5 ILE HG2* 1 1 110 1 2 1 1 12 CYS HB2 1 12 CYS HB1 1 1 111 1 1 1 1 12 CYS HB2 1 12 CYS HB1 1 1 111 1 2 1 1 13 THR H 1 13 THR HN 1 1 112 1 1 1 1 5 ILE MD 1 5 ILE HD1* 1 1 112 1 2 1 1 12 CYS HB3 1 12 CYS HB2 1 1 113 1 1 1 1 5 ILE MG 1 5 ILE HG2* 1 1 113 1 2 1 1 12 CYS HB3 1 12 CYS HB2 1 1 114 1 1 1 1 12 CYS HB3 1 12 CYS HB2 1 1 114 1 2 1 1 13 THR H 1 13 THR HN 1 1 115 1 1 1 1 19 CYS HA 1 19 CYS HA 1 1 115 1 2 1 1 20 CYS H 1 20 CYS HN 1 1 116 1 1 1 1 5 ILE HB 1 5 ILE HB 1 1 116 1 2 1 1 19 CYS HA 1 19 CYS HA 1 1 117 1 1 1 1 5 ILE H 1 5 ILE HN 1 1 117 1 2 1 1 19 CYS HA 1 19 CYS HA 1 1 118 1 1 1 1 19 CYS HB2 1 19 CYS HBS 1 1 118 1 2 1 1 23 ARG H 1 23 ARG HN 1 1 119 1 1 1 1 19 CYS HB2 1 19 CYS HBS 1 1 119 1 2 1 1 20 CYS H 1 20 CYS HN 1 1 120 1 1 1 1 19 CYS HB3 1 19 CYS HBR 1 1 120 1 2 1 1 23 ARG H 1 23 ARG HN 1 1 121 1 1 1 1 19 CYS HB3 1 19 CYS HBR 1 1 121 1 2 1 1 23 ARG HA 1 23 ARG HA 1 1 122 1 1 1 1 19 CYS HB3 1 19 CYS HBR 1 1 122 1 2 1 1 20 CYS H 1 20 CYS HN 1 1 123 1 1 1 1 20 CYS HA 1 20 CYS HA 1 1 123 1 2 1 1 21 ARG H 1 21 ARG HN 1 1 124 1 1 1 1 4 CYS HB3 1 4 CYS HB2 1 1 124 1 2 1 1 20 CYS HA 1 20 CYS HA 1 1 125 1 1 1 1 5 ILE H 1 5 ILE HN 1 1 125 1 2 1 1 20 CYS HA 1 20 CYS HA 1 1 126 1 1 1 1 20 CYS HB2 1 20 CYS HB1 1 1 126 1 2 1 1 21 ARG H 1 21 ARG HN 1 1 127 1 1 1 1 20 CYS HB3 1 20 CYS HB2 1 1 127 1 2 1 1 21 ARG H 1 21 ARG HN 1 1 128 1 1 1 1 6 ALA MB 1 6 ALA HB* 1 1 128 1 2 1 1 20 CYS HB3 1 20 CYS HB2 1 1 129 1 1 1 1 20 CYS H 1 20 CYS HN 1 1 129 1 2 1 1 21 ARG H 1 21 ARG HN 1 1 130 1 1 1 1 25 CYS HA 1 25 CYS HA 1 1 130 1 2 1 1 26 ARG H 1 26 ARG HN 1 1 131 1 1 1 1 25 CYS HA 1 25 CYS HA 1 1 131 1 2 1 1 37 THR H 1 37 THR HN 1 1 132 1 1 1 1 25 CYS HB3 1 25 CYS HBR 1 1 132 1 2 1 1 26 ARG H 1 26 ARG HN 1 1 133 1 1 1 1 25 CYS HB2 1 25 CYS HBS 1 1 133 1 2 1 1 26 ARG H 1 26 ARG HN 1 1 134 1 1 1 1 27 CYS HB2 1 27 CYS HB1 1 1 134 1 2 1 1 28 SER H 1 28 SER HN 1 1 135 1 1 1 1 27 CYS HB3 1 27 CYS HB2 1 1 135 1 2 1 1 28 SER H 1 28 SER HN 1 1 136 1 1 1 1 34 CYS HB2 1 34 CYS HBS 1 1 136 1 2 1 1 35 GLU H 1 35 GLU HN 1 1 137 1 1 1 1 34 CYS HB3 1 34 CYS HBR 1 1 137 1 2 1 1 35 GLU H 1 35 GLU HN 1 1 138 1 1 1 1 19 CYS HB2 1 19 CYS HBS 1 1 138 1 2 1 1 36 CYS HA 1 36 CYS HA 1 1 139 1 1 1 1 19 CYS HB2 1 19 CYS HBS 1 1 139 1 2 1 1 36 CYS HB2 1 36 CYS HBS 1 1 140 1 1 1 1 26 ARG H 1 26 ARG HN 1 1 140 1 2 1 1 36 CYS HA 1 36 CYS HA 1 1 141 1 1 1 1 36 CYS HB2 1 36 CYS HBS 1 1 141 1 2 1 1 37 THR H 1 37 THR HN 1 1 142 1 1 1 1 36 CYS HB3 1 36 CYS HBR 1 1 142 1 2 1 1 37 THR H 1 37 THR HN 1 1 143 1 1 1 1 9 TYR HA 1 9 TYR HA 1 1 143 1 2 1 1 36 CYS H 1 36 CYS HN 1 1 144 1 1 1 1 11 LYS HA 1 11 LYS HA 1 1 144 1 2 1 1 36 CYS H 1 36 CYS HN 1 1 145 1 1 1 1 4 CYS HB2 1 4 CYS HB1 1 1 145 1 2 1 1 20 CYS HB3 1 20 CYS HB2 1 1 146 1 1 1 1 4 CYS HB2 1 4 CYS HB1 1 1 146 1 2 1 1 5 ILE H 1 5 ILE HN 1 1 147 1 1 1 1 4 CYS HB3 1 4 CYS HB2 1 1 147 1 2 1 1 5 ILE H 1 5 ILE HN 1 1 148 1 1 1 1 3 ASN H 1 3 ASN HN 1 1 148 1 2 1 1 4 CYS H 1 4 CYS HN 1 1 149 1 1 1 1 4 CYS H 1 4 CYS HN 1 1 149 1 2 1 1 17 THR MG 1 17 THR HG2* 1 1 150 1 1 1 1 1 GLU HA 1 1 GLUN HA 1 1 150 1 2 1 1 2 ASP H 1 2 ASP HN 1 1 151 1 1 1 1 1 GLU HB2 1 1 GLUN HB1 1 1 151 1 2 1 1 2 ASP H 1 2 ASP HN 1 1 152 1 1 1 1 1 GLU HB3 1 1 GLUN HB2 1 1 152 1 2 1 1 2 ASP H 1 2 ASP HN 1 1 153 1 1 1 1 35 GLU HA 1 35 GLU HA 1 1 153 1 2 1 1 36 CYS H 1 36 CYS HN 1 1 154 1 1 1 1 35 GLU HB2 1 35 GLU HB1 1 1 154 1 2 1 1 36 CYS H 1 36 CYS HN 1 1 155 1 1 1 1 35 GLU HB3 1 35 GLU HB2 1 1 155 1 2 1 1 36 CYS H 1 36 CYS HN 1 1 156 1 1 1 1 26 ARG H 1 26 ARG HN 1 1 156 1 2 1 1 35 GLU H 1 35 GLU HN 1 1 157 1 1 1 1 27 CYS HA 1 27 CYS HA 1 1 157 1 2 1 1 35 GLU H 1 35 GLU HN 1 1 158 1 1 1 1 9 TYR HA 1 9 TYR HA 1 1 158 1 2 1 1 35 GLU HA 1 35 GLU HA 1 1 159 1 1 1 1 7 GLU HA 1 7 GLU HA 1 1 159 1 2 1 1 36 CYS HB2 1 36 CYS HBS 1 1 160 1 1 1 1 7 GLU HA 1 7 GLU HA 1 1 160 1 2 1 1 36 CYS HB3 1 36 CYS HBR 1 1 161 1 1 1 1 7 GLU HB2 1 7 GLU HB1 1 1 161 1 2 1 1 8 ASP H 1 8 ASP HN 1 1 162 1 1 1 1 7 GLU HB2 1 7 GLU HB1 1 1 162 1 2 1 1 10 GLY HA2 1 10 GLY HA1 1 1 163 1 1 1 1 7 GLU HB3 1 7 GLU HB2 1 1 163 1 2 1 1 8 ASP H 1 8 ASP HN 1 1 164 1 1 1 1 7 GLU HB3 1 7 GLU HB2 1 1 164 1 2 1 1 10 GLY HA2 1 10 GLY HA1 1 1 165 1 1 1 1 5 ILE MG 1 5 ILE HG2* 1 1 165 1 2 1 1 7 GLU H 1 7 GLU HN 1 1 166 1 1 1 1 10 GLY HA2 1 10 GLY HA1 1 1 166 1 2 1 1 11 LYS H 1 11 LYS HN 1 1 167 1 1 1 1 10 GLY H 1 10 GLY HN 1 1 167 1 2 1 1 36 CYS H 1 36 CYS HN 1 1 168 1 1 1 1 10 GLY H 1 10 GLY HN 1 1 168 1 2 1 1 36 CYS HB2 1 36 CYS HBS 1 1 169 1 1 1 1 10 GLY H 1 10 GLY HN 1 1 169 1 2 1 1 36 CYS HB3 1 36 CYS HBR 1 1 170 1 1 1 1 7 GLU HB2 1 7 GLU HB1 1 1 170 1 2 1 1 10 GLY H 1 10 GLY HN 1 1 171 1 1 1 1 7 GLU HB3 1 7 GLU HB2 1 1 171 1 2 1 1 10 GLY H 1 10 GLY HN 1 1 172 1 1 1 1 7 GLU QG 1 7 GLU HG* 1 1 172 1 2 1 1 10 GLY H 1 10 GLY HN 1 1 173 1 1 1 1 5 ILE MG 1 5 ILE HG2* 1 1 173 1 2 1 1 10 GLY H 1 10 GLY HN 1 1 174 1 1 1 1 10 GLY H 1 10 GLY HN 1 1 174 1 2 1 1 11 LYS H 1 11 LYS HN 1 1 175 1 1 1 1 15 GLY HA2 1 15 GLY HA1 1 1 175 1 2 1 1 16 GLY H 1 16 GLY HN 1 1 176 1 1 1 1 15 GLY HA3 1 15 GLY HA2 1 1 176 1 2 1 1 16 GLY H 1 16 GLY HN 1 1 177 1 1 1 1 15 GLY H 1 15 GLY HN 1 1 177 1 2 1 1 16 GLY H 1 16 GLY HN 1 1 178 1 1 1 1 13 THR HA 1 13 THR HA 1 1 178 1 2 1 1 16 GLY HA3 1 16 GLY HA2 1 1 179 1 1 1 1 16 GLY H 1 16 GLY HN 1 1 179 1 2 1 1 17 THR H 1 17 THR HN 1 1 180 1 1 1 1 22 GLY H 1 22 GLY HN 1 1 180 1 2 1 1 23 ARG H 1 23 ARG HN 1 1 181 1 1 1 1 27 CYS HB3 1 27 CYS HB2 1 1 181 1 2 1 1 31 GLY HA2 1 31 GLY HA1 1 1 182 1 1 1 1 27 CYS HB2 1 27 CYS HB1 1 1 182 1 2 1 1 31 GLY HA2 1 31 GLY HA1 1 1 183 1 1 1 1 27 CYS HB3 1 27 CYS HB2 1 1 183 1 2 1 1 31 GLY HA3 1 31 GLY HA2 1 1 184 1 1 1 1 27 CYS HB2 1 27 CYS HB1 1 1 184 1 2 1 1 31 GLY HA3 1 31 GLY HA2 1 1 185 1 1 1 1 31 GLY HA2 1 31 GLY HA1 1 1 185 1 2 1 1 32 THR H 1 32 THR HN 1 1 186 1 1 1 1 31 GLY HA3 1 31 GLY HA2 1 1 186 1 2 1 1 32 THR H 1 32 THR HN 1 1 187 1 1 1 1 31 GLY H 1 31 GLY HN 1 1 187 1 2 1 1 32 THR H 1 32 THR HN 1 1 188 1 1 1 1 30 ILE HA 1 30 ILE HA 1 1 188 1 2 1 1 31 GLY H 1 31 GLY HN 1 1 189 1 1 1 1 30 ILE HB 1 30 ILE HB 1 1 189 1 2 1 1 31 GLY H 1 31 GLY HN 1 1 190 1 1 1 1 30 ILE H 1 30 ILE HN 1 1 190 1 2 1 1 31 GLY H 1 31 GLY HN 1 1 191 1 1 1 1 5 ILE MG 1 5 ILE HG2* 1 1 191 1 2 1 1 36 CYS HB3 1 36 CYS HBR 1 1 192 1 1 1 1 5 ILE MG 1 5 ILE HG2* 1 1 192 1 2 1 1 36 CYS HB2 1 36 CYS HBS 1 1 193 1 1 1 1 5 ILE HA 1 5 ILE HA 1 1 193 1 2 1 1 17 THR HB 1 17 THR HB 1 1 194 1 1 1 1 5 ILE HA 1 5 ILE HA 1 1 194 1 2 1 1 17 THR MG 1 17 THR HG2* 1 1 195 1 1 1 1 5 ILE HB 1 5 ILE HB 1 1 195 1 2 1 1 6 ALA H 1 6 ALA HN 1 1 196 1 1 1 1 11 LYS HB2 1 11 LYS HB1 1 1 196 1 2 1 1 12 CYS H 1 12 CYS HN 1 1 197 1 1 1 1 11 LYS HB3 1 11 LYS HB2 1 1 197 1 2 1 1 12 CYS H 1 12 CYS HN 1 1 198 1 1 1 1 18 LYS HB2 1 18 LYS HB1 1 1 198 1 2 1 1 19 CYS H 1 19 CYS HN 1 1 199 1 1 1 1 18 LYS HB3 1 18 LYS HB2 1 1 199 1 2 1 1 19 CYS H 1 19 CYS HN 1 1 200 1 1 1 1 29 MET HA 1 29 MET HA 1 1 200 1 2 1 1 30 ILE H 1 30 ILE HN 1 1 201 1 1 1 1 29 MET HB2 1 29 MET HB1 1 1 201 1 2 1 1 30 ILE H 1 30 ILE HN 1 1 202 1 1 1 1 29 MET HB3 1 29 MET HB2 1 1 202 1 2 1 1 30 ILE H 1 30 ILE HN 1 1 203 1 1 1 1 29 MET H 1 29 MET HN 1 1 203 1 2 1 1 30 ILE H 1 30 ILE HN 1 1 204 1 1 1 1 24 PRO HA 1 24 PRO HA 1 1 204 1 2 1 1 25 CYS H 1 25 CYS HN 1 1 205 1 1 1 1 24 PRO HB2 1 24 PRO HB1 1 1 205 1 2 1 1 25 CYS H 1 25 CYS HN 1 1 206 1 1 1 1 24 PRO HB3 1 24 PRO HB2 1 1 206 1 2 1 1 25 CYS H 1 25 CYS HN 1 1 207 1 1 1 1 38 PRO HA 1 38 PRO HA 1 1 207 1 2 1 1 39 ARG H 1 39 ARG HN 1 1 208 1 1 1 1 38 PRO HB2 1 38 PRO HB1 1 1 208 1 2 1 1 39 ARG H 1 39 ARG HN 1 1 209 1 1 1 1 38 PRO HB3 1 38 PRO HB2 1 1 209 1 2 1 1 39 ARG H 1 39 ARG HN 1 1 210 1 1 1 1 28 SER HA 1 28 SER HA 1 1 210 1 2 1 1 34 CYS HA 1 34 CYS HA 1 1 211 1 1 1 1 28 SER HB2 1 28 SER HB1 1 1 211 1 2 1 1 33 ASN HB2 1 33 ASN HB1 1 1 212 1 1 1 1 28 SER HB2 1 28 SER HB1 1 1 212 1 2 1 1 33 ASN HB3 1 33 ASN HB2 1 1 213 1 1 1 1 28 SER HB2 1 28 SER HB1 1 1 213 1 2 1 1 29 MET H 1 29 MET HN 1 1 214 1 1 1 1 28 SER HB3 1 28 SER HB2 1 1 214 1 2 1 1 33 ASN HB2 1 33 ASN HB1 1 1 215 1 1 1 1 28 SER HB3 1 28 SER HB2 1 1 215 1 2 1 1 33 ASN HB3 1 33 ASN HB2 1 1 216 1 1 1 1 28 SER HB3 1 28 SER HB2 1 1 216 1 2 1 1 29 MET H 1 29 MET HN 1 1 217 1 1 1 1 5 ILE MD 1 5 ILE HD1* 1 1 217 1 2 1 1 13 THR H 1 13 THR HN 1 1 218 1 1 1 1 17 THR HB 1 17 THR HB 1 1 218 1 2 1 1 18 LYS H 1 18 LYS HN 1 1 219 1 1 1 1 4 CYS HA 1 4 CYS HA 1 1 219 1 2 1 1 17 THR MG 1 17 THR HG2* 1 1 220 1 1 1 1 4 CYS HB2 1 4 CYS HB1 1 1 220 1 2 1 1 17 THR MG 1 17 THR HG2* 1 1 221 1 1 1 1 4 CYS HB3 1 4 CYS HB2 1 1 221 1 2 1 1 17 THR MG 1 17 THR HG2* 1 1 222 1 1 1 1 5 ILE H 1 5 ILE HN 1 1 222 1 2 1 1 17 THR MG 1 17 THR HG2* 1 1 223 1 1 1 1 17 THR H 1 17 THR HN 1 1 223 1 2 1 1 18 LYS H 1 18 LYS HN 1 1 224 1 1 1 1 32 THR H 1 32 THR HN 1 1 224 1 2 1 1 33 ASN H 1 33 ASN HN 1 1 225 1 1 1 1 14 TRP QB 1 14 TRP HB* 1 1 225 1 2 1 1 15 GLY H 1 15 GLY HN 1 1 226 1 1 1 1 14 TRP HD1 1 14 TRP HD1 1 1 226 1 2 1 1 25 CYS HB3 1 25 CYS HBR 1 1 227 1 1 1 1 14 TRP HD1 1 14 TRP HD1 1 1 227 1 2 1 1 25 CYS HB2 1 25 CYS HBS 1 1 228 1 1 1 1 9 TYR HB3 1 9 TYR HB2 1 1 228 1 2 1 1 35 GLU QG 1 35 GLU HG* 1 1 229 1 1 1 1 9 TYR HB3 1 9 TYR HB2 1 1 229 1 2 1 1 10 GLY H 1 10 GLY HN 1 1 230 1 1 1 1 9 TYR HB2 1 9 TYR HB1 1 1 230 1 2 1 1 10 GLY H 1 10 GLY HN 1 1 231 1 1 1 1 8 ASP HB3 1 8 ASP HBR 1 1 231 1 2 1 1 9 TYR QD 1 9 TYR HD* 1 1 232 1 1 1 1 8 ASP HB2 1 8 ASP HBS 1 1 232 1 2 1 1 9 TYR QD 1 9 TYR HD* 1 1 233 1 1 1 1 9 TYR QD 1 9 TYR HD* 1 1 233 1 2 1 1 35 GLU HB2 1 35 GLU HB1 1 1 234 1 1 1 1 9 TYR QD 1 9 TYR HD* 1 1 234 1 2 1 1 35 GLU HB3 1 35 GLU HB2 1 1 235 1 1 1 1 9 TYR QD 1 9 TYR HD* 1 1 235 1 2 1 1 35 GLU QG 1 35 GLU HG* 1 1 236 1 1 1 1 9 TYR QD 1 9 TYR HD* 1 1 236 1 2 1 1 37 THR MG 1 37 THR HG2* 1 1 237 1 1 1 1 9 TYR QD 1 9 TYR HD* 1 1 237 1 2 1 1 37 THR HA 1 37 THR HA 1 1 238 1 1 1 1 8 ASP HB3 1 8 ASP HBR 1 1 238 1 2 1 1 9 TYR QE 1 9 TYR HE* 1 1 239 1 1 1 1 8 ASP HB2 1 8 ASP HBS 1 1 239 1 2 1 1 9 TYR QE 1 9 TYR HE* 1 1 240 1 1 1 1 9 TYR QE 1 9 TYR HE* 1 1 240 1 2 1 1 38 PRO HB2 1 38 PRO HB1 1 1 241 1 1 1 1 9 TYR QE 1 9 TYR HE* 1 1 241 1 2 1 1 38 PRO HB3 1 38 PRO HB2 1 1 242 1 1 1 1 9 TYR QE 1 9 TYR HE* 1 1 242 1 2 1 1 38 PRO HD2 1 38 PRO HD1 1 1 243 1 1 1 1 9 TYR QE 1 9 TYR HE* 1 1 243 1 2 1 1 38 PRO HD3 1 38 PRO HD2 1 1 244 1 1 1 1 9 TYR QE 1 9 TYR HE* 1 1 244 1 2 1 1 38 PRO HG2 1 38 PRO HG1 1 1 245 1 1 1 1 9 TYR QE 1 9 TYR HE* 1 1 245 1 2 1 1 38 PRO HG3 1 38 PRO HG2 1 1 246 1 1 1 1 9 TYR QE 1 9 TYR HE* 1 1 246 1 2 1 1 37 THR MG 1 37 THR HG2* 1 1 247 1 1 1 1 9 TYR QE 1 9 TYR HE* 1 1 247 1 2 1 1 37 THR HA 1 37 THR HA 1 1 248 1 1 1 1 9 TYR H 1 9 TYR HN 1 1 248 1 2 1 1 10 GLY H 1 10 GLY HN 1 1 249 1 1 1 1 39 ARG HA 1 39 ARG HA 1 1 249 1 2 1 1 40 LEU H 1 40 LEU HN 1 1 250 1 1 1 1 40 LEU HA 1 40 LEU HA 1 1 250 1 2 1 1 41 ILE H 1 41 ILE HN 1 1 251 1 1 1 1 42 MET HA 1 42 MET HA 1 1 251 1 2 1 1 43 GLU H 1 43 GLU HN 1 1 252 1 1 1 1 44 GLY QA 1 44 GLY HA* 1 1 252 1 2 1 1 45 LEU H 1 45 LEU HN 1 1 253 1 1 1 1 45 LEU HA 1 45 LEU HA 1 1 253 1 2 1 1 46 SER H 1 46 SER HN 1 1 254 1 1 1 1 46 SER HA 1 46 SER HA 1 1 254 1 2 1 1 47 PHE H 1 47 PHE HN 1 1 255 1 1 1 1 47 PHE HA 1 47 PHE HA 1 1 255 1 2 1 1 48 ALA H 1 48 ALA HN 1 1 256 1 1 1 1 39 ARG HB2 1 39 ARG HB1 1 1 256 1 2 1 1 40 LEU H 1 40 LEU HN 1 1 257 1 1 1 1 40 LEU HB2 1 40 LEU HB1 1 1 257 1 2 1 1 41 ILE H 1 41 ILE HN 1 1 258 1 1 1 1 41 ILE HB 1 41 ILE HB 1 1 258 1 2 1 1 42 MET H 1 42 MET HN 1 1 259 1 1 1 1 42 MET HB2 1 42 MET HB1 1 1 259 1 2 1 1 43 GLU H 1 43 GLU HN 1 1 260 1 1 1 1 43 GLU HB2 1 43 GLU HB1 1 1 260 1 2 1 1 44 GLY H 1 44 GLY HN 1 1 261 1 1 1 1 45 LEU HB2 1 45 LEU HB1 1 1 261 1 2 1 1 46 SER H 1 46 SER HN 1 1 262 1 1 1 1 46 SER HB2 1 46 SER HB1 1 1 262 1 2 1 1 47 PHE H 1 47 PHE HN 1 1 263 1 1 1 1 47 PHE HB2 1 47 PHE HB1 1 1 263 1 2 1 1 48 ALA H 1 48 ALA HN 1 1 264 1 1 1 1 39 ARG HB3 1 39 ARG HB2 1 1 264 1 2 1 1 40 LEU H 1 40 LEU HN 1 1 265 1 1 1 1 40 LEU HB3 1 40 LEU HB2 1 1 265 1 2 1 1 41 ILE H 1 41 ILE HN 1 1 266 1 1 1 1 42 MET HB3 1 42 MET HB2 1 1 266 1 2 1 1 43 GLU H 1 43 GLU HN 1 1 267 1 1 1 1 43 GLU HB3 1 43 GLU HB2 1 1 267 1 2 1 1 44 GLY H 1 44 GLY HN 1 1 268 1 1 1 1 45 LEU HB3 1 45 LEU HB2 1 1 268 1 2 1 1 46 SER H 1 46 SER HN 1 1 269 1 1 1 1 46 SER HB3 1 46 SER HB2 1 1 269 1 2 1 1 47 PHE H 1 47 PHE HN 1 1 270 1 1 1 1 47 PHE HB3 1 47 PHE HB2 1 1 270 1 2 1 1 48 ALA H 1 48 ALA 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 . . . . . 4.13 1.8 4.13 1 1 2 1 . . . . . 4.4 1.8 5.4 1 1 3 1 . . . . . 3.08 1.8 4.08 1 1 4 1 . . . . . 3.26 1.8 4.26 1 1 5 1 . . . . . 3.57 1.8 3.57 1 1 6 1 . . . . . 3.61 1.8 4.61 1 1 7 1 . . . . . 3.04 1.8 4.04 1 1 8 1 . . . . . 4.07 1.8 5.07 1 1 9 1 . . . . . 4.51 1.8 5.51 1 1 10 1 . . . . . 4.73 1.8 5.73 1 1 11 1 . . . . . 3.15 1.8 3.15 1 1 12 1 . . . . . 3.05 1.8 4.05 1 1 13 1 . . . . . 3.36 1.8 3.36 1 1 14 1 . . . . . 3.57 1.8 3.57 1 1 15 1 . . . . . 4.57 1.8 5.57 1 1 16 1 . . . . . 2.96 1.8 3.96 1 1 17 1 . . . . . 3.61 1.8 4.61 1 1 18 1 . . . . . 2.84 1.8 2.84 1 1 19 1 . . . . . 3.16 1.8 3.16 1 1 20 1 . . . . . 3.6 1.8 4.6 1 1 21 1 . . . . . 3.35 1.8 4.35 1 1 22 1 . . . . . 3.0 1.8 3.0 1 1 23 1 . . . . . 2.53 1.8 3.53 1 1 24 1 . . . . . 2.89 1.8 2.89 1 1 25 1 . . . . . 2.4 1.8 2.4 1 1 26 1 . . . . . 3.47 1.8 3.47 1 1 27 1 . . . . . 3.59 1.8 3.59 1 1 28 1 . . . . . 4.08 1.8 4.08 1 1 29 1 . . . . . 4.12 1.8 4.12 1 1 30 1 . . . . . 3.5 1.8 3.5 1 1 31 1 . . . . . 2.66 1.8 2.66 1 1 32 1 . . . . . 4.26 1.8 4.26 1 1 33 1 . . . . . 3.89 1.8 3.89 1 1 34 1 . . . . . 2.84 1.8 2.84 1 1 35 1 . . . . . 2.55 1.8 2.55 1 1 36 1 . . . . . 3.61 1.8 3.61 1 1 37 1 . . . . . 3.52 1.8 3.52 1 1 38 1 . . . . . 4.09 1.8 4.09 1 1 39 1 . . . . . 4.09 1.8 4.09 1 1 40 1 . . . . . 3.6 1.8 3.6 1 1 41 1 . . . . . 2.86 1.8 2.86 1 1 42 1 . . . . . 2.66 1.8 3.66 1 1 43 1 . . . . . 2.42 1.8 2.42 1 1 44 1 . . . . . 2.46 1.8 2.46 1 1 45 1 . . . . . 2.68 1.8 2.68 1 1 46 1 . . . . . 3.29 1.8 3.29 1 1 47 1 . . . . . 4.39 1.8 4.39 1 1 48 1 . . . . . 2.86 1.8 3.86 1 1 49 1 . . . . . 3.63 1.8 4.63 1 1 50 1 . . . . . 4.7 1.8 4.7 1 1 51 1 . . . . . 4.99 1.8 4.99 1 1 52 1 . . . . . 2.64 1.8 2.64 1 1 53 1 . . . . . 2.33 1.8 2.33 1 1 54 1 . . . . . 2.21 1.8 2.21 1 1 55 1 . . . . . 2.39 1.8 2.39 1 1 56 1 . . . . . 2.48 1.8 2.48 1 1 57 1 . . . . . 2.39 1.8 2.39 1 1 58 1 . . . . . 2.73 1.8 2.73 1 1 59 1 . . . . . 2.75 1.8 2.75 1 1 60 1 . . . . . 2.12 1.8 2.12 1 1 61 1 . . . . . 2.16 1.8 2.16 1 1 62 1 . . . . . 2.49 1.8 2.49 1 1 63 1 . . . . . 2.59 1.8 2.59 1 1 64 1 . . . . . 2.41 1.8 2.41 1 1 65 1 . . . . . 2.28 1.8 2.28 1 1 66 1 . . . . . 2.57 1.8 2.57 1 1 67 1 . . . . . 2.31 1.8 2.31 1 1 68 1 . . . . . 2.16 1.8 2.16 1 1 69 1 . . . . . 2.95 1.8 2.95 1 1 70 1 . . . . . 2.17 1.8 2.17 1 1 71 1 . . . . . 2.39 1.8 2.39 1 1 72 1 . . . . . 2.47 1.8 2.47 1 1 73 1 . . . . . 2.24 1.8 2.24 1 1 74 1 . . . . . 2.14 1.8 2.14 1 1 75 1 . . . . . 2.07 1.8 2.07 1 1 76 1 . . . . . 3.25 1.8 3.25 1 1 77 1 . . . . . 3.2 1.8 3.2 1 1 78 1 . . . . . 3.05 1.8 3.05 1 1 79 1 . . . . . 2.17 1.8 2.17 1 1 80 1 . . . . . 3.0 -1.0 4.0 1 1 81 1 . . . . . 2.5 -1.0 2.5 1 1 82 1 . . . . . 2.5 -1.0 2.5 1 1 83 1 . . . . . 5.0 -1.0 5.0 1 1 84 1 . . . . . 5.0 -1.0 5.0 1 1 85 1 . . . . . 2.5 -1.0 2.5 1 1 86 1 . . . . . 2.5 -1.0 2.5 1 1 87 1 . . . . . 2.5 -1.0 2.5 1 1 88 1 . . . . . 3.5 -1.0 3.5 1 1 89 1 . . . . . 5.0 -1.0 6.0 1 1 90 1 . . . . . 5.0 -1.0 5.0 1 1 91 1 . . . . . 5.0 -1.0 5.0 1 1 92 1 . . . . . 2.5 -1.0 2.5 1 1 93 1 . . . . . 5.0 -1.0 5.0 1 1 94 1 . . . . . 5.0 -1.0 5.0 1 1 95 1 . . . . . 2.5 -1.0 2.5 1 1 96 1 . . . . . 5.0 -1.0 6.0 1 1 97 1 . . . . . 3.5 -1.0 3.5 1 1 98 1 . . . . . 5.0 -1.0 5.0 1 1 99 1 . . . . . 3.5 -1.0 3.5 1 1 100 1 . . . . . 5.0 -1.0 5.0 1 1 101 1 . . . . . 5.0 -1.0 5.0 1 1 102 1 . . . . . 3.5 -1.0 3.5 1 1 103 1 . . . . . 3.5 -1.0 3.5 1 1 104 1 . . . . . 3.5 -1.0 3.5 1 1 105 1 . . . . . 5.0 -1.0 5.0 1 1 106 1 . . . . . 5.0 -1.0 5.0 1 1 107 1 . . . . . 5.0 -1.0 5.0 1 1 108 1 . . . . . 5.0 -1.0 5.0 1 1 109 1 . . . . . 2.5 -1.0 3.5 1 1 110 1 . . . . . 5.0 -1.0 6.0 1 1 111 1 . . . . . 3.5 -1.0 3.5 1 1 112 1 . . . . . 2.5 -1.0 3.5 1 1 113 1 . . . . . 5.0 -1.0 6.0 1 1 114 1 . . . . . 3.5 -1.0 3.5 1 1 115 1 . . . . . 3.5 -1.0 3.5 1 1 116 1 . . . . . 2.5 -1.0 2.5 1 1 117 1 . . . . . 5.0 -1.0 5.0 1 1 118 1 . . . . . 3.5 -1.0 3.5 1 1 119 1 . . . . . 5.0 -1.0 5.0 1 1 120 1 . . . . . 5.0 -1.0 5.0 1 1 121 1 . . . . . 5.0 -1.0 5.0 1 1 122 1 . . . . . 3.5 -1.0 3.5 1 1 123 1 . . . . . 3.5 -1.0 3.5 1 1 124 1 . . . . . 2.5 -1.0 2.5 1 1 125 1 . . . . . 2.5 -1.0 2.5 1 1 126 1 . . . . . 3.5 -1.0 3.5 1 1 127 1 . . . . . 2.5 -1.0 2.5 1 1 128 1 . . . . . 5.0 -1.0 6.0 1 1 129 1 . . . . . 5.0 -1.0 5.0 1 1 130 1 . . . . . 3.5 -1.0 3.5 1 1 131 1 . . . . . 5.0 -1.0 5.0 1 1 132 1 . . . . . 5.0 -1.0 5.0 1 1 133 1 . . . . . 5.0 -1.0 5.0 1 1 134 1 . . . . . 3.5 -1.0 3.5 1 1 135 1 . . . . . 2.5 -1.0 2.5 1 1 136 1 . . . . . 5.0 -1.0 5.0 1 1 137 1 . . . . . 3.5 -1.0 3.5 1 1 138 1 . . . . . 5.0 -1.0 5.0 1 1 139 1 . . . . . 5.0 -1.0 5.0 1 1 140 1 . . . . . 5.0 -1.0 5.0 1 1 141 1 . . . . . 5.0 -1.0 5.0 1 1 142 1 . . . . . 5.0 -1.0 5.0 1 1 143 1 . . . . . 5.0 -1.0 5.0 1 1 144 1 . . . . . 5.0 -1.0 5.0 1 1 145 1 . . . . . 5.0 -1.0 5.0 1 1 146 1 . . . . . 2.5 -1.0 2.5 1 1 147 1 . . . . . 3.5 -1.0 3.5 1 1 148 1 . . . . . 2.5 -1.0 2.5 1 1 149 1 . . . . . 5.0 -1.0 6.0 1 1 150 1 . . . . . 3.5 -1.0 3.5 1 1 151 1 . . . . . 5.0 -1.0 5.0 1 1 152 1 . . . . . 5.0 -1.0 5.0 1 1 153 1 . . . . . 3.5 -1.0 3.5 1 1 154 1 . . . . . 2.5 -1.0 2.5 1 1 155 1 . . . . . 5.0 -1.0 5.0 1 1 156 1 . . . . . 3.5 -1.0 3.5 1 1 157 1 . . . . . 3.5 -1.0 3.5 1 1 158 1 . . . . . 5.0 -1.0 5.0 1 1 159 1 . . . . . 5.0 -1.0 5.0 1 1 160 1 . . . . . 5.0 -1.0 5.0 1 1 161 1 . . . . . 5.0 -1.0 5.0 1 1 162 1 . . . . . 5.0 -1.0 5.0 1 1 163 1 . . . . . 5.0 -1.0 5.0 1 1 164 1 . . . . . 5.0 -1.0 5.0 1 1 165 1 . . . . . 5.0 -1.0 6.0 1 1 166 1 . . . . . 2.5 -1.0 2.5 1 1 167 1 . . . . . 3.5 -1.0 3.5 1 1 168 1 . . . . . 3.5 -1.0 3.5 1 1 169 1 . . . . . 5.0 -1.0 5.0 1 1 170 1 . . . . . 5.0 -1.0 5.0 1 1 171 1 . . . . . 5.0 -1.0 5.0 1 1 172 1 . . . . . 5.0 -1.0 6.0 1 1 173 1 . . . . . 5.0 -1.0 6.0 1 1 174 1 . . . . . 5.0 -1.0 5.0 1 1 175 1 . . . . . 3.5 -1.0 3.5 1 1 176 1 . . . . . 3.5 -1.0 3.5 1 1 177 1 . . . . . 2.5 -1.0 2.5 1 1 178 1 . . . . . 5.0 -1.0 5.0 1 1 179 1 . . . . . 5.0 -1.0 5.0 1 1 180 1 . . . . . 2.5 -1.0 2.5 1 1 181 1 . . . . . 3.5 -1.0 3.5 1 1 182 1 . . . . . 3.5 -1.0 3.5 1 1 183 1 . . . . . 5.0 -1.0 5.0 1 1 184 1 . . . . . 5.0 -1.0 5.0 1 1 185 1 . . . . . 3.5 -1.0 3.5 1 1 186 1 . . . . . 3.5 -1.0 3.5 1 1 187 1 . . . . . 2.5 -1.0 2.5 1 1 188 1 . . . . . 3.5 -1.0 3.5 1 1 189 1 . . . . . 5.0 -1.0 5.0 1 1 190 1 . . . . . 2.5 -1.0 2.5 1 1 191 1 . . . . . 3.5 -1.0 4.5 1 1 192 1 . . . . . 3.5 -1.0 4.5 1 1 193 1 . . . . . 5.0 -1.0 5.0 1 1 194 1 . . . . . 5.0 -1.0 6.0 1 1 195 1 . . . . . 5.0 -1.0 5.0 1 1 196 1 . . . . . 3.5 -1.0 3.5 1 1 197 1 . . . . . 3.5 -1.0 3.5 1 1 198 1 . . . . . 2.5 -1.0 2.5 1 1 199 1 . . . . . 2.5 -1.0 2.5 1 1 200 1 . . . . . 3.5 -1.0 3.5 1 1 201 1 . . . . . 3.5 -1.0 3.5 1 1 202 1 . . . . . 3.5 -1.0 3.5 1 1 203 1 . . . . . 2.5 -1.0 2.5 1 1 204 1 . . . . . 2.5 -1.0 2.5 1 1 205 1 . . . . . 3.5 -1.0 3.5 1 1 206 1 . . . . . 3.5 -1.0 3.5 1 1 207 1 . . . . . 3.5 -1.0 3.5 1 1 208 1 . . . . . 5.0 -1.0 5.0 1 1 209 1 . . . . . 5.0 -1.0 5.0 1 1 210 1 . . . . . 5.0 -1.0 5.0 1 1 211 1 . . . . . 5.0 -1.0 5.0 1 1 212 1 . . . . . 5.0 -1.0 5.0 1 1 213 1 . . . . . 3.5 -1.0 3.5 1 1 214 1 . . . . . 5.0 -1.0 5.0 1 1 215 1 . . . . . 5.0 -1.0 5.0 1 1 216 1 . . . . . 2.5 -1.0 2.5 1 1 217 1 . . . . . 5.0 -1.0 6.0 1 1 218 1 . . . . . 3.5 -1.0 3.5 1 1 219 1 . . . . . 2.5 -1.0 3.5 1 1 220 1 . . . . . 3.5 -1.0 4.5 1 1 221 1 . . . . . 3.5 -1.0 4.5 1 1 222 1 . . . . . 2.5 -1.0 3.5 1 1 223 1 . . . . . 5.0 -1.0 5.0 1 1 224 1 . . . . . 5.0 -1.0 5.0 1 1 225 1 . . . . . 3.5 -1.0 4.5 1 1 226 1 . . . . . 4.5 -1.0 4.5 1 1 227 1 . . . . . 4.5 -1.0 4.5 1 1 228 1 . . . . . 5.0 -1.0 6.0 1 1 229 1 . . . . . 5.0 -1.0 5.0 1 1 230 1 . . . . . 5.0 -1.0 5.0 1 1 231 1 . . . . . 3.5 -1.0 5.5 1 1 232 1 . . . . . 3.5 -1.0 5.5 1 1 233 1 . . . . . 5.0 -1.0 7.0 1 1 234 1 . . . . . 5.0 -1.0 7.0 1 1 235 1 . . . . . 5.0 -1.0 8.0 1 1 236 1 . . . . . 5.0 -1.0 8.0 1 1 237 1 . . . . . 5.0 -1.0 7.0 1 1 238 1 . . . . . 5.0 -1.0 7.0 1 1 239 1 . . . . . 5.0 -1.0 7.0 1 1 240 1 . . . . . 5.0 -1.0 7.0 1 1 241 1 . . . . . 5.0 -1.0 7.0 1 1 242 1 . . . . . 5.0 -1.0 7.0 1 1 243 1 . . . . . 5.0 -1.0 7.0 1 1 244 1 . . . . . 4.5 -1.0 6.5 1 1 245 1 . . . . . 4.5 -1.0 6.5 1 1 246 1 . . . . . 5.0 -1.0 8.0 1 1 247 1 . . . . . 5.0 -1.0 7.0 1 1 248 1 . . . . . 3.5 -1.0 3.5 1 1 249 1 . . . . . 3.5 -1.0 3.5 1 1 250 1 . . . . . 3.5 -1.0 3.5 1 1 251 1 . . . . . 3.5 -1.0 3.5 1 1 252 1 . . . . . 3.5 -1.0 4.5 1 1 253 1 . . . . . 3.5 -1.0 3.5 1 1 254 1 . . . . . 3.5 -1.0 3.5 1 1 255 1 . . . . . 3.5 -1.0 3.5 1 1 256 1 . . . . . 5.0 -1.0 5.0 1 1 257 1 . . . . . 5.0 -1.0 5.0 1 1 258 1 . . . . . 5.0 -1.0 5.0 1 1 259 1 . . . . . 5.0 -1.0 5.0 1 1 260 1 . . . . . 4.0 -1.0 4.0 1 1 261 1 . . . . . 5.0 -1.0 5.0 1 1 262 1 . . . . . 5.0 -1.0 5.0 1 1 263 1 . . . . . 5.0 -1.0 5.0 1 1 264 1 . . . . . 5.0 -1.0 5.0 1 1 265 1 . . . . . 5.0 -1.0 5.0 1 1 266 1 . . . . . 5.0 -1.0 5.0 1 1 267 1 . . . . . 5.0 -1.0 5.0 1 1 268 1 . . . . . 5.0 -1.0 5.0 1 1 269 1 . . . . . 5.0 -1.0 5.0 1 1 270 1 . . . . . 5.0 -1.0 5.0 1 1 stop_ save_ save_Discover_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 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 10 GLY O 1 10 GLY O 1 2 1 1 2 1 1 36 CYS H 1 36 CYS HN 1 2 2 1 1 1 1 26 ARG O 1 26 ARG O 1 2 2 1 2 1 1 35 GLU H 1 35 GLU HN 1 2 3 1 1 1 1 26 ARG H 1 26 ARG HN 1 2 3 1 2 1 1 35 GLU O 1 35 GLU O 1 2 4 1 1 1 1 24 PRO O 1 24 PRO O 1 2 4 1 2 1 1 37 THR H 1 37 THR HN 1 2 5 1 1 1 1 12 CYS H 1 12 CYS HN 1 2 5 1 2 1 1 34 CYS O 1 34 CYS O 1 2 6 1 1 1 1 19 CYS O 1 19 CYS O 1 2 6 1 2 1 1 23 ARG H 1 23 ARG HN 1 2 7 1 1 1 1 19 CYS H 1 19 CYS HN 1 2 7 1 2 1 1 23 ARG O 1 23 ARG O 1 2 8 1 1 1 1 13 THR H 1 13 THR HN 1 2 8 1 2 1 1 17 THR O 1 17 THR O 1 2 9 1 1 1 1 5 ILE H 1 5 ILE HN 1 2 9 1 2 1 1 18 LYS O 1 18 LYS O 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . -1.0 2.35 1 2 2 1 . . . . . . -1.0 2.35 1 2 3 1 . . . . . . -1.0 2.35 1 2 4 1 . . . . . . -1.0 2.35 1 2 5 1 . . . . . . -1.0 2.35 1 2 6 1 . . . . . . -1.0 2.35 1 2 7 1 . . . . . . -1.0 2.35 1 2 8 1 . . . . . . -1.0 2.35 1 2 9 1 . . . . . . -1.0 2.35 1 2 stop_ save_ save_Discover_dihedral_6 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 4 CYS C 1 1 5 ILE N 1 1 5 ILE CA 1 1 5 ILE C -174.99998 -75.0 1 4 CYS C 1 5 ILE N 1 5 ILE CA 1 5 ILE C 1 1 2 . 1 1 10 GLY C 1 1 11 LYS N 1 1 11 LYS CA 1 1 11 LYS C -89.99999 -10.0 1 10 GLY C 1 11 LYS N 1 11 LYS CA 1 11 LYS C 1 1 3 . 1 1 13 THR C 1 1 14 TRP N 1 1 14 TRP CA 1 1 14 TRP C -89.99999 -10.0 1 13 THR C 1 14 TRP N 1 14 TRP CA 1 14 TRP C 1 1 4 . 1 1 16 GLY C 1 1 17 THR N 1 1 17 THR CA 1 1 17 THR C -89.99999 -10.0 1 16 GLY C 1 17 THR N 1 17 THR CA 1 17 THR C 1 1 5 . 1 1 20 CYS C 1 1 21 ARG N 1 1 21 ARG CA 1 1 21 ARG C -89.99999 -10.0 1 20 CYS C 1 21 ARG N 1 21 ARG CA 1 21 ARG C 1 1 6 . 1 1 27 CYS C 1 1 28 SER N 1 1 28 SER CA 1 1 28 SER C -89.99999 -10.0 1 27 CYS C 1 28 SER N 1 28 SER CA 1 28 SER C 1 1 7 . 1 1 28 SER C 1 1 29 MET N 1 1 29 MET CA 1 1 29 MET C -89.99999 -10.0 1 28 SER C 1 29 MET N 1 29 MET CA 1 29 MET C 1 1 8 . 1 1 35 GLU C 1 1 36 CYS N 1 1 36 CYS CA 1 1 36 CYS C -89.99999 -10.0 1 35 GLU C 1 36 CYS N 1 36 CYS CA 1 36 CYS C 1 1 9 . 1 1 11 LYS C 1 1 12 CYS N 1 1 12 CYS CA 1 1 12 CYS C -174.99998 -75.0 1 11 LYS C 1 12 CYS N 1 12 CYS CA 1 12 CYS C 1 1 10 . 1 1 12 CYS C 1 1 13 THR N 1 1 13 THR CA 1 1 13 THR C -174.99998 -75.0 1 12 CYS C 1 13 THR N 1 13 THR CA 1 13 THR C 1 1 11 . 1 1 24 PRO C 1 1 25 CYS N 1 1 25 CYS CA 1 1 25 CYS C -174.99998 -75.0 1 24 PRO C 1 25 CYS N 1 25 CYS CA 1 25 CYS C 1 1 12 . 1 1 26 ARG C 1 1 27 CYS N 1 1 27 CYS CA 1 1 27 CYS C -174.99998 -75.0 1 26 ARG C 1 27 CYS N 1 27 CYS CA 1 27 CYS C 1 1 13 . 1 1 31 GLY C 1 1 32 THR N 1 1 32 THR CA 1 1 32 THR C -174.99998 -75.0 1 31 GLY C 1 32 THR N 1 32 THR CA 1 32 THR C 1 1 14 . 1 1 34 CYS C 1 1 35 GLU N 1 1 35 GLU CA 1 1 35 GLU C -174.99998 -75.0 1 34 CYS C 1 35 GLU N 1 35 GLU CA 1 35 GLU C 1 1 15 . 1 1 29 MET C 1 1 30 ILE N 1 1 30 ILE CA 1 1 30 ILE C -174.99998 -75.0 1 29 MET C 1 30 ILE N 1 30 ILE CA 1 30 ILE C 1 1 16 . 1 1 12 CYS N 1 1 12 CYS CA 1 1 12 CYS CB 1 1 12 CYS SG 40.0 80.0 1 12 CYS N 1 12 CYS CA 1 12 CYS CB 1 12 CYS SG 1 1 17 . 1 1 4 CYS N 1 1 4 CYS CA 1 1 4 CYS CB 1 1 4 CYS SG 40.0 80.0 1 4 CYS N 1 4 CYS CA 1 4 CYS CB 1 4 CYS SG 1 1 18 . 1 1 19 CYS N 1 1 19 CYS CA 1 1 19 CYS CB 1 1 19 CYS SG -80.0 -40.0 1 19 CYS N 1 19 CYS CA 1 19 CYS CB 1 19 CYS SG 1 1 19 . 1 1 27 CYS N 1 1 27 CYS CA 1 1 27 CYS CB 1 1 27 CYS SG -80.0 -40.0 1 27 CYS N 1 27 CYS CA 1 27 CYS CB 1 27 CYS SG 1 1 20 . 1 1 34 CYS N 1 1 34 CYS CA 1 1 34 CYS CB 1 1 34 CYS SG -80.0 -40.0 1 34 CYS N 1 34 CYS CA 1 34 CYS CB 1 34 CYS SG 1 1 21 . 1 1 20 CYS N 1 1 20 CYS CA 1 1 20 CYS CB 1 1 20 CYS SG 160.0 200.0 1 20 CYS N 1 20 CYS CA 1 20 CYS CB 1 20 CYS SG 1 1 22 . 1 1 2 ASP CA 1 1 2 ASP C 1 1 3 ASN N 1 1 3 ASN CA 170.0 190.0 1 2 ASP CA 1 2 ASP C 1 3 ASN N 1 3 ASN CA 1 1 23 . 1 1 2 ASP O 1 1 2 ASP C 1 1 3 ASN N 1 1 3 ASN H 170.0 190.0 1 2 ASP O 1 2 ASP C 1 3 ASN N 1 3 ASN HN 1 1 24 . 1 1 2 ASP CA 1 1 2 ASP C 1 1 3 ASN N 1 1 3 ASN H -10.0 10.0 1 2 ASP CA 1 2 ASP C 1 3 ASN N 1 3 ASN HN 1 1 25 . 1 1 2 ASP O 1 1 2 ASP C 1 1 3 ASN N 1 1 3 ASN CA -10.0 10.0 1 2 ASP O 1 2 ASP C 1 3 ASN N 1 3 ASN CA 1 1 26 . 1 1 3 ASN CA 1 1 3 ASN C 1 1 4 CYS N 1 1 4 CYS CA 170.0 190.0 1 3 ASN CA 1 3 ASN C 1 4 CYS N 1 4 CYS CA 1 1 27 . 1 1 3 ASN O 1 1 3 ASN C 1 1 4 CYS N 1 1 4 CYS H 170.0 190.0 1 3 ASN O 1 3 ASN C 1 4 CYS N 1 4 CYS HN 1 1 28 . 1 1 3 ASN CA 1 1 3 ASN C 1 1 4 CYS N 1 1 4 CYS H -10.0 10.0 1 3 ASN CA 1 3 ASN C 1 4 CYS N 1 4 CYS HN 1 1 29 . 1 1 3 ASN O 1 1 3 ASN C 1 1 4 CYS N 1 1 4 CYS CA -10.0 10.0 1 3 ASN O 1 3 ASN C 1 4 CYS N 1 4 CYS CA 1 1 30 . 1 1 4 CYS CA 1 1 4 CYS C 1 1 5 ILE N 1 1 5 ILE CA 170.0 190.0 1 4 CYS CA 1 4 CYS C 1 5 ILE N 1 5 ILE CA 1 1 31 . 1 1 4 CYS O 1 1 4 CYS C 1 1 5 ILE N 1 1 5 ILE H 170.0 190.0 1 4 CYS O 1 4 CYS C 1 5 ILE N 1 5 ILE HN 1 1 32 . 1 1 4 CYS CA 1 1 4 CYS C 1 1 5 ILE N 1 1 5 ILE H -10.0 10.0 1 4 CYS CA 1 4 CYS C 1 5 ILE N 1 5 ILE HN 1 1 33 . 1 1 4 CYS O 1 1 4 CYS C 1 1 5 ILE N 1 1 5 ILE CA -10.0 10.0 1 4 CYS O 1 4 CYS C 1 5 ILE N 1 5 ILE CA 1 1 34 . 1 1 5 ILE CA 1 1 5 ILE C 1 1 6 ALA N 1 1 6 ALA CA 170.0 190.0 1 5 ILE CA 1 5 ILE C 1 6 ALA N 1 6 ALA CA 1 1 35 . 1 1 5 ILE O 1 1 5 ILE C 1 1 6 ALA N 1 1 6 ALA H 170.0 190.0 1 5 ILE O 1 5 ILE C 1 6 ALA N 1 6 ALA HN 1 1 36 . 1 1 5 ILE CA 1 1 5 ILE C 1 1 6 ALA N 1 1 6 ALA H -10.0 10.0 1 5 ILE CA 1 5 ILE C 1 6 ALA N 1 6 ALA HN 1 1 37 . 1 1 5 ILE O 1 1 5 ILE C 1 1 6 ALA N 1 1 6 ALA CA -10.0 10.0 1 5 ILE O 1 5 ILE C 1 6 ALA N 1 6 ALA CA 1 1 38 . 1 1 6 ALA CA 1 1 6 ALA C 1 1 7 GLU N 1 1 7 GLU CA 170.0 190.0 1 6 ALA CA 1 6 ALA C 1 7 GLU N 1 7 GLU CA 1 1 39 . 1 1 6 ALA O 1 1 6 ALA C 1 1 7 GLU N 1 1 7 GLU H 170.0 190.0 1 6 ALA O 1 6 ALA C 1 7 GLU N 1 7 GLU HN 1 1 40 . 1 1 6 ALA CA 1 1 6 ALA C 1 1 7 GLU N 1 1 7 GLU H -10.0 10.0 1 6 ALA CA 1 6 ALA C 1 7 GLU N 1 7 GLU HN 1 1 41 . 1 1 6 ALA O 1 1 6 ALA C 1 1 7 GLU N 1 1 7 GLU CA -10.0 10.0 1 6 ALA O 1 6 ALA C 1 7 GLU N 1 7 GLU CA 1 1 42 . 1 1 7 GLU CA 1 1 7 GLU C 1 1 8 ASP N 1 1 8 ASP CA 170.0 190.0 1 7 GLU CA 1 7 GLU C 1 8 ASP N 1 8 ASP CA 1 1 43 . 1 1 7 GLU O 1 1 7 GLU C 1 1 8 ASP N 1 1 8 ASP H 170.0 190.0 1 7 GLU O 1 7 GLU C 1 8 ASP N 1 8 ASP HN 1 1 44 . 1 1 7 GLU CA 1 1 7 GLU C 1 1 8 ASP N 1 1 8 ASP H -10.0 10.0 1 7 GLU CA 1 7 GLU C 1 8 ASP N 1 8 ASP HN 1 1 45 . 1 1 7 GLU O 1 1 7 GLU C 1 1 8 ASP N 1 1 8 ASP CA -10.0 10.0 1 7 GLU O 1 7 GLU C 1 8 ASP N 1 8 ASP CA 1 1 46 . 1 1 8 ASP CA 1 1 8 ASP C 1 1 9 TYR N 1 1 9 TYR CA 170.0 190.0 1 8 ASP CA 1 8 ASP C 1 9 TYR N 1 9 TYR CA 1 1 47 . 1 1 8 ASP O 1 1 8 ASP C 1 1 9 TYR N 1 1 9 TYR H 170.0 190.0 1 8 ASP O 1 8 ASP C 1 9 TYR N 1 9 TYR HN 1 1 48 . 1 1 8 ASP CA 1 1 8 ASP C 1 1 9 TYR N 1 1 9 TYR H -10.0 10.0 1 8 ASP CA 1 8 ASP C 1 9 TYR N 1 9 TYR HN 1 1 49 . 1 1 8 ASP O 1 1 8 ASP C 1 1 9 TYR N 1 1 9 TYR CA -10.0 10.0 1 8 ASP O 1 8 ASP C 1 9 TYR N 1 9 TYR CA 1 1 50 . 1 1 9 TYR CA 1 1 9 TYR C 1 1 10 GLY N 1 1 10 GLY CA 170.0 190.0 1 9 TYR CA 1 9 TYR C 1 10 GLY N 1 10 GLY CA 1 1 51 . 1 1 9 TYR O 1 1 9 TYR C 1 1 10 GLY N 1 1 10 GLY H 170.0 190.0 1 9 TYR O 1 9 TYR C 1 10 GLY N 1 10 GLY HN 1 1 52 . 1 1 9 TYR CA 1 1 9 TYR C 1 1 10 GLY N 1 1 10 GLY H -10.0 10.0 1 9 TYR CA 1 9 TYR C 1 10 GLY N 1 10 GLY HN 1 1 53 . 1 1 9 TYR O 1 1 9 TYR C 1 1 10 GLY N 1 1 10 GLY CA -10.0 10.0 1 9 TYR O 1 9 TYR C 1 10 GLY N 1 10 GLY CA 1 1 54 . 1 1 10 GLY CA 1 1 10 GLY C 1 1 11 LYS N 1 1 11 LYS CA 170.0 190.0 1 10 GLY CA 1 10 GLY C 1 11 LYS N 1 11 LYS CA 1 1 55 . 1 1 10 GLY O 1 1 10 GLY C 1 1 11 LYS N 1 1 11 LYS H 170.0 190.0 1 10 GLY O 1 10 GLY C 1 11 LYS N 1 11 LYS HN 1 1 56 . 1 1 10 GLY CA 1 1 10 GLY C 1 1 11 LYS N 1 1 11 LYS H -10.0 10.0 1 10 GLY CA 1 10 GLY C 1 11 LYS N 1 11 LYS HN 1 1 57 . 1 1 10 GLY O 1 1 10 GLY C 1 1 11 LYS N 1 1 11 LYS CA -10.0 10.0 1 10 GLY O 1 10 GLY C 1 11 LYS N 1 11 LYS CA 1 1 58 . 1 1 11 LYS CA 1 1 11 LYS C 1 1 12 CYS N 1 1 12 CYS CA 170.0 190.0 1 11 LYS CA 1 11 LYS C 1 12 CYS N 1 12 CYS CA 1 1 59 . 1 1 11 LYS O 1 1 11 LYS C 1 1 12 CYS N 1 1 12 CYS H 170.0 190.0 1 11 LYS O 1 11 LYS C 1 12 CYS N 1 12 CYS HN 1 1 60 . 1 1 11 LYS CA 1 1 11 LYS C 1 1 12 CYS N 1 1 12 CYS H -10.0 10.0 1 11 LYS CA 1 11 LYS C 1 12 CYS N 1 12 CYS HN 1 1 61 . 1 1 11 LYS O 1 1 11 LYS C 1 1 12 CYS N 1 1 12 CYS CA -10.0 10.0 1 11 LYS O 1 11 LYS C 1 12 CYS N 1 12 CYS CA 1 1 62 . 1 1 12 CYS CA 1 1 12 CYS C 1 1 13 THR N 1 1 13 THR CA 170.0 190.0 1 12 CYS CA 1 12 CYS C 1 13 THR N 1 13 THR CA 1 1 63 . 1 1 12 CYS O 1 1 12 CYS C 1 1 13 THR N 1 1 13 THR H 170.0 190.0 1 12 CYS O 1 12 CYS C 1 13 THR N 1 13 THR HN 1 1 64 . 1 1 12 CYS CA 1 1 12 CYS C 1 1 13 THR N 1 1 13 THR H -10.0 10.0 1 12 CYS CA 1 12 CYS C 1 13 THR N 1 13 THR HN 1 1 65 . 1 1 12 CYS O 1 1 12 CYS C 1 1 13 THR N 1 1 13 THR CA -10.0 10.0 1 12 CYS O 1 12 CYS C 1 13 THR N 1 13 THR CA 1 1 66 . 1 1 13 THR CA 1 1 13 THR C 1 1 14 TRP N 1 1 14 TRP CA 170.0 190.0 1 13 THR CA 1 13 THR C 1 14 TRP N 1 14 TRP CA 1 1 67 . 1 1 13 THR O 1 1 13 THR C 1 1 14 TRP N 1 1 14 TRP H 170.0 190.0 1 13 THR O 1 13 THR C 1 14 TRP N 1 14 TRP HN 1 1 68 . 1 1 13 THR CA 1 1 13 THR C 1 1 14 TRP N 1 1 14 TRP H -10.0 10.0 1 13 THR CA 1 13 THR C 1 14 TRP N 1 14 TRP HN 1 1 69 . 1 1 13 THR O 1 1 13 THR C 1 1 14 TRP N 1 1 14 TRP CA -10.0 10.0 1 13 THR O 1 13 THR C 1 14 TRP N 1 14 TRP CA 1 1 70 . 1 1 14 TRP CA 1 1 14 TRP C 1 1 15 GLY N 1 1 15 GLY CA 170.0 190.0 1 14 TRP CA 1 14 TRP C 1 15 GLY N 1 15 GLY CA 1 1 71 . 1 1 14 TRP O 1 1 14 TRP C 1 1 15 GLY N 1 1 15 GLY H 170.0 190.0 1 14 TRP O 1 14 TRP C 1 15 GLY N 1 15 GLY HN 1 1 72 . 1 1 14 TRP CA 1 1 14 TRP C 1 1 15 GLY N 1 1 15 GLY H -10.0 10.0 1 14 TRP CA 1 14 TRP C 1 15 GLY N 1 15 GLY HN 1 1 73 . 1 1 14 TRP O 1 1 14 TRP C 1 1 15 GLY N 1 1 15 GLY CA -10.0 10.0 1 14 TRP O 1 14 TRP C 1 15 GLY N 1 15 GLY CA 1 1 74 . 1 1 15 GLY CA 1 1 15 GLY C 1 1 16 GLY N 1 1 16 GLY CA 170.0 190.0 1 15 GLY CA 1 15 GLY C 1 16 GLY N 1 16 GLY CA 1 1 75 . 1 1 15 GLY O 1 1 15 GLY C 1 1 16 GLY N 1 1 16 GLY H 170.0 190.0 1 15 GLY O 1 15 GLY C 1 16 GLY N 1 16 GLY HN 1 1 76 . 1 1 15 GLY CA 1 1 15 GLY C 1 1 16 GLY N 1 1 16 GLY H -10.0 10.0 1 15 GLY CA 1 15 GLY C 1 16 GLY N 1 16 GLY HN 1 1 77 . 1 1 15 GLY O 1 1 15 GLY C 1 1 16 GLY N 1 1 16 GLY CA -10.0 10.0 1 15 GLY O 1 15 GLY C 1 16 GLY N 1 16 GLY CA 1 1 78 . 1 1 16 GLY CA 1 1 16 GLY C 1 1 17 THR N 1 1 17 THR CA 170.0 190.0 1 16 GLY CA 1 16 GLY C 1 17 THR N 1 17 THR CA 1 1 79 . 1 1 16 GLY O 1 1 16 GLY C 1 1 17 THR N 1 1 17 THR H 170.0 190.0 1 16 GLY O 1 16 GLY C 1 17 THR N 1 17 THR HN 1 1 80 . 1 1 16 GLY CA 1 1 16 GLY C 1 1 17 THR N 1 1 17 THR H -10.0 10.0 1 16 GLY CA 1 16 GLY C 1 17 THR N 1 17 THR HN 1 1 81 . 1 1 16 GLY O 1 1 16 GLY C 1 1 17 THR N 1 1 17 THR CA -10.0 10.0 1 16 GLY O 1 16 GLY C 1 17 THR N 1 17 THR CA 1 1 82 . 1 1 17 THR CA 1 1 17 THR C 1 1 18 LYS N 1 1 18 LYS CA 170.0 190.0 1 17 THR CA 1 17 THR C 1 18 LYS N 1 18 LYS CA 1 1 83 . 1 1 17 THR O 1 1 17 THR C 1 1 18 LYS N 1 1 18 LYS H 170.0 190.0 1 17 THR O 1 17 THR C 1 18 LYS N 1 18 LYS HN 1 1 84 . 1 1 17 THR CA 1 1 17 THR C 1 1 18 LYS N 1 1 18 LYS H -10.0 10.0 1 17 THR CA 1 17 THR C 1 18 LYS N 1 18 LYS HN 1 1 85 . 1 1 17 THR O 1 1 17 THR C 1 1 18 LYS N 1 1 18 LYS CA -10.0 10.0 1 17 THR O 1 17 THR C 1 18 LYS N 1 18 LYS CA 1 1 86 . 1 1 18 LYS CA 1 1 18 LYS C 1 1 19 CYS N 1 1 19 CYS CA 170.0 190.0 1 18 LYS CA 1 18 LYS C 1 19 CYS N 1 19 CYS CA 1 1 87 . 1 1 18 LYS O 1 1 18 LYS C 1 1 19 CYS N 1 1 19 CYS H 170.0 190.0 1 18 LYS O 1 18 LYS C 1 19 CYS N 1 19 CYS HN 1 1 88 . 1 1 18 LYS CA 1 1 18 LYS C 1 1 19 CYS N 1 1 19 CYS H -10.0 10.0 1 18 LYS CA 1 18 LYS C 1 19 CYS N 1 19 CYS HN 1 1 89 . 1 1 18 LYS O 1 1 18 LYS C 1 1 19 CYS N 1 1 19 CYS CA -10.0 10.0 1 18 LYS O 1 18 LYS C 1 19 CYS N 1 19 CYS CA 1 1 90 . 1 1 19 CYS CA 1 1 19 CYS C 1 1 20 CYS N 1 1 20 CYS CA 170.0 190.0 1 19 CYS CA 1 19 CYS C 1 20 CYS N 1 20 CYS CA 1 1 91 . 1 1 19 CYS O 1 1 19 CYS C 1 1 20 CYS N 1 1 20 CYS H 170.0 190.0 1 19 CYS O 1 19 CYS C 1 20 CYS N 1 20 CYS HN 1 1 92 . 1 1 19 CYS CA 1 1 19 CYS C 1 1 20 CYS N 1 1 20 CYS H -10.0 10.0 1 19 CYS CA 1 19 CYS C 1 20 CYS N 1 20 CYS HN 1 1 93 . 1 1 19 CYS O 1 1 19 CYS C 1 1 20 CYS N 1 1 20 CYS CA -10.0 10.0 1 19 CYS O 1 19 CYS C 1 20 CYS N 1 20 CYS CA 1 1 94 . 1 1 20 CYS CA 1 1 20 CYS C 1 1 21 ARG N 1 1 21 ARG CA 170.0 190.0 1 20 CYS CA 1 20 CYS C 1 21 ARG N 1 21 ARG CA 1 1 95 . 1 1 20 CYS O 1 1 20 CYS C 1 1 21 ARG N 1 1 21 ARG H 170.0 190.0 1 20 CYS O 1 20 CYS C 1 21 ARG N 1 21 ARG HN 1 1 96 . 1 1 20 CYS CA 1 1 20 CYS C 1 1 21 ARG N 1 1 21 ARG H -10.0 10.0 1 20 CYS CA 1 20 CYS C 1 21 ARG N 1 21 ARG HN 1 1 97 . 1 1 20 CYS O 1 1 20 CYS C 1 1 21 ARG N 1 1 21 ARG CA -10.0 10.0 1 20 CYS O 1 20 CYS C 1 21 ARG N 1 21 ARG CA 1 1 98 . 1 1 21 ARG CA 1 1 21 ARG C 1 1 22 GLY N 1 1 22 GLY CA 170.0 190.0 1 21 ARG CA 1 21 ARG C 1 22 GLY N 1 22 GLY CA 1 1 99 . 1 1 21 ARG O 1 1 21 ARG C 1 1 22 GLY N 1 1 22 GLY H 170.0 190.0 1 21 ARG O 1 21 ARG C 1 22 GLY N 1 22 GLY HN 1 1 100 . 1 1 21 ARG CA 1 1 21 ARG C 1 1 22 GLY N 1 1 22 GLY H -10.0 10.0 1 21 ARG CA 1 21 ARG C 1 22 GLY N 1 22 GLY HN 1 1 101 . 1 1 21 ARG O 1 1 21 ARG C 1 1 22 GLY N 1 1 22 GLY CA -10.0 10.0 1 21 ARG O 1 21 ARG C 1 22 GLY N 1 22 GLY CA 1 1 102 . 1 1 22 GLY CA 1 1 22 GLY C 1 1 23 ARG N 1 1 23 ARG CA 170.0 190.0 1 22 GLY CA 1 22 GLY C 1 23 ARG N 1 23 ARG CA 1 1 103 . 1 1 22 GLY O 1 1 22 GLY C 1 1 23 ARG N 1 1 23 ARG H 170.0 190.0 1 22 GLY O 1 22 GLY C 1 23 ARG N 1 23 ARG HN 1 1 104 . 1 1 22 GLY CA 1 1 22 GLY C 1 1 23 ARG N 1 1 23 ARG H -10.0 10.0 1 22 GLY CA 1 22 GLY C 1 23 ARG N 1 23 ARG HN 1 1 105 . 1 1 22 GLY O 1 1 22 GLY C 1 1 23 ARG N 1 1 23 ARG CA -10.0 10.0 1 22 GLY O 1 22 GLY C 1 23 ARG N 1 23 ARG CA 1 1 106 . 1 1 23 ARG CA 1 1 23 ARG C 1 1 24 PRO N 1 1 24 PRO CA 170.0 190.0 1 23 ARG CA 1 23 ARG C 1 24 PRO N 1 24 PRO CA 1 1 107 . 1 1 23 ARG O 1 1 23 ARG C 1 1 24 PRO N 1 1 24 PRO CD 170.0 190.0 1 23 ARG O 1 23 ARG C 1 24 PRO N 1 24 PRO CD 1 1 108 . 1 1 23 ARG CA 1 1 23 ARG C 1 1 24 PRO N 1 1 24 PRO CD -10.0 10.0 1 23 ARG CA 1 23 ARG C 1 24 PRO N 1 24 PRO CD 1 1 109 . 1 1 23 ARG O 1 1 23 ARG C 1 1 24 PRO N 1 1 24 PRO CA -10.0 10.0 1 23 ARG O 1 23 ARG C 1 24 PRO N 1 24 PRO CA 1 1 110 . 1 1 24 PRO CA 1 1 24 PRO C 1 1 25 CYS N 1 1 25 CYS CA 170.0 190.0 1 24 PRO CA 1 24 PRO C 1 25 CYS N 1 25 CYS CA 1 1 111 . 1 1 24 PRO O 1 1 24 PRO C 1 1 25 CYS N 1 1 25 CYS H 170.0 190.0 1 24 PRO O 1 24 PRO C 1 25 CYS N 1 25 CYS HN 1 1 112 . 1 1 24 PRO CA 1 1 24 PRO C 1 1 25 CYS N 1 1 25 CYS H -10.0 10.0 1 24 PRO CA 1 24 PRO C 1 25 CYS N 1 25 CYS HN 1 1 113 . 1 1 24 PRO O 1 1 24 PRO C 1 1 25 CYS N 1 1 25 CYS CA -10.0 10.0 1 24 PRO O 1 24 PRO C 1 25 CYS N 1 25 CYS CA 1 1 114 . 1 1 25 CYS CA 1 1 25 CYS C 1 1 26 ARG N 1 1 26 ARG CA 170.0 190.0 1 25 CYS CA 1 25 CYS C 1 26 ARG N 1 26 ARG CA 1 1 115 . 1 1 25 CYS O 1 1 25 CYS C 1 1 26 ARG N 1 1 26 ARG H 170.0 190.0 1 25 CYS O 1 25 CYS C 1 26 ARG N 1 26 ARG HN 1 1 116 . 1 1 25 CYS CA 1 1 25 CYS C 1 1 26 ARG N 1 1 26 ARG H -10.0 10.0 1 25 CYS CA 1 25 CYS C 1 26 ARG N 1 26 ARG HN 1 1 117 . 1 1 25 CYS O 1 1 25 CYS C 1 1 26 ARG N 1 1 26 ARG CA -10.0 10.0 1 25 CYS O 1 25 CYS C 1 26 ARG N 1 26 ARG CA 1 1 118 . 1 1 26 ARG CA 1 1 26 ARG C 1 1 27 CYS N 1 1 27 CYS CA 170.0 190.0 1 26 ARG CA 1 26 ARG C 1 27 CYS N 1 27 CYS CA 1 1 119 . 1 1 26 ARG O 1 1 26 ARG C 1 1 27 CYS N 1 1 27 CYS H 170.0 190.0 1 26 ARG O 1 26 ARG C 1 27 CYS N 1 27 CYS HN 1 1 120 . 1 1 26 ARG CA 1 1 26 ARG C 1 1 27 CYS N 1 1 27 CYS H -10.0 10.0 1 26 ARG CA 1 26 ARG C 1 27 CYS N 1 27 CYS HN 1 1 121 . 1 1 26 ARG O 1 1 26 ARG C 1 1 27 CYS N 1 1 27 CYS CA -10.0 10.0 1 26 ARG O 1 26 ARG C 1 27 CYS N 1 27 CYS CA 1 1 122 . 1 1 27 CYS CA 1 1 27 CYS C 1 1 28 SER N 1 1 28 SER CA 170.0 190.0 1 27 CYS CA 1 27 CYS C 1 28 SER N 1 28 SER CA 1 1 123 . 1 1 27 CYS O 1 1 27 CYS C 1 1 28 SER N 1 1 28 SER H 170.0 190.0 1 27 CYS O 1 27 CYS C 1 28 SER N 1 28 SER HN 1 1 124 . 1 1 27 CYS CA 1 1 27 CYS C 1 1 28 SER N 1 1 28 SER H -10.0 10.0 1 27 CYS CA 1 27 CYS C 1 28 SER N 1 28 SER HN 1 1 125 . 1 1 27 CYS O 1 1 27 CYS C 1 1 28 SER N 1 1 28 SER CA -10.0 10.0 1 27 CYS O 1 27 CYS C 1 28 SER N 1 28 SER CA 1 1 126 . 1 1 28 SER CA 1 1 28 SER C 1 1 29 MET N 1 1 29 MET CA 170.0 190.0 1 28 SER CA 1 28 SER C 1 29 MET N 1 29 MET CA 1 1 127 . 1 1 28 SER O 1 1 28 SER C 1 1 29 MET N 1 1 29 MET H 170.0 190.0 1 28 SER O 1 28 SER C 1 29 MET N 1 29 MET HN 1 1 128 . 1 1 28 SER CA 1 1 28 SER C 1 1 29 MET N 1 1 29 MET H -10.0 10.0 1 28 SER CA 1 28 SER C 1 29 MET N 1 29 MET HN 1 1 129 . 1 1 28 SER O 1 1 28 SER C 1 1 29 MET N 1 1 29 MET CA -10.0 10.0 1 28 SER O 1 28 SER C 1 29 MET N 1 29 MET CA 1 1 130 . 1 1 29 MET CA 1 1 29 MET C 1 1 30 ILE N 1 1 30 ILE CA 170.0 190.0 1 29 MET CA 1 29 MET C 1 30 ILE N 1 30 ILE CA 1 1 131 . 1 1 29 MET O 1 1 29 MET C 1 1 30 ILE N 1 1 30 ILE H 170.0 190.0 1 29 MET O 1 29 MET C 1 30 ILE N 1 30 ILE HN 1 1 132 . 1 1 29 MET CA 1 1 29 MET C 1 1 30 ILE N 1 1 30 ILE H -10.0 10.0 1 29 MET CA 1 29 MET C 1 30 ILE N 1 30 ILE HN 1 1 133 . 1 1 29 MET O 1 1 29 MET C 1 1 30 ILE N 1 1 30 ILE CA -10.0 10.0 1 29 MET O 1 29 MET C 1 30 ILE N 1 30 ILE CA 1 1 134 . 1 1 30 ILE CA 1 1 30 ILE C 1 1 31 GLY N 1 1 31 GLY CA 170.0 190.0 1 30 ILE CA 1 30 ILE C 1 31 GLY N 1 31 GLY CA 1 1 135 . 1 1 30 ILE O 1 1 30 ILE C 1 1 31 GLY N 1 1 31 GLY H 170.0 190.0 1 30 ILE O 1 30 ILE C 1 31 GLY N 1 31 GLY HN 1 1 136 . 1 1 30 ILE CA 1 1 30 ILE C 1 1 31 GLY N 1 1 31 GLY H -10.0 10.0 1 30 ILE CA 1 30 ILE C 1 31 GLY N 1 31 GLY HN 1 1 137 . 1 1 30 ILE O 1 1 30 ILE C 1 1 31 GLY N 1 1 31 GLY CA -10.0 10.0 1 30 ILE O 1 30 ILE C 1 31 GLY N 1 31 GLY CA 1 1 138 . 1 1 31 GLY CA 1 1 31 GLY C 1 1 32 THR N 1 1 32 THR CA 170.0 190.0 1 31 GLY CA 1 31 GLY C 1 32 THR N 1 32 THR CA 1 1 139 . 1 1 31 GLY O 1 1 31 GLY C 1 1 32 THR N 1 1 32 THR H 170.0 190.0 1 31 GLY O 1 31 GLY C 1 32 THR N 1 32 THR HN 1 1 140 . 1 1 31 GLY CA 1 1 31 GLY C 1 1 32 THR N 1 1 32 THR H -10.0 10.0 1 31 GLY CA 1 31 GLY C 1 32 THR N 1 32 THR HN 1 1 141 . 1 1 31 GLY O 1 1 31 GLY C 1 1 32 THR N 1 1 32 THR CA -10.0 10.0 1 31 GLY O 1 31 GLY C 1 32 THR N 1 32 THR CA 1 1 142 . 1 1 32 THR CA 1 1 32 THR C 1 1 33 ASN N 1 1 33 ASN CA 170.0 190.0 1 32 THR CA 1 32 THR C 1 33 ASN N 1 33 ASN CA 1 1 143 . 1 1 32 THR O 1 1 32 THR C 1 1 33 ASN N 1 1 33 ASN H 170.0 190.0 1 32 THR O 1 32 THR C 1 33 ASN N 1 33 ASN HN 1 1 144 . 1 1 32 THR CA 1 1 32 THR C 1 1 33 ASN N 1 1 33 ASN H -10.0 10.0 1 32 THR CA 1 32 THR C 1 33 ASN N 1 33 ASN HN 1 1 145 . 1 1 32 THR O 1 1 32 THR C 1 1 33 ASN N 1 1 33 ASN CA -10.0 10.0 1 32 THR O 1 32 THR C 1 33 ASN N 1 33 ASN CA 1 1 146 . 1 1 33 ASN CA 1 1 33 ASN C 1 1 34 CYS N 1 1 34 CYS CA 170.0 190.0 1 33 ASN CA 1 33 ASN C 1 34 CYS N 1 34 CYS CA 1 1 147 . 1 1 33 ASN O 1 1 33 ASN C 1 1 34 CYS N 1 1 34 CYS H 170.0 190.0 1 33 ASN O 1 33 ASN C 1 34 CYS N 1 34 CYS HN 1 1 148 . 1 1 33 ASN CA 1 1 33 ASN C 1 1 34 CYS N 1 1 34 CYS H -10.0 10.0 1 33 ASN CA 1 33 ASN C 1 34 CYS N 1 34 CYS HN 1 1 149 . 1 1 33 ASN O 1 1 33 ASN C 1 1 34 CYS N 1 1 34 CYS CA -10.0 10.0 1 33 ASN O 1 33 ASN C 1 34 CYS N 1 34 CYS CA 1 1 150 . 1 1 34 CYS CA 1 1 34 CYS C 1 1 35 GLU N 1 1 35 GLU CA 170.0 190.0 1 34 CYS CA 1 34 CYS C 1 35 GLU N 1 35 GLU CA 1 1 151 . 1 1 34 CYS O 1 1 34 CYS C 1 1 35 GLU N 1 1 35 GLU H 170.0 190.0 1 34 CYS O 1 34 CYS C 1 35 GLU N 1 35 GLU HN 1 1 152 . 1 1 34 CYS CA 1 1 34 CYS C 1 1 35 GLU N 1 1 35 GLU H -10.0 10.0 1 34 CYS CA 1 34 CYS C 1 35 GLU N 1 35 GLU HN 1 1 153 . 1 1 34 CYS O 1 1 34 CYS C 1 1 35 GLU N 1 1 35 GLU CA -10.0 10.0 1 34 CYS O 1 34 CYS C 1 35 GLU N 1 35 GLU CA 1 1 154 . 1 1 35 GLU CA 1 1 35 GLU C 1 1 36 CYS N 1 1 36 CYS CA 170.0 190.0 1 35 GLU CA 1 35 GLU C 1 36 CYS N 1 36 CYS CA 1 1 155 . 1 1 35 GLU O 1 1 35 GLU C 1 1 36 CYS N 1 1 36 CYS H 170.0 190.0 1 35 GLU O 1 35 GLU C 1 36 CYS N 1 36 CYS HN 1 1 156 . 1 1 35 GLU CA 1 1 35 GLU C 1 1 36 CYS N 1 1 36 CYS H -10.0 10.0 1 35 GLU CA 1 35 GLU C 1 36 CYS N 1 36 CYS HN 1 1 157 . 1 1 35 GLU O 1 1 35 GLU C 1 1 36 CYS N 1 1 36 CYS CA -10.0 10.0 1 35 GLU O 1 35 GLU C 1 36 CYS N 1 36 CYS CA 1 1 158 . 1 1 36 CYS CA 1 1 36 CYS C 1 1 37 THR N 1 1 37 THR CA 170.0 190.0 1 36 CYS CA 1 36 CYS C 1 37 THR N 1 37 THR CA 1 1 159 . 1 1 36 CYS O 1 1 36 CYS C 1 1 37 THR N 1 1 37 THR H 170.0 190.0 1 36 CYS O 1 36 CYS C 1 37 THR N 1 37 THR HN 1 1 160 . 1 1 36 CYS CA 1 1 36 CYS C 1 1 37 THR N 1 1 37 THR H -10.0 10.0 1 36 CYS CA 1 36 CYS C 1 37 THR N 1 37 THR HN 1 1 161 . 1 1 36 CYS O 1 1 36 CYS C 1 1 37 THR N 1 1 37 THR CA -10.0 10.0 1 36 CYS O 1 36 CYS C 1 37 THR N 1 37 THR CA 1 1 162 . 1 1 37 THR CA 1 1 37 THR C 1 1 38 PRO N 1 1 38 PRO CA 170.0 190.0 1 37 THR CA 1 37 THR C 1 38 PRO N 1 38 PRO CA 1 1 163 . 1 1 37 THR O 1 1 37 THR C 1 1 38 PRO N 1 1 38 PRO CD 170.0 190.0 1 37 THR O 1 37 THR C 1 38 PRO N 1 38 PRO CD 1 1 164 . 1 1 37 THR CA 1 1 37 THR C 1 1 38 PRO N 1 1 38 PRO CD -10.0 10.0 1 37 THR CA 1 37 THR C 1 38 PRO N 1 38 PRO CD 1 1 165 . 1 1 37 THR O 1 1 37 THR C 1 1 38 PRO N 1 1 38 PRO CA -10.0 10.0 1 37 THR O 1 37 THR C 1 38 PRO N 1 38 PRO CA 1 1 166 . 1 1 38 PRO CA 1 1 38 PRO C 1 1 39 ARG N 1 1 39 ARG CA 170.0 190.0 1 38 PRO CA 1 38 PRO C 1 39 ARG N 1 39 ARG CA 1 1 167 . 1 1 38 PRO O 1 1 38 PRO C 1 1 39 ARG N 1 1 39 ARG H 170.0 190.0 1 38 PRO O 1 38 PRO C 1 39 ARG N 1 39 ARG HN 1 1 168 . 1 1 38 PRO CA 1 1 38 PRO C 1 1 39 ARG N 1 1 39 ARG H -10.0 10.0 1 38 PRO CA 1 38 PRO C 1 39 ARG N 1 39 ARG HN 1 1 169 . 1 1 38 PRO O 1 1 38 PRO C 1 1 39 ARG N 1 1 39 ARG CA -10.0 10.0 1 38 PRO O 1 38 PRO C 1 39 ARG N 1 39 ARG CA 1 1 170 . 1 1 39 ARG CA 1 1 39 ARG C 1 1 40 LEU N 1 1 40 LEU CA 170.0 190.0 1 39 ARG CA 1 39 ARG C 1 40 LEU N 1 40 LEU CA 1 1 171 . 1 1 39 ARG O 1 1 39 ARG C 1 1 40 LEU N 1 1 40 LEU H 170.0 190.0 1 39 ARG O 1 39 ARG C 1 40 LEU N 1 40 LEU HN 1 1 172 . 1 1 39 ARG CA 1 1 39 ARG C 1 1 40 LEU N 1 1 40 LEU H -10.0 10.0 1 39 ARG CA 1 39 ARG C 1 40 LEU N 1 40 LEU HN 1 1 173 . 1 1 39 ARG O 1 1 39 ARG C 1 1 40 LEU N 1 1 40 LEU CA -10.0 10.0 1 39 ARG O 1 39 ARG C 1 40 LEU N 1 40 LEU CA 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 GLU C C 15.778 10.998 6.447 1.00 . A A . 1 GLU C 1 1 1 2 1 1 1 GLU CA C 16.491 12.228 5.819 1.00 . A A . 1 GLU CA 1 1 1 3 1 1 1 GLU CB C 15.754 12.727 4.542 1.00 . A A . 1 GLU CB 1 1 1 4 1 1 1 GLU CD C 14.122 14.434 5.633 1.00 . A A . 1 GLU CD 1 1 1 5 1 1 1 GLU CG C 14.295 13.214 4.719 1.00 . A A . 1 GLU CG 1 1 1 6 1 1 1 GLU H1 H 18.401 11.521 6.279 1.00 . A A . 1 GLU H1 1 1 1 7 1 1 1 GLU H2 H 17.884 11.074 4.775 1.00 . A A . 1 GLU H2 1 1 1 8 1 1 1 GLU HA H 16.546 13.051 6.560 1.00 . A A . 1 GLU HA 1 1 1 9 1 1 1 GLU HB2 H 16.334 13.550 4.082 1.00 . A A . 1 GLU HB2 1 1 1 10 1 1 1 GLU HB3 H 15.752 11.926 3.776 1.00 . A A . 1 GLU HB3 1 1 1 11 1 1 1 GLU HE2 H 13.703 14.844 7.490 1.00 . A A . 1 GLU HE2 1 1 1 12 1 1 1 GLU HG2 H 13.882 13.467 3.725 1.00 . A A . 1 GLU HG2 1 1 1 13 1 1 1 GLU HG3 H 13.662 12.382 5.080 1.00 . A A . 1 GLU HG3 1 1 1 14 1 1 1 GLU N N 17.872 11.839 5.460 1.00 . A A . 1 GLU N 1 1 1 15 1 1 1 GLU O O 15.643 9.944 5.815 1.00 . A A . 1 GLU O 1 1 1 16 1 1 1 GLU OE1 O 14.254 15.594 5.247 1.00 . A A . 1 GLU OE1 1 1 1 17 1 1 1 GLU OE2 O 13.806 14.078 6.920 1.00 . A A . 1 GLU OE2 1 1 1 18 1 1 2 ASP C C 13.115 10.896 8.769 1.00 . A A . 2 ASP C 1 1 1 19 1 1 2 ASP CA C 14.439 10.179 8.388 1.00 . A A . 2 ASP CA 1 1 1 20 1 1 2 ASP CB C 15.150 9.637 9.660 1.00 . A A . 2 ASP CB 1 1 1 21 1 1 2 ASP CG C 16.360 8.731 9.383 1.00 . A A . 2 ASP CG 1 1 1 22 1 1 2 ASP H H 15.471 12.106 8.087 1.00 . A A . 2 ASP H 1 1 1 23 1 1 2 ASP HA H 14.223 9.310 7.732 1.00 . A A . 2 ASP HA 1 1 1 24 1 1 2 ASP HB2 H 15.467 10.470 10.317 1.00 . A A . 2 ASP HB2 1 1 1 25 1 1 2 ASP HB3 H 14.429 9.060 10.270 1.00 . A A . 2 ASP HB3 1 1 1 26 1 1 2 ASP HD2 H 15.040 7.318 9.163 1.00 . A A . 2 ASP HD2 1 1 1 27 1 1 2 ASP N N 15.291 11.178 7.688 1.00 . A A . 2 ASP N 1 1 1 28 1 1 2 ASP O O 13.112 11.834 9.574 1.00 . A A . 2 ASP O 1 1 1 29 1 1 2 ASP OD1 O 17.523 9.134 9.390 1.00 . A A . 2 ASP OD1 1 1 1 30 1 1 2 ASP OD2 O 15.992 7.436 9.124 1.00 . A A . 2 ASP OD2 1 1 1 31 1 1 3 ASN C C 9.667 9.956 7.722 1.00 . A A . 3 ASN C 1 1 1 32 1 1 3 ASN CA C 10.626 10.851 8.567 1.00 . A A . 3 ASN CA 1 1 1 33 1 1 3 ASN CB C 10.305 12.349 8.322 1.00 . A A . 3 ASN CB 1 1 1 34 1 1 3 ASN CG C 10.536 13.025 6.947 1.00 . A A . 3 ASN CG 1 1 1 35 1 1 3 ASN H H 12.090 9.561 7.657 1.00 . A A . 3 ASN H 1 1 1 36 1 1 3 ASN HA H 10.489 10.659 9.652 1.00 . A A . 3 ASN HA 1 1 1 37 1 1 3 ASN HB2 H 9.238 12.400 8.601 1.00 . A A . 3 ASN HB2 1 1 1 38 1 1 3 ASN HB3 H 10.823 12.953 9.092 1.00 . A A . 3 ASN HB3 1 1 1 39 1 1 3 ASN HD21 H 9.620 14.676 7.621 1.00 . A A . 3 ASN HD21 1 1 1 40 1 1 3 ASN HD22 H 10.251 14.709 5.898 1.00 . A A . 3 ASN HD22 1 1 1 41 1 1 3 ASN N N 11.996 10.439 8.175 1.00 . A A . 3 ASN N 1 1 1 42 1 1 3 ASN ND2 N 10.089 14.262 6.807 1.00 . A A . 3 ASN ND2 1 1 1 43 1 1 3 ASN O O 9.197 10.266 6.622 1.00 . A A . 3 ASN O 1 1 1 44 1 1 3 ASN OD1 O 11.114 12.466 6.015 1.00 . A A . 3 ASN OD1 1 1 1 45 1 1 4 CYS C C 7.636 7.187 9.039 1.00 . A A . 4 CYS C 1 1 1 46 1 1 4 CYS CA C 8.472 7.777 7.852 1.00 . A A . 4 CYS CA 1 1 1 47 1 1 4 CYS CB C 9.249 6.680 7.133 1.00 . A A . 4 CYS CB 1 1 1 48 1 1 4 CYS H H 10.013 8.794 9.170 1.00 . A A . 4 CYS H 1 1 1 49 1 1 4 CYS HA H 7.764 8.179 7.107 1.00 . A A . 4 CYS HA 1 1 1 50 1 1 4 CYS HB2 H 8.422 6.027 6.939 1.00 . A A . 4 CYS HB2 1 1 1 51 1 1 4 CYS HB3 H 9.578 6.930 6.114 1.00 . A A . 4 CYS HB3 1 1 1 52 1 1 4 CYS N N 9.412 8.815 8.344 1.00 . A A . 4 CYS N 1 1 1 53 1 1 4 CYS O O 7.911 7.449 10.218 1.00 . A A . 4 CYS O 1 1 1 54 1 1 4 CYS SG S 10.403 5.650 8.059 1.00 . A A . 4 CYS SG 1 1 1 55 1 1 5 ILE C C 6.161 4.218 9.728 1.00 . A A . 5 ILE C 1 1 1 56 1 1 5 ILE CA C 5.754 5.707 9.774 1.00 . A A . 5 ILE CA 1 1 1 57 1 1 5 ILE CB C 4.198 5.884 9.556 1.00 . A A . 5 ILE CB 1 1 1 58 1 1 5 ILE CD1 C 2.426 7.666 9.048 1.00 . A A . 5 ILE CD1 1 1 1 59 1 1 5 ILE CG1 C 3.862 7.375 9.418 1.00 . A A . 5 ILE CG1 1 1 1 60 1 1 5 ILE CG2 C 3.391 5.235 10.734 1.00 . A A . 5 ILE CG2 1 1 1 61 1 1 5 ILE H H 6.578 6.126 7.681 1.00 . A A . 5 ILE H 1 1 1 62 1 1 5 ILE HA H 5.979 6.136 10.763 1.00 . A A . 5 ILE HA 1 1 1 63 1 1 5 ILE HB H 3.838 5.410 8.653 1.00 . A A . 5 ILE HB 1 1 1 64 1 1 5 ILE HD11 H 1.764 7.252 9.814 1.00 . A A . 5 ILE HD11 1 1 1 65 1 1 5 ILE HD12 H 2.215 8.746 9.000 1.00 . A A . 5 ILE HD12 1 1 1 66 1 1 5 ILE HD13 H 2.156 7.210 8.078 1.00 . A A . 5 ILE HD13 1 1 1 67 1 1 5 ILE HG12 H 4.121 7.890 10.336 1.00 . A A . 5 ILE HG12 1 1 1 68 1 1 5 ILE HG13 H 4.482 7.810 8.619 1.00 . A A . 5 ILE HG13 1 1 1 69 1 1 5 ILE HG21 H 3.614 4.158 10.855 1.00 . A A . 5 ILE HG21 1 1 1 70 1 1 5 ILE HG22 H 3.544 5.718 11.714 1.00 . A A . 5 ILE HG22 1 1 1 71 1 1 5 ILE HG23 H 2.297 5.244 10.544 1.00 . A A . 5 ILE HG23 1 1 1 72 1 1 5 ILE N N 6.602 6.364 8.705 1.00 . A A . 5 ILE N 1 1 1 73 1 1 5 ILE O O 5.686 3.450 8.897 1.00 . A A . 5 ILE O 1 1 1 74 1 1 6 ALA C C 6.606 1.228 11.016 1.00 . A A . 6 ALA C 1 1 1 75 1 1 6 ALA CA C 7.584 2.361 10.499 1.00 . A A . 6 ALA CA 1 1 1 76 1 1 6 ALA CB C 8.895 2.351 11.309 1.00 . A A . 6 ALA CB 1 1 1 77 1 1 6 ALA H H 7.245 4.415 11.367 1.00 . A A . 6 ALA H 1 1 1 78 1 1 6 ALA HA H 7.772 2.169 9.413 1.00 . A A . 6 ALA HA 1 1 1 79 1 1 6 ALA HB1 H 9.611 3.113 10.946 1.00 . A A . 6 ALA HB1 1 1 1 80 1 1 6 ALA HB2 H 8.726 2.540 12.387 1.00 . A A . 6 ALA HB2 1 1 1 81 1 1 6 ALA HB3 H 9.410 1.376 11.228 1.00 . A A . 6 ALA HB3 1 1 1 82 1 1 6 ALA N N 7.041 3.755 10.618 1.00 . A A . 6 ALA N 1 1 1 83 1 1 6 ALA O O 7.021 0.091 11.263 1.00 . A A . 6 ALA O 1 1 1 84 1 1 7 GLU C C 3.186 0.236 10.818 1.00 . A A . 7 GLU C 1 1 1 85 1 1 7 GLU CA C 4.268 0.735 11.806 1.00 . A A . 7 GLU CA 1 1 1 86 1 1 7 GLU CB C 3.664 1.604 12.942 1.00 . A A . 7 GLU CB 1 1 1 87 1 1 7 GLU CD C 3.901 2.711 15.236 1.00 . A A . 7 GLU CD 1 1 1 88 1 1 7 GLU CG C 4.590 1.883 14.149 1.00 . A A . 7 GLU CG 1 1 1 89 1 1 7 GLU H H 5.266 2.593 11.046 1.00 . A A . 7 GLU H 1 1 1 90 1 1 7 GLU HA H 4.662 -0.161 12.252 1.00 . A A . 7 GLU HA 1 1 1 91 1 1 7 GLU HB2 H 3.288 2.556 12.528 1.00 . A A . 7 GLU HB2 1 1 1 92 1 1 7 GLU HB3 H 2.775 1.081 13.340 1.00 . A A . 7 GLU HB3 1 1 1 93 1 1 7 GLU HE2 H 2.683 2.464 16.735 1.00 . A A . 7 GLU HE2 1 1 1 94 1 1 7 GLU HG2 H 4.949 0.931 14.582 1.00 . A A . 7 GLU HG2 1 1 1 95 1 1 7 GLU HG3 H 5.499 2.420 13.818 1.00 . A A . 7 GLU HG3 1 1 1 96 1 1 7 GLU N N 5.313 1.567 11.156 1.00 . A A . 7 GLU N 1 1 1 97 1 1 7 GLU O O 2.972 0.775 9.733 1.00 . A A . 7 GLU O 1 1 1 98 1 1 7 GLU OE1 O 4.031 3.930 15.344 1.00 . A A . 7 GLU OE1 1 1 1 99 1 1 7 GLU OE2 O 3.118 1.940 16.058 1.00 . A A . 7 GLU OE2 1 1 1 100 1 1 8 ASP C C -0.123 -1.202 11.305 1.00 . A A . 8 ASP C 1 1 1 101 1 1 8 ASP CA C 1.257 -1.389 10.616 1.00 . A A . 8 ASP CA 1 1 1 102 1 1 8 ASP CB C 1.522 -2.890 10.457 1.00 . A A . 8 ASP CB 1 1 1 103 1 1 8 ASP CG C 1.541 -3.790 11.716 1.00 . A A . 8 ASP CG 1 1 1 104 1 1 8 ASP H H 2.819 -1.176 12.183 1.00 . A A . 8 ASP H 1 1 1 105 1 1 8 ASP HA H 1.108 -0.854 9.683 1.00 . A A . 8 ASP HA 1 1 1 106 1 1 8 ASP HB2 H 0.774 -3.222 9.745 1.00 . A A . 8 ASP HB2 1 1 1 107 1 1 8 ASP HB3 H 2.502 -3.003 10.028 1.00 . A A . 8 ASP HB3 1 1 1 108 1 1 8 ASP HD2 H 0.619 -5.072 10.578 1.00 . A A . 8 ASP HD2 1 1 1 109 1 1 8 ASP N N 2.508 -0.838 11.266 1.00 . A A . 8 ASP N 1 1 1 110 1 1 8 ASP O O -1.172 -1.685 10.880 1.00 . A A . 8 ASP O 1 1 1 111 1 1 8 ASP OD1 O 2.042 -3.467 12.793 1.00 . A A . 8 ASP OD1 1 1 1 112 1 1 8 ASP OD2 O 0.945 -5.001 11.478 1.00 . A A . 8 ASP OD2 1 1 1 113 1 1 9 TYR C C -0.492 1.543 13.776 1.00 . A A . 9 TYR C 1 1 1 114 1 1 9 TYR CA C -1.038 0.190 13.168 1.00 . A A . 9 TYR CA 1 1 1 115 1 1 9 TYR CB C -1.490 -0.797 14.297 1.00 . A A . 9 TYR CB 1 1 1 116 1 1 9 TYR CD1 C -3.057 -2.434 13.109 1.00 . A A . 9 TYR CD1 1 1 1 117 1 1 9 TYR CD2 C -1.055 -3.316 14.133 1.00 . A A . 9 TYR CD2 1 1 1 118 1 1 9 TYR CE1 C -3.372 -3.704 12.632 1.00 . A A . 9 TYR CE1 1 1 1 119 1 1 9 TYR CE2 C -1.381 -4.588 13.669 1.00 . A A . 9 TYR CE2 1 1 1 120 1 1 9 TYR CG C -1.908 -2.231 13.883 1.00 . A A . 9 TYR CG 1 1 1 121 1 1 9 TYR CZ C -2.539 -4.782 12.920 1.00 . A A . 9 TYR CZ 1 1 1 122 1 1 9 TYR H H 1.006 -0.256 12.092 1.00 . A A . 9 TYR H 1 1 1 123 1 1 9 TYR HA H -1.912 0.444 12.534 1.00 . A A . 9 TYR HA 1 1 1 124 1 1 9 TYR HB2 H -0.702 -0.854 15.074 1.00 . A A . 9 TYR HB2 1 1 1 125 1 1 9 TYR HB3 H -2.350 -0.324 14.817 1.00 . A A . 9 TYR HB3 1 1 1 126 1 1 9 TYR HD1 H -3.630 -1.589 12.763 1.00 . A A . 9 TYR HD1 1 1 1 127 1 1 9 TYR HD2 H -0.083 -3.171 14.590 1.00 . A A . 9 TYR HD2 1 1 1 128 1 1 9 TYR HE1 H -4.233 -3.841 11.994 1.00 . A A . 9 TYR HE1 1 1 1 129 1 1 9 TYR HE2 H -0.701 -5.411 13.837 1.00 . A A . 9 TYR HE2 1 1 1 130 1 1 9 TYR HH H -3.641 -5.974 11.909 1.00 . A A . 9 TYR HH 1 1 1 131 1 1 9 TYR N N 0.021 -0.451 12.343 1.00 . A A . 9 TYR N 1 1 1 132 1 1 9 TYR O O -0.915 1.953 14.862 1.00 . A A . 9 TYR O 1 1 1 133 1 1 9 TYR OH O -2.826 -6.023 12.415 1.00 . A A . 9 TYR OH 1 1 1 134 1 1 10 GLY C C -0.292 4.710 13.227 1.00 . A A . 10 GLY C 1 1 1 135 1 1 10 GLY CA C 0.805 3.663 13.392 1.00 . A A . 10 GLY CA 1 1 1 136 1 1 10 GLY H H 0.673 1.809 12.169 1.00 . A A . 10 GLY H 1 1 1 137 1 1 10 GLY HA2 H 1.304 3.714 14.369 1.00 . A A . 10 GLY HA2 1 1 1 138 1 1 10 GLY HA3 H 1.602 3.994 12.707 1.00 . A A . 10 GLY HA3 1 1 1 139 1 1 10 GLY N N 0.382 2.280 13.045 1.00 . A A . 10 GLY N 1 1 1 140 1 1 10 GLY O O -1.384 4.410 12.754 1.00 . A A . 10 GLY O 1 1 1 141 1 1 11 LYS C C -0.303 7.721 11.978 1.00 . A A . 11 LYS C 1 1 1 142 1 1 11 LYS CA C -0.873 7.102 13.285 1.00 . A A . 11 LYS CA 1 1 1 143 1 1 11 LYS CB C -0.922 8.197 14.374 1.00 . A A . 11 LYS CB 1 1 1 144 1 1 11 LYS CD C -2.483 7.049 16.108 1.00 . A A . 11 LYS CD 1 1 1 145 1 1 11 LYS CE C -2.692 6.577 17.560 1.00 . A A . 11 LYS CE 1 1 1 146 1 1 11 LYS CG C -1.135 7.760 15.843 1.00 . A A . 11 LYS CG 1 1 1 147 1 1 11 LYS H H 1.017 6.023 13.821 1.00 . A A . 11 LYS H 1 1 1 148 1 1 11 LYS HA H -1.921 6.748 13.142 1.00 . A A . 11 LYS HA 1 1 1 149 1 1 11 LYS HB2 H -0.019 8.809 14.274 1.00 . A A . 11 LYS HB2 1 1 1 150 1 1 11 LYS HB3 H -1.732 8.905 14.112 1.00 . A A . 11 LYS HB3 1 1 1 151 1 1 11 LYS HD2 H -3.304 7.744 15.847 1.00 . A A . 11 LYS HD2 1 1 1 152 1 1 11 LYS HD3 H -2.608 6.189 15.421 1.00 . A A . 11 LYS HD3 1 1 1 153 1 1 11 LYS HE2 H -2.514 7.407 18.269 1.00 . A A . 11 LYS HE2 1 1 1 154 1 1 11 LYS HE3 H -3.749 6.286 17.700 1.00 . A A . 11 LYS HE3 1 1 1 155 1 1 11 LYS HG2 H -0.295 7.112 16.157 1.00 . A A . 11 LYS HG2 1 1 1 156 1 1 11 LYS HG3 H -1.065 8.654 16.491 1.00 . A A . 11 LYS HG3 1 1 1 157 1 1 11 LYS HZ1 H -2.061 4.623 17.324 1.00 . A A . 11 LYS HZ1 1 1 1 158 1 1 11 LYS HZ2 H -2.050 5.122 18.881 1.00 . A A . 11 LYS HZ2 1 1 1 159 1 1 11 LYS N N 0.014 5.947 13.617 1.00 . A A . 11 LYS N 1 1 1 160 1 1 11 LYS NZ N -1.841 5.426 17.923 1.00 . A A . 11 LYS NZ 1 1 1 161 1 1 11 LYS O O 0.886 8.046 11.880 1.00 . A A . 11 LYS O 1 1 1 162 1 1 12 CYS C C -1.973 9.329 9.130 1.00 . A A . 12 CYS C 1 1 1 163 1 1 12 CYS CA C -0.863 8.375 9.646 1.00 . A A . 12 CYS CA 1 1 1 164 1 1 12 CYS CB C -0.703 7.164 8.689 1.00 . A A . 12 CYS CB 1 1 1 165 1 1 12 CYS H H -2.129 7.695 11.380 1.00 . A A . 12 CYS H 1 1 1 166 1 1 12 CYS HA H 0.088 8.945 9.657 1.00 . A A . 12 CYS HA 1 1 1 167 1 1 12 CYS HB2 H -0.288 7.484 7.716 1.00 . A A . 12 CYS HB2 1 1 1 168 1 1 12 CYS HB3 H 0.001 6.408 9.059 1.00 . A A . 12 CYS HB3 1 1 1 169 1 1 12 CYS N N -1.194 7.871 11.006 1.00 . A A . 12 CYS N 1 1 1 170 1 1 12 CYS O O -2.923 9.701 9.830 1.00 . A A . 12 CYS O 1 1 1 171 1 1 12 CYS SG S -2.206 6.287 8.373 1.00 . A A . 12 CYS SG 1 1 1 172 1 1 13 THR C C -2.886 10.201 5.680 1.00 . A A . 13 THR C 1 1 1 173 1 1 13 THR CA C -2.743 10.658 7.169 1.00 . A A . 13 THR CA 1 1 1 174 1 1 13 THR CB C -2.184 12.114 7.244 1.00 . A A . 13 THR CB 1 1 1 175 1 1 13 THR CG2 C -3.137 13.260 6.881 1.00 . A A . 13 THR CG2 1 1 1 176 1 1 13 THR H H -0.888 9.442 7.464 1.00 . A A . 13 THR H 1 1 1 177 1 1 13 THR HA H -3.742 10.603 7.662 1.00 . A A . 13 THR HA 1 1 1 178 1 1 13 THR HB H -1.397 12.120 6.507 1.00 . A A . 13 THR HB 1 1 1 179 1 1 13 THR HG1 H -1.373 13.327 8.505 1.00 . A A . 13 THR HG1 1 1 1 180 1 1 13 THR HG21 H -4.048 13.272 7.496 1.00 . A A . 13 THR HG21 1 1 1 181 1 1 13 THR HG22 H -2.617 14.231 7.015 1.00 . A A . 13 THR HG22 1 1 1 182 1 1 13 THR HG23 H -3.413 13.238 5.812 1.00 . A A . 13 THR HG23 1 1 1 183 1 1 13 THR N N -1.792 9.751 7.867 1.00 . A A . 13 THR N 1 1 1 184 1 1 13 THR O O -2.085 9.463 5.093 1.00 . A A . 13 THR O 1 1 1 185 1 1 13 THR OG1 O -1.750 12.446 8.564 1.00 . A A . 13 THR OG1 1 1 1 186 1 1 14 TRP C C -3.745 12.013 3.054 1.00 . A A . 14 TRP C 1 1 1 187 1 1 14 TRP CA C -4.263 10.669 3.650 1.00 . A A . 14 TRP CA 1 1 1 188 1 1 14 TRP CB C -5.787 10.467 3.396 1.00 . A A . 14 TRP CB 1 1 1 189 1 1 14 TRP CD1 C -5.753 7.816 3.526 1.00 . A A . 14 TRP CD1 1 1 1 190 1 1 14 TRP CD2 C -7.694 8.777 4.033 1.00 . A A . 14 TRP CD2 1 1 1 191 1 1 14 TRP CE2 C -7.826 7.365 4.099 1.00 . A A . 14 TRP CE2 1 1 1 192 1 1 14 TRP CE3 C -8.807 9.613 4.314 1.00 . A A . 14 TRP CE3 1 1 1 193 1 1 14 TRP CG C -6.386 9.074 3.676 1.00 . A A . 14 TRP CG 1 1 1 194 1 1 14 TRP CH2 C -10.148 7.621 4.725 1.00 . A A . 14 TRP CH2 1 1 1 195 1 1 14 TRP CZ2 C -9.067 6.783 4.450 1.00 . A A . 14 TRP CZ2 1 1 1 196 1 1 14 TRP CZ3 C -10.020 9.014 4.659 1.00 . A A . 14 TRP CZ3 1 1 1 197 1 1 14 TRP H H -4.306 11.415 5.783 1.00 . A A . 14 TRP H 1 1 1 198 1 1 14 TRP HA H -3.725 9.827 3.170 1.00 . A A . 14 TRP HA 1 1 1 199 1 1 14 TRP HB2 H -6.360 11.235 3.951 1.00 . A A . 14 TRP HB2 1 1 1 200 1 1 14 TRP HB3 H -5.998 10.687 2.332 1.00 . A A . 14 TRP HB3 1 1 1 201 1 1 14 TRP HD1 H -4.728 7.678 3.222 1.00 . A A . 14 TRP HD1 1 1 1 202 1 1 14 TRP HE1 H -6.423 5.742 3.760 1.00 . A A . 14 TRP HE1 1 1 1 203 1 1 14 TRP HE3 H -8.724 10.689 4.270 1.00 . A A . 14 TRP HE3 1 1 1 204 1 1 14 TRP HH2 H -11.098 7.188 5.001 1.00 . A A . 14 TRP HH2 1 1 1 205 1 1 14 TRP HZ2 H -9.178 5.711 4.513 1.00 . A A . 14 TRP HZ2 1 1 1 206 1 1 14 TRP HZ3 H -10.874 9.637 4.883 1.00 . A A . 14 TRP HZ3 1 1 1 207 1 1 14 TRP N N -3.972 10.714 5.112 1.00 . A A . 14 TRP N 1 1 1 208 1 1 14 TRP NE1 N -6.624 6.747 3.799 1.00 . A A . 14 TRP NE1 1 1 1 209 1 1 14 TRP O O -4.461 13.022 3.076 1.00 . A A . 14 TRP O 1 1 1 210 1 1 15 GLY C C -0.507 13.556 2.998 1.00 . A A . 15 GLY C 1 1 1 211 1 1 15 GLY CA C -1.797 13.286 2.181 1.00 . A A . 15 GLY CA 1 1 1 212 1 1 15 GLY H H -1.963 11.170 2.750 1.00 . A A . 15 GLY H 1 1 1 213 1 1 15 GLY HA2 H -1.533 13.219 1.110 1.00 . A A . 15 GLY HA2 1 1 1 214 1 1 15 GLY HA3 H -2.453 14.175 2.255 1.00 . A A . 15 GLY HA3 1 1 1 215 1 1 15 GLY N N -2.495 12.025 2.559 1.00 . A A . 15 GLY N 1 1 1 216 1 1 15 GLY O O 0.501 13.981 2.429 1.00 . A A . 15 GLY O 1 1 1 217 1 1 16 GLY C C 1.620 12.130 4.938 1.00 . A A . 16 GLY C 1 1 1 218 1 1 16 GLY CA C 0.639 13.289 5.205 1.00 . A A . 16 GLY CA 1 1 1 219 1 1 16 GLY H H -1.426 12.843 4.599 1.00 . A A . 16 GLY H 1 1 1 220 1 1 16 GLY HA2 H 1.155 14.247 5.244 1.00 . A A . 16 GLY HA2 1 1 1 221 1 1 16 GLY HA3 H 0.278 13.234 6.246 1.00 . A A . 16 GLY HA3 1 1 1 222 1 1 16 GLY N N -0.550 13.301 4.321 1.00 . A A . 16 GLY N 1 1 1 223 1 1 16 GLY O O 1.741 11.608 3.823 1.00 . A A . 16 GLY O 1 1 1 224 1 1 17 THR C C 2.437 9.258 5.823 1.00 . A A . 17 THR C 1 1 1 225 1 1 17 THR CA C 3.277 10.583 5.955 1.00 . A A . 17 THR CA 1 1 1 226 1 1 17 THR CB C 4.200 10.475 7.238 1.00 . A A . 17 THR CB 1 1 1 227 1 1 17 THR CG2 C 5.555 9.800 6.923 1.00 . A A . 17 THR CG2 1 1 1 228 1 1 17 THR H H 2.188 12.403 6.778 1.00 . A A . 17 THR H 1 1 1 229 1 1 17 THR HA H 3.920 10.730 5.060 1.00 . A A . 17 THR HA 1 1 1 230 1 1 17 THR HB H 3.707 9.847 8.013 1.00 . A A . 17 THR HB 1 1 1 231 1 1 17 THR HG1 H 3.664 12.169 7.980 1.00 . A A . 17 THR HG1 1 1 1 232 1 1 17 THR HG21 H 5.440 8.777 6.528 1.00 . A A . 17 THR HG21 1 1 1 233 1 1 17 THR HG22 H 6.169 10.349 6.188 1.00 . A A . 17 THR HG22 1 1 1 234 1 1 17 THR HG23 H 6.169 9.686 7.838 1.00 . A A . 17 THR HG23 1 1 1 235 1 1 17 THR N N 2.319 11.735 6.010 1.00 . A A . 17 THR N 1 1 1 236 1 1 17 THR O O 1.372 9.062 6.433 1.00 . A A . 17 THR O 1 1 1 237 1 1 17 THR OG1 O 4.507 11.768 7.753 1.00 . A A . 17 THR OG1 1 1 1 238 1 1 18 LYS C C 3.676 6.104 5.550 1.00 . A A . 18 LYS C 1 1 1 239 1 1 18 LYS CA C 2.593 6.957 4.842 1.00 . A A . 18 LYS CA 1 1 1 240 1 1 18 LYS CB C 2.441 6.550 3.340 1.00 . A A . 18 LYS CB 1 1 1 241 1 1 18 LYS CD C 0.342 7.940 2.588 1.00 . A A . 18 LYS CD 1 1 1 242 1 1 18 LYS CE C -0.672 6.803 2.357 1.00 . A A . 18 LYS CE 1 1 1 243 1 1 18 LYS CG C 1.810 7.538 2.325 1.00 . A A . 18 LYS CG 1 1 1 244 1 1 18 LYS H H 3.930 8.693 4.665 1.00 . A A . 18 LYS H 1 1 1 245 1 1 18 LYS HA H 1.621 6.732 5.316 1.00 . A A . 18 LYS HA 1 1 1 246 1 1 18 LYS HB2 H 3.420 6.201 2.971 1.00 . A A . 18 LYS HB2 1 1 1 247 1 1 18 LYS HB3 H 1.847 5.618 3.307 1.00 . A A . 18 LYS HB3 1 1 1 248 1 1 18 LYS HD2 H 0.243 8.344 3.614 1.00 . A A . 18 LYS HD2 1 1 1 249 1 1 18 LYS HD3 H 0.097 8.787 1.919 1.00 . A A . 18 LYS HD3 1 1 1 250 1 1 18 LYS HE2 H -0.568 6.394 1.336 1.00 . A A . 18 LYS HE2 1 1 1 251 1 1 18 LYS HE3 H -0.480 5.962 3.049 1.00 . A A . 18 LYS HE3 1 1 1 252 1 1 18 LYS HG2 H 2.427 8.454 2.284 1.00 . A A . 18 LYS HG2 1 1 1 253 1 1 18 LYS HG3 H 1.890 7.107 1.309 1.00 . A A . 18 LYS HG3 1 1 1 254 1 1 18 LYS HZ1 H -2.250 8.052 1.909 1.00 . A A . 18 LYS HZ1 1 1 1 255 1 1 18 LYS HZ2 H -2.170 7.652 3.492 1.00 . A A . 18 LYS HZ2 1 1 1 256 1 1 18 LYS N N 3.012 8.377 4.994 1.00 . A A . 18 LYS N 1 1 1 257 1 1 18 LYS NZ N -2.054 7.272 2.546 1.00 . A A . 18 LYS NZ 1 1 1 258 1 1 18 LYS O O 4.696 6.572 6.090 1.00 . A A . 18 LYS O 1 1 1 259 1 1 19 CYS C C 5.572 3.567 5.425 1.00 . A A . 19 CYS C 1 1 1 260 1 1 19 CYS CA C 4.329 3.890 6.313 1.00 . A A . 19 CYS CA 1 1 1 261 1 1 19 CYS CB C 3.545 2.675 6.838 1.00 . A A . 19 CYS CB 1 1 1 262 1 1 19 CYS H H 2.629 4.564 4.939 1.00 . A A . 19 CYS H 1 1 1 263 1 1 19 CYS HA H 4.626 4.462 7.217 1.00 . A A . 19 CYS HA 1 1 1 264 1 1 19 CYS HB2 H 2.769 2.341 6.127 1.00 . A A . 19 CYS HB2 1 1 1 265 1 1 19 CYS HB3 H 4.211 1.805 7.005 1.00 . A A . 19 CYS HB3 1 1 1 266 1 1 19 CYS N N 3.426 4.792 5.559 1.00 . A A . 19 CYS N 1 1 1 267 1 1 19 CYS O O 5.589 3.479 4.195 1.00 . A A . 19 CYS O 1 1 1 268 1 1 19 CYS SG S 2.828 3.219 8.399 1.00 . A A . 19 CYS SG 1 1 1 269 1 1 20 CYS C C 8.539 2.692 4.706 1.00 . A A . 20 CYS C 1 1 1 270 1 1 20 CYS CA C 8.068 3.591 5.889 1.00 . A A . 20 CYS CA 1 1 1 271 1 1 20 CYS CB C 8.861 3.177 7.148 1.00 . A A . 20 CYS CB 1 1 1 272 1 1 20 CYS H H 6.368 3.619 7.228 1.00 . A A . 20 CYS H 1 1 1 273 1 1 20 CYS HA H 8.179 4.665 5.743 1.00 . A A . 20 CYS HA 1 1 1 274 1 1 20 CYS HB2 H 8.390 3.590 8.043 1.00 . A A . 20 CYS HB2 1 1 1 275 1 1 20 CYS HB3 H 8.922 2.082 7.301 1.00 . A A . 20 CYS HB3 1 1 1 276 1 1 20 CYS N N 6.637 3.534 6.242 1.00 . A A . 20 CYS N 1 1 1 277 1 1 20 CYS O O 9.227 3.199 3.816 1.00 . A A . 20 CYS O 1 1 1 278 1 1 20 CYS SG S 10.511 3.901 7.060 1.00 . A A . 20 CYS SG 1 1 1 279 1 1 21 ARG C C 7.561 0.291 2.487 1.00 . A A . 21 ARG C 1 1 1 280 1 1 21 ARG CA C 8.603 0.415 3.649 1.00 . A A . 21 ARG CA 1 1 1 281 1 1 21 ARG CB C 8.851 -0.925 4.416 1.00 . A A . 21 ARG CB 1 1 1 282 1 1 21 ARG CD C 10.857 -1.807 3.004 1.00 . A A . 21 ARG CD 1 1 1 283 1 1 21 ARG CG C 9.487 -2.107 3.644 1.00 . A A . 21 ARG CG 1 1 1 284 1 1 21 ARG CZ C 12.194 -3.921 2.585 1.00 . A A . 21 ARG CZ 1 1 1 285 1 1 21 ARG H H 7.501 1.214 5.434 1.00 . A A . 21 ARG H 1 1 1 286 1 1 21 ARG HA H 9.522 0.778 3.164 1.00 . A A . 21 ARG HA 1 1 1 287 1 1 21 ARG HB2 H 9.508 -0.737 5.289 1.00 . A A . 21 ARG HB2 1 1 1 288 1 1 21 ARG HB3 H 7.899 -1.283 4.856 1.00 . A A . 21 ARG HB3 1 1 1 289 1 1 21 ARG HD2 H 10.770 -0.963 2.296 1.00 . A A . 21 ARG HD2 1 1 1 290 1 1 21 ARG HD3 H 11.584 -1.481 3.771 1.00 . A A . 21 ARG HD3 1 1 1 291 1 1 21 ARG HG2 H 9.598 -2.954 4.349 1.00 . A A . 21 ARG HG2 1 1 1 292 1 1 21 ARG HG3 H 8.785 -2.479 2.876 1.00 . A A . 21 ARG HG3 1 1 1 293 1 1 21 ARG HH11 H 12.535 -3.244 4.447 1.00 . A A . 21 ARG HH11 1 1 1 294 1 1 21 ARG HH12 H 13.413 -4.773 3.938 1.00 . A A . 21 ARG HH12 1 1 1 295 1 1 21 ARG HH21 H 12.009 -4.779 0.785 1.00 . A A . 21 ARG HH21 1 1 1 296 1 1 21 ARG HH22 H 13.132 -5.587 1.991 1.00 . A A . 21 ARG HH22 1 1 1 297 1 1 21 ARG N N 8.195 1.391 4.712 1.00 . A A . 21 ARG N 1 1 1 298 1 1 21 ARG NE N 11.379 -2.998 2.257 1.00 . A A . 21 ARG NE 1 1 1 299 1 1 21 ARG NH1 N 12.773 -3.986 3.780 1.00 . A A . 21 ARG NH1 1 1 1 300 1 1 21 ARG NH2 N 12.473 -4.857 1.697 1.00 . A A . 21 ARG NH2 1 1 1 301 1 1 21 ARG O O 7.284 -0.784 1.951 1.00 . A A . 21 ARG O 1 1 1 302 1 1 22 GLY C C 4.577 0.833 1.492 1.00 . A A . 22 GLY C 1 1 1 303 1 1 22 GLY CA C 5.888 1.560 1.134 1.00 . A A . 22 GLY CA 1 1 1 304 1 1 22 GLY H H 7.281 2.131 2.831 1.00 . A A . 22 GLY H 1 1 1 305 1 1 22 GLY HA2 H 5.673 2.631 0.965 1.00 . A A . 22 GLY HA2 1 1 1 306 1 1 22 GLY HA3 H 6.228 1.182 0.167 1.00 . A A . 22 GLY HA3 1 1 1 307 1 1 22 GLY N N 7.005 1.444 2.111 1.00 . A A . 22 GLY N 1 1 1 308 1 1 22 GLY O O 4.002 0.096 0.688 1.00 . A A . 22 GLY O 1 1 1 309 1 1 23 ARG C C 1.786 1.248 3.436 1.00 . A A . 23 ARG C 1 1 1 310 1 1 23 ARG CA C 3.058 0.329 3.384 1.00 . A A . 23 ARG CA 1 1 1 311 1 1 23 ARG CB C 3.529 -0.079 4.804 1.00 . A A . 23 ARG CB 1 1 1 312 1 1 23 ARG CD C 4.011 -2.611 4.734 1.00 . A A . 23 ARG CD 1 1 1 313 1 1 23 ARG CG C 4.578 -1.200 4.937 1.00 . A A . 23 ARG CG 1 1 1 314 1 1 23 ARG CZ C 5.041 -4.878 5.154 1.00 . A A . 23 ARG CZ 1 1 1 315 1 1 23 ARG H H 4.804 1.681 3.235 1.00 . A A . 23 ARG H 1 1 1 316 1 1 23 ARG HA H 2.833 -0.595 2.822 1.00 . A A . 23 ARG HA 1 1 1 317 1 1 23 ARG HB2 H 4.021 0.794 5.238 1.00 . A A . 23 ARG HB2 1 1 1 318 1 1 23 ARG HB3 H 2.671 -0.294 5.469 1.00 . A A . 23 ARG HB3 1 1 1 319 1 1 23 ARG HD2 H 3.224 -2.802 5.488 1.00 . A A . 23 ARG HD2 1 1 1 320 1 1 23 ARG HD3 H 3.525 -2.694 3.747 1.00 . A A . 23 ARG HD3 1 1 1 321 1 1 23 ARG HG2 H 5.418 -1.002 4.246 1.00 . A A . 23 ARG HG2 1 1 1 322 1 1 23 ARG HG3 H 5.015 -1.130 5.953 1.00 . A A . 23 ARG HG3 1 1 1 323 1 1 23 ARG HH11 H 3.053 -4.944 5.452 1.00 . A A . 23 ARG HH11 1 1 1 324 1 1 23 ARG HH12 H 3.989 -6.502 5.702 1.00 . A A . 23 ARG HH12 1 1 1 325 1 1 23 ARG HH21 H 7.021 -5.056 4.914 1.00 . A A . 23 ARG HH21 1 1 1 326 1 1 23 ARG HH22 H 6.095 -6.559 5.416 1.00 . A A . 23 ARG HH22 1 1 1 327 1 1 23 ARG N N 4.153 1.071 2.727 1.00 . A A . 23 ARG N 1 1 1 328 1 1 23 ARG NE N 5.090 -3.642 4.843 1.00 . A A . 23 ARG NE 1 1 1 329 1 1 23 ARG NH1 N 3.912 -5.506 5.469 1.00 . A A . 23 ARG NH1 1 1 1 330 1 1 23 ARG NH2 N 6.166 -5.568 5.162 1.00 . A A . 23 ARG NH2 1 1 1 331 1 1 23 ARG O O 1.912 2.436 3.788 1.00 . A A . 23 ARG O 1 1 1 332 1 1 24 PRO C C -1.266 2.127 4.257 1.00 . A A . 24 PRO C 1 1 1 333 1 1 24 PRO CA C -0.645 1.614 2.922 1.00 . A A . 24 PRO CA 1 1 1 334 1 1 24 PRO CB C -1.588 0.686 2.125 1.00 . A A . 24 PRO CB 1 1 1 335 1 1 24 PRO CD C 0.304 -0.653 2.707 1.00 . A A . 24 PRO CD 1 1 1 336 1 1 24 PRO CG C -1.209 -0.736 2.535 1.00 . A A . 24 PRO CG 1 1 1 337 1 1 24 PRO HA H -0.398 2.514 2.322 1.00 . A A . 24 PRO HA 1 1 1 338 1 1 24 PRO HB2 H -2.662 0.895 2.283 1.00 . A A . 24 PRO HB2 1 1 1 339 1 1 24 PRO HB3 H -1.406 0.821 1.042 1.00 . A A . 24 PRO HB3 1 1 1 340 1 1 24 PRO HD2 H 0.662 -1.370 3.469 1.00 . A A . 24 PRO HD2 1 1 1 341 1 1 24 PRO HD3 H 0.814 -0.885 1.754 1.00 . A A . 24 PRO HD3 1 1 1 342 1 1 24 PRO HG2 H -1.691 -1.007 3.492 1.00 . A A . 24 PRO HG2 1 1 1 343 1 1 24 PRO HG3 H -1.515 -1.494 1.793 1.00 . A A . 24 PRO HG3 1 1 1 344 1 1 24 PRO N N 0.556 0.754 3.093 1.00 . A A . 24 PRO N 1 1 1 345 1 1 24 PRO O O -0.838 1.756 5.356 1.00 . A A . 24 PRO O 1 1 1 346 1 1 25 CYS C C -4.582 3.455 4.924 1.00 . A A . 25 CYS C 1 1 1 347 1 1 25 CYS CA C -3.066 3.502 5.279 1.00 . A A . 25 CYS CA 1 1 1 348 1 1 25 CYS CB C -2.617 4.945 5.637 1.00 . A A . 25 CYS CB 1 1 1 349 1 1 25 CYS H H -2.538 3.220 3.156 1.00 . A A . 25 CYS H 1 1 1 350 1 1 25 CYS HA H -2.884 2.862 6.167 1.00 . A A . 25 CYS HA 1 1 1 351 1 1 25 CYS HB2 H -1.990 5.392 4.854 1.00 . A A . 25 CYS HB2 1 1 1 352 1 1 25 CYS HB3 H -3.486 5.597 5.822 1.00 . A A . 25 CYS HB3 1 1 1 353 1 1 25 CYS N N -2.285 2.994 4.125 1.00 . A A . 25 CYS N 1 1 1 354 1 1 25 CYS O O -5.024 3.710 3.798 1.00 . A A . 25 CYS O 1 1 1 355 1 1 25 CYS SG S -1.650 4.855 7.121 1.00 . A A . 25 CYS SG 1 1 1 356 1 1 26 ARG C C -7.212 3.783 7.338 1.00 . A A . 26 ARG C 1 1 1 357 1 1 26 ARG CA C -6.841 3.167 5.967 1.00 . A A . 26 ARG CA 1 1 1 358 1 1 26 ARG CB C -7.437 1.745 5.775 1.00 . A A . 26 ARG CB 1 1 1 359 1 1 26 ARG CD C -9.562 2.348 4.335 1.00 . A A . 26 ARG CD 1 1 1 360 1 1 26 ARG CG C -8.969 1.646 5.576 1.00 . A A . 26 ARG CG 1 1 1 361 1 1 26 ARG CZ C -8.370 2.447 2.113 1.00 . A A . 26 ARG CZ 1 1 1 362 1 1 26 ARG H H -4.865 3.105 6.870 1.00 . A A . 26 ARG H 1 1 1 363 1 1 26 ARG HA H -7.191 3.822 5.144 1.00 . A A . 26 ARG HA 1 1 1 364 1 1 26 ARG HB2 H -6.955 1.263 4.905 1.00 . A A . 26 ARG HB2 1 1 1 365 1 1 26 ARG HB3 H -7.160 1.108 6.635 1.00 . A A . 26 ARG HB3 1 1 1 366 1 1 26 ARG HD2 H -10.661 2.235 4.363 1.00 . A A . 26 ARG HD2 1 1 1 367 1 1 26 ARG HD3 H -9.399 3.438 4.409 1.00 . A A . 26 ARG HD3 1 1 1 368 1 1 26 ARG HG2 H -9.251 0.576 5.550 1.00 . A A . 26 ARG HG2 1 1 1 369 1 1 26 ARG HG3 H -9.472 2.042 6.478 1.00 . A A . 26 ARG HG3 1 1 1 370 1 1 26 ARG HH11 H -8.274 4.207 3.083 1.00 . A A . 26 ARG HH11 1 1 1 371 1 1 26 ARG HH12 H -7.454 4.109 1.444 1.00 . A A . 26 ARG HH12 1 1 1 372 1 1 26 ARG HH21 H -8.322 0.818 0.951 1.00 . A A . 26 ARG HH21 1 1 1 373 1 1 26 ARG HH22 H -7.481 2.323 0.323 1.00 . A A . 26 ARG HH22 1 1 1 374 1 1 26 ARG N N -5.359 3.124 5.966 1.00 . A A . 26 ARG N 1 1 1 375 1 1 26 ARG NE N -9.082 1.782 3.045 1.00 . A A . 26 ARG NE 1 1 1 376 1 1 26 ARG NH1 N -7.994 3.719 2.225 1.00 . A A . 26 ARG NH1 1 1 1 377 1 1 26 ARG NH2 N -8.023 1.797 1.018 1.00 . A A . 26 ARG NH2 1 1 1 378 1 1 26 ARG O O -6.632 3.417 8.377 1.00 . A A . 26 ARG O 1 1 1 379 1 1 27 CYS C C -9.082 4.747 9.759 1.00 . A A . 27 CYS C 1 1 1 380 1 1 27 CYS CA C -8.355 5.529 8.611 1.00 . A A . 27 CYS CA 1 1 1 381 1 1 27 CYS CB C -9.212 6.811 8.338 1.00 . A A . 27 CYS CB 1 1 1 382 1 1 27 CYS H H -8.570 5.007 6.467 1.00 . A A . 27 CYS H 1 1 1 383 1 1 27 CYS HA H -7.318 5.797 8.842 1.00 . A A . 27 CYS HA 1 1 1 384 1 1 27 CYS HB2 H -10.005 6.580 7.642 1.00 . A A . 27 CYS HB2 1 1 1 385 1 1 27 CYS HB3 H -9.754 7.173 9.233 1.00 . A A . 27 CYS HB3 1 1 1 386 1 1 27 CYS N N -8.160 4.744 7.370 1.00 . A A . 27 CYS N 1 1 1 387 1 1 27 CYS O O -9.682 3.679 9.601 1.00 . A A . 27 CYS O 1 1 1 388 1 1 27 CYS SG S -8.362 8.282 7.745 1.00 . A A . 27 CYS SG 1 1 1 389 1 1 28 SER C C -11.276 4.975 12.023 1.00 . A A . 28 SER C 1 1 1 390 1 1 28 SER CA C -9.723 5.101 12.192 1.00 . A A . 28 SER CA 1 1 1 391 1 1 28 SER CB C -9.316 6.278 13.136 1.00 . A A . 28 SER CB 1 1 1 392 1 1 28 SER H H -8.497 6.299 10.830 1.00 . A A . 28 SER H 1 1 1 393 1 1 28 SER HA H -9.384 4.141 12.626 1.00 . A A . 28 SER HA 1 1 1 394 1 1 28 SER HB2 H -9.447 7.264 12.649 1.00 . A A . 28 SER HB2 1 1 1 395 1 1 28 SER HB3 H -9.939 6.352 14.043 1.00 . A A . 28 SER HB3 1 1 1 396 1 1 28 SER HG H -7.431 6.144 12.782 1.00 . A A . 28 SER HG 1 1 1 397 1 1 28 SER N N -8.986 5.403 10.935 1.00 . A A . 28 SER N 1 1 1 398 1 1 28 SER O O -11.851 5.114 10.937 1.00 . A A . 28 SER O 1 1 1 399 1 1 28 SER OG O -7.970 6.134 13.575 1.00 . A A . 28 SER OG 1 1 1 400 1 1 29 MET C C -14.310 5.645 12.856 1.00 . A A . 29 MET C 1 1 1 401 1 1 29 MET CA C -13.409 4.422 13.227 1.00 . A A . 29 MET CA 1 1 1 402 1 1 29 MET CB C -13.724 3.990 14.688 1.00 . A A . 29 MET CB 1 1 1 403 1 1 29 MET CE C -11.533 0.493 15.424 1.00 . A A . 29 MET CE 1 1 1 404 1 1 29 MET CG C -13.391 2.527 15.037 1.00 . A A . 29 MET CG 1 1 1 405 1 1 29 MET H H -11.360 4.767 13.990 1.00 . A A . 29 MET H 1 1 1 406 1 1 29 MET HA H -13.670 3.603 12.528 1.00 . A A . 29 MET HA 1 1 1 407 1 1 29 MET HB2 H -13.241 4.665 15.422 1.00 . A A . 29 MET HB2 1 1 1 408 1 1 29 MET HB3 H -14.803 4.133 14.876 1.00 . A A . 29 MET HB3 1 1 1 409 1 1 29 MET HE1 H -12.038 -0.084 14.628 1.00 . A A . 29 MET HE1 1 1 1 410 1 1 29 MET HE2 H -10.484 0.152 15.481 1.00 . A A . 29 MET HE2 1 1 1 411 1 1 29 MET HE3 H -12.023 0.258 16.387 1.00 . A A . 29 MET HE3 1 1 1 412 1 1 29 MET HG2 H -13.812 2.272 16.027 1.00 . A A . 29 MET HG2 1 1 1 413 1 1 29 MET HG3 H -13.857 1.835 14.311 1.00 . A A . 29 MET HG3 1 1 1 414 1 1 29 MET N N -11.941 4.692 13.152 1.00 . A A . 29 MET N 1 1 1 415 1 1 29 MET O O -15.389 5.445 12.290 1.00 . A A . 29 MET O 1 1 1 416 1 1 29 MET SD S -11.604 2.262 15.081 1.00 . A A . 29 MET SD 1 1 1 417 1 1 30 ILE C C -14.541 8.486 11.306 1.00 . A A . 30 ILE C 1 1 1 418 1 1 30 ILE CA C -14.634 8.127 12.840 1.00 . A A . 30 ILE CA 1 1 1 419 1 1 30 ILE CB C -14.084 9.256 13.813 1.00 . A A . 30 ILE CB 1 1 1 420 1 1 30 ILE CD1 C -16.382 10.448 14.216 1.00 . A A . 30 ILE CD1 1 1 1 421 1 1 30 ILE CG1 C -14.936 10.559 13.705 1.00 . A A . 30 ILE CG1 1 1 1 422 1 1 30 ILE CG2 C -12.610 9.664 13.513 1.00 . A A . 30 ILE CG2 1 1 1 423 1 1 30 ILE H H -12.911 6.855 13.528 1.00 . A A . 30 ILE H 1 1 1 424 1 1 30 ILE HA H -15.704 7.951 13.035 1.00 . A A . 30 ILE HA 1 1 1 425 1 1 30 ILE HB H -14.130 8.894 14.859 1.00 . A A . 30 ILE HB 1 1 1 426 1 1 30 ILE HD11 H -16.419 10.086 15.260 1.00 . A A . 30 ILE HD11 1 1 1 427 1 1 30 ILE HD12 H -16.886 11.431 14.192 1.00 . A A . 30 ILE HD12 1 1 1 428 1 1 30 ILE HD13 H -16.989 9.761 13.599 1.00 . A A . 30 ILE HD13 1 1 1 429 1 1 30 ILE HG12 H -14.454 11.363 14.294 1.00 . A A . 30 ILE HG12 1 1 1 430 1 1 30 ILE HG13 H -14.947 10.941 12.666 1.00 . A A . 30 ILE HG13 1 1 1 431 1 1 30 ILE HG21 H -11.927 8.795 13.513 1.00 . A A . 30 ILE HG21 1 1 1 432 1 1 30 ILE HG22 H -12.496 10.170 12.537 1.00 . A A . 30 ILE HG22 1 1 1 433 1 1 30 ILE HG23 H -12.222 10.361 14.278 1.00 . A A . 30 ILE HG23 1 1 1 434 1 1 30 ILE N N -13.876 6.879 13.172 1.00 . A A . 30 ILE N 1 1 1 435 1 1 30 ILE O O -15.559 8.912 10.751 1.00 . A A . 30 ILE O 1 1 1 436 1 1 31 GLY C C -11.925 9.530 8.927 1.00 . A A . 31 GLY C 1 1 1 437 1 1 31 GLY CA C -13.194 8.699 9.217 1.00 . A A . 31 GLY CA 1 1 1 438 1 1 31 GLY H H -12.611 8.078 11.275 1.00 . A A . 31 GLY H 1 1 1 439 1 1 31 GLY HA2 H -13.152 7.769 8.619 1.00 . A A . 31 GLY HA2 1 1 1 440 1 1 31 GLY HA3 H -14.064 9.254 8.816 1.00 . A A . 31 GLY HA3 1 1 1 441 1 1 31 GLY N N -13.383 8.313 10.642 1.00 . A A . 31 GLY N 1 1 1 442 1 1 31 GLY O O -11.222 9.258 7.951 1.00 . A A . 31 GLY O 1 1 1 443 1 1 32 THR C C -9.434 10.792 10.858 1.00 . A A . 32 THR C 1 1 1 444 1 1 32 THR CA C -10.394 11.337 9.745 1.00 . A A . 32 THR CA 1 1 1 445 1 1 32 THR CB C -10.703 12.857 9.983 1.00 . A A . 32 THR CB 1 1 1 446 1 1 32 THR CG2 C -11.512 13.482 8.828 1.00 . A A . 32 THR CG2 1 1 1 447 1 1 32 THR H H -12.274 10.531 10.588 1.00 . A A . 32 THR H 1 1 1 448 1 1 32 THR HA H -9.887 11.233 8.765 1.00 . A A . 32 THR HA 1 1 1 449 1 1 32 THR HB H -9.739 13.393 10.070 1.00 . A A . 32 THR HB 1 1 1 450 1 1 32 THR HG1 H -11.596 13.981 11.270 1.00 . A A . 32 THR HG1 1 1 1 451 1 1 32 THR HG21 H -10.988 13.373 7.860 1.00 . A A . 32 THR HG21 1 1 1 452 1 1 32 THR HG22 H -12.512 13.024 8.718 1.00 . A A . 32 THR HG22 1 1 1 453 1 1 32 THR HG23 H -11.667 14.564 8.991 1.00 . A A . 32 THR HG23 1 1 1 454 1 1 32 THR N N -11.665 10.549 9.761 1.00 . A A . 32 THR N 1 1 1 455 1 1 32 THR O O -9.836 10.008 11.726 1.00 . A A . 32 THR O 1 1 1 456 1 1 32 THR OG1 O -11.463 13.034 11.179 1.00 . A A . 32 THR OG1 1 1 1 457 1 1 33 ASN C C -6.718 9.315 11.450 1.00 . A A . 33 ASN C 1 1 1 458 1 1 33 ASN CA C -7.049 10.801 11.755 1.00 . A A . 33 ASN CA 1 1 1 459 1 1 33 ASN CB C -7.443 11.002 13.265 1.00 . A A . 33 ASN CB 1 1 1 460 1 1 33 ASN CG C -7.344 12.459 13.754 1.00 . A A . 33 ASN CG 1 1 1 461 1 1 33 ASN H H -7.888 11.731 9.966 1.00 . A A . 33 ASN H 1 1 1 462 1 1 33 ASN HA H -6.148 11.407 11.537 1.00 . A A . 33 ASN HA 1 1 1 463 1 1 33 ASN HB2 H -8.436 10.587 13.509 1.00 . A A . 33 ASN HB2 1 1 1 464 1 1 33 ASN HB3 H -6.791 10.378 13.906 1.00 . A A . 33 ASN HB3 1 1 1 465 1 1 33 ASN HD21 H -9.323 12.702 13.532 1.00 . A A . 33 ASN HD21 1 1 1 466 1 1 33 ASN HD22 H -8.364 14.142 14.144 1.00 . A A . 33 ASN HD22 1 1 1 467 1 1 33 ASN N N -8.146 11.221 10.818 1.00 . A A . 33 ASN N 1 1 1 468 1 1 33 ASN ND2 N -8.458 13.174 13.816 1.00 . A A . 33 ASN ND2 1 1 1 469 1 1 33 ASN O O -7.044 8.417 12.233 1.00 . A A . 33 ASN O 1 1 1 470 1 1 33 ASN OD1 O -6.263 12.951 14.079 1.00 . A A . 33 ASN OD1 1 1 1 471 1 1 34 CYS C C -4.898 6.825 10.646 1.00 . A A . 34 CYS C 1 1 1 472 1 1 34 CYS CA C -5.909 7.667 9.802 1.00 . A A . 34 CYS CA 1 1 1 473 1 1 34 CYS CB C -5.360 7.629 8.337 1.00 . A A . 34 CYS CB 1 1 1 474 1 1 34 CYS H H -6.024 9.895 9.686 1.00 . A A . 34 CYS H 1 1 1 475 1 1 34 CYS HA H -6.913 7.259 9.849 1.00 . A A . 34 CYS HA 1 1 1 476 1 1 34 CYS HB2 H -4.550 8.336 8.271 1.00 . A A . 34 CYS HB2 1 1 1 477 1 1 34 CYS HB3 H -4.944 6.635 8.087 1.00 . A A . 34 CYS HB3 1 1 1 478 1 1 34 CYS N N -6.067 9.063 10.291 1.00 . A A . 34 CYS N 1 1 1 479 1 1 34 CYS O O -4.106 7.363 11.427 1.00 . A A . 34 CYS O 1 1 1 480 1 1 34 CYS SG S -6.571 7.882 7.039 1.00 . A A . 34 CYS SG 1 1 1 481 1 1 35 GLU C C -3.252 3.776 9.770 1.00 . A A . 35 GLU C 1 1 1 482 1 1 35 GLU CA C -3.866 4.579 10.966 1.00 . A A . 35 GLU CA 1 1 1 483 1 1 35 GLU CB C -4.368 3.542 12.016 1.00 . A A . 35 GLU CB 1 1 1 484 1 1 35 GLU CD C -5.678 2.911 14.119 1.00 . A A . 35 GLU CD 1 1 1 485 1 1 35 GLU CG C -5.242 4.036 13.179 1.00 . A A . 35 GLU CG 1 1 1 486 1 1 35 GLU H H -5.620 5.213 9.707 1.00 . A A . 35 GLU H 1 1 1 487 1 1 35 GLU HA H -3.078 5.201 11.431 1.00 . A A . 35 GLU HA 1 1 1 488 1 1 35 GLU HB2 H -4.771 2.665 11.493 1.00 . A A . 35 GLU HB2 1 1 1 489 1 1 35 GLU HB3 H -3.472 3.100 12.490 1.00 . A A . 35 GLU HB3 1 1 1 490 1 1 35 GLU HE2 H -4.967 1.855 15.592 1.00 . A A . 35 GLU HE2 1 1 1 491 1 1 35 GLU HG2 H -4.685 4.799 13.756 1.00 . A A . 35 GLU HG2 1 1 1 492 1 1 35 GLU HG3 H -6.139 4.535 12.781 1.00 . A A . 35 GLU HG3 1 1 1 493 1 1 35 GLU N N -4.936 5.485 10.437 1.00 . A A . 35 GLU N 1 1 1 494 1 1 35 GLU O O -3.737 3.778 8.633 1.00 . A A . 35 GLU O 1 1 1 495 1 1 35 GLU OE1 O -6.792 2.390 14.079 1.00 . A A . 35 GLU OE1 1 1 1 496 1 1 35 GLU OE2 O -4.689 2.559 15.003 1.00 . A A . 35 GLU OE2 1 1 1 497 1 1 36 CYS C C -1.926 0.841 9.056 1.00 . A A . 36 CYS C 1 1 1 498 1 1 36 CYS CA C -1.361 2.285 9.089 1.00 . A A . 36 CYS CA 1 1 1 499 1 1 36 CYS CB C 0.167 2.334 9.449 1.00 . A A . 36 CYS CB 1 1 1 500 1 1 36 CYS H H -2.031 3.073 11.100 1.00 . A A . 36 CYS H 1 1 1 501 1 1 36 CYS HA H -1.472 2.730 8.075 1.00 . A A . 36 CYS HA 1 1 1 502 1 1 36 CYS HB2 H 0.376 2.420 10.532 1.00 . A A . 36 CYS HB2 1 1 1 503 1 1 36 CYS HB3 H 0.712 1.403 9.232 1.00 . A A . 36 CYS HB3 1 1 1 504 1 1 36 CYS N N -2.146 3.078 10.080 1.00 . A A . 36 CYS N 1 1 1 505 1 1 36 CYS O O -2.645 0.371 9.947 1.00 . A A . 36 CYS O 1 1 1 506 1 1 36 CYS SG S 0.895 3.618 8.436 1.00 . A A . 36 CYS SG 1 1 1 507 1 1 37 THR C C -1.012 -1.964 6.894 1.00 . A A . 37 THR C 1 1 1 508 1 1 37 THR CA C -2.170 -1.170 7.596 1.00 . A A . 37 THR CA 1 1 1 509 1 1 37 THR CB C -3.416 -1.108 6.648 1.00 . A A . 37 THR CB 1 1 1 510 1 1 37 THR CG2 C -4.661 -0.541 7.357 1.00 . A A . 37 THR CG2 1 1 1 511 1 1 37 THR H H -1.060 0.705 7.261 1.00 . A A . 37 THR H 1 1 1 512 1 1 37 THR HA H -2.466 -1.681 8.530 1.00 . A A . 37 THR HA 1 1 1 513 1 1 37 THR HB H -3.636 -2.138 6.308 1.00 . A A . 37 THR HB 1 1 1 514 1 1 37 THR HG1 H -3.957 -0.304 4.983 1.00 . A A . 37 THR HG1 1 1 1 515 1 1 37 THR HG21 H -4.910 -1.115 8.268 1.00 . A A . 37 THR HG21 1 1 1 516 1 1 37 THR HG22 H -4.530 0.517 7.654 1.00 . A A . 37 THR HG22 1 1 1 517 1 1 37 THR HG23 H -5.545 -0.582 6.697 1.00 . A A . 37 THR HG23 1 1 1 518 1 1 37 THR N N -1.646 0.183 7.922 1.00 . A A . 37 THR N 1 1 1 519 1 1 37 THR O O -0.328 -1.389 6.035 1.00 . A A . 37 THR O 1 1 1 520 1 1 37 THR OG1 O -3.163 -0.272 5.521 1.00 . A A . 37 THR OG1 1 1 1 521 1 1 38 PRO C C 0.214 -4.285 5.026 1.00 . A A . 38 PRO C 1 1 1 522 1 1 38 PRO CA C 0.351 -4.054 6.568 1.00 . A A . 38 PRO CA 1 1 1 523 1 1 38 PRO CB C 0.342 -5.358 7.400 1.00 . A A . 38 PRO CB 1 1 1 524 1 1 38 PRO CD C -1.520 -4.054 8.189 1.00 . A A . 38 PRO CD 1 1 1 525 1 1 38 PRO CG C -1.072 -5.496 7.967 1.00 . A A . 38 PRO CG 1 1 1 526 1 1 38 PRO HA H 1.308 -3.529 6.706 1.00 . A A . 38 PRO HA 1 1 1 527 1 1 38 PRO HB2 H 0.648 -6.255 6.833 1.00 . A A . 38 PRO HB2 1 1 1 528 1 1 38 PRO HB3 H 1.064 -5.267 8.235 1.00 . A A . 38 PRO HB3 1 1 1 529 1 1 38 PRO HD2 H -2.609 -3.934 8.073 1.00 . A A . 38 PRO HD2 1 1 1 530 1 1 38 PRO HD3 H -1.274 -3.720 9.212 1.00 . A A . 38 PRO HD3 1 1 1 531 1 1 38 PRO HG2 H -1.732 -5.995 7.232 1.00 . A A . 38 PRO HG2 1 1 1 532 1 1 38 PRO HG3 H -1.101 -6.096 8.895 1.00 . A A . 38 PRO HG3 1 1 1 533 1 1 38 PRO N N -0.764 -3.277 7.185 1.00 . A A . 38 PRO N 1 1 1 534 1 1 38 PRO O O 1.145 -3.962 4.284 1.00 . A A . 38 PRO O 1 1 1 535 1 1 39 ARG C C -2.726 -5.040 2.879 1.00 . A A . 39 ARG C 1 1 1 536 1 1 39 ARG CA C -1.188 -5.013 3.098 1.00 . A A . 39 ARG CA 1 1 1 537 1 1 39 ARG CB C -0.532 -6.332 2.585 1.00 . A A . 39 ARG CB 1 1 1 538 1 1 39 ARG CD C 0.006 -8.858 2.805 1.00 . A A . 39 ARG CD 1 1 1 539 1 1 39 ARG CG C -0.879 -7.683 3.266 1.00 . A A . 39 ARG CG 1 1 1 540 1 1 39 ARG CZ C 2.448 -9.444 2.863 1.00 . A A . 39 ARG CZ 1 1 1 541 1 1 39 ARG H H -1.613 -5.018 5.281 1.00 . A A . 39 ARG H 1 1 1 542 1 1 39 ARG HA H -0.751 -4.165 2.529 1.00 . A A . 39 ARG HA 1 1 1 543 1 1 39 ARG HB2 H -0.730 -6.426 1.500 1.00 . A A . 39 ARG HB2 1 1 1 544 1 1 39 ARG HB3 H 0.561 -6.187 2.640 1.00 . A A . 39 ARG HB3 1 1 1 545 1 1 39 ARG HD2 H -0.439 -9.807 3.159 1.00 . A A . 39 ARG HD2 1 1 1 546 1 1 39 ARG HD3 H 0.001 -8.916 1.699 1.00 . A A . 39 ARG HD3 1 1 1 547 1 1 39 ARG HG2 H -0.827 -7.589 4.367 1.00 . A A . 39 ARG HG2 1 1 1 548 1 1 39 ARG HG3 H -1.934 -7.931 3.048 1.00 . A A . 39 ARG HG3 1 1 1 549 1 1 39 ARG HH11 H 1.459 -10.454 1.432 1.00 . A A . 39 ARG HH11 1 1 1 550 1 1 39 ARG HH12 H 3.259 -10.775 1.590 1.00 . A A . 39 ARG HH12 1 1 1 551 1 1 39 ARG HH21 H 3.649 -8.564 4.203 1.00 . A A . 39 ARG HH21 1 1 1 552 1 1 39 ARG HH22 H 4.413 -9.775 3.055 1.00 . A A . 39 ARG HH22 1 1 1 553 1 1 39 ARG N N -0.924 -4.820 4.550 1.00 . A A . 39 ARG N 1 1 1 554 1 1 39 ARG NE N 1.391 -8.755 3.333 1.00 . A A . 39 ARG NE 1 1 1 555 1 1 39 ARG NH1 N 2.382 -10.315 1.858 1.00 . A A . 39 ARG NH1 1 1 1 556 1 1 39 ARG NH2 N 3.623 -9.240 3.432 1.00 . A A . 39 ARG NH2 1 1 1 557 1 1 39 ARG O O -3.461 -5.788 3.535 1.00 . A A . 39 ARG O 1 1 1 558 1 1 40 LEU C C -4.765 -4.702 0.106 1.00 . A A . 40 LEU C 1 1 1 559 1 1 40 LEU CA C -4.619 -4.126 1.540 1.00 . A A . 40 LEU CA 1 1 1 560 1 1 40 LEU CB C -5.104 -2.646 1.579 1.00 . A A . 40 LEU CB 1 1 1 561 1 1 40 LEU CD1 C -5.452 -0.435 2.795 1.00 . A A . 40 LEU CD1 1 1 1 562 1 1 40 LEU CD2 C -6.072 -2.576 3.978 1.00 . A A . 40 LEU CD2 1 1 1 563 1 1 40 LEU CG C -5.111 -1.929 2.960 1.00 . A A . 40 LEU CG 1 1 1 564 1 1 40 LEU H H -2.466 -3.651 1.458 1.00 . A A . 40 LEU H 1 1 1 565 1 1 40 LEU HA H -5.255 -4.704 2.241 1.00 . A A . 40 LEU HA 1 1 1 566 1 1 40 LEU HB2 H -4.484 -2.054 0.878 1.00 . A A . 40 LEU HB2 1 1 1 567 1 1 40 LEU HB3 H -6.126 -2.594 1.155 1.00 . A A . 40 LEU HB3 1 1 1 568 1 1 40 LEU HD11 H -4.802 0.056 2.048 1.00 . A A . 40 LEU HD11 1 1 1 569 1 1 40 LEU HD12 H -6.497 -0.281 2.467 1.00 . A A . 40 LEU HD12 1 1 1 570 1 1 40 LEU HD13 H -5.317 0.118 3.742 1.00 . A A . 40 LEU HD13 1 1 1 571 1 1 40 LEU HD21 H -7.115 -2.597 3.610 1.00 . A A . 40 LEU HD21 1 1 1 572 1 1 40 LEU HD22 H -5.784 -3.617 4.210 1.00 . A A . 40 LEU HD22 1 1 1 573 1 1 40 LEU HD23 H -6.077 -2.033 4.940 1.00 . A A . 40 LEU HD23 1 1 1 574 1 1 40 LEU HG H -4.090 -1.980 3.382 1.00 . A A . 40 LEU HG 1 1 1 575 1 1 40 LEU N N -3.187 -4.212 1.927 1.00 . A A . 40 LEU N 1 1 1 576 1 1 40 LEU O O -4.138 -4.218 -0.844 1.00 . A A . 40 LEU O 1 1 1 577 1 1 41 ILE C C -6.787 -5.486 -2.236 1.00 . A A . 41 ILE C 1 1 1 578 1 1 41 ILE CA C -5.864 -6.405 -1.354 1.00 . A A . 41 ILE CA 1 1 1 579 1 1 41 ILE CB C -6.464 -7.840 -1.062 1.00 . A A . 41 ILE CB 1 1 1 580 1 1 41 ILE CD1 C -6.711 -10.174 -2.222 1.00 . A A . 41 ILE CD1 1 1 1 581 1 1 41 ILE CG1 C -6.491 -8.661 -2.389 1.00 . A A . 41 ILE CG1 1 1 1 582 1 1 41 ILE CG2 C -7.906 -7.786 -0.471 1.00 . A A . 41 ILE CG2 1 1 1 583 1 1 41 ILE H H -6.082 -6.040 0.820 1.00 . A A . 41 ILE H 1 1 1 584 1 1 41 ILE HA H -4.894 -6.522 -1.879 1.00 . A A . 41 ILE HA 1 1 1 585 1 1 41 ILE HB H -5.803 -8.360 -0.341 1.00 . A A . 41 ILE HB 1 1 1 586 1 1 41 ILE HD11 H -5.949 -10.627 -1.562 1.00 . A A . 41 ILE HD11 1 1 1 587 1 1 41 ILE HD12 H -7.704 -10.405 -1.796 1.00 . A A . 41 ILE HD12 1 1 1 588 1 1 41 ILE HD13 H -6.649 -10.692 -3.197 1.00 . A A . 41 ILE HD13 1 1 1 589 1 1 41 ILE HG12 H -7.249 -8.258 -3.087 1.00 . A A . 41 ILE HG12 1 1 1 590 1 1 41 ILE HG13 H -5.525 -8.537 -2.916 1.00 . A A . 41 ILE HG13 1 1 1 591 1 1 41 ILE HG21 H -7.957 -7.157 0.437 1.00 . A A . 41 ILE HG21 1 1 1 592 1 1 41 ILE HG22 H -8.649 -7.387 -1.186 1.00 . A A . 41 ILE HG22 1 1 1 593 1 1 41 ILE HG23 H -8.259 -8.788 -0.168 1.00 . A A . 41 ILE HG23 1 1 1 594 1 1 41 ILE N N -5.619 -5.734 -0.043 1.00 . A A . 41 ILE N 1 1 1 595 1 1 41 ILE O O -7.790 -4.942 -1.761 1.00 . A A . 41 ILE O 1 1 1 596 1 1 42 MET C C -6.740 -2.884 -3.996 1.00 . A A . 42 MET C 1 1 1 597 1 1 42 MET CA C -6.976 -4.347 -4.505 1.00 . A A . 42 MET CA 1 1 1 598 1 1 42 MET CB C -8.493 -4.655 -4.724 1.00 . A A . 42 MET CB 1 1 1 599 1 1 42 MET CE C -8.910 -5.899 -7.918 1.00 . A A . 42 MET CE 1 1 1 600 1 1 42 MET CG C -9.139 -3.933 -5.921 1.00 . A A . 42 MET CG 1 1 1 601 1 1 42 MET H H -5.527 -5.823 -3.748 1.00 . A A . 42 MET H 1 1 1 602 1 1 42 MET HA H -6.439 -4.480 -5.465 1.00 . A A . 42 MET HA 1 1 1 603 1 1 42 MET HB2 H -8.627 -5.742 -4.880 1.00 . A A . 42 MET HB2 1 1 1 604 1 1 42 MET HB3 H -9.086 -4.422 -3.821 1.00 . A A . 42 MET HB3 1 1 1 605 1 1 42 MET HE1 H -10.010 -5.869 -8.021 1.00 . A A . 42 MET HE1 1 1 1 606 1 1 42 MET HE2 H -8.485 -6.230 -8.883 1.00 . A A . 42 MET HE2 1 1 1 607 1 1 42 MET HE3 H -8.654 -6.657 -7.155 1.00 . A A . 42 MET HE3 1 1 1 608 1 1 42 MET HG2 H -10.200 -4.224 -6.023 1.00 . A A . 42 MET HG2 1 1 1 609 1 1 42 MET HG3 H -9.142 -2.842 -5.750 1.00 . A A . 42 MET HG3 1 1 1 610 1 1 42 MET N N -6.379 -5.300 -3.514 1.00 . A A . 42 MET N 1 1 1 611 1 1 42 MET O O -7.474 -2.378 -3.142 1.00 . A A . 42 MET O 1 1 1 612 1 1 42 MET SD S -8.259 -4.278 -7.465 1.00 . A A . 42 MET SD 1 1 1 613 1 1 43 GLU C C -4.453 -1.079 -2.679 1.00 . A A . 43 GLU C 1 1 1 614 1 1 43 GLU CA C -5.095 -0.930 -4.099 1.00 . A A . 43 GLU CA 1 1 1 615 1 1 43 GLU CB C -6.145 0.226 -4.025 1.00 . A A . 43 GLU CB 1 1 1 616 1 1 43 GLU CD C -7.877 -0.146 -5.928 1.00 . A A . 43 GLU CD 1 1 1 617 1 1 43 GLU CG C -6.748 0.719 -5.360 1.00 . A A . 43 GLU CG 1 1 1 618 1 1 43 GLU H H -5.169 -2.821 -5.221 1.00 . A A . 43 GLU H 1 1 1 619 1 1 43 GLU HA H -4.317 -0.656 -4.839 1.00 . A A . 43 GLU HA 1 1 1 620 1 1 43 GLU HB2 H -6.936 0.014 -3.287 1.00 . A A . 43 GLU HB2 1 1 1 621 1 1 43 GLU HB3 H -5.631 1.108 -3.597 1.00 . A A . 43 GLU HB3 1 1 1 622 1 1 43 GLU HE2 H -8.175 -1.451 -7.342 1.00 . A A . 43 GLU HE2 1 1 1 623 1 1 43 GLU HG2 H -7.159 1.734 -5.206 1.00 . A A . 43 GLU HG2 1 1 1 624 1 1 43 GLU HG3 H -5.947 0.853 -6.112 1.00 . A A . 43 GLU HG3 1 1 1 625 1 1 43 GLU N N -5.663 -2.254 -4.523 1.00 . A A . 43 GLU N 1 1 1 626 1 1 43 GLU O O -5.066 -1.567 -1.723 1.00 . A A . 43 GLU O 1 1 1 627 1 1 43 GLU OE1 O -9.020 -0.150 -5.473 1.00 . A A . 43 GLU OE1 1 1 1 628 1 1 43 GLU OE2 O -7.464 -0.910 -6.990 1.00 . A A . 43 GLU OE2 1 1 1 629 1 1 44 GLY C C -1.225 -1.626 -1.466 1.00 . A A . 44 GLY C 1 1 1 630 1 1 44 GLY CA C -2.404 -0.647 -1.339 1.00 . A A . 44 GLY CA 1 1 1 631 1 1 44 GLY H H -2.882 -0.133 -3.433 1.00 . A A . 44 GLY H 1 1 1 632 1 1 44 GLY HA2 H -1.998 0.366 -1.168 1.00 . A A . 44 GLY HA2 1 1 1 633 1 1 44 GLY HA3 H -3.024 -0.853 -0.445 1.00 . A A . 44 GLY HA3 1 1 1 634 1 1 44 GLY N N -3.202 -0.608 -2.584 1.00 . A A . 44 GLY N 1 1 1 635 1 1 44 GLY O O -0.276 -1.340 -2.200 1.00 . A A . 44 GLY O 1 1 1 636 1 1 45 LEU C C 1.061 -3.510 -0.187 1.00 . A A . 45 LEU C 1 1 1 637 1 1 45 LEU CA C -0.334 -3.914 -0.779 1.00 . A A . 45 LEU CA 1 1 1 638 1 1 45 LEU CB C -0.132 -4.445 -2.242 1.00 . A A . 45 LEU CB 1 1 1 639 1 1 45 LEU CD1 C -1.103 -5.288 -4.443 1.00 . A A . 45 LEU CD1 1 1 1 640 1 1 45 LEU CD2 C -1.856 -6.367 -2.288 1.00 . A A . 45 LEU CD2 1 1 1 641 1 1 45 LEU CG C -1.380 -5.054 -2.945 1.00 . A A . 45 LEU CG 1 1 1 642 1 1 45 LEU H H -2.161 -2.832 -0.182 1.00 . A A . 45 LEU H 1 1 1 643 1 1 45 LEU HA H -0.753 -4.717 -0.142 1.00 . A A . 45 LEU HA 1 1 1 644 1 1 45 LEU HB2 H 0.295 -3.644 -2.875 1.00 . A A . 45 LEU HB2 1 1 1 645 1 1 45 LEU HB3 H 0.660 -5.220 -2.235 1.00 . A A . 45 LEU HB3 1 1 1 646 1 1 45 LEU HD11 H -0.817 -4.350 -4.955 1.00 . A A . 45 LEU HD11 1 1 1 647 1 1 45 LEU HD12 H -0.285 -6.014 -4.608 1.00 . A A . 45 LEU HD12 1 1 1 648 1 1 45 LEU HD13 H -1.997 -5.674 -4.969 1.00 . A A . 45 LEU HD13 1 1 1 649 1 1 45 LEU HD21 H -1.067 -7.142 -2.286 1.00 . A A . 45 LEU HD21 1 1 1 650 1 1 45 LEU HD22 H -2.167 -6.212 -1.239 1.00 . A A . 45 LEU HD22 1 1 1 651 1 1 45 LEU HD23 H -2.731 -6.793 -2.815 1.00 . A A . 45 LEU HD23 1 1 1 652 1 1 45 LEU HG H -2.210 -4.325 -2.887 1.00 . A A . 45 LEU HG 1 1 1 653 1 1 45 LEU N N -1.306 -2.767 -0.745 1.00 . A A . 45 LEU N 1 1 1 654 1 1 45 LEU O O 1.506 -2.358 -0.249 1.00 . A A . 45 LEU O 1 1 1 655 1 1 46 SER C C 4.199 -4.034 -0.048 1.00 . A A . 46 SER C 1 1 1 656 1 1 46 SER CA C 3.095 -4.330 1.013 1.00 . A A . 46 SER CA 1 1 1 657 1 1 46 SER CB C 3.463 -5.614 1.797 1.00 . A A . 46 SER CB 1 1 1 658 1 1 46 SER H H 1.296 -5.429 0.356 1.00 . A A . 46 SER H 1 1 1 659 1 1 46 SER HA H 3.035 -3.484 1.726 1.00 . A A . 46 SER HA 1 1 1 660 1 1 46 SER HB2 H 4.455 -5.499 2.270 1.00 . A A . 46 SER HB2 1 1 1 661 1 1 46 SER HB3 H 2.764 -5.764 2.639 1.00 . A A . 46 SER HB3 1 1 1 662 1 1 46 SER HG H 2.587 -6.871 0.629 1.00 . A A . 46 SER HG 1 1 1 663 1 1 46 SER N N 1.765 -4.517 0.371 1.00 . A A . 46 SER N 1 1 1 664 1 1 46 SER O O 4.361 -4.772 -1.026 1.00 . A A . 46 SER O 1 1 1 665 1 1 46 SER OG O 3.474 -6.787 0.986 1.00 . A A . 46 SER OG 1 1 1 666 1 1 47 PHE C C 5.319 -1.984 -2.124 1.00 . A A . 47 PHE C 1 1 1 667 1 1 47 PHE CA C 5.966 -2.342 -0.744 1.00 . A A . 47 PHE CA 1 1 1 668 1 1 47 PHE CB C 7.156 -3.348 -0.893 1.00 . A A . 47 PHE CB 1 1 1 669 1 1 47 PHE CD1 C 9.312 -2.014 -0.632 1.00 . A A . 47 PHE CD1 1 1 1 670 1 1 47 PHE CD2 C 8.733 -2.823 -2.833 1.00 . A A . 47 PHE CD2 1 1 1 671 1 1 47 PHE CE1 C 10.462 -1.424 -1.151 1.00 . A A . 47 PHE CE1 1 1 1 672 1 1 47 PHE CE2 C 9.884 -2.232 -3.350 1.00 . A A . 47 PHE CE2 1 1 1 673 1 1 47 PHE CG C 8.437 -2.716 -1.469 1.00 . A A . 47 PHE CG 1 1 1 674 1 1 47 PHE CZ C 10.746 -1.533 -2.509 1.00 . A A . 47 PHE CZ 1 1 1 675 1 1 47 PHE H H 4.669 -2.424 1.033 1.00 . A A . 47 PHE H 1 1 1 676 1 1 47 PHE HA H 6.338 -1.404 -0.290 1.00 . A A . 47 PHE HA 1 1 1 677 1 1 47 PHE HB2 H 7.406 -3.776 0.098 1.00 . A A . 47 PHE HB2 1 1 1 678 1 1 47 PHE HB3 H 6.859 -4.230 -1.493 1.00 . A A . 47 PHE HB3 1 1 1 679 1 1 47 PHE HD1 H 9.104 -1.919 0.423 1.00 . A A . 47 PHE HD1 1 1 1 680 1 1 47 PHE HD2 H 8.070 -3.357 -3.498 1.00 . A A . 47 PHE HD2 1 1 1 681 1 1 47 PHE HE1 H 11.132 -0.883 -0.499 1.00 . A A . 47 PHE HE1 1 1 1 682 1 1 47 PHE HE2 H 10.105 -2.313 -4.404 1.00 . A A . 47 PHE HE2 1 1 1 683 1 1 47 PHE HZ H 11.637 -1.074 -2.912 1.00 . A A . 47 PHE HZ 1 1 1 684 1 1 47 PHE N N 4.930 -2.917 0.172 1.00 . A A . 47 PHE N 1 1 1 685 1 1 47 PHE O O 5.227 -2.815 -3.035 1.00 . A A . 47 PHE O 1 1 1 686 1 1 48 ALA C C 4.401 1.311 -3.532 1.00 . A A . 48 ALA C 1 1 1 687 1 1 48 ALA CA C 4.173 -0.212 -3.447 1.00 . A A . 48 ALA CA 1 1 1 688 1 1 48 ALA CB C 2.666 -0.543 -3.379 1.00 . A A . 48 ALA CB 1 1 1 689 1 1 48 ALA H H 4.992 -0.142 -1.404 1.00 . A A . 48 ALA H 1 1 1 690 1 1 48 ALA HXT H 4.012 2.952 -2.549 1.00 . A A . 48 ALA HXT 1 1 1 691 1 1 48 ALA HA H 4.598 -0.680 -4.356 1.00 . A A . 48 ALA HA 1 1 1 692 1 1 48 ALA HB1 H 2.177 -0.112 -2.484 1.00 . A A . 48 ALA HB1 1 1 1 693 1 1 48 ALA HB2 H 2.125 -0.159 -4.264 1.00 . A A . 48 ALA HB2 1 1 1 694 1 1 48 ALA HB3 H 2.489 -1.635 -3.350 1.00 . A A . 48 ALA HB3 1 1 1 695 1 1 48 ALA N N 4.856 -0.726 -2.237 1.00 . A A . 48 ALA N 1 1 1 696 1 1 48 ALA O O 5.009 1.840 -4.462 1.00 . A A . 48 ALA O 1 1 1 697 1 1 48 ALA OXT O 3.861 2.007 -2.473 1.00 . A A . 48 ALA OXT 1 1 2 698 1 1 1 GLU C C 13.658 6.567 7.196 1.00 . A A . 1 GLU C 1 1 2 699 1 1 1 GLU CA C 13.731 5.511 6.051 1.00 . A A . 1 GLU CA 1 1 2 700 1 1 1 GLU CB C 15.037 5.568 5.201 1.00 . A A . 1 GLU CB 1 1 2 701 1 1 1 GLU CD C 17.587 5.346 5.129 1.00 . A A . 1 GLU CD 1 1 2 702 1 1 1 GLU CG C 16.323 5.220 5.983 1.00 . A A . 1 GLU CG 1 1 2 703 1 1 1 GLU H1 H 11.692 5.674 5.626 1.00 . A A . 1 GLU H1 1 1 2 704 1 1 1 GLU H2 H 12.566 5.012 4.390 1.00 . A A . 1 GLU H2 1 1 2 705 1 1 1 GLU HA H 13.635 4.521 6.520 1.00 . A A . 1 GLU HA 1 1 2 706 1 1 1 GLU HB2 H 14.955 4.858 4.354 1.00 . A A . 1 GLU HB2 1 1 2 707 1 1 1 GLU HB3 H 15.147 6.566 4.731 1.00 . A A . 1 GLU HB3 1 1 2 708 1 1 1 GLU HE2 H 18.824 6.718 4.512 1.00 . A A . 1 GLU HE2 1 1 2 709 1 1 1 GLU HG2 H 16.425 5.872 6.871 1.00 . A A . 1 GLU HG2 1 1 2 710 1 1 1 GLU HG3 H 16.254 4.190 6.380 1.00 . A A . 1 GLU HG3 1 1 2 711 1 1 1 GLU N N 12.589 5.721 5.131 1.00 . A A . 1 GLU N 1 1 2 712 1 1 1 GLU O O 13.297 6.205 8.319 1.00 . A A . 1 GLU O 1 1 2 713 1 1 1 GLU OE1 O 18.132 4.389 4.580 1.00 . A A . 1 GLU OE1 1 1 2 714 1 1 1 GLU OE2 O 18.033 6.641 5.051 1.00 . A A . 1 GLU OE2 1 1 2 715 1 1 2 ASP C C 12.615 9.640 7.974 1.00 . A A . 2 ASP C 1 1 2 716 1 1 2 ASP CA C 14.002 8.926 7.943 1.00 . A A . 2 ASP CA 1 1 2 717 1 1 2 ASP CB C 15.141 9.938 7.609 1.00 . A A . 2 ASP CB 1 1 2 718 1 1 2 ASP CG C 15.104 10.700 6.268 1.00 . A A . 2 ASP CG 1 1 2 719 1 1 2 ASP H H 14.300 7.980 5.955 1.00 . A A . 2 ASP H 1 1 2 720 1 1 2 ASP HA H 14.214 8.502 8.947 1.00 . A A . 2 ASP HA 1 1 2 721 1 1 2 ASP HB2 H 15.183 10.693 8.417 1.00 . A A . 2 ASP HB2 1 1 2 722 1 1 2 ASP HB3 H 16.115 9.419 7.690 1.00 . A A . 2 ASP HB3 1 1 2 723 1 1 2 ASP HD2 H 16.164 9.216 5.588 1.00 . A A . 2 ASP HD2 1 1 2 724 1 1 2 ASP N N 13.993 7.843 6.923 1.00 . A A . 2 ASP N 1 1 2 725 1 1 2 ASP O O 12.024 9.939 6.931 1.00 . A A . 2 ASP O 1 1 2 726 1 1 2 ASP OD1 O 14.527 11.777 6.117 1.00 . A A . 2 ASP OD1 1 1 2 727 1 1 2 ASP OD2 O 15.780 10.038 5.275 1.00 . A A . 2 ASP OD2 1 1 2 728 1 1 3 ASN C C 9.518 9.890 8.984 1.00 . A A . 3 ASN C 1 1 2 729 1 1 3 ASN CA C 10.817 10.613 9.509 1.00 . A A . 3 ASN CA 1 1 2 730 1 1 3 ASN CB C 10.857 12.047 8.893 1.00 . A A . 3 ASN CB 1 1 2 731 1 1 3 ASN CG C 12.011 12.984 9.313 1.00 . A A . 3 ASN CG 1 1 2 732 1 1 3 ASN H H 12.654 9.464 9.960 1.00 . A A . 3 ASN H 1 1 2 733 1 1 3 ASN HA H 10.714 10.643 10.602 1.00 . A A . 3 ASN HA 1 1 2 734 1 1 3 ASN HB2 H 10.867 11.906 7.798 1.00 . A A . 3 ASN HB2 1 1 2 735 1 1 3 ASN HB3 H 9.902 12.572 9.090 1.00 . A A . 3 ASN HB3 1 1 2 736 1 1 3 ASN HD21 H 11.021 13.505 10.978 1.00 . A A . 3 ASN HD21 1 1 2 737 1 1 3 ASN HD22 H 12.666 14.271 10.705 1.00 . A A . 3 ASN HD22 1 1 2 738 1 1 3 ASN N N 12.125 9.910 9.206 1.00 . A A . 3 ASN N 1 1 2 739 1 1 3 ASN ND2 N 11.887 13.654 10.448 1.00 . A A . 3 ASN ND2 1 1 2 740 1 1 3 ASN O O 8.456 10.501 8.833 1.00 . A A . 3 ASN O 1 1 2 741 1 1 3 ASN OD1 O 13.018 13.106 8.617 1.00 . A A . 3 ASN OD1 1 1 2 742 1 1 4 CYS C C 7.687 7.020 9.283 1.00 . A A . 4 CYS C 1 1 2 743 1 1 4 CYS CA C 8.554 7.733 8.185 1.00 . A A . 4 CYS CA 1 1 2 744 1 1 4 CYS CB C 9.222 6.714 7.273 1.00 . A A . 4 CYS CB 1 1 2 745 1 1 4 CYS H H 10.622 8.373 8.860 1.00 . A A . 4 CYS H 1 1 2 746 1 1 4 CYS HA H 7.870 8.319 7.548 1.00 . A A . 4 CYS HA 1 1 2 747 1 1 4 CYS HB2 H 8.328 6.203 6.996 1.00 . A A . 4 CYS HB2 1 1 2 748 1 1 4 CYS HB3 H 9.562 7.077 6.293 1.00 . A A . 4 CYS HB3 1 1 2 749 1 1 4 CYS N N 9.620 8.580 8.778 1.00 . A A . 4 CYS N 1 1 2 750 1 1 4 CYS O O 8.001 7.092 10.478 1.00 . A A . 4 CYS O 1 1 2 751 1 1 4 CYS SG S 10.268 5.428 7.983 1.00 . A A . 4 CYS SG 1 1 2 752 1 1 5 ILE C C 6.084 4.070 9.599 1.00 . A A . 5 ILE C 1 1 2 753 1 1 5 ILE CA C 5.741 5.553 9.862 1.00 . A A . 5 ILE CA 1 1 2 754 1 1 5 ILE CB C 4.182 5.774 9.747 1.00 . A A . 5 ILE CB 1 1 2 755 1 1 5 ILE CD1 C 2.464 7.558 9.169 1.00 . A A . 5 ILE CD1 1 1 2 756 1 1 5 ILE CG1 C 3.870 7.274 9.627 1.00 . A A . 5 ILE CG1 1 1 2 757 1 1 5 ILE CG2 C 3.451 5.159 10.988 1.00 . A A . 5 ILE CG2 1 1 2 758 1 1 5 ILE H H 6.509 6.229 7.821 1.00 . A A . 5 ILE H 1 1 2 759 1 1 5 ILE HA H 6.005 5.850 10.877 1.00 . A A . 5 ILE HA 1 1 2 760 1 1 5 ILE HB H 3.724 5.279 8.899 1.00 . A A . 5 ILE HB 1 1 2 761 1 1 5 ILE HD11 H 1.754 7.059 9.839 1.00 . A A . 5 ILE HD11 1 1 2 762 1 1 5 ILE HD12 H 2.239 8.634 9.204 1.00 . A A . 5 ILE HD12 1 1 2 763 1 1 5 ILE HD13 H 2.287 7.197 8.139 1.00 . A A . 5 ILE HD13 1 1 2 764 1 1 5 ILE HG12 H 4.058 7.771 10.572 1.00 . A A . 5 ILE HG12 1 1 2 765 1 1 5 ILE HG13 H 4.525 7.750 8.882 1.00 . A A . 5 ILE HG13 1 1 2 766 1 1 5 ILE HG21 H 3.783 5.555 11.963 1.00 . A A . 5 ILE HG21 1 1 2 767 1 1 5 ILE HG22 H 2.354 5.316 10.959 1.00 . A A . 5 ILE HG22 1 1 2 768 1 1 5 ILE HG23 H 3.550 4.056 11.024 1.00 . A A . 5 ILE HG23 1 1 2 769 1 1 5 ILE N N 6.590 6.315 8.863 1.00 . A A . 5 ILE N 1 1 2 770 1 1 5 ILE O O 5.451 3.384 8.797 1.00 . A A . 5 ILE O 1 1 2 771 1 1 6 ALA C C 6.696 1.006 10.629 1.00 . A A . 6 ALA C 1 1 2 772 1 1 6 ALA CA C 7.586 2.149 10.000 1.00 . A A . 6 ALA CA 1 1 2 773 1 1 6 ALA CB C 9.022 2.084 10.553 1.00 . A A . 6 ALA CB 1 1 2 774 1 1 6 ALA H H 7.430 4.145 11.038 1.00 . A A . 6 ALA H 1 1 2 775 1 1 6 ALA HA H 7.581 2.006 8.894 1.00 . A A . 6 ALA HA 1 1 2 776 1 1 6 ALA HB1 H 9.674 2.853 10.098 1.00 . A A . 6 ALA HB1 1 1 2 777 1 1 6 ALA HB2 H 9.058 2.224 11.651 1.00 . A A . 6 ALA HB2 1 1 2 778 1 1 6 ALA HB3 H 9.491 1.107 10.334 1.00 . A A . 6 ALA HB3 1 1 2 779 1 1 6 ALA N N 7.101 3.539 10.287 1.00 . A A . 6 ALA N 1 1 2 780 1 1 6 ALA O O 7.134 -0.138 10.783 1.00 . A A . 6 ALA O 1 1 2 781 1 1 7 GLU C C 3.300 0.038 10.967 1.00 . A A . 7 GLU C 1 1 2 782 1 1 7 GLU CA C 4.515 0.532 11.772 1.00 . A A . 7 GLU CA 1 1 2 783 1 1 7 GLU CB C 4.073 1.416 12.991 1.00 . A A . 7 GLU CB 1 1 2 784 1 1 7 GLU CD C 6.059 2.909 13.767 1.00 . A A . 7 GLU CD 1 1 2 785 1 1 7 GLU CG C 5.121 1.737 14.085 1.00 . A A . 7 GLU CG 1 1 2 786 1 1 7 GLU H H 5.396 2.386 10.909 1.00 . A A . 7 GLU H 1 1 2 787 1 1 7 GLU HA H 4.989 -0.369 12.121 1.00 . A A . 7 GLU HA 1 1 2 788 1 1 7 GLU HB2 H 3.592 2.349 12.642 1.00 . A A . 7 GLU HB2 1 1 2 789 1 1 7 GLU HB3 H 3.257 0.890 13.523 1.00 . A A . 7 GLU HB3 1 1 2 790 1 1 7 GLU HE2 H 7.961 3.270 13.566 1.00 . A A . 7 GLU HE2 1 1 2 791 1 1 7 GLU HG2 H 4.588 1.994 15.019 1.00 . A A . 7 GLU HG2 1 1 2 792 1 1 7 GLU HG3 H 5.699 0.825 14.332 1.00 . A A . 7 GLU HG3 1 1 2 793 1 1 7 GLU N N 5.449 1.357 10.980 1.00 . A A . 7 GLU N 1 1 2 794 1 1 7 GLU O O 2.993 0.482 9.861 1.00 . A A . 7 GLU O 1 1 2 795 1 1 7 GLU OE1 O 5.665 4.053 13.538 1.00 . A A . 7 GLU OE1 1 1 2 796 1 1 7 GLU OE2 O 7.378 2.534 13.766 1.00 . A A . 7 GLU OE2 1 1 2 797 1 1 8 ASP C C 0.435 -0.895 12.462 1.00 . A A . 8 ASP C 1 1 2 798 1 1 8 ASP CA C 1.280 -1.403 11.262 1.00 . A A . 8 ASP CA 1 1 2 799 1 1 8 ASP CB C 1.133 -2.931 11.142 1.00 . A A . 8 ASP CB 1 1 2 800 1 1 8 ASP CG C 2.091 -3.592 10.134 1.00 . A A . 8 ASP CG 1 1 2 801 1 1 8 ASP H H 3.036 -1.157 12.537 1.00 . A A . 8 ASP H 1 1 2 802 1 1 8 ASP HA H 0.962 -0.987 10.278 1.00 . A A . 8 ASP HA 1 1 2 803 1 1 8 ASP HB2 H 1.199 -3.351 12.152 1.00 . A A . 8 ASP HB2 1 1 2 804 1 1 8 ASP HB3 H 0.109 -3.158 10.801 1.00 . A A . 8 ASP HB3 1 1 2 805 1 1 8 ASP HD2 H 2.014 -5.116 11.341 1.00 . A A . 8 ASP HD2 1 1 2 806 1 1 8 ASP N N 2.619 -0.907 11.634 1.00 . A A . 8 ASP N 1 1 2 807 1 1 8 ASP O O 0.713 -1.097 13.653 1.00 . A A . 8 ASP O 1 1 2 808 1 1 8 ASP OD1 O 2.494 -3.047 9.105 1.00 . A A . 8 ASP OD1 1 1 2 809 1 1 8 ASP OD2 O 2.431 -4.864 10.513 1.00 . A A . 8 ASP OD2 1 1 2 810 1 1 9 TYR C C -0.794 1.817 13.644 1.00 . A A . 9 TYR C 1 1 2 811 1 1 9 TYR CA C -1.540 0.619 12.908 1.00 . A A . 9 TYR CA 1 1 2 812 1 1 9 TYR CB C -2.285 -0.345 13.907 1.00 . A A . 9 TYR CB 1 1 2 813 1 1 9 TYR CD1 C -4.058 -1.318 12.327 1.00 . A A . 9 TYR CD1 1 1 2 814 1 1 9 TYR CD2 C -2.439 -2.822 13.305 1.00 . A A . 9 TYR CD2 1 1 2 815 1 1 9 TYR CE1 C -4.501 -2.343 11.492 1.00 . A A . 9 TYR CE1 1 1 2 816 1 1 9 TYR CE2 C -2.885 -3.845 12.470 1.00 . A A . 9 TYR CE2 1 1 2 817 1 1 9 TYR CG C -3.006 -1.543 13.225 1.00 . A A . 9 TYR CG 1 1 2 818 1 1 9 TYR CZ C -3.912 -3.603 11.562 1.00 . A A . 9 TYR CZ 1 1 2 819 1 1 9 TYR H H -0.705 -0.332 11.046 1.00 . A A . 9 TYR H 1 1 2 820 1 1 9 TYR HA H -2.281 1.107 12.252 1.00 . A A . 9 TYR HA 1 1 2 821 1 1 9 TYR HB2 H -1.593 -0.700 14.695 1.00 . A A . 9 TYR HB2 1 1 2 822 1 1 9 TYR HB3 H -3.042 0.240 14.464 1.00 . A A . 9 TYR HB3 1 1 2 823 1 1 9 TYR HD1 H -4.480 -0.329 12.216 1.00 . A A . 9 TYR HD1 1 1 2 824 1 1 9 TYR HD2 H -1.597 -3.009 13.956 1.00 . A A . 9 TYR HD2 1 1 2 825 1 1 9 TYR HE1 H -5.270 -2.151 10.759 1.00 . A A . 9 TYR HE1 1 1 2 826 1 1 9 TYR HE2 H -2.401 -4.812 12.497 1.00 . A A . 9 TYR HE2 1 1 2 827 1 1 9 TYR HH H -3.804 -5.388 10.885 1.00 . A A . 9 TYR HH 1 1 2 828 1 1 9 TYR N N -0.616 -0.207 12.057 1.00 . A A . 9 TYR N 1 1 2 829 1 1 9 TYR O O -1.216 2.239 14.726 1.00 . A A . 9 TYR O 1 1 2 830 1 1 9 TYR OH O -4.317 -4.596 10.708 1.00 . A A . 9 TYR OH 1 1 2 831 1 1 10 GLY C C 0.129 4.871 12.798 1.00 . A A . 10 GLY C 1 1 2 832 1 1 10 GLY CA C 0.872 3.702 13.438 1.00 . A A . 10 GLY CA 1 1 2 833 1 1 10 GLY H H 0.511 1.972 12.125 1.00 . A A . 10 GLY H 1 1 2 834 1 1 10 GLY HA2 H 0.973 3.792 14.524 1.00 . A A . 10 GLY HA2 1 1 2 835 1 1 10 GLY HA3 H 1.907 3.845 13.119 1.00 . A A . 10 GLY HA3 1 1 2 836 1 1 10 GLY N N 0.249 2.420 13.012 1.00 . A A . 10 GLY N 1 1 2 837 1 1 10 GLY O O -0.458 4.771 11.722 1.00 . A A . 10 GLY O 1 1 2 838 1 1 11 LYS C C -0.111 7.868 11.865 1.00 . A A . 11 LYS C 1 1 2 839 1 1 11 LYS CA C -0.701 7.161 13.126 1.00 . A A . 11 LYS CA 1 1 2 840 1 1 11 LYS CB C -0.799 8.230 14.236 1.00 . A A . 11 LYS CB 1 1 2 841 1 1 11 LYS CD C -1.408 8.874 16.685 1.00 . A A . 11 LYS CD 1 1 2 842 1 1 11 LYS CE C -0.157 9.687 17.074 1.00 . A A . 11 LYS CE 1 1 2 843 1 1 11 LYS CG C -1.148 7.746 15.665 1.00 . A A . 11 LYS CG 1 1 2 844 1 1 11 LYS H H 0.848 5.887 14.252 1.00 . A A . 11 LYS H 1 1 2 845 1 1 11 LYS HA H -1.732 6.782 12.935 1.00 . A A . 11 LYS HA 1 1 2 846 1 1 11 LYS HB2 H 0.121 8.822 14.218 1.00 . A A . 11 LYS HB2 1 1 2 847 1 1 11 LYS HB3 H -1.580 8.953 13.930 1.00 . A A . 11 LYS HB3 1 1 2 848 1 1 11 LYS HD2 H -2.196 9.547 16.296 1.00 . A A . 11 LYS HD2 1 1 2 849 1 1 11 LYS HD3 H -1.839 8.417 17.596 1.00 . A A . 11 LYS HD3 1 1 2 850 1 1 11 LYS HE2 H 0.628 9.020 17.476 1.00 . A A . 11 LYS HE2 1 1 2 851 1 1 11 LYS HE3 H 0.280 10.180 16.186 1.00 . A A . 11 LYS HE3 1 1 2 852 1 1 11 LYS HG2 H -2.055 7.115 15.610 1.00 . A A . 11 LYS HG2 1 1 2 853 1 1 11 LYS HG3 H -0.353 7.078 16.047 1.00 . A A . 11 LYS HG3 1 1 2 854 1 1 11 LYS HZ1 H -1.148 11.388 17.694 1.00 . A A . 11 LYS HZ1 1 1 2 855 1 1 11 LYS HZ2 H 0.365 11.264 18.301 1.00 . A A . 11 LYS HZ2 1 1 2 856 1 1 11 LYS N N 0.166 5.998 13.492 1.00 . A A . 11 LYS N 1 1 2 857 1 1 11 LYS NZ N -0.474 10.717 18.080 1.00 . A A . 11 LYS NZ 1 1 2 858 1 1 11 LYS O O 1.049 8.288 11.812 1.00 . A A . 11 LYS O 1 1 2 859 1 1 12 CYS C C -1.885 9.511 9.149 1.00 . A A . 12 CYS C 1 1 2 860 1 1 12 CYS CA C -0.754 8.531 9.535 1.00 . A A . 12 CYS CA 1 1 2 861 1 1 12 CYS CB C -0.686 7.389 8.480 1.00 . A A . 12 CYS CB 1 1 2 862 1 1 12 CYS H H -1.913 7.688 11.263 1.00 . A A . 12 CYS H 1 1 2 863 1 1 12 CYS HA H 0.201 9.090 9.525 1.00 . A A . 12 CYS HA 1 1 2 864 1 1 12 CYS HB2 H -0.455 7.776 7.473 1.00 . A A . 12 CYS HB2 1 1 2 865 1 1 12 CYS HB3 H 0.116 6.679 8.691 1.00 . A A . 12 CYS HB3 1 1 2 866 1 1 12 CYS N N -1.002 7.956 10.883 1.00 . A A . 12 CYS N 1 1 2 867 1 1 12 CYS O O -2.877 9.693 9.868 1.00 . A A . 12 CYS O 1 1 2 868 1 1 12 CYS SG S -2.129 6.357 8.369 1.00 . A A . 12 CYS SG 1 1 2 869 1 1 13 THR C C -2.753 10.755 5.825 1.00 . A A . 13 THR C 1 1 2 870 1 1 13 THR CA C -2.842 10.939 7.371 1.00 . A A . 13 THR CA 1 1 2 871 1 1 13 THR CB C -2.811 12.486 7.759 1.00 . A A . 13 THR CB 1 1 2 872 1 1 13 THR CG2 C -1.994 12.887 9.008 1.00 . A A . 13 THR CG2 1 1 2 873 1 1 13 THR H H -0.847 9.878 7.481 1.00 . A A . 13 THR H 1 1 2 874 1 1 13 THR HA H -3.817 10.519 7.713 1.00 . A A . 13 THR HA 1 1 2 875 1 1 13 THR HB H -3.873 12.772 7.871 1.00 . A A . 13 THR HB 1 1 2 876 1 1 13 THR HG1 H -2.321 14.196 7.034 1.00 . A A . 13 THR HG1 1 1 2 877 1 1 13 THR HG21 H -2.350 12.377 9.919 1.00 . A A . 13 THR HG21 1 1 2 878 1 1 13 THR HG22 H -0.918 12.657 8.886 1.00 . A A . 13 THR HG22 1 1 2 879 1 1 13 THR HG23 H -2.060 13.975 9.194 1.00 . A A . 13 THR HG23 1 1 2 880 1 1 13 THR N N -1.722 10.147 7.973 1.00 . A A . 13 THR N 1 1 2 881 1 1 13 THR O O -1.684 10.581 5.223 1.00 . A A . 13 THR O 1 1 2 882 1 1 13 THR OG1 O -2.226 13.287 6.742 1.00 . A A . 13 THR OG1 1 1 2 883 1 1 14 TRP C C -3.796 12.510 3.389 1.00 . A A . 14 TRP C 1 1 2 884 1 1 14 TRP CA C -4.051 11.004 3.713 1.00 . A A . 14 TRP CA 1 1 2 885 1 1 14 TRP CB C -5.442 10.501 3.235 1.00 . A A . 14 TRP CB 1 1 2 886 1 1 14 TRP CD1 C -4.751 7.933 3.374 1.00 . A A . 14 TRP CD1 1 1 2 887 1 1 14 TRP CD2 C -6.935 8.345 3.487 1.00 . A A . 14 TRP CD2 1 1 2 888 1 1 14 TRP CE2 C -6.704 6.946 3.568 1.00 . A A . 14 TRP CE2 1 1 2 889 1 1 14 TRP CE3 C -8.260 8.854 3.525 1.00 . A A . 14 TRP CE3 1 1 2 890 1 1 14 TRP CG C -5.708 8.982 3.371 1.00 . A A . 14 TRP CG 1 1 2 891 1 1 14 TRP CH2 C -9.089 6.571 3.721 1.00 . A A . 14 TRP CH2 1 1 2 892 1 1 14 TRP CZ2 C -7.794 6.050 3.684 1.00 . A A . 14 TRP CZ2 1 1 2 893 1 1 14 TRP CZ3 C -9.317 7.951 3.643 1.00 . A A . 14 TRP CZ3 1 1 2 894 1 1 14 TRP H H -4.711 11.068 5.847 1.00 . A A . 14 TRP H 1 1 2 895 1 1 14 TRP HA H -3.284 10.375 3.217 1.00 . A A . 14 TRP HA 1 1 2 896 1 1 14 TRP HB2 H -6.243 11.065 3.752 1.00 . A A . 14 TRP HB2 1 1 2 897 1 1 14 TRP HB3 H -5.565 10.760 2.166 1.00 . A A . 14 TRP HB3 1 1 2 898 1 1 14 TRP HD1 H -3.684 8.073 3.289 1.00 . A A . 14 TRP HD1 1 1 2 899 1 1 14 TRP HE1 H -4.891 5.752 3.537 1.00 . A A . 14 TRP HE1 1 1 2 900 1 1 14 TRP HE3 H -8.452 9.916 3.464 1.00 . A A . 14 TRP HE3 1 1 2 901 1 1 14 TRP HH2 H -9.929 5.899 3.816 1.00 . A A . 14 TRP HH2 1 1 2 902 1 1 14 TRP HZ2 H -7.632 4.984 3.746 1.00 . A A . 14 TRP HZ2 1 1 2 903 1 1 14 TRP HZ3 H -10.331 8.324 3.677 1.00 . A A . 14 TRP HZ3 1 1 2 904 1 1 14 TRP N N -3.934 10.896 5.197 1.00 . A A . 14 TRP N 1 1 2 905 1 1 14 TRP NE1 N -5.350 6.669 3.509 1.00 . A A . 14 TRP NE1 1 1 2 906 1 1 14 TRP O O -4.652 13.383 3.567 1.00 . A A . 14 TRP O 1 1 2 907 1 1 15 GLY C C -1.063 14.369 4.110 1.00 . A A . 15 GLY C 1 1 2 908 1 1 15 GLY CA C -1.953 14.122 2.858 1.00 . A A . 15 GLY CA 1 1 2 909 1 1 15 GLY H H -1.961 11.926 2.877 1.00 . A A . 15 GLY H 1 1 2 910 1 1 15 GLY HA2 H -1.348 14.187 1.934 1.00 . A A . 15 GLY HA2 1 1 2 911 1 1 15 GLY HA3 H -2.726 14.906 2.772 1.00 . A A . 15 GLY HA3 1 1 2 912 1 1 15 GLY N N -2.545 12.764 2.973 1.00 . A A . 15 GLY N 1 1 2 913 1 1 15 GLY O O -1.336 15.266 4.911 1.00 . A A . 15 GLY O 1 1 2 914 1 1 16 GLY C C 1.976 12.464 5.237 1.00 . A A . 16 GLY C 1 1 2 915 1 1 16 GLY CA C 0.801 13.419 5.481 1.00 . A A . 16 GLY CA 1 1 2 916 1 1 16 GLY H H 0.052 12.848 3.496 1.00 . A A . 16 GLY H 1 1 2 917 1 1 16 GLY HA2 H 1.157 14.357 5.927 1.00 . A A . 16 GLY HA2 1 1 2 918 1 1 16 GLY HA3 H 0.151 12.991 6.269 1.00 . A A . 16 GLY HA3 1 1 2 919 1 1 16 GLY N N -0.024 13.531 4.258 1.00 . A A . 16 GLY N 1 1 2 920 1 1 16 GLY O O 2.460 12.269 4.114 1.00 . A A . 16 GLY O 1 1 2 921 1 1 17 THR C C 2.525 9.428 5.978 1.00 . A A . 17 THR C 1 1 2 922 1 1 17 THR CA C 3.380 10.711 6.274 1.00 . A A . 17 THR CA 1 1 2 923 1 1 17 THR CB C 4.215 10.480 7.598 1.00 . A A . 17 THR CB 1 1 2 924 1 1 17 THR CG2 C 5.597 9.878 7.281 1.00 . A A . 17 THR CG2 1 1 2 925 1 1 17 THR H H 1.984 12.253 7.184 1.00 . A A . 17 THR H 1 1 2 926 1 1 17 THR HA H 4.093 10.920 5.447 1.00 . A A . 17 THR HA 1 1 2 927 1 1 17 THR HB H 3.715 9.744 8.263 1.00 . A A . 17 THR HB 1 1 2 928 1 1 17 THR HG1 H 4.956 11.497 9.056 1.00 . A A . 17 THR HG1 1 1 2 929 1 1 17 THR HG21 H 5.527 8.930 6.718 1.00 . A A . 17 THR HG21 1 1 2 930 1 1 17 THR HG22 H 6.245 10.555 6.697 1.00 . A A . 17 THR HG22 1 1 2 931 1 1 17 THR HG23 H 6.131 9.632 8.216 1.00 . A A . 17 THR HG23 1 1 2 932 1 1 17 THR N N 2.410 11.847 6.343 1.00 . A A . 17 THR N 1 1 2 933 1 1 17 THR O O 1.437 9.195 6.535 1.00 . A A . 17 THR O 1 1 2 934 1 1 17 THR OG1 O 4.441 11.714 8.276 1.00 . A A . 17 THR OG1 1 1 2 935 1 1 18 LYS C C 3.606 6.296 5.567 1.00 . A A . 18 LYS C 1 1 2 936 1 1 18 LYS CA C 2.668 7.238 4.774 1.00 . A A . 18 LYS CA 1 1 2 937 1 1 18 LYS CB C 2.700 6.937 3.241 1.00 . A A . 18 LYS CB 1 1 2 938 1 1 18 LYS CD C 0.766 8.439 2.377 1.00 . A A . 18 LYS CD 1 1 2 939 1 1 18 LYS CE C 0.363 9.534 1.374 1.00 . A A . 18 LYS CE 1 1 2 940 1 1 18 LYS CG C 2.244 8.018 2.230 1.00 . A A . 18 LYS CG 1 1 2 941 1 1 18 LYS H H 4.051 8.949 4.819 1.00 . A A . 18 LYS H 1 1 2 942 1 1 18 LYS HA H 1.634 7.026 5.098 1.00 . A A . 18 LYS HA 1 1 2 943 1 1 18 LYS HB2 H 3.697 6.545 2.979 1.00 . A A . 18 LYS HB2 1 1 2 944 1 1 18 LYS HB3 H 2.062 6.049 3.068 1.00 . A A . 18 LYS HB3 1 1 2 945 1 1 18 LYS HD2 H 0.120 7.549 2.245 1.00 . A A . 18 LYS HD2 1 1 2 946 1 1 18 LYS HD3 H 0.581 8.798 3.407 1.00 . A A . 18 LYS HD3 1 1 2 947 1 1 18 LYS HE2 H 0.973 10.443 1.531 1.00 . A A . 18 LYS HE2 1 1 2 948 1 1 18 LYS HE3 H 0.557 9.202 0.337 1.00 . A A . 18 LYS HE3 1 1 2 949 1 1 18 LYS HG2 H 2.901 8.904 2.314 1.00 . A A . 18 LYS HG2 1 1 2 950 1 1 18 LYS HG3 H 2.410 7.632 1.207 1.00 . A A . 18 LYS HG3 1 1 2 951 1 1 18 LYS HZ1 H -1.300 10.639 0.852 1.00 . A A . 18 LYS HZ1 1 1 2 952 1 1 18 LYS HZ2 H -1.246 10.260 2.441 1.00 . A A . 18 LYS HZ2 1 1 2 953 1 1 18 LYS N N 3.113 8.626 5.078 1.00 . A A . 18 LYS N 1 1 2 954 1 1 18 LYS NZ N -1.061 9.884 1.505 1.00 . A A . 18 LYS NZ 1 1 2 955 1 1 18 LYS O O 4.562 6.677 6.274 1.00 . A A . 18 LYS O 1 1 2 956 1 1 19 CYS C C 5.147 3.460 5.521 1.00 . A A . 19 CYS C 1 1 2 957 1 1 19 CYS CA C 3.924 4.007 6.325 1.00 . A A . 19 CYS CA 1 1 2 958 1 1 19 CYS CB C 2.845 3.008 6.764 1.00 . A A . 19 CYS CB 1 1 2 959 1 1 19 CYS H H 2.578 4.810 4.714 1.00 . A A . 19 CYS H 1 1 2 960 1 1 19 CYS HA H 4.234 4.532 7.256 1.00 . A A . 19 CYS HA 1 1 2 961 1 1 19 CYS HB2 H 2.515 2.414 5.926 1.00 . A A . 19 CYS HB2 1 1 2 962 1 1 19 CYS HB3 H 3.242 2.327 7.549 1.00 . A A . 19 CYS HB3 1 1 2 963 1 1 19 CYS N N 3.287 5.005 5.446 1.00 . A A . 19 CYS N 1 1 2 964 1 1 19 CYS O O 5.073 2.805 4.482 1.00 . A A . 19 CYS O 1 1 2 965 1 1 19 CYS SG S 1.422 3.949 7.378 1.00 . A A . 19 CYS SG 1 1 2 966 1 1 20 CYS C C 7.945 3.356 4.204 1.00 . A A . 20 CYS C 1 1 2 967 1 1 20 CYS CA C 7.678 3.967 5.634 1.00 . A A . 20 CYS CA 1 1 2 968 1 1 20 CYS CB C 8.485 3.289 6.769 1.00 . A A . 20 CYS CB 1 1 2 969 1 1 20 CYS H H 6.038 4.396 6.969 1.00 . A A . 20 CYS H 1 1 2 970 1 1 20 CYS HA H 7.902 5.028 5.688 1.00 . A A . 20 CYS HA 1 1 2 971 1 1 20 CYS HB2 H 8.136 3.641 7.749 1.00 . A A . 20 CYS HB2 1 1 2 972 1 1 20 CYS HB3 H 8.432 2.188 6.760 1.00 . A A . 20 CYS HB3 1 1 2 973 1 1 20 CYS N N 6.265 3.930 6.083 1.00 . A A . 20 CYS N 1 1 2 974 1 1 20 CYS O O 7.458 3.948 3.236 1.00 . A A . 20 CYS O 1 1 2 975 1 1 20 CYS SG S 10.188 3.870 6.704 1.00 . A A . 20 CYS SG 1 1 2 976 1 1 21 ARG C C 8.358 0.652 2.060 1.00 . A A . 21 ARG C 1 1 2 977 1 1 21 ARG CA C 9.215 1.788 2.696 1.00 . A A . 21 ARG CA 1 1 2 978 1 1 21 ARG CB C 10.704 1.363 2.908 1.00 . A A . 21 ARG CB 1 1 2 979 1 1 21 ARG CD C 12.494 -0.241 3.931 1.00 . A A . 21 ARG CD 1 1 2 980 1 1 21 ARG CG C 11.001 0.128 3.802 1.00 . A A . 21 ARG CG 1 1 2 981 1 1 21 ARG CZ C 13.426 0.761 6.063 1.00 . A A . 21 ARG CZ 1 1 2 982 1 1 21 ARG H H 9.006 1.803 4.892 1.00 . A A . 21 ARG H 1 1 2 983 1 1 21 ARG HA H 9.125 2.606 1.971 1.00 . A A . 21 ARG HA 1 1 2 984 1 1 21 ARG HB2 H 11.147 1.177 1.911 1.00 . A A . 21 ARG HB2 1 1 2 985 1 1 21 ARG HB3 H 11.278 2.231 3.289 1.00 . A A . 21 ARG HB3 1 1 2 986 1 1 21 ARG HD2 H 12.586 -1.266 4.338 1.00 . A A . 21 ARG HD2 1 1 2 987 1 1 21 ARG HD3 H 12.965 -0.287 2.931 1.00 . A A . 21 ARG HD3 1 1 2 988 1 1 21 ARG HG2 H 10.560 0.265 4.807 1.00 . A A . 21 ARG HG2 1 1 2 989 1 1 21 ARG HG3 H 10.478 -0.746 3.378 1.00 . A A . 21 ARG HG3 1 1 2 990 1 1 21 ARG HH11 H 12.285 -0.841 6.478 1.00 . A A . 21 ARG HH11 1 1 2 991 1 1 21 ARG HH12 H 13.069 0.019 7.897 1.00 . A A . 21 ARG HH12 1 1 2 992 1 1 21 ARG HH21 H 14.603 2.371 5.895 1.00 . A A . 21 ARG HH21 1 1 2 993 1 1 21 ARG HH22 H 14.299 1.723 7.585 1.00 . A A . 21 ARG HH22 1 1 2 994 1 1 21 ARG N N 8.749 2.281 4.034 1.00 . A A . 21 ARG N 1 1 2 995 1 1 21 ARG NE N 13.261 0.715 4.798 1.00 . A A . 21 ARG NE 1 1 2 996 1 1 21 ARG NH1 N 12.870 -0.110 6.899 1.00 . A A . 21 ARG NH1 1 1 2 997 1 1 21 ARG NH2 N 14.185 1.717 6.565 1.00 . A A . 21 ARG NH2 1 1 2 998 1 1 21 ARG O O 8.848 -0.136 1.244 1.00 . A A . 21 ARG O 1 1 2 999 1 1 22 GLY C C 4.677 -0.472 2.275 1.00 . A A . 22 GLY C 1 1 2 1000 1 1 22 GLY CA C 6.077 -0.219 1.693 1.00 . A A . 22 GLY CA 1 1 2 1001 1 1 22 GLY H H 6.958 1.390 3.092 1.00 . A A . 22 GLY H 1 1 2 1002 1 1 22 GLY HA2 H 5.939 0.161 0.666 1.00 . A A . 22 GLY HA2 1 1 2 1003 1 1 22 GLY HA3 H 6.518 -1.220 1.590 1.00 . A A . 22 GLY HA3 1 1 2 1004 1 1 22 GLY N N 7.069 0.653 2.378 1.00 . A A . 22 GLY N 1 1 2 1005 1 1 22 GLY O O 3.956 -1.310 1.726 1.00 . A A . 22 GLY O 1 1 2 1006 1 1 23 ARG C C 1.978 1.101 3.604 1.00 . A A . 23 ARG C 1 1 2 1007 1 1 23 ARG CA C 3.014 -0.010 4.053 1.00 . A A . 23 ARG CA 1 1 2 1008 1 1 23 ARG CB C 3.262 0.048 5.588 1.00 . A A . 23 ARG CB 1 1 2 1009 1 1 23 ARG CD C 4.896 -1.999 5.893 1.00 . A A . 23 ARG CD 1 1 2 1010 1 1 23 ARG CG C 3.699 -1.178 6.402 1.00 . A A . 23 ARG CG 1 1 2 1011 1 1 23 ARG CZ C 7.131 -1.262 6.828 1.00 . A A . 23 ARG CZ 1 1 2 1012 1 1 23 ARG H H 4.965 0.918 3.671 1.00 . A A . 23 ARG H 1 1 2 1013 1 1 23 ARG HA H 2.618 -1.016 3.838 1.00 . A A . 23 ARG HA 1 1 2 1014 1 1 23 ARG HB2 H 3.994 0.841 5.820 1.00 . A A . 23 ARG HB2 1 1 2 1015 1 1 23 ARG HB3 H 2.316 0.345 6.080 1.00 . A A . 23 ARG HB3 1 1 2 1016 1 1 23 ARG HD2 H 4.967 -2.945 6.463 1.00 . A A . 23 ARG HD2 1 1 2 1017 1 1 23 ARG HD3 H 4.713 -2.304 4.850 1.00 . A A . 23 ARG HD3 1 1 2 1018 1 1 23 ARG HG2 H 3.898 -0.821 7.435 1.00 . A A . 23 ARG HG2 1 1 2 1019 1 1 23 ARG HG3 H 2.822 -1.836 6.501 1.00 . A A . 23 ARG HG3 1 1 2 1020 1 1 23 ARG HH11 H 6.245 -2.557 8.085 1.00 . A A . 23 ARG HH11 1 1 2 1021 1 1 23 ARG HH12 H 7.897 -1.920 8.565 1.00 . A A . 23 ARG HH12 1 1 2 1022 1 1 23 ARG HH21 H 8.205 0.026 5.737 1.00 . A A . 23 ARG HH21 1 1 2 1023 1 1 23 ARG HH22 H 8.936 -0.551 7.318 1.00 . A A . 23 ARG HH22 1 1 2 1024 1 1 23 ARG N N 4.291 0.218 3.349 1.00 . A A . 23 ARG N 1 1 2 1025 1 1 23 ARG NE N 6.196 -1.253 5.962 1.00 . A A . 23 ARG NE 1 1 2 1026 1 1 23 ARG NH1 N 7.086 -1.987 7.940 1.00 . A A . 23 ARG NH1 1 1 2 1027 1 1 23 ARG NH2 N 8.198 -0.520 6.606 1.00 . A A . 23 ARG NH2 1 1 2 1028 1 1 23 ARG O O 2.270 2.314 3.699 1.00 . A A . 23 ARG O 1 1 2 1029 1 1 24 PRO C C -1.051 2.122 4.253 1.00 . A A . 24 PRO C 1 1 2 1030 1 1 24 PRO CA C -0.356 1.708 2.912 1.00 . A A . 24 PRO CA 1 1 2 1031 1 1 24 PRO CB C -1.254 0.945 1.913 1.00 . A A . 24 PRO CB 1 1 2 1032 1 1 24 PRO CD C 0.355 -0.649 2.780 1.00 . A A . 24 PRO CD 1 1 2 1033 1 1 24 PRO CG C -1.075 -0.538 2.246 1.00 . A A . 24 PRO CG 1 1 2 1034 1 1 24 PRO HA H 0.001 2.644 2.442 1.00 . A A . 24 PRO HA 1 1 2 1035 1 1 24 PRO HB2 H -2.316 1.253 1.939 1.00 . A A . 24 PRO HB2 1 1 2 1036 1 1 24 PRO HB3 H -0.905 1.135 0.880 1.00 . A A . 24 PRO HB3 1 1 2 1037 1 1 24 PRO HD2 H 0.393 -1.324 3.656 1.00 . A A . 24 PRO HD2 1 1 2 1038 1 1 24 PRO HD3 H 1.030 -1.060 2.006 1.00 . A A . 24 PRO HD3 1 1 2 1039 1 1 24 PRO HG2 H -1.799 -0.845 3.022 1.00 . A A . 24 PRO HG2 1 1 2 1040 1 1 24 PRO HG3 H -1.250 -1.189 1.370 1.00 . A A . 24 PRO HG3 1 1 2 1041 1 1 24 PRO N N 0.747 0.737 3.126 1.00 . A A . 24 PRO N 1 1 2 1042 1 1 24 PRO O O -0.617 1.733 5.344 1.00 . A A . 24 PRO O 1 1 2 1043 1 1 25 CYS C C -4.433 3.150 5.049 1.00 . A A . 25 CYS C 1 1 2 1044 1 1 25 CYS CA C -2.915 3.339 5.352 1.00 . A A . 25 CYS CA 1 1 2 1045 1 1 25 CYS CB C -2.601 4.814 5.722 1.00 . A A . 25 CYS CB 1 1 2 1046 1 1 25 CYS H H -2.346 3.227 3.207 1.00 . A A . 25 CYS H 1 1 2 1047 1 1 25 CYS HA H -2.647 2.709 6.225 1.00 . A A . 25 CYS HA 1 1 2 1048 1 1 25 CYS HB2 H -2.077 5.327 4.903 1.00 . A A . 25 CYS HB2 1 1 2 1049 1 1 25 CYS HB3 H -3.522 5.368 5.955 1.00 . A A . 25 CYS HB3 1 1 2 1050 1 1 25 CYS N N -2.119 2.929 4.162 1.00 . A A . 25 CYS N 1 1 2 1051 1 1 25 CYS O O -4.932 3.348 3.935 1.00 . A A . 25 CYS O 1 1 2 1052 1 1 25 CYS SG S -1.576 4.851 7.181 1.00 . A A . 25 CYS SG 1 1 2 1053 1 1 26 ARG C C -6.974 3.465 7.494 1.00 . A A . 26 ARG C 1 1 2 1054 1 1 26 ARG CA C -6.626 2.717 6.182 1.00 . A A . 26 ARG CA 1 1 2 1055 1 1 26 ARG CB C -7.142 1.255 6.180 1.00 . A A . 26 ARG CB 1 1 2 1056 1 1 26 ARG CD C -9.118 -0.367 6.029 1.00 . A A . 26 ARG CD 1 1 2 1057 1 1 26 ARG CG C -8.673 1.106 6.051 1.00 . A A . 26 ARG CG 1 1 2 1058 1 1 26 ARG CZ C -11.271 -1.643 5.928 1.00 . A A . 26 ARG CZ 1 1 2 1059 1 1 26 ARG H H -4.619 2.806 7.005 1.00 . A A . 26 ARG H 1 1 2 1060 1 1 26 ARG HA H -7.058 3.241 5.304 1.00 . A A . 26 ARG HA 1 1 2 1061 1 1 26 ARG HB2 H -6.672 0.710 5.338 1.00 . A A . 26 ARG HB2 1 1 2 1062 1 1 26 ARG HB3 H -6.798 0.732 7.094 1.00 . A A . 26 ARG HB3 1 1 2 1063 1 1 26 ARG HD2 H -8.646 -0.892 5.176 1.00 . A A . 26 ARG HD2 1 1 2 1064 1 1 26 ARG HD3 H -8.765 -0.879 6.945 1.00 . A A . 26 ARG HD3 1 1 2 1065 1 1 26 ARG HG2 H -9.167 1.632 6.890 1.00 . A A . 26 ARG HG2 1 1 2 1066 1 1 26 ARG HG3 H -9.015 1.616 5.129 1.00 . A A . 26 ARG HG3 1 1 2 1067 1 1 26 ARG HH11 H -9.671 -2.855 6.082 1.00 . A A . 26 ARG HH11 1 1 2 1068 1 1 26 ARG HH12 H -11.321 -3.655 6.003 1.00 . A A . 26 ARG HH12 1 1 2 1069 1 1 26 ARG HH21 H -13.009 -0.661 5.775 1.00 . A A . 26 ARG HH21 1 1 2 1070 1 1 26 ARG HH22 H -13.082 -2.494 5.840 1.00 . A A . 26 ARG HH22 1 1 2 1071 1 1 26 ARG N N -5.146 2.767 6.121 1.00 . A A . 26 ARG N 1 1 2 1072 1 1 26 ARG NE N -10.593 -0.480 5.930 1.00 . A A . 26 ARG NE 1 1 2 1073 1 1 26 ARG NH1 N -10.695 -2.842 6.013 1.00 . A A . 26 ARG NH1 1 1 2 1074 1 1 26 ARG NH2 N -12.588 -1.594 5.838 1.00 . A A . 26 ARG NH2 1 1 2 1075 1 1 26 ARG O O -6.411 3.180 8.565 1.00 . A A . 26 ARG O 1 1 2 1076 1 1 27 CYS C C -8.915 4.734 9.723 1.00 . A A . 27 CYS C 1 1 2 1077 1 1 27 CYS CA C -8.080 5.370 8.561 1.00 . A A . 27 CYS CA 1 1 2 1078 1 1 27 CYS CB C -8.801 6.642 8.064 1.00 . A A . 27 CYS CB 1 1 2 1079 1 1 27 CYS H H -8.278 4.627 6.486 1.00 . A A . 27 CYS H 1 1 2 1080 1 1 27 CYS HA H -7.055 5.632 8.867 1.00 . A A . 27 CYS HA 1 1 2 1081 1 1 27 CYS HB2 H -9.816 6.427 7.750 1.00 . A A . 27 CYS HB2 1 1 2 1082 1 1 27 CYS HB3 H -8.914 7.374 8.885 1.00 . A A . 27 CYS HB3 1 1 2 1083 1 1 27 CYS N N -7.886 4.450 7.418 1.00 . A A . 27 CYS N 1 1 2 1084 1 1 27 CYS O O -9.562 3.689 9.596 1.00 . A A . 27 CYS O 1 1 2 1085 1 1 27 CYS SG S -7.879 7.455 6.757 1.00 . A A . 27 CYS SG 1 1 2 1086 1 1 28 SER C C -11.229 5.163 11.866 1.00 . A A . 28 SER C 1 1 2 1087 1 1 28 SER CA C -9.678 5.139 12.092 1.00 . A A . 28 SER CA 1 1 2 1088 1 1 28 SER CB C -9.208 6.203 13.130 1.00 . A A . 28 SER CB 1 1 2 1089 1 1 28 SER H H -8.294 6.282 10.817 1.00 . A A . 28 SER H 1 1 2 1090 1 1 28 SER HA H -9.441 4.126 12.470 1.00 . A A . 28 SER HA 1 1 2 1091 1 1 28 SER HB2 H -9.230 7.229 12.712 1.00 . A A . 28 SER HB2 1 1 2 1092 1 1 28 SER HB3 H -9.861 6.261 14.017 1.00 . A A . 28 SER HB3 1 1 2 1093 1 1 28 SER HG H -7.334 5.898 12.829 1.00 . A A . 28 SER HG 1 1 2 1094 1 1 28 SER N N -8.885 5.445 10.868 1.00 . A A . 28 SER N 1 1 2 1095 1 1 28 SER O O -11.748 5.422 10.774 1.00 . A A . 28 SER O 1 1 2 1096 1 1 28 SER OG O -7.903 5.891 13.602 1.00 . A A . 28 SER OG 1 1 2 1097 1 1 29 MET C C -14.207 6.072 12.664 1.00 . A A . 29 MET C 1 1 2 1098 1 1 29 MET CA C -13.445 4.745 12.983 1.00 . A A . 29 MET CA 1 1 2 1099 1 1 29 MET CB C -13.840 4.274 14.413 1.00 . A A . 29 MET CB 1 1 2 1100 1 1 29 MET CE C -12.085 0.507 14.929 1.00 . A A . 29 MET CE 1 1 2 1101 1 1 29 MET CG C -13.689 2.765 14.680 1.00 . A A . 29 MET CG 1 1 2 1102 1 1 29 MET H H -11.396 4.827 13.810 1.00 . A A . 29 MET H 1 1 2 1103 1 1 29 MET HA H -13.770 3.996 12.235 1.00 . A A . 29 MET HA 1 1 2 1104 1 1 29 MET HB2 H -13.298 4.845 15.192 1.00 . A A . 29 MET HB2 1 1 2 1105 1 1 29 MET HB3 H -14.897 4.536 14.592 1.00 . A A . 29 MET HB3 1 1 2 1106 1 1 29 MET HE1 H -12.692 0.234 15.811 1.00 . A A . 29 MET HE1 1 1 2 1107 1 1 29 MET HE2 H -12.558 0.069 14.032 1.00 . A A . 29 MET HE2 1 1 2 1108 1 1 29 MET HE3 H -11.086 0.050 15.046 1.00 . A A . 29 MET HE3 1 1 2 1109 1 1 29 MET HG2 H -14.175 2.502 15.638 1.00 . A A . 29 MET HG2 1 1 2 1110 1 1 29 MET HG3 H -14.200 2.174 13.897 1.00 . A A . 29 MET HG3 1 1 2 1111 1 1 29 MET N N -11.954 4.861 12.955 1.00 . A A . 29 MET N 1 1 2 1112 1 1 29 MET O O -15.297 6.015 12.088 1.00 . A A . 29 MET O 1 1 2 1113 1 1 29 MET SD S -11.946 2.298 14.770 1.00 . A A . 29 MET SD 1 1 2 1114 1 1 30 ILE C C -13.977 8.879 11.187 1.00 . A A . 30 ILE C 1 1 2 1115 1 1 30 ILE CA C -14.219 8.574 12.708 1.00 . A A . 30 ILE CA 1 1 2 1116 1 1 30 ILE CB C -13.568 9.661 13.660 1.00 . A A . 30 ILE CB 1 1 2 1117 1 1 30 ILE CD1 C -15.202 9.128 15.710 1.00 . A A . 30 ILE CD1 1 1 2 1118 1 1 30 ILE CG1 C -13.770 9.353 15.184 1.00 . A A . 30 ILE CG1 1 1 2 1119 1 1 30 ILE CG2 C -14.186 11.057 13.372 1.00 . A A . 30 ILE CG2 1 1 2 1120 1 1 30 ILE H H -12.685 7.091 13.383 1.00 . A A . 30 ILE H 1 1 2 1121 1 1 30 ILE HA H -15.310 8.553 12.872 1.00 . A A . 30 ILE HA 1 1 2 1122 1 1 30 ILE HB H -12.477 9.721 13.479 1.00 . A A . 30 ILE HB 1 1 2 1123 1 1 30 ILE HD11 H -15.847 10.010 15.547 1.00 . A A . 30 ILE HD11 1 1 2 1124 1 1 30 ILE HD12 H -15.687 8.262 15.225 1.00 . A A . 30 ILE HD12 1 1 2 1125 1 1 30 ILE HD13 H -15.195 8.928 16.797 1.00 . A A . 30 ILE HD13 1 1 2 1126 1 1 30 ILE HG12 H -13.171 8.462 15.448 1.00 . A A . 30 ILE HG12 1 1 2 1127 1 1 30 ILE HG13 H -13.307 10.162 15.780 1.00 . A A . 30 ILE HG13 1 1 2 1128 1 1 30 ILE HG21 H -15.288 11.064 13.474 1.00 . A A . 30 ILE HG21 1 1 2 1129 1 1 30 ILE HG22 H -13.788 11.832 14.053 1.00 . A A . 30 ILE HG22 1 1 2 1130 1 1 30 ILE HG23 H -13.955 11.404 12.348 1.00 . A A . 30 ILE HG23 1 1 2 1131 1 1 30 ILE N N -13.641 7.235 13.031 1.00 . A A . 30 ILE N 1 1 2 1132 1 1 30 ILE O O -14.947 9.101 10.457 1.00 . A A . 30 ILE O 1 1 2 1133 1 1 31 GLY C C -10.997 10.084 9.335 1.00 . A A . 31 GLY C 1 1 2 1134 1 1 31 GLY CA C -12.337 9.328 9.371 1.00 . A A . 31 GLY CA 1 1 2 1135 1 1 31 GLY H H -12.035 8.769 11.502 1.00 . A A . 31 GLY H 1 1 2 1136 1 1 31 GLY HA2 H -12.263 8.433 8.727 1.00 . A A . 31 GLY HA2 1 1 2 1137 1 1 31 GLY HA3 H -13.119 9.965 8.912 1.00 . A A . 31 GLY HA3 1 1 2 1138 1 1 31 GLY N N -12.711 8.893 10.739 1.00 . A A . 31 GLY N 1 1 2 1139 1 1 31 GLY O O -10.084 9.698 8.601 1.00 . A A . 31 GLY O 1 1 2 1140 1 1 32 THR C C -8.815 11.100 11.502 1.00 . A A . 32 THR C 1 1 2 1141 1 1 32 THR CA C -9.606 11.864 10.391 1.00 . A A . 32 THR CA 1 1 2 1142 1 1 32 THR CB C -9.847 13.341 10.847 1.00 . A A . 32 THR CB 1 1 2 1143 1 1 32 THR CG2 C -10.472 14.209 9.738 1.00 . A A . 32 THR CG2 1 1 2 1144 1 1 32 THR H H -11.689 11.222 10.788 1.00 . A A . 32 THR H 1 1 2 1145 1 1 32 THR HA H -9.003 11.880 9.459 1.00 . A A . 32 THR HA 1 1 2 1146 1 1 32 THR HB H -8.862 13.767 11.124 1.00 . A A . 32 THR HB 1 1 2 1147 1 1 32 THR HG1 H -11.563 13.022 11.665 1.00 . A A . 32 THR HG1 1 1 2 1148 1 1 32 THR HG21 H -9.845 14.219 8.827 1.00 . A A . 32 THR HG21 1 1 2 1149 1 1 32 THR HG22 H -11.478 13.855 9.444 1.00 . A A . 32 THR HG22 1 1 2 1150 1 1 32 THR HG23 H -10.580 15.259 10.067 1.00 . A A . 32 THR HG23 1 1 2 1151 1 1 32 THR N N -10.897 11.158 10.138 1.00 . A A . 32 THR N 1 1 2 1152 1 1 32 THR O O -9.373 10.313 12.278 1.00 . A A . 32 THR O 1 1 2 1153 1 1 32 THR OG1 O -10.730 13.389 11.968 1.00 . A A . 32 THR OG1 1 1 2 1154 1 1 33 ASN C C -6.417 9.118 11.816 1.00 . A A . 33 ASN C 1 1 2 1155 1 1 33 ASN CA C -6.477 10.583 12.347 1.00 . A A . 33 ASN CA 1 1 2 1156 1 1 33 ASN CB C -6.817 10.620 13.880 1.00 . A A . 33 ASN CB 1 1 2 1157 1 1 33 ASN CG C -6.492 11.958 14.571 1.00 . A A . 33 ASN CG 1 1 2 1158 1 1 33 ASN H H -7.161 11.909 10.741 1.00 . A A . 33 ASN H 1 1 2 1159 1 1 33 ASN HA H -5.481 11.041 12.190 1.00 . A A . 33 ASN HA 1 1 2 1160 1 1 33 ASN HB2 H -7.859 10.323 14.094 1.00 . A A . 33 ASN HB2 1 1 2 1161 1 1 33 ASN HB3 H -6.249 9.825 14.402 1.00 . A A . 33 ASN HB3 1 1 2 1162 1 1 33 ASN HD21 H -8.387 12.574 14.337 1.00 . A A . 33 ASN HD21 1 1 2 1163 1 1 33 ASN HD22 H -7.226 13.729 15.165 1.00 . A A . 33 ASN HD22 1 1 2 1164 1 1 33 ASN N N -7.484 11.340 11.531 1.00 . A A . 33 ASN N 1 1 2 1165 1 1 33 ASN ND2 N -7.470 12.841 14.712 1.00 . A A . 33 ASN ND2 1 1 2 1166 1 1 33 ASN O O -6.818 8.169 12.494 1.00 . A A . 33 ASN O 1 1 2 1167 1 1 33 ASN OD1 O -5.359 12.205 14.983 1.00 . A A . 33 ASN OD1 1 1 2 1168 1 1 34 CYS C C -4.689 6.721 10.647 1.00 . A A . 34 CYS C 1 1 2 1169 1 1 34 CYS CA C -5.773 7.603 9.950 1.00 . A A . 34 CYS CA 1 1 2 1170 1 1 34 CYS CB C -5.407 7.783 8.459 1.00 . A A . 34 CYS CB 1 1 2 1171 1 1 34 CYS H H -5.732 9.833 10.090 1.00 . A A . 34 CYS H 1 1 2 1172 1 1 34 CYS HA H -6.758 7.117 10.014 1.00 . A A . 34 CYS HA 1 1 2 1173 1 1 34 CYS HB2 H -4.416 8.217 8.363 1.00 . A A . 34 CYS HB2 1 1 2 1174 1 1 34 CYS HB3 H -5.349 6.799 7.958 1.00 . A A . 34 CYS HB3 1 1 2 1175 1 1 34 CYS N N -5.883 8.946 10.589 1.00 . A A . 34 CYS N 1 1 2 1176 1 1 34 CYS O O -3.882 7.227 11.437 1.00 . A A . 34 CYS O 1 1 2 1177 1 1 34 CYS SG S -6.663 8.760 7.628 1.00 . A A . 34 CYS SG 1 1 2 1178 1 1 35 GLU C C -3.004 3.616 9.703 1.00 . A A . 35 GLU C 1 1 2 1179 1 1 35 GLU CA C -3.549 4.527 10.855 1.00 . A A . 35 GLU CA 1 1 2 1180 1 1 35 GLU CB C -3.987 3.609 12.039 1.00 . A A . 35 GLU CB 1 1 2 1181 1 1 35 GLU CD C -5.197 3.135 14.234 1.00 . A A . 35 GLU CD 1 1 2 1182 1 1 35 GLU CG C -4.962 4.145 13.108 1.00 . A A . 35 GLU CG 1 1 2 1183 1 1 35 GLU H H -5.402 5.108 9.687 1.00 . A A . 35 GLU H 1 1 2 1184 1 1 35 GLU HA H -2.719 5.166 11.205 1.00 . A A . 35 GLU HA 1 1 2 1185 1 1 35 GLU HB2 H -4.292 2.622 11.654 1.00 . A A . 35 GLU HB2 1 1 2 1186 1 1 35 GLU HB3 H -3.053 3.361 12.579 1.00 . A A . 35 GLU HB3 1 1 2 1187 1 1 35 GLU HE2 H -6.476 1.760 14.745 1.00 . A A . 35 GLU HE2 1 1 2 1188 1 1 35 GLU HG2 H -4.563 5.084 13.538 1.00 . A A . 35 GLU HG2 1 1 2 1189 1 1 35 GLU HG3 H -5.926 4.416 12.640 1.00 . A A . 35 GLU HG3 1 1 2 1190 1 1 35 GLU N N -4.673 5.397 10.363 1.00 . A A . 35 GLU N 1 1 2 1191 1 1 35 GLU O O -3.556 3.513 8.606 1.00 . A A . 35 GLU O 1 1 2 1192 1 1 35 GLU OE1 O -4.440 3.007 15.196 1.00 . A A . 35 GLU OE1 1 1 2 1193 1 1 35 GLU OE2 O -6.334 2.394 14.038 1.00 . A A . 35 GLU OE2 1 1 2 1194 1 1 36 CYS C C -1.640 0.718 8.945 1.00 . A A . 36 CYS C 1 1 2 1195 1 1 36 CYS CA C -1.054 2.157 9.050 1.00 . A A . 36 CYS CA 1 1 2 1196 1 1 36 CYS CB C 0.438 2.143 9.559 1.00 . A A . 36 CYS CB 1 1 2 1197 1 1 36 CYS H H -1.679 3.041 11.016 1.00 . A A . 36 CYS H 1 1 2 1198 1 1 36 CYS HA H -1.093 2.647 8.044 1.00 . A A . 36 CYS HA 1 1 2 1199 1 1 36 CYS HB2 H 0.520 1.745 10.577 1.00 . A A . 36 CYS HB2 1 1 2 1200 1 1 36 CYS HB3 H 1.098 1.456 9.008 1.00 . A A . 36 CYS HB3 1 1 2 1201 1 1 36 CYS N N -1.872 2.955 10.011 1.00 . A A . 36 CYS N 1 1 2 1202 1 1 36 CYS O O -2.454 0.273 9.764 1.00 . A A . 36 CYS O 1 1 2 1203 1 1 36 CYS SG S 1.184 3.743 9.331 1.00 . A A . 36 CYS SG 1 1 2 1204 1 1 37 THR C C -0.615 -2.262 7.048 1.00 . A A . 37 THR C 1 1 2 1205 1 1 37 THR CA C -1.775 -1.369 7.607 1.00 . A A . 37 THR CA 1 1 2 1206 1 1 37 THR CB C -2.949 -1.356 6.566 1.00 . A A . 37 THR CB 1 1 2 1207 1 1 37 THR CG2 C -4.248 -0.792 7.167 1.00 . A A . 37 THR CG2 1 1 2 1208 1 1 37 THR H H -0.616 0.491 7.241 1.00 . A A . 37 THR H 1 1 2 1209 1 1 37 THR HA H -2.140 -1.811 8.555 1.00 . A A . 37 THR HA 1 1 2 1210 1 1 37 THR HB H -3.135 -2.398 6.243 1.00 . A A . 37 THR HB 1 1 2 1211 1 1 37 THR HG1 H -3.376 -0.608 4.844 1.00 . A A . 37 THR HG1 1 1 2 1212 1 1 37 THR HG21 H -4.551 -1.341 8.078 1.00 . A A . 37 THR HG21 1 1 2 1213 1 1 37 THR HG22 H -4.158 0.277 7.437 1.00 . A A . 37 THR HG22 1 1 2 1214 1 1 37 THR HG23 H -5.081 -0.879 6.447 1.00 . A A . 37 THR HG23 1 1 2 1215 1 1 37 THR N N -1.258 0.005 7.877 1.00 . A A . 37 THR N 1 1 2 1216 1 1 37 THR O O 0.224 -1.763 6.287 1.00 . A A . 37 THR O 1 1 2 1217 1 1 37 THR OG1 O -2.623 -0.550 5.436 1.00 . A A . 37 THR OG1 1 1 2 1218 1 1 38 PRO C C 0.357 -4.712 5.219 1.00 . A A . 38 PRO C 1 1 2 1219 1 1 38 PRO CA C 0.443 -4.535 6.772 1.00 . A A . 38 PRO CA 1 1 2 1220 1 1 38 PRO CB C 0.159 -5.836 7.557 1.00 . A A . 38 PRO CB 1 1 2 1221 1 1 38 PRO CD C -1.499 -4.267 8.276 1.00 . A A . 38 PRO CD 1 1 2 1222 1 1 38 PRO CG C -1.295 -5.754 8.016 1.00 . A A . 38 PRO CG 1 1 2 1223 1 1 38 PRO HA H 1.465 -4.169 6.990 1.00 . A A . 38 PRO HA 1 1 2 1224 1 1 38 PRO HB2 H 0.344 -6.760 6.986 1.00 . A A . 38 PRO HB2 1 1 2 1225 1 1 38 PRO HB3 H 0.821 -5.887 8.442 1.00 . A A . 38 PRO HB3 1 1 2 1226 1 1 38 PRO HD2 H -2.548 -3.966 8.122 1.00 . A A . 38 PRO HD2 1 1 2 1227 1 1 38 PRO HD3 H -1.248 -4.003 9.318 1.00 . A A . 38 PRO HD3 1 1 2 1228 1 1 38 PRO HG2 H -1.971 -6.101 7.211 1.00 . A A . 38 PRO HG2 1 1 2 1229 1 1 38 PRO HG3 H -1.498 -6.374 8.909 1.00 . A A . 38 PRO HG3 1 1 2 1230 1 1 38 PRO N N -0.568 -3.600 7.343 1.00 . A A . 38 PRO N 1 1 2 1231 1 1 38 PRO O O -0.626 -4.328 4.572 1.00 . A A . 38 PRO O 1 1 2 1232 1 1 39 ARG C C 0.711 -6.411 2.510 1.00 . A A . 39 ARG C 1 1 2 1233 1 1 39 ARG CA C 1.621 -5.327 3.160 1.00 . A A . 39 ARG CA 1 1 2 1234 1 1 39 ARG CB C 3.103 -5.669 2.827 1.00 . A A . 39 ARG CB 1 1 2 1235 1 1 39 ARG CD C 5.555 -4.886 2.743 1.00 . A A . 39 ARG CD 1 1 2 1236 1 1 39 ARG CG C 4.133 -4.605 3.258 1.00 . A A . 39 ARG CG 1 1 2 1237 1 1 39 ARG CZ C 7.813 -3.822 2.979 1.00 . A A . 39 ARG CZ 1 1 2 1238 1 1 39 ARG H H 2.175 -5.553 5.285 1.00 . A A . 39 ARG H 1 1 2 1239 1 1 39 ARG HA H 1.388 -4.330 2.730 1.00 . A A . 39 ARG HA 1 1 2 1240 1 1 39 ARG HB2 H 3.384 -6.649 3.261 1.00 . A A . 39 ARG HB2 1 1 2 1241 1 1 39 ARG HB3 H 3.195 -5.803 1.731 1.00 . A A . 39 ARG HB3 1 1 2 1242 1 1 39 ARG HD2 H 5.893 -5.883 3.087 1.00 . A A . 39 ARG HD2 1 1 2 1243 1 1 39 ARG HD3 H 5.560 -4.914 1.636 1.00 . A A . 39 ARG HD3 1 1 2 1244 1 1 39 ARG HG2 H 3.798 -3.613 2.905 1.00 . A A . 39 ARG HG2 1 1 2 1245 1 1 39 ARG HG3 H 4.143 -4.547 4.363 1.00 . A A . 39 ARG HG3 1 1 2 1246 1 1 39 ARG HH11 H 7.881 -5.502 1.874 1.00 . A A . 39 ARG HH11 1 1 2 1247 1 1 39 ARG HH12 H 9.463 -4.614 2.145 1.00 . A A . 39 ARG HH12 1 1 2 1248 1 1 39 ARG HH21 H 8.004 -2.136 4.039 1.00 . A A . 39 ARG HH21 1 1 2 1249 1 1 39 ARG HH22 H 9.526 -2.834 3.289 1.00 . A A . 39 ARG HH22 1 1 2 1250 1 1 39 ARG N N 1.428 -5.283 4.636 1.00 . A A . 39 ARG N 1 1 2 1251 1 1 39 ARG NE N 6.491 -3.843 3.225 1.00 . A A . 39 ARG NE 1 1 2 1252 1 1 39 ARG NH1 N 8.451 -4.741 2.257 1.00 . A A . 39 ARG NH1 1 1 2 1253 1 1 39 ARG NH2 N 8.519 -2.831 3.488 1.00 . A A . 39 ARG NH2 1 1 2 1254 1 1 39 ARG O O 0.764 -7.594 2.867 1.00 . A A . 39 ARG O 1 1 2 1255 1 1 40 LEU C C -0.377 -6.576 -0.810 1.00 . A A . 40 LEU C 1 1 2 1256 1 1 40 LEU CA C -0.869 -6.866 0.637 1.00 . A A . 40 LEU CA 1 1 2 1257 1 1 40 LEU CB C -2.404 -6.633 0.816 1.00 . A A . 40 LEU CB 1 1 2 1258 1 1 40 LEU CD1 C -4.651 -5.487 0.483 1.00 . A A . 40 LEU CD1 1 1 2 1259 1 1 40 LEU CD2 C -2.701 -4.068 1.209 1.00 . A A . 40 LEU CD2 1 1 2 1260 1 1 40 LEU CG C -3.122 -5.310 0.396 1.00 . A A . 40 LEU CG 1 1 2 1261 1 1 40 LEU H H -0.024 -4.961 1.345 1.00 . A A . 40 LEU H 1 1 2 1262 1 1 40 LEU HA H -0.676 -7.931 0.884 1.00 . A A . 40 LEU HA 1 1 2 1263 1 1 40 LEU HB2 H -2.891 -7.459 0.261 1.00 . A A . 40 LEU HB2 1 1 2 1264 1 1 40 LEU HB3 H -2.660 -6.850 1.872 1.00 . A A . 40 LEU HB3 1 1 2 1265 1 1 40 LEU HD11 H -5.001 -6.327 -0.148 1.00 . A A . 40 LEU HD11 1 1 2 1266 1 1 40 LEU HD12 H -4.990 -5.691 1.517 1.00 . A A . 40 LEU HD12 1 1 2 1267 1 1 40 LEU HD13 H -5.189 -4.587 0.132 1.00 . A A . 40 LEU HD13 1 1 2 1268 1 1 40 LEU HD21 H -2.828 -4.220 2.298 1.00 . A A . 40 LEU HD21 1 1 2 1269 1 1 40 LEU HD22 H -1.643 -3.802 1.034 1.00 . A A . 40 LEU HD22 1 1 2 1270 1 1 40 LEU HD23 H -3.289 -3.174 0.930 1.00 . A A . 40 LEU HD23 1 1 2 1271 1 1 40 LEU HG H -2.898 -5.109 -0.667 1.00 . A A . 40 LEU HG 1 1 2 1272 1 1 40 LEU N N -0.090 -5.969 1.527 1.00 . A A . 40 LEU N 1 1 2 1273 1 1 40 LEU O O -0.528 -5.465 -1.334 1.00 . A A . 40 LEU O 1 1 2 1274 1 1 41 ILE C C -0.064 -7.810 -3.839 1.00 . A A . 41 ILE C 1 1 2 1275 1 1 41 ILE CA C 0.965 -7.405 -2.739 1.00 . A A . 41 ILE CA 1 1 2 1276 1 1 41 ILE CB C 2.277 -8.283 -2.794 1.00 . A A . 41 ILE CB 1 1 2 1277 1 1 41 ILE CD1 C 3.726 -6.528 -1.386 1.00 . A A . 41 ILE CD1 1 1 2 1278 1 1 41 ILE CG1 C 3.270 -7.982 -1.619 1.00 . A A . 41 ILE CG1 1 1 2 1279 1 1 41 ILE CG2 C 3.022 -8.026 -4.134 1.00 . A A . 41 ILE CG2 1 1 2 1280 1 1 41 ILE H H 0.340 -8.450 -0.891 1.00 . A A . 41 ILE H 1 1 2 1281 1 1 41 ILE HA H 1.263 -6.344 -2.874 1.00 . A A . 41 ILE HA 1 1 2 1282 1 1 41 ILE HB H 2.016 -9.357 -2.738 1.00 . A A . 41 ILE HB 1 1 2 1283 1 1 41 ILE HD11 H 4.239 -6.107 -2.269 1.00 . A A . 41 ILE HD11 1 1 2 1284 1 1 41 ILE HD12 H 2.876 -5.865 -1.143 1.00 . A A . 41 ILE HD12 1 1 2 1285 1 1 41 ILE HD13 H 4.433 -6.467 -0.539 1.00 . A A . 41 ILE HD13 1 1 2 1286 1 1 41 ILE HG12 H 2.822 -8.347 -0.676 1.00 . A A . 41 ILE HG12 1 1 2 1287 1 1 41 ILE HG13 H 4.172 -8.612 -1.740 1.00 . A A . 41 ILE HG13 1 1 2 1288 1 1 41 ILE HG21 H 3.270 -6.959 -4.285 1.00 . A A . 41 ILE HG21 1 1 2 1289 1 1 41 ILE HG22 H 3.968 -8.595 -4.193 1.00 . A A . 41 ILE HG22 1 1 2 1290 1 1 41 ILE HG23 H 2.420 -8.342 -5.006 1.00 . A A . 41 ILE HG23 1 1 2 1291 1 1 41 ILE N N 0.266 -7.581 -1.433 1.00 . A A . 41 ILE N 1 1 2 1292 1 1 41 ILE O O -0.370 -8.995 -4.021 1.00 . A A . 41 ILE O 1 1 2 1293 1 1 42 MET C C -1.137 -6.350 -6.889 1.00 . A A . 42 MET C 1 1 2 1294 1 1 42 MET CA C -1.656 -6.982 -5.569 1.00 . A A . 42 MET CA 1 1 2 1295 1 1 42 MET CB C -2.984 -6.320 -5.092 1.00 . A A . 42 MET CB 1 1 2 1296 1 1 42 MET CE C -3.912 -9.186 -2.251 1.00 . A A . 42 MET CE 1 1 2 1297 1 1 42 MET CG C -3.604 -6.896 -3.803 1.00 . A A . 42 MET CG 1 1 2 1298 1 1 42 MET H H -0.256 -5.862 -4.279 1.00 . A A . 42 MET H 1 1 2 1299 1 1 42 MET HA H -1.868 -8.057 -5.741 1.00 . A A . 42 MET HA 1 1 2 1300 1 1 42 MET HB2 H -2.840 -5.231 -4.949 1.00 . A A . 42 MET HB2 1 1 2 1301 1 1 42 MET HB3 H -3.737 -6.406 -5.898 1.00 . A A . 42 MET HB3 1 1 2 1302 1 1 42 MET HE1 H -4.664 -8.619 -1.672 1.00 . A A . 42 MET HE1 1 1 2 1303 1 1 42 MET HE2 H -4.154 -10.261 -2.170 1.00 . A A . 42 MET HE2 1 1 2 1304 1 1 42 MET HE3 H -2.922 -9.023 -1.788 1.00 . A A . 42 MET HE3 1 1 2 1305 1 1 42 MET HG2 H -2.939 -6.707 -2.940 1.00 . A A . 42 MET HG2 1 1 2 1306 1 1 42 MET HG3 H -4.559 -6.389 -3.573 1.00 . A A . 42 MET HG3 1 1 2 1307 1 1 42 MET N N -0.597 -6.794 -4.542 1.00 . A A . 42 MET N 1 1 2 1308 1 1 42 MET O O -1.308 -5.150 -7.137 1.00 . A A . 42 MET O 1 1 2 1309 1 1 42 MET SD S -3.900 -8.669 -3.980 1.00 . A A . 42 MET SD 1 1 2 1310 1 1 43 GLU C C 0.285 -7.887 -9.966 1.00 . A A . 43 GLU C 1 1 2 1311 1 1 43 GLU CA C 0.196 -6.699 -8.966 1.00 . A A . 43 GLU CA 1 1 2 1312 1 1 43 GLU CB C 1.615 -6.146 -8.645 1.00 . A A . 43 GLU CB 1 1 2 1313 1 1 43 GLU CD C 3.628 -4.753 -9.425 1.00 . A A . 43 GLU CD 1 1 2 1314 1 1 43 GLU CG C 2.299 -5.403 -9.813 1.00 . A A . 43 GLU CG 1 1 2 1315 1 1 43 GLU H H -0.366 -8.139 -7.388 1.00 . A A . 43 GLU H 1 1 2 1316 1 1 43 GLU HA H -0.418 -5.887 -9.410 1.00 . A A . 43 GLU HA 1 1 2 1317 1 1 43 GLU HB2 H 1.517 -5.423 -7.819 1.00 . A A . 43 GLU HB2 1 1 2 1318 1 1 43 GLU HB3 H 2.275 -6.950 -8.264 1.00 . A A . 43 GLU HB3 1 1 2 1319 1 1 43 GLU HE2 H 5.532 -5.163 -9.423 1.00 . A A . 43 GLU HE2 1 1 2 1320 1 1 43 GLU HG2 H 2.459 -6.086 -10.668 1.00 . A A . 43 GLU HG2 1 1 2 1321 1 1 43 GLU HG3 H 1.620 -4.617 -10.188 1.00 . A A . 43 GLU HG3 1 1 2 1322 1 1 43 GLU N N -0.454 -7.170 -7.714 1.00 . A A . 43 GLU N 1 1 2 1323 1 1 43 GLU O O 0.622 -9.025 -9.616 1.00 . A A . 43 GLU O 1 1 2 1324 1 1 43 GLU OE1 O 3.715 -3.615 -8.964 1.00 . A A . 43 GLU OE1 1 1 2 1325 1 1 43 GLU OE2 O 4.699 -5.578 -9.659 1.00 . A A . 43 GLU OE2 1 1 2 1326 1 1 44 GLY C C -1.090 -9.452 -12.563 1.00 . A A . 44 GLY C 1 1 2 1327 1 1 44 GLY CA C 0.121 -8.517 -12.363 1.00 . A A . 44 GLY CA 1 1 2 1328 1 1 44 GLY H H -0.138 -6.554 -11.365 1.00 . A A . 44 GLY H 1 1 2 1329 1 1 44 GLY HA2 H 0.281 -7.935 -13.291 1.00 . A A . 44 GLY HA2 1 1 2 1330 1 1 44 GLY HA3 H 1.044 -9.120 -12.259 1.00 . A A . 44 GLY HA3 1 1 2 1331 1 1 44 GLY N N 0.007 -7.562 -11.236 1.00 . A A . 44 GLY N 1 1 2 1332 1 1 44 GLY O O -0.948 -10.673 -12.457 1.00 . A A . 44 GLY O 1 1 2 1333 1 1 45 LEU C C -4.334 -8.664 -14.134 1.00 . A A . 45 LEU C 1 1 2 1334 1 1 45 LEU CA C -3.485 -9.631 -13.255 1.00 . A A . 45 LEU CA 1 1 2 1335 1 1 45 LEU CB C -4.219 -10.148 -11.966 1.00 . A A . 45 LEU CB 1 1 2 1336 1 1 45 LEU CD1 C -6.589 -10.768 -12.860 1.00 . A A . 45 LEU CD1 1 1 2 1337 1 1 45 LEU CD2 C -4.797 -12.562 -12.697 1.00 . A A . 45 LEU CD2 1 1 2 1338 1 1 45 LEU CG C -5.324 -11.235 -12.113 1.00 . A A . 45 LEU CG 1 1 2 1339 1 1 45 LEU H H -2.226 -7.846 -12.934 1.00 . A A . 45 LEU H 1 1 2 1340 1 1 45 LEU HA H -3.197 -10.490 -13.882 1.00 . A A . 45 LEU HA 1 1 2 1341 1 1 45 LEU HB2 H -3.463 -10.576 -11.279 1.00 . A A . 45 LEU HB2 1 1 2 1342 1 1 45 LEU HB3 H -4.628 -9.296 -11.390 1.00 . A A . 45 LEU HB3 1 1 2 1343 1 1 45 LEU HD11 H -6.982 -9.821 -12.445 1.00 . A A . 45 LEU HD11 1 1 2 1344 1 1 45 LEU HD12 H -6.403 -10.603 -13.937 1.00 . A A . 45 LEU HD12 1 1 2 1345 1 1 45 LEU HD13 H -7.404 -11.513 -12.784 1.00 . A A . 45 LEU HD13 1 1 2 1346 1 1 45 LEU HD21 H -3.932 -12.943 -12.124 1.00 . A A . 45 LEU HD21 1 1 2 1347 1 1 45 LEU HD22 H -5.569 -13.353 -12.673 1.00 . A A . 45 LEU HD22 1 1 2 1348 1 1 45 LEU HD23 H -4.474 -12.457 -13.750 1.00 . A A . 45 LEU HD23 1 1 2 1349 1 1 45 LEU HG H -5.654 -11.467 -11.083 1.00 . A A . 45 LEU HG 1 1 2 1350 1 1 45 LEU N N -2.261 -8.870 -12.878 1.00 . A A . 45 LEU N 1 1 2 1351 1 1 45 LEU O O -4.358 -8.836 -15.357 1.00 . A A . 45 LEU O 1 1 2 1352 1 1 46 SER C C -4.571 -5.251 -13.912 1.00 . A A . 46 SER C 1 1 2 1353 1 1 46 SER CA C -5.490 -6.456 -14.265 1.00 . A A . 46 SER CA 1 1 2 1354 1 1 46 SER CB C -6.965 -6.230 -13.858 1.00 . A A . 46 SER CB 1 1 2 1355 1 1 46 SER H H -4.833 -7.634 -12.517 1.00 . A A . 46 SER H 1 1 2 1356 1 1 46 SER HA H -5.474 -6.617 -15.363 1.00 . A A . 46 SER HA 1 1 2 1357 1 1 46 SER HB2 H -7.568 -7.136 -14.061 1.00 . A A . 46 SER HB2 1 1 2 1358 1 1 46 SER HB3 H -7.063 -6.035 -12.773 1.00 . A A . 46 SER HB3 1 1 2 1359 1 1 46 SER HG H -6.998 -4.374 -14.359 1.00 . A A . 46 SER HG 1 1 2 1360 1 1 46 SER N N -4.971 -7.639 -13.533 1.00 . A A . 46 SER N 1 1 2 1361 1 1 46 SER O O -4.814 -4.518 -12.946 1.00 . A A . 46 SER O 1 1 2 1362 1 1 46 SER OG O -7.527 -5.143 -14.583 1.00 . A A . 46 SER OG 1 1 2 1363 1 1 47 PHE C C -1.637 -3.769 -15.657 1.00 . A A . 47 PHE C 1 1 2 1364 1 1 47 PHE CA C -2.375 -4.156 -14.344 1.00 . A A . 47 PHE CA 1 1 2 1365 1 1 47 PHE CB C -1.394 -4.829 -13.330 1.00 . A A . 47 PHE CB 1 1 2 1366 1 1 47 PHE CD1 C -0.542 -2.925 -11.859 1.00 . A A . 47 PHE CD1 1 1 2 1367 1 1 47 PHE CD2 C 1.042 -4.070 -13.279 1.00 . A A . 47 PHE CD2 1 1 2 1368 1 1 47 PHE CE1 C 0.469 -2.075 -11.418 1.00 . A A . 47 PHE CE1 1 1 2 1369 1 1 47 PHE CE2 C 2.052 -3.218 -12.837 1.00 . A A . 47 PHE CE2 1 1 2 1370 1 1 47 PHE CG C -0.265 -3.925 -12.798 1.00 . A A . 47 PHE CG 1 1 2 1371 1 1 47 PHE CZ C 1.764 -2.220 -11.909 1.00 . A A . 47 PHE CZ 1 1 2 1372 1 1 47 PHE H H -3.380 -5.788 -15.436 1.00 . A A . 47 PHE H 1 1 2 1373 1 1 47 PHE HA H -2.806 -3.245 -13.878 1.00 . A A . 47 PHE HA 1 1 2 1374 1 1 47 PHE HB2 H -1.966 -5.202 -12.458 1.00 . A A . 47 PHE HB2 1 1 2 1375 1 1 47 PHE HB3 H -0.969 -5.751 -13.776 1.00 . A A . 47 PHE HB3 1 1 2 1376 1 1 47 PHE HD1 H -1.546 -2.794 -11.479 1.00 . A A . 47 PHE HD1 1 1 2 1377 1 1 47 PHE HD2 H 1.279 -4.832 -14.008 1.00 . A A . 47 PHE HD2 1 1 2 1378 1 1 47 PHE HE1 H 0.248 -1.300 -10.698 1.00 . A A . 47 PHE HE1 1 1 2 1379 1 1 47 PHE HE2 H 3.058 -3.330 -13.214 1.00 . A A . 47 PHE HE2 1 1 2 1380 1 1 47 PHE HZ H 2.548 -1.560 -11.567 1.00 . A A . 47 PHE HZ 1 1 2 1381 1 1 47 PHE N N -3.471 -5.103 -14.677 1.00 . A A . 47 PHE N 1 1 2 1382 1 1 47 PHE O O -1.187 -4.634 -16.419 1.00 . A A . 47 PHE O 1 1 2 1383 1 1 48 ALA C C 0.883 -1.829 -16.449 1.00 . A A . 48 ALA C 1 1 2 1384 1 1 48 ALA CA C -0.585 -1.910 -16.934 1.00 . A A . 48 ALA CA 1 1 2 1385 1 1 48 ALA CB C -1.107 -0.516 -17.332 1.00 . A A . 48 ALA CB 1 1 2 1386 1 1 48 ALA H H -1.864 -1.844 -15.141 1.00 . A A . 48 ALA H 1 1 2 1387 1 1 48 ALA HXT H 1.959 -1.028 -15.032 1.00 . A A . 48 ALA HXT 1 1 2 1388 1 1 48 ALA HA H -0.620 -2.559 -17.831 1.00 . A A . 48 ALA HA 1 1 2 1389 1 1 48 ALA HB1 H -1.107 0.198 -16.486 1.00 . A A . 48 ALA HB1 1 1 2 1390 1 1 48 ALA HB2 H -0.491 -0.069 -18.134 1.00 . A A . 48 ALA HB2 1 1 2 1391 1 1 48 ALA HB3 H -2.142 -0.563 -17.720 1.00 . A A . 48 ALA HB3 1 1 2 1392 1 1 48 ALA N N -1.453 -2.451 -15.859 1.00 . A A . 48 ALA N 1 1 2 1393 1 1 48 ALA O O 1.803 -2.419 -17.014 1.00 . A A . 48 ALA O 1 1 2 1394 1 1 48 ALA OXT O 1.046 -1.051 -15.325 1.00 . A A . 48 ALA OXT 1 1 3 1395 1 1 1 GLU C C 5.950 11.052 13.059 1.00 . A A . 1 GLU C 1 1 3 1396 1 1 1 GLU CA C 4.867 9.937 12.946 1.00 . A A . 1 GLU CA 1 1 3 1397 1 1 1 GLU CB C 5.391 8.482 12.723 1.00 . A A . 1 GLU CB 1 1 3 1398 1 1 1 GLU CD C 7.511 8.216 14.234 1.00 . A A . 1 GLU CD 1 1 3 1399 1 1 1 GLU CG C 6.078 7.779 13.916 1.00 . A A . 1 GLU CG 1 1 3 1400 1 1 1 GLU H1 H 3.584 11.208 11.893 1.00 . A A . 1 GLU H1 1 1 3 1401 1 1 1 GLU H2 H 3.233 9.607 11.684 1.00 . A A . 1 GLU H2 1 1 3 1402 1 1 1 GLU HA H 4.268 9.974 13.870 1.00 . A A . 1 GLU HA 1 1 3 1403 1 1 1 GLU HB2 H 4.522 7.840 12.482 1.00 . A A . 1 GLU HB2 1 1 3 1404 1 1 1 GLU HB3 H 6.033 8.422 11.824 1.00 . A A . 1 GLU HB3 1 1 3 1405 1 1 1 GLU HE2 H 9.281 8.208 13.421 1.00 . A A . 1 GLU HE2 1 1 3 1406 1 1 1 GLU HG2 H 5.451 7.884 14.821 1.00 . A A . 1 GLU HG2 1 1 3 1407 1 1 1 GLU HG3 H 6.102 6.691 13.715 1.00 . A A . 1 GLU HG3 1 1 3 1408 1 1 1 GLU N N 4.002 10.277 11.791 1.00 . A A . 1 GLU N 1 1 3 1409 1 1 1 GLU O O 5.740 11.998 13.825 1.00 . A A . 1 GLU O 1 1 3 1410 1 1 1 GLU OE1 O 7.833 8.750 15.293 1.00 . A A . 1 GLU OE1 1 1 3 1411 1 1 1 GLU OE2 O 8.384 7.934 13.214 1.00 . A A . 1 GLU OE2 1 1 3 1412 1 1 2 ASP C C 8.742 12.017 10.835 1.00 . A A . 2 ASP C 1 1 3 1413 1 1 2 ASP CA C 8.111 12.041 12.258 1.00 . A A . 2 ASP CA 1 1 3 1414 1 1 2 ASP CB C 9.179 11.826 13.382 1.00 . A A . 2 ASP CB 1 1 3 1415 1 1 2 ASP CG C 8.766 12.310 14.778 1.00 . A A . 2 ASP CG 1 1 3 1416 1 1 2 ASP H H 7.110 10.127 11.734 1.00 . A A . 2 ASP H 1 1 3 1417 1 1 2 ASP HA H 7.647 13.032 12.394 1.00 . A A . 2 ASP HA 1 1 3 1418 1 1 2 ASP HB2 H 9.488 10.763 13.438 1.00 . A A . 2 ASP HB2 1 1 3 1419 1 1 2 ASP HB3 H 10.108 12.367 13.118 1.00 . A A . 2 ASP HB3 1 1 3 1420 1 1 2 ASP HD2 H 9.134 14.090 14.081 1.00 . A A . 2 ASP HD2 1 1 3 1421 1 1 2 ASP N N 7.068 10.974 12.309 1.00 . A A . 2 ASP N 1 1 3 1422 1 1 2 ASP O O 8.455 12.916 10.039 1.00 . A A . 2 ASP O 1 1 3 1423 1 1 2 ASP OD1 O 8.411 11.556 15.683 1.00 . A A . 2 ASP OD1 1 1 3 1424 1 1 2 ASP OD2 O 8.836 13.675 14.894 1.00 . A A . 2 ASP OD2 1 1 3 1425 1 1 3 ASN C C 9.322 10.008 8.249 1.00 . A A . 3 ASN C 1 1 3 1426 1 1 3 ASN CA C 10.224 10.867 9.175 1.00 . A A . 3 ASN CA 1 1 3 1427 1 1 3 ASN CB C 11.667 10.299 9.403 1.00 . A A . 3 ASN CB 1 1 3 1428 1 1 3 ASN CG C 12.678 11.300 10.003 1.00 . A A . 3 ASN CG 1 1 3 1429 1 1 3 ASN H H 9.705 10.333 11.271 1.00 . A A . 3 ASN H 1 1 3 1430 1 1 3 ASN HA H 10.323 11.805 8.670 1.00 . A A . 3 ASN HA 1 1 3 1431 1 1 3 ASN HB2 H 11.637 9.363 9.996 1.00 . A A . 3 ASN HB2 1 1 3 1432 1 1 3 ASN HB3 H 12.079 9.984 8.426 1.00 . A A . 3 ASN HB3 1 1 3 1433 1 1 3 ASN HD21 H 12.601 10.366 11.777 1.00 . A A . 3 ASN HD21 1 1 3 1434 1 1 3 ASN HD22 H 13.704 11.827 11.644 1.00 . A A . 3 ASN HD22 1 1 3 1435 1 1 3 ASN N N 9.575 11.009 10.512 1.00 . A A . 3 ASN N 1 1 3 1436 1 1 3 ASN ND2 N 13.029 11.150 11.271 1.00 . A A . 3 ASN ND2 1 1 3 1437 1 1 3 ASN O O 8.652 10.511 7.343 1.00 . A A . 3 ASN O 1 1 3 1438 1 1 3 ASN OD1 O 13.148 12.214 9.327 1.00 . A A . 3 ASN OD1 1 1 3 1439 1 1 4 CYS C C 7.576 7.047 9.149 1.00 . A A . 4 CYS C 1 1 3 1440 1 1 4 CYS CA C 8.412 7.706 7.999 1.00 . A A . 4 CYS CA 1 1 3 1441 1 1 4 CYS CB C 9.209 6.660 7.233 1.00 . A A . 4 CYS CB 1 1 3 1442 1 1 4 CYS H H 9.952 8.710 9.368 1.00 . A A . 4 CYS H 1 1 3 1443 1 1 4 CYS HA H 7.705 8.135 7.268 1.00 . A A . 4 CYS HA 1 1 3 1444 1 1 4 CYS HB2 H 8.396 6.000 7.010 1.00 . A A . 4 CYS HB2 1 1 3 1445 1 1 4 CYS HB3 H 9.532 6.955 6.224 1.00 . A A . 4 CYS HB3 1 1 3 1446 1 1 4 CYS N N 9.334 8.726 8.553 1.00 . A A . 4 CYS N 1 1 3 1447 1 1 4 CYS O O 7.850 7.247 10.340 1.00 . A A . 4 CYS O 1 1 3 1448 1 1 4 CYS SG S 10.376 5.612 8.118 1.00 . A A . 4 CYS SG 1 1 3 1449 1 1 5 ILE C C 6.120 4.059 9.723 1.00 . A A . 5 ILE C 1 1 3 1450 1 1 5 ILE CA C 5.692 5.537 9.809 1.00 . A A . 5 ILE CA 1 1 3 1451 1 1 5 ILE CB C 4.136 5.680 9.581 1.00 . A A . 5 ILE CB 1 1 3 1452 1 1 5 ILE CD1 C 2.339 7.406 9.016 1.00 . A A . 5 ILE CD1 1 1 3 1453 1 1 5 ILE CG1 C 3.774 7.160 9.387 1.00 . A A . 5 ILE CG1 1 1 3 1454 1 1 5 ILE CG2 C 3.340 5.073 10.785 1.00 . A A . 5 ILE CG2 1 1 3 1455 1 1 5 ILE H H 6.536 6.030 7.743 1.00 . A A . 5 ILE H 1 1 3 1456 1 1 5 ILE HA H 5.896 5.947 10.809 1.00 . A A . 5 ILE HA 1 1 3 1457 1 1 5 ILE HB H 3.781 5.152 8.703 1.00 . A A . 5 ILE HB 1 1 3 1458 1 1 5 ILE HD11 H 1.669 6.983 9.777 1.00 . A A . 5 ILE HD11 1 1 3 1459 1 1 5 ILE HD12 H 2.121 8.482 8.958 1.00 . A A . 5 ILE HD12 1 1 3 1460 1 1 5 ILE HD13 H 2.093 6.946 8.044 1.00 . A A . 5 ILE HD13 1 1 3 1461 1 1 5 ILE HG12 H 4.015 7.723 10.278 1.00 . A A . 5 ILE HG12 1 1 3 1462 1 1 5 ILE HG13 H 4.379 7.593 8.577 1.00 . A A . 5 ILE HG13 1 1 3 1463 1 1 5 ILE HG21 H 3.598 4.017 10.989 1.00 . A A . 5 ILE HG21 1 1 3 1464 1 1 5 ILE HG22 H 3.449 5.634 11.731 1.00 . A A . 5 ILE HG22 1 1 3 1465 1 1 5 ILE HG23 H 2.251 5.035 10.576 1.00 . A A . 5 ILE HG23 1 1 3 1466 1 1 5 ILE N N 6.546 6.236 8.772 1.00 . A A . 5 ILE N 1 1 3 1467 1 1 5 ILE O O 5.628 3.286 8.907 1.00 . A A . 5 ILE O 1 1 3 1468 1 1 6 ALA C C 6.706 1.092 10.998 1.00 . A A . 6 ALA C 1 1 3 1469 1 1 6 ALA CA C 7.612 2.237 10.402 1.00 . A A . 6 ALA CA 1 1 3 1470 1 1 6 ALA CB C 8.986 2.261 11.101 1.00 . A A . 6 ALA CB 1 1 3 1471 1 1 6 ALA H H 7.273 4.272 11.313 1.00 . A A . 6 ALA H 1 1 3 1472 1 1 6 ALA HA H 7.715 2.045 9.308 1.00 . A A . 6 ALA HA 1 1 3 1473 1 1 6 ALA HB1 H 9.651 3.038 10.679 1.00 . A A . 6 ALA HB1 1 1 3 1474 1 1 6 ALA HB2 H 8.902 2.449 12.189 1.00 . A A . 6 ALA HB2 1 1 3 1475 1 1 6 ALA HB3 H 9.515 1.298 10.979 1.00 . A A . 6 ALA HB3 1 1 3 1476 1 1 6 ALA N N 7.049 3.614 10.566 1.00 . A A . 6 ALA N 1 1 3 1477 1 1 6 ALA O O 7.180 -0.034 11.182 1.00 . A A . 6 ALA O 1 1 3 1478 1 1 7 GLU C C 3.099 0.304 11.552 1.00 . A A . 7 GLU C 1 1 3 1479 1 1 7 GLU CA C 4.523 0.499 12.077 1.00 . A A . 7 GLU CA 1 1 3 1480 1 1 7 GLU CB C 4.464 1.116 13.525 1.00 . A A . 7 GLU CB 1 1 3 1481 1 1 7 GLU CD C 6.887 0.821 14.438 1.00 . A A . 7 GLU CD 1 1 3 1482 1 1 7 GLU CG C 5.399 0.480 14.577 1.00 . A A . 7 GLU CG 1 1 3 1483 1 1 7 GLU H H 5.338 2.418 11.213 1.00 . A A . 7 GLU H 1 1 3 1484 1 1 7 GLU HA H 4.916 -0.500 12.047 1.00 . A A . 7 GLU HA 1 1 3 1485 1 1 7 GLU HB2 H 4.605 2.217 13.519 1.00 . A A . 7 GLU HB2 1 1 3 1486 1 1 7 GLU HB3 H 3.436 1.043 13.937 1.00 . A A . 7 GLU HB3 1 1 3 1487 1 1 7 GLU HE2 H 8.074 2.359 14.573 1.00 . A A . 7 GLU HE2 1 1 3 1488 1 1 7 GLU HG2 H 5.072 0.801 15.584 1.00 . A A . 7 GLU HG2 1 1 3 1489 1 1 7 GLU HG3 H 5.269 -0.619 14.575 1.00 . A A . 7 GLU HG3 1 1 3 1490 1 1 7 GLU N N 5.424 1.393 11.299 1.00 . A A . 7 GLU N 1 1 3 1491 1 1 7 GLU O O 2.504 1.216 10.998 1.00 . A A . 7 GLU O 1 1 3 1492 1 1 7 GLU OE1 O 7.749 -0.011 14.158 1.00 . A A . 7 GLU OE1 1 1 3 1493 1 1 7 GLU OE2 O 7.141 2.151 14.662 1.00 . A A . 7 GLU OE2 1 1 3 1494 1 1 8 ASP C C 0.436 -0.560 12.881 1.00 . A A . 8 ASP C 1 1 3 1495 1 1 8 ASP CA C 1.156 -1.307 11.729 1.00 . A A . 8 ASP CA 1 1 3 1496 1 1 8 ASP CB C 0.936 -2.822 11.915 1.00 . A A . 8 ASP CB 1 1 3 1497 1 1 8 ASP CG C -0.520 -3.318 11.878 1.00 . A A . 8 ASP CG 1 1 3 1498 1 1 8 ASP H H 3.249 -1.540 12.326 1.00 . A A . 8 ASP H 1 1 3 1499 1 1 8 ASP HA H 0.754 -1.078 10.705 1.00 . A A . 8 ASP HA 1 1 3 1500 1 1 8 ASP HB2 H 1.475 -3.316 11.114 1.00 . A A . 8 ASP HB2 1 1 3 1501 1 1 8 ASP HB3 H 1.327 -3.103 12.901 1.00 . A A . 8 ASP HB3 1 1 3 1502 1 1 8 ASP HD2 H 0.186 -4.893 12.776 1.00 . A A . 8 ASP HD2 1 1 3 1503 1 1 8 ASP N N 2.582 -0.919 11.856 1.00 . A A . 8 ASP N 1 1 3 1504 1 1 8 ASP O O 0.861 -0.457 14.039 1.00 . A A . 8 ASP O 1 1 3 1505 1 1 8 ASP OD1 O -1.453 -2.684 11.391 1.00 . A A . 8 ASP OD1 1 1 3 1506 1 1 8 ASP OD2 O -0.652 -4.556 12.452 1.00 . A A . 8 ASP OD2 1 1 3 1507 1 1 9 TYR C C -0.819 2.168 13.750 1.00 . A A . 9 TYR C 1 1 3 1508 1 1 9 TYR CA C -1.580 0.898 13.179 1.00 . A A . 9 TYR CA 1 1 3 1509 1 1 9 TYR CB C -2.297 0.089 14.319 1.00 . A A . 9 TYR CB 1 1 3 1510 1 1 9 TYR CD1 C -3.975 -1.189 12.840 1.00 . A A . 9 TYR CD1 1 1 3 1511 1 1 9 TYR CD2 C -2.716 -2.425 14.491 1.00 . A A . 9 TYR CD2 1 1 3 1512 1 1 9 TYR CE1 C -4.551 -2.376 12.394 1.00 . A A . 9 TYR CE1 1 1 3 1513 1 1 9 TYR CE2 C -3.306 -3.609 14.053 1.00 . A A . 9 TYR CE2 1 1 3 1514 1 1 9 TYR CG C -3.054 -1.201 13.899 1.00 . A A . 9 TYR CG 1 1 3 1515 1 1 9 TYR CZ C -4.224 -3.583 13.006 1.00 . A A . 9 TYR CZ 1 1 3 1516 1 1 9 TYR H H -0.824 -0.459 11.505 1.00 . A A . 9 TYR H 1 1 3 1517 1 1 9 TYR HA H -2.327 1.292 12.471 1.00 . A A . 9 TYR HA 1 1 3 1518 1 1 9 TYR HB2 H -1.569 -0.136 15.123 1.00 . A A . 9 TYR HB2 1 1 3 1519 1 1 9 TYR HB3 H -3.032 0.755 14.808 1.00 . A A . 9 TYR HB3 1 1 3 1520 1 1 9 TYR HD1 H -4.178 -0.277 12.297 1.00 . A A . 9 TYR HD1 1 1 3 1521 1 1 9 TYR HD2 H -1.931 -2.481 15.232 1.00 . A A . 9 TYR HD2 1 1 3 1522 1 1 9 TYR HE1 H -5.206 -2.368 11.534 1.00 . A A . 9 TYR HE1 1 1 3 1523 1 1 9 TYR HE2 H -2.994 -4.554 14.476 1.00 . A A . 9 TYR HE2 1 1 3 1524 1 1 9 TYR HH H -5.343 -4.559 11.800 1.00 . A A . 9 TYR HH 1 1 3 1525 1 1 9 TYR N N -0.688 -0.047 12.438 1.00 . A A . 9 TYR N 1 1 3 1526 1 1 9 TYR O O -1.310 2.796 14.694 1.00 . A A . 9 TYR O 1 1 3 1527 1 1 9 TYR OH O -4.755 -4.755 12.534 1.00 . A A . 9 TYR OH 1 1 3 1528 1 1 10 GLY C C 0.198 4.984 12.693 1.00 . A A . 10 GLY C 1 1 3 1529 1 1 10 GLY CA C 0.968 3.895 13.430 1.00 . A A . 10 GLY CA 1 1 3 1530 1 1 10 GLY H H 0.634 2.003 12.364 1.00 . A A . 10 GLY H 1 1 3 1531 1 1 10 GLY HA2 H 1.053 4.072 14.509 1.00 . A A . 10 GLY HA2 1 1 3 1532 1 1 10 GLY HA3 H 2.012 3.977 13.125 1.00 . A A . 10 GLY HA3 1 1 3 1533 1 1 10 GLY N N 0.323 2.594 13.143 1.00 . A A . 10 GLY N 1 1 3 1534 1 1 10 GLY O O -0.315 4.812 11.582 1.00 . A A . 10 GLY O 1 1 3 1535 1 1 11 LYS C C -0.149 7.944 11.729 1.00 . A A . 11 LYS C 1 1 3 1536 1 1 11 LYS CA C -0.782 7.209 12.943 1.00 . A A . 11 LYS CA 1 1 3 1537 1 1 11 LYS CB C -1.035 8.244 14.049 1.00 . A A . 11 LYS CB 1 1 3 1538 1 1 11 LYS CD C -2.514 10.211 14.930 1.00 . A A . 11 LYS CD 1 1 3 1539 1 1 11 LYS CE C -3.325 9.538 16.055 1.00 . A A . 11 LYS CE 1 1 3 1540 1 1 11 LYS CG C -2.159 9.275 13.759 1.00 . A A . 11 LYS CG 1 1 3 1541 1 1 11 LYS H H 0.776 6.032 14.169 1.00 . A A . 11 LYS H 1 1 3 1542 1 1 11 LYS HA H -1.763 6.743 12.695 1.00 . A A . 11 LYS HA 1 1 3 1543 1 1 11 LYS HB2 H -1.345 7.665 14.921 1.00 . A A . 11 LYS HB2 1 1 3 1544 1 1 11 LYS HB3 H -0.100 8.768 14.273 1.00 . A A . 11 LYS HB3 1 1 3 1545 1 1 11 LYS HD2 H -1.591 10.669 15.336 1.00 . A A . 11 LYS HD2 1 1 3 1546 1 1 11 LYS HD3 H -3.101 11.055 14.520 1.00 . A A . 11 LYS HD3 1 1 3 1547 1 1 11 LYS HE2 H -4.242 9.075 15.645 1.00 . A A . 11 LYS HE2 1 1 3 1548 1 1 11 LYS HE3 H -2.744 8.720 16.519 1.00 . A A . 11 LYS HE3 1 1 3 1549 1 1 11 LYS HG2 H -1.852 9.904 12.903 1.00 . A A . 11 LYS HG2 1 1 3 1550 1 1 11 LYS HG3 H -3.074 8.756 13.416 1.00 . A A . 11 LYS HG3 1 1 3 1551 1 1 11 LYS HZ1 H -4.270 10.043 17.819 1.00 . A A . 11 LYS HZ1 1 1 3 1552 1 1 11 LYS HZ2 H -4.307 11.235 16.701 1.00 . A A . 11 LYS HZ2 1 1 3 1553 1 1 11 LYS N N 0.130 6.115 13.375 1.00 . A A . 11 LYS N 1 1 3 1554 1 1 11 LYS NZ N -3.704 10.506 17.099 1.00 . A A . 11 LYS NZ 1 1 3 1555 1 1 11 LYS O O 1.006 8.377 11.683 1.00 . A A . 11 LYS O 1 1 3 1556 1 1 12 CYS C C -1.998 9.524 9.041 1.00 . A A . 12 CYS C 1 1 3 1557 1 1 12 CYS CA C -0.857 8.550 9.414 1.00 . A A . 12 CYS CA 1 1 3 1558 1 1 12 CYS CB C -0.836 7.371 8.402 1.00 . A A . 12 CYS CB 1 1 3 1559 1 1 12 CYS H H -1.933 7.716 11.237 1.00 . A A . 12 CYS H 1 1 3 1560 1 1 12 CYS HA H 0.113 9.088 9.365 1.00 . A A . 12 CYS HA 1 1 3 1561 1 1 12 CYS HB2 H -0.668 7.716 7.367 1.00 . A A . 12 CYS HB2 1 1 3 1562 1 1 12 CYS HB3 H -0.024 6.671 8.601 1.00 . A A . 12 CYS HB3 1 1 3 1563 1 1 12 CYS N N -1.061 8.016 10.779 1.00 . A A . 12 CYS N 1 1 3 1564 1 1 12 CYS O O -2.972 9.729 9.777 1.00 . A A . 12 CYS O 1 1 3 1565 1 1 12 CYS SG S -2.275 6.334 8.420 1.00 . A A . 12 CYS SG 1 1 3 1566 1 1 13 THR C C -2.898 10.620 5.694 1.00 . A A . 13 THR C 1 1 3 1567 1 1 13 THR CA C -2.979 10.893 7.227 1.00 . A A . 13 THR CA 1 1 3 1568 1 1 13 THR CB C -2.928 12.456 7.532 1.00 . A A . 13 THR CB 1 1 3 1569 1 1 13 THR CG2 C -2.081 12.912 8.742 1.00 . A A . 13 THR CG2 1 1 3 1570 1 1 13 THR H H -0.996 9.838 7.348 1.00 . A A . 13 THR H 1 1 3 1571 1 1 13 THR HA H -3.953 10.497 7.603 1.00 . A A . 13 THR HA 1 1 3 1572 1 1 13 THR HB H -3.986 12.757 7.649 1.00 . A A . 13 THR HB 1 1 3 1573 1 1 13 THR HG1 H -2.424 14.122 6.716 1.00 . A A . 13 THR HG1 1 1 3 1574 1 1 13 THR HG21 H -2.414 12.444 9.683 1.00 . A A . 13 THR HG21 1 1 3 1575 1 1 13 THR HG22 H -1.008 12.671 8.604 1.00 . A A . 13 THR HG22 1 1 3 1576 1 1 13 THR HG23 H -2.138 14.008 8.877 1.00 . A A . 13 THR HG23 1 1 3 1577 1 1 13 THR N N -1.861 10.118 7.845 1.00 . A A . 13 THR N 1 1 3 1578 1 1 13 THR O O -1.832 10.409 5.097 1.00 . A A . 13 THR O 1 1 3 1579 1 1 13 THR OG1 O -2.359 13.198 6.462 1.00 . A A . 13 THR OG1 1 1 3 1580 1 1 14 TRP C C -3.929 12.225 3.154 1.00 . A A . 14 TRP C 1 1 3 1581 1 1 14 TRP CA C -4.191 10.742 3.571 1.00 . A A . 14 TRP CA 1 1 3 1582 1 1 14 TRP CB C -5.582 10.207 3.127 1.00 . A A . 14 TRP CB 1 1 3 1583 1 1 14 TRP CD1 C -4.852 7.659 3.384 1.00 . A A . 14 TRP CD1 1 1 3 1584 1 1 14 TRP CD2 C -7.043 8.035 3.461 1.00 . A A . 14 TRP CD2 1 1 3 1585 1 1 14 TRP CE2 C -6.787 6.644 3.601 1.00 . A A . 14 TRP CE2 1 1 3 1586 1 1 14 TRP CE3 C -8.378 8.518 3.463 1.00 . A A . 14 TRP CE3 1 1 3 1587 1 1 14 TRP CG C -5.827 8.690 3.329 1.00 . A A . 14 TRP CG 1 1 3 1588 1 1 14 TRP CH2 C -9.164 6.228 3.743 1.00 . A A . 14 TRP CH2 1 1 3 1589 1 1 14 TRP CZ2 C -7.860 5.732 3.742 1.00 . A A . 14 TRP CZ2 1 1 3 1590 1 1 14 TRP CZ3 C -9.419 7.599 3.605 1.00 . A A . 14 TRP CZ3 1 1 3 1591 1 1 14 TRP H H -4.846 10.958 5.703 1.00 . A A . 14 TRP H 1 1 3 1592 1 1 14 TRP HA H -3.422 10.086 3.114 1.00 . A A . 14 TRP HA 1 1 3 1593 1 1 14 TRP HB2 H -6.385 10.784 3.625 1.00 . A A . 14 TRP HB2 1 1 3 1594 1 1 14 TRP HB3 H -5.715 10.417 2.049 1.00 . A A . 14 TRP HB3 1 1 3 1595 1 1 14 TRP HD1 H -3.786 7.813 3.301 1.00 . A A . 14 TRP HD1 1 1 3 1596 1 1 14 TRP HE1 H -4.952 5.485 3.630 1.00 . A A . 14 TRP HE1 1 1 3 1597 1 1 14 TRP HE3 H -8.591 9.572 3.356 1.00 . A A . 14 TRP HE3 1 1 3 1598 1 1 14 TRP HH2 H -9.992 5.542 3.853 1.00 . A A . 14 TRP HH2 1 1 3 1599 1 1 14 TRP HZ2 H -7.678 4.672 3.850 1.00 . A A . 14 TRP HZ2 1 1 3 1600 1 1 14 TRP HZ3 H -10.440 7.951 3.610 1.00 . A A . 14 TRP HZ3 1 1 3 1601 1 1 14 TRP N N -4.079 10.725 5.060 1.00 . A A . 14 TRP N 1 1 3 1602 1 1 14 TRP NE1 N -5.428 6.392 3.563 1.00 . A A . 14 TRP NE1 1 1 3 1603 1 1 14 TRP O O -4.784 13.110 3.264 1.00 . A A . 14 TRP O 1 1 3 1604 1 1 15 GLY C C -1.164 14.098 3.774 1.00 . A A . 15 GLY C 1 1 3 1605 1 1 15 GLY CA C -2.065 13.788 2.544 1.00 . A A . 15 GLY CA 1 1 3 1606 1 1 15 GLY H H -2.089 11.599 2.710 1.00 . A A . 15 GLY H 1 1 3 1607 1 1 15 GLY HA2 H -1.466 13.794 1.614 1.00 . A A . 15 GLY HA2 1 1 3 1608 1 1 15 GLY HA3 H -2.831 14.573 2.418 1.00 . A A . 15 GLY HA3 1 1 3 1609 1 1 15 GLY N N -2.670 12.445 2.740 1.00 . A A . 15 GLY N 1 1 3 1610 1 1 15 GLY O O -1.424 15.042 4.523 1.00 . A A . 15 GLY O 1 1 3 1611 1 1 16 GLY C C 1.852 12.212 5.005 1.00 . A A . 16 GLY C 1 1 3 1612 1 1 16 GLY CA C 0.700 13.212 5.188 1.00 . A A . 16 GLY CA 1 1 3 1613 1 1 16 GLY H H -0.065 12.535 3.243 1.00 . A A . 16 GLY H 1 1 3 1614 1 1 16 GLY HA2 H 1.081 14.172 5.564 1.00 . A A . 16 GLY HA2 1 1 3 1615 1 1 16 GLY HA3 H 0.047 12.856 6.008 1.00 . A A . 16 GLY HA3 1 1 3 1616 1 1 16 GLY N N -0.131 13.260 3.964 1.00 . A A . 16 GLY N 1 1 3 1617 1 1 16 GLY O O 2.301 11.902 3.894 1.00 . A A . 16 GLY O 1 1 3 1618 1 1 17 THR C C 2.371 9.241 6.022 1.00 . A A . 17 THR C 1 1 3 1619 1 1 17 THR CA C 3.254 10.530 6.162 1.00 . A A . 17 THR CA 1 1 3 1620 1 1 17 THR CB C 4.126 10.415 7.479 1.00 . A A . 17 THR CB 1 1 3 1621 1 1 17 THR CG2 C 5.478 9.723 7.198 1.00 . A A . 17 THR CG2 1 1 3 1622 1 1 17 THR H H 1.916 12.178 6.965 1.00 . A A . 17 THR H 1 1 3 1623 1 1 17 THR HA H 3.944 10.639 5.298 1.00 . A A . 17 THR HA 1 1 3 1624 1 1 17 THR HB H 3.607 9.789 8.241 1.00 . A A . 17 THR HB 1 1 3 1625 1 1 17 THR HG1 H 4.958 11.556 8.788 1.00 . A A . 17 THR HG1 1 1 3 1626 1 1 17 THR HG21 H 5.357 8.703 6.794 1.00 . A A . 17 THR HG21 1 1 3 1627 1 1 17 THR HG22 H 6.111 10.268 6.475 1.00 . A A . 17 THR HG22 1 1 3 1628 1 1 17 THR HG23 H 6.070 9.601 8.125 1.00 . A A . 17 THR HG23 1 1 3 1629 1 1 17 THR N N 2.308 11.690 6.151 1.00 . A A . 17 THR N 1 1 3 1630 1 1 17 THR O O 1.272 9.109 6.584 1.00 . A A . 17 THR O 1 1 3 1631 1 1 17 THR OG1 O 4.424 11.706 8.004 1.00 . A A . 17 THR OG1 1 1 3 1632 1 1 18 LYS C C 3.641 6.021 5.643 1.00 . A A . 18 LYS C 1 1 3 1633 1 1 18 LYS CA C 2.462 6.900 5.144 1.00 . A A . 18 LYS CA 1 1 3 1634 1 1 18 LYS CB C 2.027 6.534 3.692 1.00 . A A . 18 LYS CB 1 1 3 1635 1 1 18 LYS CD C 0.478 6.962 1.639 1.00 . A A . 18 LYS CD 1 1 3 1636 1 1 18 LYS CE C 1.456 6.645 0.486 1.00 . A A . 18 LYS CE 1 1 3 1637 1 1 18 LYS CG C 1.092 7.516 2.945 1.00 . A A . 18 LYS CG 1 1 3 1638 1 1 18 LYS H H 3.879 8.569 4.935 1.00 . A A . 18 LYS H 1 1 3 1639 1 1 18 LYS HA H 1.587 6.679 5.777 1.00 . A A . 18 LYS HA 1 1 3 1640 1 1 18 LYS HB2 H 2.918 6.267 3.103 1.00 . A A . 18 LYS HB2 1 1 3 1641 1 1 18 LYS HB3 H 1.486 5.569 3.758 1.00 . A A . 18 LYS HB3 1 1 3 1642 1 1 18 LYS HD2 H -0.089 6.043 1.879 1.00 . A A . 18 LYS HD2 1 1 3 1643 1 1 18 LYS HD3 H -0.289 7.672 1.277 1.00 . A A . 18 LYS HD3 1 1 3 1644 1 1 18 LYS HE2 H 2.231 5.930 0.817 1.00 . A A . 18 LYS HE2 1 1 3 1645 1 1 18 LYS HE3 H 0.907 6.130 -0.323 1.00 . A A . 18 LYS HE3 1 1 3 1646 1 1 18 LYS HG2 H 0.263 7.799 3.620 1.00 . A A . 18 LYS HG2 1 1 3 1647 1 1 18 LYS HG3 H 1.627 8.461 2.735 1.00 . A A . 18 LYS HG3 1 1 3 1648 1 1 18 LYS HZ1 H 1.394 8.475 -0.469 1.00 . A A . 18 LYS HZ1 1 1 3 1649 1 1 18 LYS HZ2 H 2.704 7.583 -0.866 1.00 . A A . 18 LYS HZ2 1 1 3 1650 1 1 18 LYS N N 2.941 8.304 5.255 1.00 . A A . 18 LYS N 1 1 3 1651 1 1 18 LYS NZ N 2.102 7.845 -0.078 1.00 . A A . 18 LYS NZ 1 1 3 1652 1 1 18 LYS O O 4.713 6.463 6.099 1.00 . A A . 18 LYS O 1 1 3 1653 1 1 19 CYS C C 5.574 3.549 5.374 1.00 . A A . 19 CYS C 1 1 3 1654 1 1 19 CYS CA C 4.324 3.764 6.274 1.00 . A A . 19 CYS CA 1 1 3 1655 1 1 19 CYS CB C 3.583 2.472 6.673 1.00 . A A . 19 CYS CB 1 1 3 1656 1 1 19 CYS H H 2.503 4.539 5.112 1.00 . A A . 19 CYS H 1 1 3 1657 1 1 19 CYS HA H 4.591 4.269 7.222 1.00 . A A . 19 CYS HA 1 1 3 1658 1 1 19 CYS HB2 H 2.759 2.230 5.980 1.00 . A A . 19 CYS HB2 1 1 3 1659 1 1 19 CYS HB3 H 4.258 1.592 6.678 1.00 . A A . 19 CYS HB3 1 1 3 1660 1 1 19 CYS N N 3.385 4.712 5.621 1.00 . A A . 19 CYS N 1 1 3 1661 1 1 19 CYS O O 5.598 3.553 4.141 1.00 . A A . 19 CYS O 1 1 3 1662 1 1 19 CYS SG S 2.954 2.808 8.328 1.00 . A A . 19 CYS SG 1 1 3 1663 1 1 20 CYS C C 8.555 2.783 4.636 1.00 . A A . 20 CYS C 1 1 3 1664 1 1 20 CYS CA C 8.063 3.604 5.860 1.00 . A A . 20 CYS CA 1 1 3 1665 1 1 20 CYS CB C 8.872 3.153 7.098 1.00 . A A . 20 CYS CB 1 1 3 1666 1 1 20 CYS H H 6.356 3.489 7.189 1.00 . A A . 20 CYS H 1 1 3 1667 1 1 20 CYS HA H 8.147 4.687 5.763 1.00 . A A . 20 CYS HA 1 1 3 1668 1 1 20 CYS HB2 H 8.395 3.518 8.011 1.00 . A A . 20 CYS HB2 1 1 3 1669 1 1 20 CYS HB3 H 8.956 2.054 7.205 1.00 . A A . 20 CYS HB3 1 1 3 1670 1 1 20 CYS N N 6.634 3.483 6.201 1.00 . A A . 20 CYS N 1 1 3 1671 1 1 20 CYS O O 9.206 3.360 3.760 1.00 . A A . 20 CYS O 1 1 3 1672 1 1 20 CYS SG S 10.508 3.913 7.042 1.00 . A A . 20 CYS SG 1 1 3 1673 1 1 21 ARG C C 7.668 0.445 2.308 1.00 . A A . 21 ARG C 1 1 3 1674 1 1 21 ARG CA C 8.709 0.570 3.471 1.00 . A A . 21 ARG CA 1 1 3 1675 1 1 21 ARG CB C 9.015 -0.816 4.117 1.00 . A A . 21 ARG CB 1 1 3 1676 1 1 21 ARG CD C 10.466 -2.269 5.651 1.00 . A A . 21 ARG CD 1 1 3 1677 1 1 21 ARG CG C 10.236 -0.864 5.069 1.00 . A A . 21 ARG CG 1 1 3 1678 1 1 21 ARG CZ C 12.132 -3.227 7.280 1.00 . A A . 21 ARG CZ 1 1 3 1679 1 1 21 ARG H H 7.596 1.223 5.314 1.00 . A A . 21 ARG H 1 1 3 1680 1 1 21 ARG HA H 9.603 0.998 2.996 1.00 . A A . 21 ARG HA 1 1 3 1681 1 1 21 ARG HB2 H 8.116 -1.200 4.638 1.00 . A A . 21 ARG HB2 1 1 3 1682 1 1 21 ARG HB3 H 9.209 -1.550 3.311 1.00 . A A . 21 ARG HB3 1 1 3 1683 1 1 21 ARG HD2 H 9.563 -2.609 6.193 1.00 . A A . 21 ARG HD2 1 1 3 1684 1 1 21 ARG HD3 H 10.635 -2.998 4.835 1.00 . A A . 21 ARG HD3 1 1 3 1685 1 1 21 ARG HG2 H 11.138 -0.527 4.524 1.00 . A A . 21 ARG HG2 1 1 3 1686 1 1 21 ARG HG3 H 10.094 -0.143 5.896 1.00 . A A . 21 ARG HG3 1 1 3 1687 1 1 21 ARG HH11 H 10.811 -4.628 6.701 1.00 . A A . 21 ARG HH11 1 1 3 1688 1 1 21 ARG HH12 H 12.108 -5.142 7.892 1.00 . A A . 21 ARG HH12 1 1 3 1689 1 1 21 ARG HH21 H 13.552 -2.010 7.996 1.00 . A A . 21 ARG HH21 1 1 3 1690 1 1 21 ARG HH22 H 13.563 -3.750 8.579 1.00 . A A . 21 ARG HH22 1 1 3 1691 1 1 21 ARG N N 8.269 1.469 4.590 1.00 . A A . 21 ARG N 1 1 3 1692 1 1 21 ARG NE N 11.639 -2.282 6.580 1.00 . A A . 21 ARG NE 1 1 3 1693 1 1 21 ARG NH1 N 11.632 -4.460 7.292 1.00 . A A . 21 ARG NH1 1 1 3 1694 1 1 21 ARG NH2 N 13.189 -2.970 8.027 1.00 . A A . 21 ARG NH2 1 1 3 1695 1 1 21 ARG O O 7.515 -0.595 1.658 1.00 . A A . 21 ARG O 1 1 3 1696 1 1 22 GLY C C 4.655 0.968 1.250 1.00 . A A . 22 GLY C 1 1 3 1697 1 1 22 GLY CA C 5.969 1.713 0.990 1.00 . A A . 22 GLY CA 1 1 3 1698 1 1 22 GLY H H 7.211 2.223 2.810 1.00 . A A . 22 GLY H 1 1 3 1699 1 1 22 GLY HA2 H 5.760 2.790 0.845 1.00 . A A . 22 GLY HA2 1 1 3 1700 1 1 22 GLY HA3 H 6.374 1.376 0.033 1.00 . A A . 22 GLY HA3 1 1 3 1701 1 1 22 GLY N N 7.000 1.568 2.043 1.00 . A A . 22 GLY N 1 1 3 1702 1 1 22 GLY O O 4.252 0.094 0.477 1.00 . A A . 22 GLY O 1 1 3 1703 1 1 23 ARG C C 1.659 1.596 3.043 1.00 . A A . 23 ARG C 1 1 3 1704 1 1 23 ARG CA C 2.872 0.612 2.923 1.00 . A A . 23 ARG CA 1 1 3 1705 1 1 23 ARG CB C 3.266 0.016 4.302 1.00 . A A . 23 ARG CB 1 1 3 1706 1 1 23 ARG CD C 3.490 -2.488 3.448 1.00 . A A . 23 ARG CD 1 1 3 1707 1 1 23 ARG CG C 4.025 -1.331 4.321 1.00 . A A . 23 ARG CG 1 1 3 1708 1 1 23 ARG CZ C 1.254 -3.611 3.124 1.00 . A A . 23 ARG CZ 1 1 3 1709 1 1 23 ARG H H 4.637 1.960 2.922 1.00 . A A . 23 ARG H 1 1 3 1710 1 1 23 ARG HA H 2.588 -0.237 2.285 1.00 . A A . 23 ARG HA 1 1 3 1711 1 1 23 ARG HB2 H 3.917 0.727 4.823 1.00 . A A . 23 ARG HB2 1 1 3 1712 1 1 23 ARG HB3 H 2.379 -0.082 4.956 1.00 . A A . 23 ARG HB3 1 1 3 1713 1 1 23 ARG HD2 H 3.642 -2.249 2.379 1.00 . A A . 23 ARG HD2 1 1 3 1714 1 1 23 ARG HD3 H 4.094 -3.396 3.629 1.00 . A A . 23 ARG HD3 1 1 3 1715 1 1 23 ARG HG2 H 5.074 -1.132 4.032 1.00 . A A . 23 ARG HG2 1 1 3 1716 1 1 23 ARG HG3 H 4.090 -1.663 5.376 1.00 . A A . 23 ARG HG3 1 1 3 1717 1 1 23 ARG HH11 H 2.632 -4.381 1.879 1.00 . A A . 23 ARG HH11 1 1 3 1718 1 1 23 ARG HH12 H 0.929 -5.057 1.765 1.00 . A A . 23 ARG HH12 1 1 3 1719 1 1 23 ARG HH21 H -0.283 -3.003 4.252 1.00 . A A . 23 ARG HH21 1 1 3 1720 1 1 23 ARG HH22 H -0.614 -4.324 3.023 1.00 . A A . 23 ARG HH22 1 1 3 1721 1 1 23 ARG N N 4.031 1.342 2.366 1.00 . A A . 23 ARG N 1 1 3 1722 1 1 23 ARG NE N 2.039 -2.786 3.697 1.00 . A A . 23 ARG NE 1 1 3 1723 1 1 23 ARG NH1 N 1.645 -4.434 2.156 1.00 . A A . 23 ARG NH1 1 1 3 1724 1 1 23 ARG NH2 N -0.009 -3.650 3.505 1.00 . A A . 23 ARG NH2 1 1 3 1725 1 1 23 ARG O O 1.784 2.617 3.738 1.00 . A A . 23 ARG O 1 1 3 1726 1 1 24 PRO C C -1.318 2.300 3.996 1.00 . A A . 24 PRO C 1 1 3 1727 1 1 24 PRO CA C -0.754 2.163 2.543 1.00 . A A . 24 PRO CA 1 1 3 1728 1 1 24 PRO CB C -1.759 1.444 1.607 1.00 . A A . 24 PRO CB 1 1 3 1729 1 1 24 PRO CD C 0.305 0.260 1.391 1.00 . A A . 24 PRO CD 1 1 3 1730 1 1 24 PRO CG C -0.918 0.689 0.589 1.00 . A A . 24 PRO CG 1 1 3 1731 1 1 24 PRO HA H -0.541 3.189 2.180 1.00 . A A . 24 PRO HA 1 1 3 1732 1 1 24 PRO HB2 H -2.383 0.716 2.163 1.00 . A A . 24 PRO HB2 1 1 3 1733 1 1 24 PRO HB3 H -2.457 2.152 1.124 1.00 . A A . 24 PRO HB3 1 1 3 1734 1 1 24 PRO HD2 H 0.151 -0.715 1.890 1.00 . A A . 24 PRO HD2 1 1 3 1735 1 1 24 PRO HD3 H 1.173 0.163 0.712 1.00 . A A . 24 PRO HD3 1 1 3 1736 1 1 24 PRO HG2 H -1.455 -0.168 0.141 1.00 . A A . 24 PRO HG2 1 1 3 1737 1 1 24 PRO HG3 H -0.622 1.361 -0.239 1.00 . A A . 24 PRO HG3 1 1 3 1738 1 1 24 PRO N N 0.474 1.330 2.401 1.00 . A A . 24 PRO N 1 1 3 1739 1 1 24 PRO O O -0.808 1.725 4.966 1.00 . A A . 24 PRO O 1 1 3 1740 1 1 25 CYS C C -4.635 3.019 5.185 1.00 . A A . 25 CYS C 1 1 3 1741 1 1 25 CYS CA C -3.117 3.326 5.377 1.00 . A A . 25 CYS CA 1 1 3 1742 1 1 25 CYS CB C -2.893 4.798 5.824 1.00 . A A . 25 CYS CB 1 1 3 1743 1 1 25 CYS H H -2.716 3.506 3.220 1.00 . A A . 25 CYS H 1 1 3 1744 1 1 25 CYS HA H -2.720 2.661 6.170 1.00 . A A . 25 CYS HA 1 1 3 1745 1 1 25 CYS HB2 H -2.439 5.397 5.023 1.00 . A A . 25 CYS HB2 1 1 3 1746 1 1 25 CYS HB3 H -3.844 5.269 6.125 1.00 . A A . 25 CYS HB3 1 1 3 1747 1 1 25 CYS N N -2.399 3.090 4.103 1.00 . A A . 25 CYS N 1 1 3 1748 1 1 25 CYS O O -5.224 3.168 4.108 1.00 . A A . 25 CYS O 1 1 3 1749 1 1 25 CYS SG S -1.800 4.813 7.230 1.00 . A A . 25 CYS SG 1 1 3 1750 1 1 26 ARG C C -7.036 3.247 7.728 1.00 . A A . 26 ARG C 1 1 3 1751 1 1 26 ARG CA C -6.709 2.431 6.454 1.00 . A A . 26 ARG CA 1 1 3 1752 1 1 26 ARG CB C -7.106 0.934 6.577 1.00 . A A . 26 ARG CB 1 1 3 1753 1 1 26 ARG CD C -9.475 1.036 5.505 1.00 . A A . 26 ARG CD 1 1 3 1754 1 1 26 ARG CG C -8.616 0.630 6.720 1.00 . A A . 26 ARG CG 1 1 3 1755 1 1 26 ARG CZ C -11.895 0.963 4.859 1.00 . A A . 26 ARG CZ 1 1 3 1756 1 1 26 ARG H H -4.664 2.673 7.147 1.00 . A A . 26 ARG H 1 1 3 1757 1 1 26 ARG HA H -7.228 2.859 5.572 1.00 . A A . 26 ARG HA 1 1 3 1758 1 1 26 ARG HB2 H -6.725 0.384 5.695 1.00 . A A . 26 ARG HB2 1 1 3 1759 1 1 26 ARG HB3 H -6.579 0.480 7.438 1.00 . A A . 26 ARG HB3 1 1 3 1760 1 1 26 ARG HD2 H -9.399 2.127 5.336 1.00 . A A . 26 ARG HD2 1 1 3 1761 1 1 26 ARG HD3 H -9.091 0.548 4.589 1.00 . A A . 26 ARG HD3 1 1 3 1762 1 1 26 ARG HG2 H -8.730 -0.457 6.899 1.00 . A A . 26 ARG HG2 1 1 3 1763 1 1 26 ARG HG3 H -9.003 1.116 7.636 1.00 . A A . 26 ARG HG3 1 1 3 1764 1 1 26 ARG HH11 H -10.770 1.927 3.497 1.00 . A A . 26 ARG HH11 1 1 3 1765 1 1 26 ARG HH12 H -12.567 1.795 3.154 1.00 . A A . 26 ARG HH12 1 1 3 1766 1 1 26 ARG HH21 H -13.220 0.054 6.054 1.00 . A A . 26 ARG HH21 1 1 3 1767 1 1 26 ARG HH22 H -13.860 0.804 4.506 1.00 . A A . 26 ARG HH22 1 1 3 1768 1 1 26 ARG N N -5.243 2.585 6.300 1.00 . A A . 26 ARG N 1 1 3 1769 1 1 26 ARG NE N -10.896 0.665 5.712 1.00 . A A . 26 ARG NE 1 1 3 1770 1 1 26 ARG NH1 N -11.727 1.631 3.719 1.00 . A A . 26 ARG NH1 1 1 3 1771 1 1 26 ARG NH2 N -13.115 0.567 5.172 1.00 . A A . 26 ARG NH2 1 1 3 1772 1 1 26 ARG O O -6.465 3.012 8.805 1.00 . A A . 26 ARG O 1 1 3 1773 1 1 27 CYS C C -8.924 4.643 9.915 1.00 . A A . 27 CYS C 1 1 3 1774 1 1 27 CYS CA C -8.117 5.219 8.701 1.00 . A A . 27 CYS CA 1 1 3 1775 1 1 27 CYS CB C -8.861 6.455 8.148 1.00 . A A . 27 CYS CB 1 1 3 1776 1 1 27 CYS H H -8.339 4.366 6.672 1.00 . A A . 27 CYS H 1 1 3 1777 1 1 27 CYS HA H -7.088 5.509 8.971 1.00 . A A . 27 CYS HA 1 1 3 1778 1 1 27 CYS HB2 H -9.880 6.215 7.864 1.00 . A A . 27 CYS HB2 1 1 3 1779 1 1 27 CYS HB3 H -8.965 7.227 8.933 1.00 . A A . 27 CYS HB3 1 1 3 1780 1 1 27 CYS N N -7.939 4.237 7.608 1.00 . A A . 27 CYS N 1 1 3 1781 1 1 27 CYS O O -9.561 3.585 9.859 1.00 . A A . 27 CYS O 1 1 3 1782 1 1 27 CYS SG S -7.969 7.213 6.789 1.00 . A A . 27 CYS SG 1 1 3 1783 1 1 28 SER C C -11.246 5.226 12.005 1.00 . A A . 28 SER C 1 1 3 1784 1 1 28 SER CA C -9.697 5.194 12.249 1.00 . A A . 28 SER CA 1 1 3 1785 1 1 28 SER CB C -9.218 6.305 13.231 1.00 . A A . 28 SER CB 1 1 3 1786 1 1 28 SER H H -8.303 6.255 10.909 1.00 . A A . 28 SER H 1 1 3 1787 1 1 28 SER HA H -9.480 4.202 12.688 1.00 . A A . 28 SER HA 1 1 3 1788 1 1 28 SER HB2 H -9.222 7.308 12.761 1.00 . A A . 28 SER HB2 1 1 3 1789 1 1 28 SER HB3 H -9.877 6.416 14.109 1.00 . A A . 28 SER HB3 1 1 3 1790 1 1 28 SER HG H -7.345 5.957 12.961 1.00 . A A . 28 SER HG 1 1 3 1791 1 1 28 SER N N -8.890 5.420 11.016 1.00 . A A . 28 SER N 1 1 3 1792 1 1 28 SER O O -11.751 5.403 10.890 1.00 . A A . 28 SER O 1 1 3 1793 1 1 28 SER OG O -7.920 6.000 13.729 1.00 . A A . 28 SER OG 1 1 3 1794 1 1 29 MET C C -14.254 6.152 12.681 1.00 . A A . 29 MET C 1 1 3 1795 1 1 29 MET CA C -13.474 4.870 13.118 1.00 . A A . 29 MET CA 1 1 3 1796 1 1 29 MET CB C -13.885 4.504 14.574 1.00 . A A . 29 MET CB 1 1 3 1797 1 1 29 MET CE C -11.335 3.245 16.482 1.00 . A A . 29 MET CE 1 1 3 1798 1 1 29 MET CG C -13.704 3.025 14.972 1.00 . A A . 29 MET CG 1 1 3 1799 1 1 29 MET H H -11.438 5.040 13.966 1.00 . A A . 29 MET H 1 1 3 1800 1 1 29 MET HA H -13.771 4.057 12.427 1.00 . A A . 29 MET HA 1 1 3 1801 1 1 29 MET HB2 H -13.375 5.156 15.310 1.00 . A A . 29 MET HB2 1 1 3 1802 1 1 29 MET HB3 H -14.953 4.749 14.716 1.00 . A A . 29 MET HB3 1 1 3 1803 1 1 29 MET HE1 H -11.924 2.913 17.356 1.00 . A A . 29 MET HE1 1 1 3 1804 1 1 29 MET HE2 H -10.283 2.950 16.644 1.00 . A A . 29 MET HE2 1 1 3 1805 1 1 29 MET HE3 H -11.375 4.349 16.434 1.00 . A A . 29 MET HE3 1 1 3 1806 1 1 29 MET HG2 H -14.127 2.845 15.978 1.00 . A A . 29 MET HG2 1 1 3 1807 1 1 29 MET HG3 H -14.272 2.374 14.284 1.00 . A A . 29 MET HG3 1 1 3 1808 1 1 29 MET N N -11.987 5.018 13.104 1.00 . A A . 29 MET N 1 1 3 1809 1 1 29 MET O O -15.320 6.029 12.072 1.00 . A A . 29 MET O 1 1 3 1810 1 1 29 MET SD S -11.968 2.510 14.958 1.00 . A A . 29 MET SD 1 1 3 1811 1 1 30 ILE C C -14.032 8.862 11.026 1.00 . A A . 30 ILE C 1 1 3 1812 1 1 30 ILE CA C -14.326 8.650 12.554 1.00 . A A . 30 ILE CA 1 1 3 1813 1 1 30 ILE CB C -13.740 9.812 13.458 1.00 . A A . 30 ILE CB 1 1 3 1814 1 1 30 ILE CD1 C -15.494 9.429 15.441 1.00 . A A . 30 ILE CD1 1 1 3 1815 1 1 30 ILE CG1 C -14.033 9.611 14.985 1.00 . A A . 30 ILE CG1 1 1 3 1816 1 1 30 ILE CG2 C -14.349 11.178 13.035 1.00 . A A . 30 ILE CG2 1 1 3 1817 1 1 30 ILE H H -12.779 7.253 13.377 1.00 . A A . 30 ILE H 1 1 3 1818 1 1 30 ILE HA H -15.421 8.611 12.676 1.00 . A A . 30 ILE HA 1 1 3 1819 1 1 30 ILE HB H -12.640 9.871 13.336 1.00 . A A . 30 ILE HB 1 1 3 1820 1 1 30 ILE HD11 H -16.123 10.298 15.177 1.00 . A A . 30 ILE HD11 1 1 3 1821 1 1 30 ILE HD12 H -15.957 8.531 14.993 1.00 . A A . 30 ILE HD12 1 1 3 1822 1 1 30 ILE HD13 H -15.552 9.308 16.538 1.00 . A A . 30 ILE HD13 1 1 3 1823 1 1 30 ILE HG12 H -13.456 8.740 15.346 1.00 . A A . 30 ILE HG12 1 1 3 1824 1 1 30 ILE HG13 H -13.600 10.460 15.548 1.00 . A A . 30 ILE HG13 1 1 3 1825 1 1 30 ILE HG21 H -15.455 11.178 13.062 1.00 . A A . 30 ILE HG21 1 1 3 1826 1 1 30 ILE HG22 H -14.003 12.002 13.687 1.00 . A A . 30 ILE HG22 1 1 3 1827 1 1 30 ILE HG23 H -14.051 11.459 12.008 1.00 . A A . 30 ILE HG23 1 1 3 1828 1 1 30 ILE N N -13.727 7.351 12.989 1.00 . A A . 30 ILE N 1 1 3 1829 1 1 30 ILE O O -14.979 9.014 10.249 1.00 . A A . 30 ILE O 1 1 3 1830 1 1 31 GLY C C -10.989 10.007 9.222 1.00 . A A . 31 GLY C 1 1 3 1831 1 1 31 GLY CA C -12.340 9.270 9.253 1.00 . A A . 31 GLY CA 1 1 3 1832 1 1 31 GLY H H -12.100 8.808 11.415 1.00 . A A . 31 GLY H 1 1 3 1833 1 1 31 GLY HA2 H -12.271 8.356 8.636 1.00 . A A . 31 GLY HA2 1 1 3 1834 1 1 31 GLY HA3 H -13.102 9.905 8.761 1.00 . A A . 31 GLY HA3 1 1 3 1835 1 1 31 GLY N N -12.751 8.883 10.625 1.00 . A A . 31 GLY N 1 1 3 1836 1 1 31 GLY O O -10.062 9.582 8.528 1.00 . A A . 31 GLY O 1 1 3 1837 1 1 32 THR C C -8.823 11.081 11.376 1.00 . A A . 32 THR C 1 1 3 1838 1 1 32 THR CA C -9.607 11.818 10.241 1.00 . A A . 32 THR CA 1 1 3 1839 1 1 32 THR CB C -9.859 13.303 10.666 1.00 . A A . 32 THR CB 1 1 3 1840 1 1 32 THR CG2 C -10.474 14.147 9.532 1.00 . A A . 32 THR CG2 1 1 3 1841 1 1 32 THR H H -11.705 11.212 10.610 1.00 . A A . 32 THR H 1 1 3 1842 1 1 32 THR HA H -8.993 11.816 9.317 1.00 . A A . 32 THR HA 1 1 3 1843 1 1 32 THR HB H -8.880 13.739 10.947 1.00 . A A . 32 THR HB 1 1 3 1844 1 1 32 THR HG1 H -11.581 12.981 11.471 1.00 . A A . 32 THR HG1 1 1 3 1845 1 1 32 THR HG21 H -9.833 14.144 8.631 1.00 . A A . 32 THR HG21 1 1 3 1846 1 1 32 THR HG22 H -11.473 13.783 9.231 1.00 . A A . 32 THR HG22 1 1 3 1847 1 1 32 THR HG23 H -10.592 15.202 9.840 1.00 . A A . 32 THR HG23 1 1 3 1848 1 1 32 THR N N -10.897 11.112 9.984 1.00 . A A . 32 THR N 1 1 3 1849 1 1 32 THR O O -9.383 10.306 12.162 1.00 . A A . 32 THR O 1 1 3 1850 1 1 32 THR OG1 O -10.757 13.368 11.775 1.00 . A A . 32 THR OG1 1 1 3 1851 1 1 33 ASN C C -6.415 9.118 11.767 1.00 . A A . 33 ASN C 1 1 3 1852 1 1 33 ASN CA C -6.488 10.599 12.253 1.00 . A A . 33 ASN CA 1 1 3 1853 1 1 33 ASN CB C -6.839 10.680 13.782 1.00 . A A . 33 ASN CB 1 1 3 1854 1 1 33 ASN CG C -6.589 12.057 14.426 1.00 . A A . 33 ASN CG 1 1 3 1855 1 1 33 ASN H H -7.170 11.889 10.615 1.00 . A A . 33 ASN H 1 1 3 1856 1 1 33 ASN HA H -5.492 11.056 12.090 1.00 . A A . 33 ASN HA 1 1 3 1857 1 1 33 ASN HB2 H -7.865 10.331 13.996 1.00 . A A . 33 ASN HB2 1 1 3 1858 1 1 33 ASN HB3 H -6.229 9.940 14.335 1.00 . A A . 33 ASN HB3 1 1 3 1859 1 1 33 ASN HD21 H -8.554 12.462 14.393 1.00 . A A . 33 ASN HD21 1 1 3 1860 1 1 33 ASN HD22 H -7.443 13.745 15.092 1.00 . A A . 33 ASN HD22 1 1 3 1861 1 1 33 ASN N N -7.494 11.330 11.412 1.00 . A A . 33 ASN N 1 1 3 1862 1 1 33 ASN ND2 N -7.636 12.835 14.660 1.00 . A A . 33 ASN ND2 1 1 3 1863 1 1 33 ASN O O -6.775 8.185 12.490 1.00 . A A . 33 ASN O 1 1 3 1864 1 1 33 ASN OD1 O -5.454 12.429 14.720 1.00 . A A . 33 ASN OD1 1 1 3 1865 1 1 34 CYS C C -4.721 6.686 10.635 1.00 . A A . 34 CYS C 1 1 3 1866 1 1 34 CYS CA C -5.817 7.548 9.931 1.00 . A A . 34 CYS CA 1 1 3 1867 1 1 34 CYS CB C -5.479 7.677 8.429 1.00 . A A . 34 CYS CB 1 1 3 1868 1 1 34 CYS H H -5.792 9.779 9.995 1.00 . A A . 34 CYS H 1 1 3 1869 1 1 34 CYS HA H -6.801 7.068 10.026 1.00 . A A . 34 CYS HA 1 1 3 1870 1 1 34 CYS HB2 H -4.501 8.129 8.301 1.00 . A A . 34 CYS HB2 1 1 3 1871 1 1 34 CYS HB3 H -5.405 6.675 7.965 1.00 . A A . 34 CYS HB3 1 1 3 1872 1 1 34 CYS N N -5.915 8.910 10.531 1.00 . A A . 34 CYS N 1 1 3 1873 1 1 34 CYS O O -3.894 7.216 11.386 1.00 . A A . 34 CYS O 1 1 3 1874 1 1 34 CYS SG S -6.770 8.587 7.577 1.00 . A A . 34 CYS SG 1 1 3 1875 1 1 35 GLU C C -3.093 3.531 9.751 1.00 . A A . 35 GLU C 1 1 3 1876 1 1 35 GLU CA C -3.585 4.490 10.890 1.00 . A A . 35 GLU CA 1 1 3 1877 1 1 35 GLU CB C -4.001 3.636 12.127 1.00 . A A . 35 GLU CB 1 1 3 1878 1 1 35 GLU CD C -5.222 3.246 14.338 1.00 . A A . 35 GLU CD 1 1 3 1879 1 1 35 GLU CG C -4.999 4.200 13.163 1.00 . A A . 35 GLU CG 1 1 3 1880 1 1 35 GLU H H -5.464 5.042 9.755 1.00 . A A . 35 GLU H 1 1 3 1881 1 1 35 GLU HA H -2.731 5.136 11.179 1.00 . A A . 35 GLU HA 1 1 3 1882 1 1 35 GLU HB2 H -4.272 2.616 11.803 1.00 . A A . 35 GLU HB2 1 1 3 1883 1 1 35 GLU HB3 H -3.061 3.461 12.680 1.00 . A A . 35 GLU HB3 1 1 3 1884 1 1 35 GLU HE2 H -4.431 2.814 16.063 1.00 . A A . 35 GLU HE2 1 1 3 1885 1 1 35 GLU HG2 H -4.640 5.179 13.535 1.00 . A A . 35 GLU HG2 1 1 3 1886 1 1 35 GLU HG3 H -5.970 4.402 12.677 1.00 . A A . 35 GLU HG3 1 1 3 1887 1 1 35 GLU N N -4.715 5.354 10.399 1.00 . A A . 35 GLU N 1 1 3 1888 1 1 35 GLU O O -3.688 3.411 8.680 1.00 . A A . 35 GLU O 1 1 3 1889 1 1 35 GLU OE1 O -6.135 2.422 14.377 1.00 . A A . 35 GLU OE1 1 1 3 1890 1 1 35 GLU OE2 O -4.288 3.415 15.328 1.00 . A A . 35 GLU OE2 1 1 3 1891 1 1 36 CYS C C -1.649 0.592 8.916 1.00 . A A . 36 CYS C 1 1 3 1892 1 1 36 CYS CA C -1.190 2.073 8.999 1.00 . A A . 36 CYS CA 1 1 3 1893 1 1 36 CYS CB C 0.322 2.133 9.392 1.00 . A A . 36 CYS CB 1 1 3 1894 1 1 36 CYS H H -1.704 2.950 11.007 1.00 . A A . 36 CYS H 1 1 3 1895 1 1 36 CYS HA H -1.331 2.556 7.999 1.00 . A A . 36 CYS HA 1 1 3 1896 1 1 36 CYS HB2 H 0.489 2.152 10.489 1.00 . A A . 36 CYS HB2 1 1 3 1897 1 1 36 CYS HB3 H 0.901 1.221 9.143 1.00 . A A . 36 CYS HB3 1 1 3 1898 1 1 36 CYS N N -1.960 2.854 10.017 1.00 . A A . 36 CYS N 1 1 3 1899 1 1 36 CYS O O -2.269 0.030 9.825 1.00 . A A . 36 CYS O 1 1 3 1900 1 1 36 CYS SG S 1.094 3.452 8.474 1.00 . A A . 36 CYS SG 1 1 3 1901 1 1 37 THR C C -0.254 -2.311 7.691 1.00 . A A . 37 THR C 1 1 3 1902 1 1 37 THR CA C -1.573 -1.464 7.498 1.00 . A A . 37 THR CA 1 1 3 1903 1 1 37 THR CB C -2.105 -1.654 6.038 1.00 . A A . 37 THR CB 1 1 3 1904 1 1 37 THR CG2 C -3.484 -0.992 5.840 1.00 . A A . 37 THR CG2 1 1 3 1905 1 1 37 THR H H -0.850 0.581 7.070 1.00 . A A . 37 THR H 1 1 3 1906 1 1 37 THR HA H -2.348 -1.831 8.197 1.00 . A A . 37 THR HA 1 1 3 1907 1 1 37 THR HB H -2.198 -2.740 5.844 1.00 . A A . 37 THR HB 1 1 3 1908 1 1 37 THR HG1 H -1.163 -0.143 5.303 1.00 . A A . 37 THR HG1 1 1 3 1909 1 1 37 THR HG21 H -4.229 -1.385 6.557 1.00 . A A . 37 THR HG21 1 1 3 1910 1 1 37 THR HG22 H -3.444 0.105 5.978 1.00 . A A . 37 THR HG22 1 1 3 1911 1 1 37 THR HG23 H -3.878 -1.179 4.825 1.00 . A A . 37 THR HG23 1 1 3 1912 1 1 37 THR N N -1.294 -0.025 7.772 1.00 . A A . 37 THR N 1 1 3 1913 1 1 37 THR O O 0.836 -1.822 7.367 1.00 . A A . 37 THR O 1 1 3 1914 1 1 37 THR OG1 O -1.209 -1.077 5.089 1.00 . A A . 37 THR OG1 1 1 3 1915 1 1 38 PRO C C 1.506 -4.968 7.006 1.00 . A A . 38 PRO C 1 1 3 1916 1 1 38 PRO CA C 0.879 -4.473 8.344 1.00 . A A . 38 PRO CA 1 1 3 1917 1 1 38 PRO CB C 0.313 -5.639 9.182 1.00 . A A . 38 PRO CB 1 1 3 1918 1 1 38 PRO CD C -1.557 -4.269 8.559 1.00 . A A . 38 PRO CD 1 1 3 1919 1 1 38 PRO CG C -1.168 -5.725 8.805 1.00 . A A . 38 PRO CG 1 1 3 1920 1 1 38 PRO HA H 1.668 -3.943 8.913 1.00 . A A . 38 PRO HA 1 1 3 1921 1 1 38 PRO HB2 H 0.828 -6.603 9.036 1.00 . A A . 38 PRO HB2 1 1 3 1922 1 1 38 PRO HB3 H 0.416 -5.416 10.258 1.00 . A A . 38 PRO HB3 1 1 3 1923 1 1 38 PRO HD2 H -2.313 -4.142 7.782 1.00 . A A . 38 PRO HD2 1 1 3 1924 1 1 38 PRO HD3 H -1.999 -3.830 9.462 1.00 . A A . 38 PRO HD3 1 1 3 1925 1 1 38 PRO HG2 H -1.296 -6.319 7.880 1.00 . A A . 38 PRO HG2 1 1 3 1926 1 1 38 PRO HG3 H -1.780 -6.202 9.591 1.00 . A A . 38 PRO HG3 1 1 3 1927 1 1 38 PRO N N -0.307 -3.591 8.174 1.00 . A A . 38 PRO N 1 1 3 1928 1 1 38 PRO O O 0.785 -5.269 6.049 1.00 . A A . 38 PRO O 1 1 3 1929 1 1 39 ARG C C 3.454 -7.172 5.714 1.00 . A A . 39 ARG C 1 1 3 1930 1 1 39 ARG CA C 3.571 -5.616 5.781 1.00 . A A . 39 ARG CA 1 1 3 1931 1 1 39 ARG CB C 5.060 -5.171 5.841 1.00 . A A . 39 ARG CB 1 1 3 1932 1 1 39 ARG CD C 7.403 -5.038 6.953 1.00 . A A . 39 ARG CD 1 1 3 1933 1 1 39 ARG CG C 5.959 -5.582 7.036 1.00 . A A . 39 ARG CG 1 1 3 1934 1 1 39 ARG CZ C 8.526 -5.406 4.723 1.00 . A A . 39 ARG CZ 1 1 3 1935 1 1 39 ARG H H 3.332 -4.838 7.840 1.00 . A A . 39 ARG H 1 1 3 1936 1 1 39 ARG HA H 3.125 -5.183 4.864 1.00 . A A . 39 ARG HA 1 1 3 1937 1 1 39 ARG HB2 H 5.540 -5.521 4.908 1.00 . A A . 39 ARG HB2 1 1 3 1938 1 1 39 ARG HB3 H 5.088 -4.068 5.758 1.00 . A A . 39 ARG HB3 1 1 3 1939 1 1 39 ARG HD2 H 7.404 -3.948 6.759 1.00 . A A . 39 ARG HD2 1 1 3 1940 1 1 39 ARG HD3 H 7.865 -5.136 7.953 1.00 . A A . 39 ARG HD3 1 1 3 1941 1 1 39 ARG HG2 H 5.501 -5.204 7.969 1.00 . A A . 39 ARG HG2 1 1 3 1942 1 1 39 ARG HG3 H 5.978 -6.682 7.149 1.00 . A A . 39 ARG HG3 1 1 3 1943 1 1 39 ARG HH11 H 7.364 -3.764 4.704 1.00 . A A . 39 ARG HH11 1 1 3 1944 1 1 39 ARG HH12 H 8.267 -4.167 3.159 1.00 . A A . 39 ARG HH12 1 1 3 1945 1 1 39 ARG HH21 H 9.737 -6.982 4.485 1.00 . A A . 39 ARG HH21 1 1 3 1946 1 1 39 ARG HH22 H 9.517 -5.865 3.046 1.00 . A A . 39 ARG HH22 1 1 3 1947 1 1 39 ARG N N 2.846 -5.103 6.976 1.00 . A A . 39 ARG N 1 1 3 1948 1 1 39 ARG NE N 8.276 -5.771 5.998 1.00 . A A . 39 ARG NE 1 1 3 1949 1 1 39 ARG NH1 N 7.998 -4.335 4.135 1.00 . A A . 39 ARG NH1 1 1 3 1950 1 1 39 ARG NH2 N 9.343 -6.160 4.013 1.00 . A A . 39 ARG NH2 1 1 3 1951 1 1 39 ARG O O 3.677 -7.887 6.697 1.00 . A A . 39 ARG O 1 1 3 1952 1 1 40 LEU C C 3.206 -9.569 2.930 1.00 . A A . 40 LEU C 1 1 3 1953 1 1 40 LEU CA C 2.667 -9.079 4.307 1.00 . A A . 40 LEU CA 1 1 3 1954 1 1 40 LEU CB C 1.109 -9.188 4.402 1.00 . A A . 40 LEU CB 1 1 3 1955 1 1 40 LEU CD1 C -0.092 -9.096 2.103 1.00 . A A . 40 LEU CD1 1 1 3 1956 1 1 40 LEU CD2 C -1.139 -7.990 4.109 1.00 . A A . 40 LEU CD2 1 1 3 1957 1 1 40 LEU CG C 0.195 -8.366 3.432 1.00 . A A . 40 LEU CG 1 1 3 1958 1 1 40 LEU H H 2.900 -6.944 3.805 1.00 . A A . 40 LEU H 1 1 3 1959 1 1 40 LEU HA H 3.114 -9.722 5.092 1.00 . A A . 40 LEU HA 1 1 3 1960 1 1 40 LEU HB2 H 0.823 -10.256 4.351 1.00 . A A . 40 LEU HB2 1 1 3 1961 1 1 40 LEU HB3 H 0.853 -8.918 5.447 1.00 . A A . 40 LEU HB3 1 1 3 1962 1 1 40 LEU HD11 H -0.598 -10.067 2.263 1.00 . A A . 40 LEU HD11 1 1 3 1963 1 1 40 LEU HD12 H -0.741 -8.495 1.438 1.00 . A A . 40 LEU HD12 1 1 3 1964 1 1 40 LEU HD13 H 0.828 -9.302 1.529 1.00 . A A . 40 LEU HD13 1 1 3 1965 1 1 40 LEU HD21 H -0.974 -7.399 5.029 1.00 . A A . 40 LEU HD21 1 1 3 1966 1 1 40 LEU HD22 H -1.775 -7.371 3.448 1.00 . A A . 40 LEU HD22 1 1 3 1967 1 1 40 LEU HD23 H -1.728 -8.882 4.394 1.00 . A A . 40 LEU HD23 1 1 3 1968 1 1 40 LEU HG H 0.698 -7.412 3.188 1.00 . A A . 40 LEU HG 1 1 3 1969 1 1 40 LEU N N 3.051 -7.657 4.527 1.00 . A A . 40 LEU N 1 1 3 1970 1 1 40 LEU O O 3.406 -8.793 1.987 1.00 . A A . 40 LEU O 1 1 3 1971 1 1 41 ILE C C 2.725 -11.769 0.592 1.00 . A A . 41 ILE C 1 1 3 1972 1 1 41 ILE CA C 3.925 -11.544 1.582 1.00 . A A . 41 ILE CA 1 1 3 1973 1 1 41 ILE CB C 4.681 -12.879 1.991 1.00 . A A . 41 ILE CB 1 1 3 1974 1 1 41 ILE CD1 C 6.511 -12.762 0.115 1.00 . A A . 41 ILE CD1 1 1 3 1975 1 1 41 ILE CG1 C 5.358 -13.552 0.754 1.00 . A A . 41 ILE CG1 1 1 3 1976 1 1 41 ILE CG2 C 3.735 -13.949 2.615 1.00 . A A . 41 ILE CG2 1 1 3 1977 1 1 41 ILE H H 3.202 -11.437 3.671 1.00 . A A . 41 ILE H 1 1 3 1978 1 1 41 ILE HA H 4.653 -10.861 1.098 1.00 . A A . 41 ILE HA 1 1 3 1979 1 1 41 ILE HB H 5.466 -12.639 2.733 1.00 . A A . 41 ILE HB 1 1 3 1980 1 1 41 ILE HD11 H 7.296 -12.513 0.853 1.00 . A A . 41 ILE HD11 1 1 3 1981 1 1 41 ILE HD12 H 6.992 -13.348 -0.690 1.00 . A A . 41 ILE HD12 1 1 3 1982 1 1 41 ILE HD13 H 6.165 -11.817 -0.340 1.00 . A A . 41 ILE HD13 1 1 3 1983 1 1 41 ILE HG12 H 5.776 -14.533 1.054 1.00 . A A . 41 ILE HG12 1 1 3 1984 1 1 41 ILE HG13 H 4.610 -13.792 -0.026 1.00 . A A . 41 ILE HG13 1 1 3 1985 1 1 41 ILE HG21 H 3.183 -13.556 3.489 1.00 . A A . 41 ILE HG21 1 1 3 1986 1 1 41 ILE HG22 H 2.985 -14.335 1.900 1.00 . A A . 41 ILE HG22 1 1 3 1987 1 1 41 ILE HG23 H 4.305 -14.823 2.980 1.00 . A A . 41 ILE HG23 1 1 3 1988 1 1 41 ILE N N 3.411 -10.897 2.824 1.00 . A A . 41 ILE N 1 1 3 1989 1 1 41 ILE O O 1.685 -12.337 0.944 1.00 . A A . 41 ILE O 1 1 3 1990 1 1 42 MET C C 2.493 -12.786 -2.602 1.00 . A A . 42 MET C 1 1 3 1991 1 1 42 MET CA C 1.980 -11.564 -1.780 1.00 . A A . 42 MET CA 1 1 3 1992 1 1 42 MET CB C 1.902 -10.280 -2.652 1.00 . A A . 42 MET CB 1 1 3 1993 1 1 42 MET CE C -0.513 -8.982 -5.794 1.00 . A A . 42 MET CE 1 1 3 1994 1 1 42 MET CG C 0.813 -10.293 -3.738 1.00 . A A . 42 MET CG 1 1 3 1995 1 1 42 MET H H 3.827 -10.857 -0.809 1.00 . A A . 42 MET H 1 1 3 1996 1 1 42 MET HA H 0.964 -11.780 -1.390 1.00 . A A . 42 MET HA 1 1 3 1997 1 1 42 MET HB2 H 1.702 -9.405 -2.003 1.00 . A A . 42 MET HB2 1 1 3 1998 1 1 42 MET HB3 H 2.882 -10.071 -3.124 1.00 . A A . 42 MET HB3 1 1 3 1999 1 1 42 MET HE1 H -1.467 -9.203 -5.281 1.00 . A A . 42 MET HE1 1 1 3 2000 1 1 42 MET HE2 H -0.661 -8.083 -6.420 1.00 . A A . 42 MET HE2 1 1 3 2001 1 1 42 MET HE3 H -0.274 -9.829 -6.462 1.00 . A A . 42 MET HE3 1 1 3 2002 1 1 42 MET HG2 H 0.990 -11.105 -4.468 1.00 . A A . 42 MET HG2 1 1 3 2003 1 1 42 MET HG3 H -0.184 -10.471 -3.292 1.00 . A A . 42 MET HG3 1 1 3 2004 1 1 42 MET N N 2.919 -11.310 -0.657 1.00 . A A . 42 MET N 1 1 3 2005 1 1 42 MET O O 3.691 -12.902 -2.893 1.00 . A A . 42 MET O 1 1 3 2006 1 1 42 MET SD S 0.811 -8.709 -4.601 1.00 . A A . 42 MET SD 1 1 3 2007 1 1 43 GLU C C 2.199 -14.564 -5.244 1.00 . A A . 43 GLU C 1 1 3 2008 1 1 43 GLU CA C 1.912 -14.916 -3.751 1.00 . A A . 43 GLU CA 1 1 3 2009 1 1 43 GLU CB C 0.731 -15.915 -3.632 1.00 . A A . 43 GLU CB 1 1 3 2010 1 1 43 GLU CD C -0.172 -18.293 -3.970 1.00 . A A . 43 GLU CD 1 1 3 2011 1 1 43 GLU CG C 0.965 -17.310 -4.258 1.00 . A A . 43 GLU CG 1 1 3 2012 1 1 43 GLU H H 0.606 -13.474 -2.699 1.00 . A A . 43 GLU H 1 1 3 2013 1 1 43 GLU HA H 2.812 -15.380 -3.295 1.00 . A A . 43 GLU HA 1 1 3 2014 1 1 43 GLU HB2 H 0.548 -16.070 -2.556 1.00 . A A . 43 GLU HB2 1 1 3 2015 1 1 43 GLU HB3 H -0.200 -15.473 -4.040 1.00 . A A . 43 GLU HB3 1 1 3 2016 1 1 43 GLU HE2 H -1.790 -18.975 -4.811 1.00 . A A . 43 GLU HE2 1 1 3 2017 1 1 43 GLU HG2 H 1.113 -17.222 -5.351 1.00 . A A . 43 GLU HG2 1 1 3 2018 1 1 43 GLU HG3 H 1.904 -17.743 -3.872 1.00 . A A . 43 GLU HG3 1 1 3 2019 1 1 43 GLU N N 1.566 -13.683 -2.994 1.00 . A A . 43 GLU N 1 1 3 2020 1 1 43 GLU O O 1.436 -13.866 -5.922 1.00 . A A . 43 GLU O 1 1 3 2021 1 1 43 GLU OE1 O -0.248 -18.955 -2.934 1.00 . A A . 43 GLU OE1 1 1 3 2022 1 1 43 GLU OE2 O -1.081 -18.354 -4.995 1.00 . A A . 43 GLU OE2 1 1 3 2023 1 1 44 GLY C C 4.676 -16.152 -7.432 1.00 . A A . 44 GLY C 1 1 3 2024 1 1 44 GLY CA C 3.817 -14.925 -7.094 1.00 . A A . 44 GLY CA 1 1 3 2025 1 1 44 GLY H H 3.778 -15.723 -5.028 1.00 . A A . 44 GLY H 1 1 3 2026 1 1 44 GLY HA2 H 2.979 -14.793 -7.808 1.00 . A A . 44 GLY HA2 1 1 3 2027 1 1 44 GLY HA3 H 4.431 -14.008 -7.165 1.00 . A A . 44 GLY HA3 1 1 3 2028 1 1 44 GLY N N 3.335 -15.092 -5.707 1.00 . A A . 44 GLY N 1 1 3 2029 1 1 44 GLY O O 5.794 -16.267 -6.924 1.00 . A A . 44 GLY O 1 1 3 2030 1 1 45 LEU C C 3.588 -19.169 -7.056 1.00 . A A . 45 LEU C 1 1 3 2031 1 1 45 LEU CA C 4.392 -18.551 -8.243 1.00 . A A . 45 LEU CA 1 1 3 2032 1 1 45 LEU CB C 5.898 -18.948 -8.073 1.00 . A A . 45 LEU CB 1 1 3 2033 1 1 45 LEU CD1 C 8.347 -18.699 -8.720 1.00 . A A . 45 LEU CD1 1 1 3 2034 1 1 45 LEU CD2 C 6.639 -19.077 -10.545 1.00 . A A . 45 LEU CD2 1 1 3 2035 1 1 45 LEU CG C 6.891 -18.446 -9.160 1.00 . A A . 45 LEU CG 1 1 3 2036 1 1 45 LEU H H 3.194 -16.753 -8.602 1.00 . A A . 45 LEU H 1 1 3 2037 1 1 45 LEU HA H 4.027 -18.948 -9.210 1.00 . A A . 45 LEU HA 1 1 3 2038 1 1 45 LEU HB2 H 6.256 -18.639 -7.072 1.00 . A A . 45 LEU HB2 1 1 3 2039 1 1 45 LEU HB3 H 5.965 -20.054 -8.037 1.00 . A A . 45 LEU HB3 1 1 3 2040 1 1 45 LEU HD11 H 8.573 -18.203 -7.758 1.00 . A A . 45 LEU HD11 1 1 3 2041 1 1 45 LEU HD12 H 8.562 -19.777 -8.592 1.00 . A A . 45 LEU HD12 1 1 3 2042 1 1 45 LEU HD13 H 9.071 -18.304 -9.457 1.00 . A A . 45 LEU HD13 1 1 3 2043 1 1 45 LEU HD21 H 6.729 -20.180 -10.522 1.00 . A A . 45 LEU HD21 1 1 3 2044 1 1 45 LEU HD22 H 5.631 -18.837 -10.927 1.00 . A A . 45 LEU HD22 1 1 3 2045 1 1 45 LEU HD23 H 7.357 -18.705 -11.299 1.00 . A A . 45 LEU HD23 1 1 3 2046 1 1 45 LEU HG H 6.774 -17.352 -9.264 1.00 . A A . 45 LEU HG 1 1 3 2047 1 1 45 LEU N N 4.093 -17.078 -8.227 1.00 . A A . 45 LEU N 1 1 3 2048 1 1 45 LEU O O 3.662 -18.700 -5.914 1.00 . A A . 45 LEU O 1 1 3 2049 1 1 46 SER C C 2.541 -21.514 -5.200 1.00 . A A . 46 SER C 1 1 3 2050 1 1 46 SER CA C 1.824 -20.800 -6.389 1.00 . A A . 46 SER CA 1 1 3 2051 1 1 46 SER CB C 0.916 -21.798 -7.151 1.00 . A A . 46 SER CB 1 1 3 2052 1 1 46 SER H H 2.844 -20.530 -8.329 1.00 . A A . 46 SER H 1 1 3 2053 1 1 46 SER HA H 1.185 -19.986 -5.993 1.00 . A A . 46 SER HA 1 1 3 2054 1 1 46 SER HB2 H 0.146 -22.205 -6.469 1.00 . A A . 46 SER HB2 1 1 3 2055 1 1 46 SER HB3 H 0.350 -21.271 -7.942 1.00 . A A . 46 SER HB3 1 1 3 2056 1 1 46 SER HG H 2.249 -22.486 -8.359 1.00 . A A . 46 SER HG 1 1 3 2057 1 1 46 SER N N 2.813 -20.232 -7.347 1.00 . A A . 46 SER N 1 1 3 2058 1 1 46 SER O O 3.290 -22.480 -5.387 1.00 . A A . 46 SER O 1 1 3 2059 1 1 46 SER OG O 1.632 -22.882 -7.740 1.00 . A A . 46 SER OG 1 1 3 2060 1 1 47 PHE C C 1.993 -22.247 -1.870 1.00 . A A . 47 PHE C 1 1 3 2061 1 1 47 PHE CA C 3.003 -21.449 -2.748 1.00 . A A . 47 PHE CA 1 1 3 2062 1 1 47 PHE CB C 3.600 -20.212 -1.997 1.00 . A A . 47 PHE CB 1 1 3 2063 1 1 47 PHE CD1 C 5.758 -19.942 -3.377 1.00 . A A . 47 PHE CD1 1 1 3 2064 1 1 47 PHE CD2 C 4.532 -17.960 -2.746 1.00 . A A . 47 PHE CD2 1 1 3 2065 1 1 47 PHE CE1 C 6.687 -19.151 -4.049 1.00 . A A . 47 PHE CE1 1 1 3 2066 1 1 47 PHE CE2 C 5.463 -17.171 -3.417 1.00 . A A . 47 PHE CE2 1 1 3 2067 1 1 47 PHE CG C 4.662 -19.354 -2.730 1.00 . A A . 47 PHE CG 1 1 3 2068 1 1 47 PHE CZ C 6.538 -17.767 -4.068 1.00 . A A . 47 PHE CZ 1 1 3 2069 1 1 47 PHE H H 1.679 -20.179 -3.980 1.00 . A A . 47 PHE H 1 1 3 2070 1 1 47 PHE HA H 3.835 -22.131 -2.986 1.00 . A A . 47 PHE HA 1 1 3 2071 1 1 47 PHE HB2 H 2.770 -19.561 -1.655 1.00 . A A . 47 PHE HB2 1 1 3 2072 1 1 47 PHE HB3 H 4.062 -20.567 -1.056 1.00 . A A . 47 PHE HB3 1 1 3 2073 1 1 47 PHE HD1 H 5.890 -21.014 -3.373 1.00 . A A . 47 PHE HD1 1 1 3 2074 1 1 47 PHE HD2 H 3.703 -17.478 -2.246 1.00 . A A . 47 PHE HD2 1 1 3 2075 1 1 47 PHE HE1 H 7.521 -19.611 -4.557 1.00 . A A . 47 PHE HE1 1 1 3 2076 1 1 47 PHE HE2 H 5.349 -16.097 -3.434 1.00 . A A . 47 PHE HE2 1 1 3 2077 1 1 47 PHE HZ H 7.257 -17.156 -4.593 1.00 . A A . 47 PHE HZ 1 1 3 2078 1 1 47 PHE N N 2.315 -20.984 -3.986 1.00 . A A . 47 PHE N 1 1 3 2079 1 1 47 PHE O O 2.168 -23.458 -1.709 1.00 . A A . 47 PHE O 1 1 3 2080 1 1 48 ALA C C -1.286 -22.677 -1.523 1.00 . A A . 48 ALA C 1 1 3 2081 1 1 48 ALA CA C -0.141 -22.255 -0.574 1.00 . A A . 48 ALA CA 1 1 3 2082 1 1 48 ALA CB C -0.647 -21.273 0.501 1.00 . A A . 48 ALA CB 1 1 3 2083 1 1 48 ALA H H 0.937 -20.592 -1.570 1.00 . A A . 48 ALA H 1 1 3 2084 1 1 48 ALA HXT H -2.564 -21.905 -2.779 1.00 . A A . 48 ALA HXT 1 1 3 2085 1 1 48 ALA HA H 0.236 -23.161 -0.061 1.00 . A A . 48 ALA HA 1 1 3 2086 1 1 48 ALA HB1 H -1.039 -20.332 0.070 1.00 . A A . 48 ALA HB1 1 1 3 2087 1 1 48 ALA HB2 H -1.461 -21.719 1.103 1.00 . A A . 48 ALA HB2 1 1 3 2088 1 1 48 ALA HB3 H 0.155 -20.998 1.212 1.00 . A A . 48 ALA HB3 1 1 3 2089 1 1 48 ALA N N 0.943 -21.591 -1.339 1.00 . A A . 48 ALA N 1 1 3 2090 1 1 48 ALA O O -1.639 -23.848 -1.658 1.00 . A A . 48 ALA O 1 1 3 2091 1 1 48 ALA OXT O -1.858 -21.620 -2.195 1.00 . A A . 48 ALA OXT 1 1 4 2092 1 1 1 GLU C C 13.227 5.797 10.112 1.00 . A A . 1 GLU C 1 1 4 2093 1 1 1 GLU CA C 12.812 4.445 10.763 1.00 . A A . 1 GLU CA 1 1 4 2094 1 1 1 GLU CB C 13.972 3.921 11.655 1.00 . A A . 1 GLU CB 1 1 4 2095 1 1 1 GLU CD C 14.732 2.361 13.548 1.00 . A A . 1 GLU CD 1 1 4 2096 1 1 1 GLU CG C 13.613 2.724 12.565 1.00 . A A . 1 GLU CG 1 1 4 2097 1 1 1 GLU H1 H 11.740 3.774 9.097 1.00 . A A . 1 GLU H1 1 1 4 2098 1 1 1 GLU H2 H 12.205 2.552 10.108 1.00 . A A . 1 GLU H2 1 1 4 2099 1 1 1 GLU HA H 11.902 4.595 11.376 1.00 . A A . 1 GLU HA 1 1 4 2100 1 1 1 GLU HB2 H 14.854 3.668 11.034 1.00 . A A . 1 GLU HB2 1 1 4 2101 1 1 1 GLU HB3 H 14.313 4.746 12.311 1.00 . A A . 1 GLU HB3 1 1 4 2102 1 1 1 GLU HE2 H 16.526 1.601 13.542 1.00 . A A . 1 GLU HE2 1 1 4 2103 1 1 1 GLU HG2 H 12.696 2.952 13.139 1.00 . A A . 1 GLU HG2 1 1 4 2104 1 1 1 GLU HG3 H 13.362 1.837 11.955 1.00 . A A . 1 GLU HG3 1 1 4 2105 1 1 1 GLU N N 12.499 3.450 9.707 1.00 . A A . 1 GLU N 1 1 4 2106 1 1 1 GLU O O 13.870 5.839 9.057 1.00 . A A . 1 GLU O 1 1 4 2107 1 1 1 GLU OE1 O 14.641 2.524 14.764 1.00 . A A . 1 GLU OE1 1 1 4 2108 1 1 1 GLU OE2 O 15.831 1.831 12.920 1.00 . A A . 1 GLU OE2 1 1 4 2109 1 1 2 ASP C C 12.547 8.845 9.259 1.00 . A A . 2 ASP C 1 1 4 2110 1 1 2 ASP CA C 13.298 8.317 10.527 1.00 . A A . 2 ASP CA 1 1 4 2111 1 1 2 ASP CB C 14.846 8.421 10.325 1.00 . A A . 2 ASP CB 1 1 4 2112 1 1 2 ASP CG C 15.406 9.852 10.374 1.00 . A A . 2 ASP CG 1 1 4 2113 1 1 2 ASP H H 12.347 6.690 11.665 1.00 . A A . 2 ASP H 1 1 4 2114 1 1 2 ASP HA H 13.001 8.926 11.404 1.00 . A A . 2 ASP HA 1 1 4 2115 1 1 2 ASP HB2 H 15.361 7.853 11.123 1.00 . A A . 2 ASP HB2 1 1 4 2116 1 1 2 ASP HB3 H 15.162 7.932 9.384 1.00 . A A . 2 ASP HB3 1 1 4 2117 1 1 2 ASP HD2 H 16.186 9.426 8.642 1.00 . A A . 2 ASP HD2 1 1 4 2118 1 1 2 ASP N N 12.879 6.904 10.814 1.00 . A A . 2 ASP N 1 1 4 2119 1 1 2 ASP O O 12.688 8.309 8.155 1.00 . A A . 2 ASP O 1 1 4 2120 1 1 2 ASP OD1 O 15.215 10.626 11.312 1.00 . A A . 2 ASP OD1 1 1 4 2121 1 1 2 ASP OD2 O 16.146 10.159 9.260 1.00 . A A . 2 ASP OD2 1 1 4 2122 1 1 3 ASN C C 9.810 9.755 7.718 1.00 . A A . 3 ASN C 1 1 4 2123 1 1 3 ASN CA C 10.916 10.634 8.416 1.00 . A A . 3 ASN CA 1 1 4 2124 1 1 3 ASN CB C 11.859 11.200 7.311 1.00 . A A . 3 ASN CB 1 1 4 2125 1 1 3 ASN CG C 12.950 12.205 7.740 1.00 . A A . 3 ASN CG 1 1 4 2126 1 1 3 ASN H H 11.635 10.153 10.453 1.00 . A A . 3 ASN H 1 1 4 2127 1 1 3 ASN HA H 10.367 11.433 8.933 1.00 . A A . 3 ASN HA 1 1 4 2128 1 1 3 ASN HB2 H 12.316 10.325 6.820 1.00 . A A . 3 ASN HB2 1 1 4 2129 1 1 3 ASN HB3 H 11.263 11.680 6.510 1.00 . A A . 3 ASN HB3 1 1 4 2130 1 1 3 ASN HD21 H 11.592 13.676 7.862 1.00 . A A . 3 ASN HD21 1 1 4 2131 1 1 3 ASN HD22 H 13.331 14.105 8.258 1.00 . A A . 3 ASN HD22 1 1 4 2132 1 1 3 ASN N N 11.759 9.927 9.461 1.00 . A A . 3 ASN N 1 1 4 2133 1 1 3 ASN ND2 N 12.587 13.456 7.977 1.00 . A A . 3 ASN ND2 1 1 4 2134 1 1 3 ASN O O 9.310 10.073 6.633 1.00 . A A . 3 ASN O 1 1 4 2135 1 1 3 ASN OD1 O 14.125 11.859 7.854 1.00 . A A . 3 ASN OD1 1 1 4 2136 1 1 4 CYS C C 7.593 7.091 9.081 1.00 . A A . 4 CYS C 1 1 4 2137 1 1 4 CYS CA C 8.433 7.685 7.899 1.00 . A A . 4 CYS CA 1 1 4 2138 1 1 4 CYS CB C 9.181 6.589 7.150 1.00 . A A . 4 CYS CB 1 1 4 2139 1 1 4 CYS H H 10.062 8.597 9.181 1.00 . A A . 4 CYS H 1 1 4 2140 1 1 4 CYS HA H 7.729 8.117 7.167 1.00 . A A . 4 CYS HA 1 1 4 2141 1 1 4 CYS HB2 H 8.350 5.938 6.965 1.00 . A A . 4 CYS HB2 1 1 4 2142 1 1 4 CYS HB3 H 9.498 6.869 6.133 1.00 . A A . 4 CYS HB3 1 1 4 2143 1 1 4 CYS N N 9.406 8.687 8.398 1.00 . A A . 4 CYS N 1 1 4 2144 1 1 4 CYS O O 7.861 7.350 10.262 1.00 . A A . 4 CYS O 1 1 4 2145 1 1 4 CYS SG S 10.367 5.559 8.032 1.00 . A A . 4 CYS SG 1 1 4 2146 1 1 5 ILE C C 6.176 4.098 9.692 1.00 . A A . 5 ILE C 1 1 4 2147 1 1 5 ILE CA C 5.731 5.571 9.792 1.00 . A A . 5 ILE CA 1 1 4 2148 1 1 5 ILE CB C 4.165 5.716 9.595 1.00 . A A . 5 ILE CB 1 1 4 2149 1 1 5 ILE CD1 C 2.349 7.477 9.147 1.00 . A A . 5 ILE CD1 1 1 4 2150 1 1 5 ILE CG1 C 3.797 7.200 9.468 1.00 . A A . 5 ILE CG1 1 1 4 2151 1 1 5 ILE CG2 C 3.381 5.058 10.782 1.00 . A A . 5 ILE CG2 1 1 4 2152 1 1 5 ILE H H 6.567 6.020 7.716 1.00 . A A . 5 ILE H 1 1 4 2153 1 1 5 ILE HA H 5.959 5.979 10.789 1.00 . A A . 5 ILE HA 1 1 4 2154 1 1 5 ILE HB H 3.799 5.226 8.699 1.00 . A A . 5 ILE HB 1 1 4 2155 1 1 5 ILE HD11 H 2.056 7.012 8.188 1.00 . A A . 5 ILE HD11 1 1 4 2156 1 1 5 ILE HD12 H 1.699 7.086 9.944 1.00 . A A . 5 ILE HD12 1 1 4 2157 1 1 5 ILE HD13 H 2.152 8.556 9.080 1.00 . A A . 5 ILE HD13 1 1 4 2158 1 1 5 ILE HG12 H 4.069 7.729 10.372 1.00 . A A . 5 ILE HG12 1 1 4 2159 1 1 5 ILE HG13 H 4.383 7.645 8.650 1.00 . A A . 5 ILE HG13 1 1 4 2160 1 1 5 ILE HG21 H 3.600 3.980 10.880 1.00 . A A . 5 ILE HG21 1 1 4 2161 1 1 5 ILE HG22 H 3.551 5.527 11.767 1.00 . A A . 5 ILE HG22 1 1 4 2162 1 1 5 ILE HG23 H 2.282 5.074 10.620 1.00 . A A . 5 ILE HG23 1 1 4 2163 1 1 5 ILE N N 6.560 6.270 8.736 1.00 . A A . 5 ILE N 1 1 4 2164 1 1 5 ILE O O 5.667 3.323 8.889 1.00 . A A . 5 ILE O 1 1 4 2165 1 1 6 ALA C C 6.707 1.168 11.061 1.00 . A A . 6 ALA C 1 1 4 2166 1 1 6 ALA CA C 7.650 2.254 10.394 1.00 . A A . 6 ALA CA 1 1 4 2167 1 1 6 ALA CB C 9.033 2.255 11.067 1.00 . A A . 6 ALA CB 1 1 4 2168 1 1 6 ALA H H 7.364 4.322 11.250 1.00 . A A . 6 ALA H 1 1 4 2169 1 1 6 ALA HA H 7.742 2.013 9.304 1.00 . A A . 6 ALA HA 1 1 4 2170 1 1 6 ALA HB1 H 9.706 3.009 10.619 1.00 . A A . 6 ALA HB1 1 1 4 2171 1 1 6 ALA HB2 H 8.970 2.464 12.153 1.00 . A A . 6 ALA HB2 1 1 4 2172 1 1 6 ALA HB3 H 9.531 1.276 10.948 1.00 . A A . 6 ALA HB3 1 1 4 2173 1 1 6 ALA N N 7.133 3.658 10.512 1.00 . A A . 6 ALA N 1 1 4 2174 1 1 6 ALA O O 7.142 0.065 11.407 1.00 . A A . 6 ALA O 1 1 4 2175 1 1 7 GLU C C 3.246 0.192 11.205 1.00 . A A . 7 GLU C 1 1 4 2176 1 1 7 GLU CA C 4.418 0.772 12.020 1.00 . A A . 7 GLU CA 1 1 4 2177 1 1 7 GLU CB C 3.901 1.768 13.105 1.00 . A A . 7 GLU CB 1 1 4 2178 1 1 7 GLU CD C 4.300 3.203 15.180 1.00 . A A . 7 GLU CD 1 1 4 2179 1 1 7 GLU CG C 4.911 2.206 14.191 1.00 . A A . 7 GLU CG 1 1 4 2180 1 1 7 GLU H H 5.363 2.532 11.024 1.00 . A A . 7 GLU H 1 1 4 2181 1 1 7 GLU HA H 4.848 -0.084 12.496 1.00 . A A . 7 GLU HA 1 1 4 2182 1 1 7 GLU HB2 H 3.488 2.661 12.608 1.00 . A A . 7 GLU HB2 1 1 4 2183 1 1 7 GLU HB3 H 3.036 1.320 13.631 1.00 . A A . 7 GLU HB3 1 1 4 2184 1 1 7 GLU HE2 H 3.866 5.098 15.291 1.00 . A A . 7 GLU HE2 1 1 4 2185 1 1 7 GLU HG2 H 5.279 1.320 14.740 1.00 . A A . 7 GLU HG2 1 1 4 2186 1 1 7 GLU HG3 H 5.806 2.663 13.729 1.00 . A A . 7 GLU HG3 1 1 4 2187 1 1 7 GLU N N 5.420 1.522 11.227 1.00 . A A . 7 GLU N 1 1 4 2188 1 1 7 GLU O O 2.929 0.584 10.084 1.00 . A A . 7 GLU O 1 1 4 2189 1 1 7 GLU OE1 O 3.892 2.886 16.296 1.00 . A A . 7 GLU OE1 1 1 4 2190 1 1 7 GLU OE2 O 4.257 4.477 14.672 1.00 . A A . 7 GLU OE2 1 1 4 2191 1 1 8 ASP C C 0.440 -0.836 12.708 1.00 . A A . 8 ASP C 1 1 4 2192 1 1 8 ASP CA C 1.317 -1.375 11.546 1.00 . A A . 8 ASP CA 1 1 4 2193 1 1 8 ASP CB C 1.287 -2.914 11.516 1.00 . A A . 8 ASP CB 1 1 4 2194 1 1 8 ASP CG C 2.409 -3.555 10.678 1.00 . A A . 8 ASP CG 1 1 4 2195 1 1 8 ASP H H 3.047 -0.964 12.810 1.00 . A A . 8 ASP H 1 1 4 2196 1 1 8 ASP HA H 0.981 -1.038 10.539 1.00 . A A . 8 ASP HA 1 1 4 2197 1 1 8 ASP HB2 H 1.250 -3.264 12.553 1.00 . A A . 8 ASP HB2 1 1 4 2198 1 1 8 ASP HB3 H 0.335 -3.242 11.070 1.00 . A A . 8 ASP HB3 1 1 4 2199 1 1 8 ASP HD2 H 2.917 -4.427 12.342 1.00 . A A . 8 ASP HD2 1 1 4 2200 1 1 8 ASP N N 2.617 -0.771 11.899 1.00 . A A . 8 ASP N 1 1 4 2201 1 1 8 ASP O O 0.678 -1.017 13.910 1.00 . A A . 8 ASP O 1 1 4 2202 1 1 8 ASP OD1 O 2.573 -3.334 9.478 1.00 . A A . 8 ASP OD1 1 1 4 2203 1 1 8 ASP OD2 O 3.199 -4.389 11.425 1.00 . A A . 8 ASP OD2 1 1 4 2204 1 1 9 TYR C C -0.732 1.939 13.745 1.00 . A A . 9 TYR C 1 1 4 2205 1 1 9 TYR CA C -1.504 0.745 13.043 1.00 . A A . 9 TYR CA 1 1 4 2206 1 1 9 TYR CB C -2.309 -0.147 14.053 1.00 . A A . 9 TYR CB 1 1 4 2207 1 1 9 TYR CD1 C -4.342 -0.803 12.641 1.00 . A A . 9 TYR CD1 1 1 4 2208 1 1 9 TYR CD2 C -2.787 -2.536 13.284 1.00 . A A . 9 TYR CD2 1 1 4 2209 1 1 9 TYR CE1 C -5.030 -1.717 11.847 1.00 . A A . 9 TYR CE1 1 1 4 2210 1 1 9 TYR CE2 C -3.479 -3.449 12.491 1.00 . A A . 9 TYR CE2 1 1 4 2211 1 1 9 TYR CG C -3.204 -1.202 13.354 1.00 . A A . 9 TYR CG 1 1 4 2212 1 1 9 TYR CZ C -4.595 -3.037 11.768 1.00 . A A . 9 TYR CZ 1 1 4 2213 1 1 9 TYR H H -0.617 -0.276 11.238 1.00 . A A . 9 TYR H 1 1 4 2214 1 1 9 TYR HA H -2.209 1.234 12.353 1.00 . A A . 9 TYR HA 1 1 4 2215 1 1 9 TYR HB2 H -1.641 -0.619 14.798 1.00 . A A . 9 TYR HB2 1 1 4 2216 1 1 9 TYR HB3 H -2.964 0.504 14.661 1.00 . A A . 9 TYR HB3 1 1 4 2217 1 1 9 TYR HD1 H -4.660 0.230 12.652 1.00 . A A . 9 TYR HD1 1 1 4 2218 1 1 9 TYR HD2 H -1.893 -2.860 13.798 1.00 . A A . 9 TYR HD2 1 1 4 2219 1 1 9 TYR HE1 H -5.885 -1.392 11.271 1.00 . A A . 9 TYR HE1 1 1 4 2220 1 1 9 TYR HE2 H -3.127 -4.469 12.416 1.00 . A A . 9 TYR HE2 1 1 4 2221 1 1 9 TYR HH H -5.987 -3.478 10.532 1.00 . A A . 9 TYR HH 1 1 4 2222 1 1 9 TYR N N -0.577 -0.131 12.248 1.00 . A A . 9 TYR N 1 1 4 2223 1 1 9 TYR O O -1.052 2.331 14.871 1.00 . A A . 9 TYR O 1 1 4 2224 1 1 9 TYR OH O -5.252 -3.927 10.957 1.00 . A A . 9 TYR OH 1 1 4 2225 1 1 10 GLY C C 0.115 5.003 12.749 1.00 . A A . 10 GLY C 1 1 4 2226 1 1 10 GLY CA C 0.866 3.851 13.398 1.00 . A A . 10 GLY CA 1 1 4 2227 1 1 10 GLY H H 0.442 2.097 12.128 1.00 . A A . 10 GLY H 1 1 4 2228 1 1 10 GLY HA2 H 1.012 3.954 14.477 1.00 . A A . 10 GLY HA2 1 1 4 2229 1 1 10 GLY HA3 H 1.884 3.998 13.047 1.00 . A A . 10 GLY HA3 1 1 4 2230 1 1 10 GLY N N 0.227 2.566 13.017 1.00 . A A . 10 GLY N 1 1 4 2231 1 1 10 GLY O O -0.398 4.923 11.633 1.00 . A A . 10 GLY O 1 1 4 2232 1 1 11 LYS C C -0.226 8.005 11.925 1.00 . A A . 11 LYS C 1 1 4 2233 1 1 11 LYS CA C -0.805 7.248 13.157 1.00 . A A . 11 LYS CA 1 1 4 2234 1 1 11 LYS CB C -0.943 8.249 14.330 1.00 . A A . 11 LYS CB 1 1 4 2235 1 1 11 LYS CD C -0.011 9.616 16.344 1.00 . A A . 11 LYS CD 1 1 4 2236 1 1 11 LYS CE C -0.346 11.068 15.940 1.00 . A A . 11 LYS CE 1 1 4 2237 1 1 11 LYS CG C 0.287 8.622 15.198 1.00 . A A . 11 LYS CG 1 1 4 2238 1 1 11 LYS H H 0.715 5.946 14.286 1.00 . A A . 11 LYS H 1 1 4 2239 1 1 11 LYS HA H -1.828 6.854 12.928 1.00 . A A . 11 LYS HA 1 1 4 2240 1 1 11 LYS HB2 H -1.406 9.180 13.950 1.00 . A A . 11 LYS HB2 1 1 4 2241 1 1 11 LYS HB3 H -1.745 7.825 14.951 1.00 . A A . 11 LYS HB3 1 1 4 2242 1 1 11 LYS HD2 H -0.846 9.217 16.951 1.00 . A A . 11 LYS HD2 1 1 4 2243 1 1 11 LYS HD3 H 0.851 9.627 17.038 1.00 . A A . 11 LYS HD3 1 1 4 2244 1 1 11 LYS HE2 H -1.203 11.096 15.243 1.00 . A A . 11 LYS HE2 1 1 4 2245 1 1 11 LYS HE3 H -0.677 11.626 16.835 1.00 . A A . 11 LYS HE3 1 1 4 2246 1 1 11 LYS HG2 H 0.701 7.700 15.648 1.00 . A A . 11 LYS HG2 1 1 4 2247 1 1 11 LYS HG3 H 1.096 9.019 14.558 1.00 . A A . 11 LYS HG3 1 1 4 2248 1 1 11 LYS HZ1 H 1.571 11.833 16.013 1.00 . A A . 11 LYS HZ1 1 1 4 2249 1 1 11 LYS HZ2 H 0.539 12.760 15.149 1.00 . A A . 11 LYS HZ2 1 1 4 2250 1 1 11 LYS N N 0.072 6.089 13.499 1.00 . A A . 11 LYS N 1 1 4 2251 1 1 11 LYS NZ N 0.797 11.786 15.342 1.00 . A A . 11 LYS NZ 1 1 4 2252 1 1 11 LYS O O 0.906 8.499 11.889 1.00 . A A . 11 LYS O 1 1 4 2253 1 1 12 CYS C C -1.972 9.520 9.138 1.00 . A A . 12 CYS C 1 1 4 2254 1 1 12 CYS CA C -0.852 8.542 9.562 1.00 . A A . 12 CYS CA 1 1 4 2255 1 1 12 CYS CB C -0.808 7.350 8.569 1.00 . A A . 12 CYS CB 1 1 4 2256 1 1 12 CYS H H -2.018 7.686 11.271 1.00 . A A . 12 CYS H 1 1 4 2257 1 1 12 CYS HA H 0.121 9.075 9.533 1.00 . A A . 12 CYS HA 1 1 4 2258 1 1 12 CYS HB2 H -0.546 7.675 7.547 1.00 . A A . 12 CYS HB2 1 1 4 2259 1 1 12 CYS HB3 H -0.046 6.615 8.846 1.00 . A A . 12 CYS HB3 1 1 4 2260 1 1 12 CYS N N -1.109 8.025 10.928 1.00 . A A . 12 CYS N 1 1 4 2261 1 1 12 CYS O O -2.957 9.754 9.852 1.00 . A A . 12 CYS O 1 1 4 2262 1 1 12 CYS SG S -2.321 6.418 8.492 1.00 . A A . 12 CYS SG 1 1 4 2263 1 1 13 THR C C -2.874 10.527 5.769 1.00 . A A . 13 THR C 1 1 4 2264 1 1 13 THR CA C -2.921 10.856 7.292 1.00 . A A . 13 THR CA 1 1 4 2265 1 1 13 THR CB C -2.837 12.428 7.545 1.00 . A A . 13 THR CB 1 1 4 2266 1 1 13 THR CG2 C -1.951 12.910 8.717 1.00 . A A . 13 THR CG2 1 1 4 2267 1 1 13 THR H H -0.939 9.772 7.454 1.00 . A A . 13 THR H 1 1 4 2268 1 1 13 THR HA H -3.899 10.492 7.692 1.00 . A A . 13 THR HA 1 1 4 2269 1 1 13 THR HB H -3.886 12.750 7.682 1.00 . A A . 13 THR HB 1 1 4 2270 1 1 13 THR HG1 H -2.344 14.057 6.653 1.00 . A A . 13 THR HG1 1 1 4 2271 1 1 13 THR HG21 H -2.268 12.478 9.681 1.00 . A A . 13 THR HG21 1 1 4 2272 1 1 13 THR HG22 H -0.886 12.648 8.561 1.00 . A A . 13 THR HG22 1 1 4 2273 1 1 13 THR HG23 H -1.991 14.010 8.819 1.00 . A A . 13 THR HG23 1 1 4 2274 1 1 13 THR N N -1.809 10.085 7.931 1.00 . A A . 13 THR N 1 1 4 2275 1 1 13 THR O O -1.829 10.258 5.160 1.00 . A A . 13 THR O 1 1 4 2276 1 1 13 THR OG1 O -2.287 13.124 6.435 1.00 . A A . 13 THR OG1 1 1 4 2277 1 1 14 TRP C C -3.930 12.070 3.191 1.00 . A A . 14 TRP C 1 1 4 2278 1 1 14 TRP CA C -4.225 10.615 3.677 1.00 . A A . 14 TRP CA 1 1 4 2279 1 1 14 TRP CB C -5.651 10.117 3.304 1.00 . A A . 14 TRP CB 1 1 4 2280 1 1 14 TRP CD1 C -5.219 7.662 4.273 1.00 . A A . 14 TRP CD1 1 1 4 2281 1 1 14 TRP CD2 C -7.032 7.899 3.010 1.00 . A A . 14 TRP CD2 1 1 4 2282 1 1 14 TRP CE2 C -6.922 6.552 3.448 1.00 . A A . 14 TRP CE2 1 1 4 2283 1 1 14 TRP CE3 C -8.130 8.300 2.204 1.00 . A A . 14 TRP CE3 1 1 4 2284 1 1 14 TRP CG C -5.956 8.612 3.518 1.00 . A A . 14 TRP CG 1 1 4 2285 1 1 14 TRP CH2 C -8.977 6.017 2.294 1.00 . A A . 14 TRP CH2 1 1 4 2286 1 1 14 TRP CZ2 C -7.907 5.603 3.088 1.00 . A A . 14 TRP CZ2 1 1 4 2287 1 1 14 TRP CZ3 C -9.087 7.345 1.859 1.00 . A A . 14 TRP CZ3 1 1 4 2288 1 1 14 TRP H H -4.815 10.921 5.809 1.00 . A A . 14 TRP H 1 1 4 2289 1 1 14 TRP HA H -3.499 9.910 3.221 1.00 . A A . 14 TRP HA 1 1 4 2290 1 1 14 TRP HB2 H -6.418 10.717 3.830 1.00 . A A . 14 TRP HB2 1 1 4 2291 1 1 14 TRP HB3 H -5.819 10.335 2.232 1.00 . A A . 14 TRP HB3 1 1 4 2292 1 1 14 TRP HD1 H -4.311 7.874 4.818 1.00 . A A . 14 TRP HD1 1 1 4 2293 1 1 14 TRP HE1 H -5.467 5.526 4.689 1.00 . A A . 14 TRP HE1 1 1 4 2294 1 1 14 TRP HE3 H -8.230 9.321 1.866 1.00 . A A . 14 TRP HE3 1 1 4 2295 1 1 14 TRP HH2 H -9.736 5.302 2.012 1.00 . A A . 14 TRP HH2 1 1 4 2296 1 1 14 TRP HZ2 H -7.837 4.577 3.422 1.00 . A A . 14 TRP HZ2 1 1 4 2297 1 1 14 TRP HZ3 H -9.930 7.635 1.248 1.00 . A A . 14 TRP HZ3 1 1 4 2298 1 1 14 TRP N N -4.065 10.652 5.160 1.00 . A A . 14 TRP N 1 1 4 2299 1 1 14 TRP NE1 N -5.797 6.384 4.232 1.00 . A A . 14 TRP NE1 1 1 4 2300 1 1 14 TRP O O -4.765 12.977 3.275 1.00 . A A . 14 TRP O 1 1 4 2301 1 1 15 GLY C C -1.159 13.953 3.692 1.00 . A A . 15 GLY C 1 1 4 2302 1 1 15 GLY CA C -2.061 13.578 2.483 1.00 . A A . 15 GLY CA 1 1 4 2303 1 1 15 GLY H H -2.105 11.397 2.747 1.00 . A A . 15 GLY H 1 1 4 2304 1 1 15 GLY HA2 H -1.462 13.530 1.554 1.00 . A A . 15 GLY HA2 1 1 4 2305 1 1 15 GLY HA3 H -2.821 14.361 2.311 1.00 . A A . 15 GLY HA3 1 1 4 2306 1 1 15 GLY N N -2.675 12.250 2.748 1.00 . A A . 15 GLY N 1 1 4 2307 1 1 15 GLY O O -1.434 14.919 4.408 1.00 . A A . 15 GLY O 1 1 4 2308 1 1 16 GLY C C 1.899 12.176 4.961 1.00 . A A . 16 GLY C 1 1 4 2309 1 1 16 GLY CA C 0.736 13.163 5.119 1.00 . A A . 16 GLY CA 1 1 4 2310 1 1 16 GLY H H -0.027 12.399 3.205 1.00 . A A . 16 GLY H 1 1 4 2311 1 1 16 GLY HA2 H 1.114 14.140 5.446 1.00 . A A . 16 GLY HA2 1 1 4 2312 1 1 16 GLY HA3 H 0.098 12.836 5.962 1.00 . A A . 16 GLY HA3 1 1 4 2313 1 1 16 GLY N N -0.107 13.146 3.902 1.00 . A A . 16 GLY N 1 1 4 2314 1 1 16 GLY O O 2.363 11.859 3.857 1.00 . A A . 16 GLY O 1 1 4 2315 1 1 17 THR C C 2.428 9.235 5.989 1.00 . A A . 17 THR C 1 1 4 2316 1 1 17 THR CA C 3.307 10.527 6.149 1.00 . A A . 17 THR CA 1 1 4 2317 1 1 17 THR CB C 4.156 10.408 7.477 1.00 . A A . 17 THR CB 1 1 4 2318 1 1 17 THR CG2 C 5.524 9.733 7.213 1.00 . A A . 17 THR CG2 1 1 4 2319 1 1 17 THR H H 1.941 12.173 6.918 1.00 . A A . 17 THR H 1 1 4 2320 1 1 17 THR HA H 4.013 10.647 5.299 1.00 . A A . 17 THR HA 1 1 4 2321 1 1 17 THR HB H 3.630 9.769 8.220 1.00 . A A . 17 THR HB 1 1 4 2322 1 1 17 THR HG1 H 4.905 12.176 7.339 1.00 . A A . 17 THR HG1 1 1 4 2323 1 1 17 THR HG21 H 5.420 8.720 6.787 1.00 . A A . 17 THR HG21 1 1 4 2324 1 1 17 THR HG22 H 6.173 10.294 6.517 1.00 . A A . 17 THR HG22 1 1 4 2325 1 1 17 THR HG23 H 6.098 9.594 8.150 1.00 . A A . 17 THR HG23 1 1 4 2326 1 1 17 THR N N 2.349 11.675 6.118 1.00 . A A . 17 THR N 1 1 4 2327 1 1 17 THR O O 1.343 9.066 6.573 1.00 . A A . 17 THR O 1 1 4 2328 1 1 17 THR OG1 O 4.427 11.697 8.020 1.00 . A A . 17 THR OG1 1 1 4 2329 1 1 18 LYS C C 3.645 6.063 5.652 1.00 . A A . 18 LYS C 1 1 4 2330 1 1 18 LYS CA C 2.556 6.944 4.987 1.00 . A A . 18 LYS CA 1 1 4 2331 1 1 18 LYS CB C 2.369 6.579 3.479 1.00 . A A . 18 LYS CB 1 1 4 2332 1 1 18 LYS CD C 0.216 7.937 2.825 1.00 . A A . 18 LYS CD 1 1 4 2333 1 1 18 LYS CE C -0.767 6.770 2.608 1.00 . A A . 18 LYS CE 1 1 4 2334 1 1 18 LYS CG C 1.688 7.587 2.517 1.00 . A A . 18 LYS CG 1 1 4 2335 1 1 18 LYS H H 3.935 8.648 4.866 1.00 . A A . 18 LYS H 1 1 4 2336 1 1 18 LYS HA H 1.592 6.723 5.475 1.00 . A A . 18 LYS HA 1 1 4 2337 1 1 18 LYS HB2 H 3.344 6.264 3.072 1.00 . A A . 18 LYS HB2 1 1 4 2338 1 1 18 LYS HB3 H 1.792 5.636 3.431 1.00 . A A . 18 LYS HB3 1 1 4 2339 1 1 18 LYS HD2 H 0.130 8.324 3.859 1.00 . A A . 18 LYS HD2 1 1 4 2340 1 1 18 LYS HD3 H -0.072 8.784 2.174 1.00 . A A . 18 LYS HD3 1 1 4 2341 1 1 18 LYS HE2 H -0.648 6.346 1.594 1.00 . A A . 18 LYS HE2 1 1 4 2342 1 1 18 LYS HE3 H -0.559 5.947 3.316 1.00 . A A . 18 LYS HE3 1 1 4 2343 1 1 18 LYS HG2 H 2.279 8.521 2.496 1.00 . A A . 18 LYS HG2 1 1 4 2344 1 1 18 LYS HG3 H 1.757 7.196 1.485 1.00 . A A . 18 LYS HG3 1 1 4 2345 1 1 18 LYS HZ1 H -2.377 7.962 2.120 1.00 . A A . 18 LYS HZ1 1 1 4 2346 1 1 18 LYS HZ2 H -2.292 7.610 3.714 1.00 . A A . 18 LYS HZ2 1 1 4 2347 1 1 18 LYS N N 3.002 8.350 5.167 1.00 . A A . 18 LYS N 1 1 4 2348 1 1 18 LYS NZ N -2.162 7.206 2.779 1.00 . A A . 18 LYS NZ 1 1 4 2349 1 1 18 LYS O O 4.679 6.507 6.184 1.00 . A A . 18 LYS O 1 1 4 2350 1 1 19 CYS C C 5.557 3.565 5.382 1.00 . A A . 19 CYS C 1 1 4 2351 1 1 19 CYS CA C 4.316 3.808 6.286 1.00 . A A . 19 CYS CA 1 1 4 2352 1 1 19 CYS CB C 3.572 2.526 6.707 1.00 . A A . 19 CYS CB 1 1 4 2353 1 1 19 CYS H H 2.579 4.573 5.001 1.00 . A A . 19 CYS H 1 1 4 2354 1 1 19 CYS HA H 4.598 4.323 7.228 1.00 . A A . 19 CYS HA 1 1 4 2355 1 1 19 CYS HB2 H 2.759 2.263 6.007 1.00 . A A . 19 CYS HB2 1 1 4 2356 1 1 19 CYS HB3 H 4.249 1.646 6.743 1.00 . A A . 19 CYS HB3 1 1 4 2357 1 1 19 CYS N N 3.386 4.754 5.621 1.00 . A A . 19 CYS N 1 1 4 2358 1 1 19 CYS O O 5.578 3.579 4.148 1.00 . A A . 19 CYS O 1 1 4 2359 1 1 19 CYS SG S 2.929 2.905 8.344 1.00 . A A . 19 CYS SG 1 1 4 2360 1 1 20 CYS C C 8.504 2.661 4.641 1.00 . A A . 20 CYS C 1 1 4 2361 1 1 20 CYS CA C 8.044 3.535 5.843 1.00 . A A . 20 CYS CA 1 1 4 2362 1 1 20 CYS CB C 8.856 3.095 7.079 1.00 . A A . 20 CYS CB 1 1 4 2363 1 1 20 CYS H H 6.348 3.460 7.191 1.00 . A A . 20 CYS H 1 1 4 2364 1 1 20 CYS HA H 8.145 4.615 5.717 1.00 . A A . 20 CYS HA 1 1 4 2365 1 1 20 CYS HB2 H 8.391 3.479 7.988 1.00 . A A . 20 CYS HB2 1 1 4 2366 1 1 20 CYS HB3 H 8.922 1.995 7.193 1.00 . A A . 20 CYS HB3 1 1 4 2367 1 1 20 CYS N N 6.617 3.457 6.201 1.00 . A A . 20 CYS N 1 1 4 2368 1 1 20 CYS O O 9.232 3.160 3.780 1.00 . A A . 20 CYS O 1 1 4 2369 1 1 20 CYS SG S 10.494 3.839 6.987 1.00 . A A . 20 CYS SG 1 1 4 2370 1 1 21 ARG C C 7.601 0.355 2.301 1.00 . A A . 21 ARG C 1 1 4 2371 1 1 21 ARG CA C 8.532 0.393 3.562 1.00 . A A . 21 ARG CA 1 1 4 2372 1 1 21 ARG CB C 8.571 -1.003 4.261 1.00 . A A . 21 ARG CB 1 1 4 2373 1 1 21 ARG CD C 9.252 -2.461 6.252 1.00 . A A . 21 ARG CD 1 1 4 2374 1 1 21 ARG CG C 9.562 -1.189 5.437 1.00 . A A . 21 ARG CG 1 1 4 2375 1 1 21 ARG CZ C 10.000 -2.188 8.652 1.00 . A A . 21 ARG CZ 1 1 4 2376 1 1 21 ARG H H 7.402 1.202 5.330 1.00 . A A . 21 ARG H 1 1 4 2377 1 1 21 ARG HA H 9.515 0.693 3.181 1.00 . A A . 21 ARG HA 1 1 4 2378 1 1 21 ARG HB2 H 7.547 -1.255 4.602 1.00 . A A . 21 ARG HB2 1 1 4 2379 1 1 21 ARG HB3 H 8.810 -1.782 3.512 1.00 . A A . 21 ARG HB3 1 1 4 2380 1 1 21 ARG HD2 H 8.192 -2.472 6.572 1.00 . A A . 21 ARG HD2 1 1 4 2381 1 1 21 ARG HD3 H 9.375 -3.358 5.620 1.00 . A A . 21 ARG HD3 1 1 4 2382 1 1 21 ARG HG2 H 10.599 -1.216 5.052 1.00 . A A . 21 ARG HG2 1 1 4 2383 1 1 21 ARG HG3 H 9.518 -0.315 6.114 1.00 . A A . 21 ARG HG3 1 1 4 2384 1 1 21 ARG HH11 H 8.193 -1.348 8.385 1.00 . A A . 21 ARG HH11 1 1 4 2385 1 1 21 ARG HH12 H 8.915 -1.264 10.070 1.00 . A A . 21 ARG HH12 1 1 4 2386 1 1 21 ARG HH21 H 11.783 -2.941 9.152 1.00 . A A . 21 ARG HH21 1 1 4 2387 1 1 21 ARG HH22 H 10.820 -2.108 10.473 1.00 . A A . 21 ARG HH22 1 1 4 2388 1 1 21 ARG N N 8.106 1.376 4.614 1.00 . A A . 21 ARG N 1 1 4 2389 1 1 21 ARG NE N 10.146 -2.580 7.447 1.00 . A A . 21 ARG NE 1 1 4 2390 1 1 21 ARG NH1 N 8.926 -1.532 9.079 1.00 . A A . 21 ARG NH1 1 1 4 2391 1 1 21 ARG NH2 N 10.962 -2.442 9.514 1.00 . A A . 21 ARG NH2 1 1 4 2392 1 1 21 ARG O O 7.417 -0.673 1.641 1.00 . A A . 21 ARG O 1 1 4 2393 1 1 22 GLY C C 4.647 0.962 1.272 1.00 . A A . 22 GLY C 1 1 4 2394 1 1 22 GLY CA C 5.963 1.703 0.983 1.00 . A A . 22 GLY CA 1 1 4 2395 1 1 22 GLY H H 7.234 2.131 2.802 1.00 . A A . 22 GLY H 1 1 4 2396 1 1 22 GLY HA2 H 5.759 2.784 0.871 1.00 . A A . 22 GLY HA2 1 1 4 2397 1 1 22 GLY HA3 H 6.330 1.382 0.007 1.00 . A A . 22 GLY HA3 1 1 4 2398 1 1 22 GLY N N 7.034 1.522 1.993 1.00 . A A . 22 GLY N 1 1 4 2399 1 1 22 GLY O O 4.188 0.144 0.470 1.00 . A A . 22 GLY O 1 1 4 2400 1 1 23 ARG C C 1.719 1.486 3.176 1.00 . A A . 23 ARG C 1 1 4 2401 1 1 23 ARG CA C 2.952 0.530 3.029 1.00 . A A . 23 ARG CA 1 1 4 2402 1 1 23 ARG CB C 3.388 -0.033 4.409 1.00 . A A . 23 ARG CB 1 1 4 2403 1 1 23 ARG CD C 3.691 -2.648 4.169 1.00 . A A . 23 ARG CD 1 1 4 2404 1 1 23 ARG CG C 4.320 -1.262 4.445 1.00 . A A . 23 ARG CG 1 1 4 2405 1 1 23 ARG CZ C 3.868 -2.983 1.654 1.00 . A A . 23 ARG CZ 1 1 4 2406 1 1 23 ARG H H 4.696 1.899 2.984 1.00 . A A . 23 ARG H 1 1 4 2407 1 1 23 ARG HA H 2.680 -0.316 2.384 1.00 . A A . 23 ARG HA 1 1 4 2408 1 1 23 ARG HB2 H 3.957 0.756 4.912 1.00 . A A . 23 ARG HB2 1 1 4 2409 1 1 23 ARG HB3 H 2.520 -0.218 5.069 1.00 . A A . 23 ARG HB3 1 1 4 2410 1 1 23 ARG HD2 H 4.417 -3.437 4.432 1.00 . A A . 23 ARG HD2 1 1 4 2411 1 1 23 ARG HD3 H 2.834 -2.812 4.849 1.00 . A A . 23 ARG HD3 1 1 4 2412 1 1 23 ARG HG2 H 5.194 -1.082 3.794 1.00 . A A . 23 ARG HG2 1 1 4 2413 1 1 23 ARG HG3 H 4.748 -1.297 5.466 1.00 . A A . 23 ARG HG3 1 1 4 2414 1 1 23 ARG HH11 H 5.704 -2.769 2.441 1.00 . A A . 23 ARG HH11 1 1 4 2415 1 1 23 ARG HH12 H 5.595 -3.032 0.628 1.00 . A A . 23 ARG HH12 1 1 4 2416 1 1 23 ARG HH21 H 2.151 -3.214 0.651 1.00 . A A . 23 ARG HH21 1 1 4 2417 1 1 23 ARG HH22 H 3.706 -3.269 -0.320 1.00 . A A . 23 ARG HH22 1 1 4 2418 1 1 23 ARG N N 4.089 1.275 2.441 1.00 . A A . 23 ARG N 1 1 4 2419 1 1 23 ARG NE N 3.237 -2.858 2.755 1.00 . A A . 23 ARG NE 1 1 4 2420 1 1 23 ARG NH1 N 5.192 -2.923 1.566 1.00 . A A . 23 ARG NH1 1 1 4 2421 1 1 23 ARG NH2 N 3.171 -3.175 0.550 1.00 . A A . 23 ARG NH2 1 1 4 2422 1 1 23 ARG O O 1.886 2.615 3.667 1.00 . A A . 23 ARG O 1 1 4 2423 1 1 24 PRO C C -1.347 2.127 4.242 1.00 . A A . 24 PRO C 1 1 4 2424 1 1 24 PRO CA C -0.721 1.965 2.820 1.00 . A A . 24 PRO CA 1 1 4 2425 1 1 24 PRO CB C -1.660 1.273 1.805 1.00 . A A . 24 PRO CB 1 1 4 2426 1 1 24 PRO CD C 0.176 -0.233 2.165 1.00 . A A . 24 PRO CD 1 1 4 2427 1 1 24 PRO CG C -1.330 -0.214 1.913 1.00 . A A . 24 PRO CG 1 1 4 2428 1 1 24 PRO HA H -0.466 2.984 2.465 1.00 . A A . 24 PRO HA 1 1 4 2429 1 1 24 PRO HB2 H -2.734 1.476 1.974 1.00 . A A . 24 PRO HB2 1 1 4 2430 1 1 24 PRO HB3 H -1.436 1.631 0.781 1.00 . A A . 24 PRO HB3 1 1 4 2431 1 1 24 PRO HD2 H 0.463 -1.077 2.821 1.00 . A A . 24 PRO HD2 1 1 4 2432 1 1 24 PRO HD3 H 0.724 -0.343 1.209 1.00 . A A . 24 PRO HD3 1 1 4 2433 1 1 24 PRO HG2 H -1.868 -0.663 2.769 1.00 . A A . 24 PRO HG2 1 1 4 2434 1 1 24 PRO HG3 H -1.618 -0.782 1.010 1.00 . A A . 24 PRO HG3 1 1 4 2435 1 1 24 PRO N N 0.471 1.080 2.784 1.00 . A A . 24 PRO N 1 1 4 2436 1 1 24 PRO O O -0.935 1.490 5.222 1.00 . A A . 24 PRO O 1 1 4 2437 1 1 25 CYS C C -4.630 2.938 5.318 1.00 . A A . 25 CYS C 1 1 4 2438 1 1 25 CYS CA C -3.126 3.275 5.549 1.00 . A A . 25 CYS CA 1 1 4 2439 1 1 25 CYS CB C -2.942 4.759 5.961 1.00 . A A . 25 CYS CB 1 1 4 2440 1 1 25 CYS H H -2.594 3.465 3.420 1.00 . A A . 25 CYS H 1 1 4 2441 1 1 25 CYS HA H -2.745 2.644 6.376 1.00 . A A . 25 CYS HA 1 1 4 2442 1 1 25 CYS HB2 H -2.477 5.351 5.157 1.00 . A A . 25 CYS HB2 1 1 4 2443 1 1 25 CYS HB3 H -3.908 5.225 6.214 1.00 . A A . 25 CYS HB3 1 1 4 2444 1 1 25 CYS N N -2.361 3.007 4.309 1.00 . A A . 25 CYS N 1 1 4 2445 1 1 25 CYS O O -5.202 3.086 4.232 1.00 . A A . 25 CYS O 1 1 4 2446 1 1 25 CYS SG S -1.904 4.810 7.407 1.00 . A A . 25 CYS SG 1 1 4 2447 1 1 26 ARG C C -7.112 3.187 7.748 1.00 . A A . 26 ARG C 1 1 4 2448 1 1 26 ARG CA C -6.703 2.285 6.559 1.00 . A A . 26 ARG CA 1 1 4 2449 1 1 26 ARG CB C -7.014 0.786 6.811 1.00 . A A . 26 ARG CB 1 1 4 2450 1 1 26 ARG CD C -8.816 -1.052 7.162 1.00 . A A . 26 ARG CD 1 1 4 2451 1 1 26 ARG CG C -8.511 0.404 6.752 1.00 . A A . 26 ARG CG 1 1 4 2452 1 1 26 ARG CZ C -7.394 -3.051 6.571 1.00 . A A . 26 ARG CZ 1 1 4 2453 1 1 26 ARG H H -4.673 2.583 7.276 1.00 . A A . 26 ARG H 1 1 4 2454 1 1 26 ARG HA H -7.225 2.598 5.631 1.00 . A A . 26 ARG HA 1 1 4 2455 1 1 26 ARG HB2 H -6.480 0.176 6.057 1.00 . A A . 26 ARG HB2 1 1 4 2456 1 1 26 ARG HB3 H -6.588 0.469 7.784 1.00 . A A . 26 ARG HB3 1 1 4 2457 1 1 26 ARG HD2 H -8.500 -1.210 8.211 1.00 . A A . 26 ARG HD2 1 1 4 2458 1 1 26 ARG HD3 H -9.913 -1.192 7.176 1.00 . A A . 26 ARG HD3 1 1 4 2459 1 1 26 ARG HG2 H -9.083 1.073 7.422 1.00 . A A . 26 ARG HG2 1 1 4 2460 1 1 26 ARG HG3 H -8.908 0.603 5.738 1.00 . A A . 26 ARG HG3 1 1 4 2461 1 1 26 ARG HH11 H -7.331 -2.653 8.543 1.00 . A A . 26 ARG HH11 1 1 4 2462 1 1 26 ARG HH12 H -6.332 -4.070 7.942 1.00 . A A . 26 ARG HH12 1 1 4 2463 1 1 26 ARG HH21 H -7.288 -3.649 4.663 1.00 . A A . 26 ARG HH21 1 1 4 2464 1 1 26 ARG HH22 H -6.312 -4.594 5.896 1.00 . A A . 26 ARG HH22 1 1 4 2465 1 1 26 ARG N N -5.243 2.489 6.424 1.00 . A A . 26 ARG N 1 1 4 2466 1 1 26 ARG NE N -8.239 -2.056 6.227 1.00 . A A . 26 ARG NE 1 1 4 2467 1 1 26 ARG NH1 N -6.976 -3.282 7.814 1.00 . A A . 26 ARG NH1 1 1 4 2468 1 1 26 ARG NH2 N -6.953 -3.845 5.613 1.00 . A A . 26 ARG NH2 1 1 4 2469 1 1 26 ARG O O -6.587 3.032 8.861 1.00 . A A . 26 ARG O 1 1 4 2470 1 1 27 CYS C C -9.125 4.654 9.761 1.00 . A A . 27 CYS C 1 1 4 2471 1 1 27 CYS CA C -8.253 5.190 8.574 1.00 . A A . 27 CYS CA 1 1 4 2472 1 1 27 CYS CB C -8.953 6.415 7.953 1.00 . A A . 27 CYS CB 1 1 4 2473 1 1 27 CYS H H -8.391 4.229 6.580 1.00 . A A . 27 CYS H 1 1 4 2474 1 1 27 CYS HA H -7.241 5.488 8.892 1.00 . A A . 27 CYS HA 1 1 4 2475 1 1 27 CYS HB2 H -9.975 6.193 7.677 1.00 . A A . 27 CYS HB2 1 1 4 2476 1 1 27 CYS HB3 H -9.042 7.223 8.703 1.00 . A A . 27 CYS HB3 1 1 4 2477 1 1 27 CYS N N -8.025 4.155 7.536 1.00 . A A . 27 CYS N 1 1 4 2478 1 1 27 CYS O O -9.715 3.567 9.726 1.00 . A A . 27 CYS O 1 1 4 2479 1 1 27 CYS SG S -8.030 7.090 6.574 1.00 . A A . 27 CYS SG 1 1 4 2480 1 1 28 SER C C -11.397 5.123 12.010 1.00 . A A . 28 SER C 1 1 4 2481 1 1 28 SER CA C -9.832 5.129 12.119 1.00 . A A . 28 SER CA 1 1 4 2482 1 1 28 SER CB C -9.260 6.171 13.129 1.00 . A A . 28 SER CB 1 1 4 2483 1 1 28 SER H H -8.590 6.311 10.728 1.00 . A A . 28 SER H 1 1 4 2484 1 1 28 SER HA H -9.562 4.121 12.475 1.00 . A A . 28 SER HA 1 1 4 2485 1 1 28 SER HB2 H -8.179 6.355 12.977 1.00 . A A . 28 SER HB2 1 1 4 2486 1 1 28 SER HB3 H -9.773 7.144 13.030 1.00 . A A . 28 SER HB3 1 1 4 2487 1 1 28 SER HG H -8.938 4.882 14.519 1.00 . A A . 28 SER HG 1 1 4 2488 1 1 28 SER N N -9.164 5.467 10.834 1.00 . A A . 28 SER N 1 1 4 2489 1 1 28 SER O O -12.010 5.074 10.938 1.00 . A A . 28 SER O 1 1 4 2490 1 1 28 SER OG O -9.411 5.716 14.468 1.00 . A A . 28 SER OG 1 1 4 2491 1 1 29 MET C C -14.377 6.043 12.878 1.00 . A A . 29 MET C 1 1 4 2492 1 1 29 MET CA C -13.474 4.893 13.413 1.00 . A A . 29 MET CA 1 1 4 2493 1 1 29 MET CB C -13.661 4.718 14.949 1.00 . A A . 29 MET CB 1 1 4 2494 1 1 29 MET CE C -12.923 6.687 18.555 1.00 . A A . 29 MET CE 1 1 4 2495 1 1 29 MET CG C -13.326 5.855 15.940 1.00 . A A . 29 MET CG 1 1 4 2496 1 1 29 MET H H -11.328 5.271 13.939 1.00 . A A . 29 MET H 1 1 4 2497 1 1 29 MET HA H -13.795 3.969 12.894 1.00 . A A . 29 MET HA 1 1 4 2498 1 1 29 MET HB2 H -14.701 4.406 15.136 1.00 . A A . 29 MET HB2 1 1 4 2499 1 1 29 MET HB3 H -13.035 3.870 15.243 1.00 . A A . 29 MET HB3 1 1 4 2500 1 1 29 MET HE1 H -13.620 7.525 18.367 1.00 . A A . 29 MET HE1 1 1 4 2501 1 1 29 MET HE2 H -12.926 6.477 19.640 1.00 . A A . 29 MET HE2 1 1 4 2502 1 1 29 MET HE3 H -11.905 7.012 18.272 1.00 . A A . 29 MET HE3 1 1 4 2503 1 1 29 MET HG2 H -12.315 6.262 15.754 1.00 . A A . 29 MET HG2 1 1 4 2504 1 1 29 MET HG3 H -14.039 6.691 15.837 1.00 . A A . 29 MET HG3 1 1 4 2505 1 1 29 MET N N -12.010 5.103 13.194 1.00 . A A . 29 MET N 1 1 4 2506 1 1 29 MET O O -15.401 5.792 12.235 1.00 . A A . 29 MET O 1 1 4 2507 1 1 29 MET SD S -13.413 5.221 17.626 1.00 . A A . 29 MET SD 1 1 4 2508 1 1 30 ILE C C -14.322 8.746 11.108 1.00 . A A . 30 ILE C 1 1 4 2509 1 1 30 ILE CA C -14.625 8.522 12.633 1.00 . A A . 30 ILE CA 1 1 4 2510 1 1 30 ILE CB C -14.174 9.799 13.461 1.00 . A A . 30 ILE CB 1 1 4 2511 1 1 30 ILE CD1 C -12.143 11.261 14.260 1.00 . A A . 30 ILE CD1 1 1 4 2512 1 1 30 ILE CG1 C -12.628 9.914 13.701 1.00 . A A . 30 ILE CG1 1 1 4 2513 1 1 30 ILE CG2 C -14.901 9.753 14.832 1.00 . A A . 30 ILE CG2 1 1 4 2514 1 1 30 ILE H H -13.061 7.208 13.655 1.00 . A A . 30 ILE H 1 1 4 2515 1 1 30 ILE HA H -15.720 8.401 12.719 1.00 . A A . 30 ILE HA 1 1 4 2516 1 1 30 ILE HB H -14.486 10.718 12.927 1.00 . A A . 30 ILE HB 1 1 4 2517 1 1 30 ILE HD11 H -12.470 12.107 13.628 1.00 . A A . 30 ILE HD11 1 1 4 2518 1 1 30 ILE HD12 H -12.515 11.444 15.284 1.00 . A A . 30 ILE HD12 1 1 4 2519 1 1 30 ILE HD13 H -11.039 11.296 14.306 1.00 . A A . 30 ILE HD13 1 1 4 2520 1 1 30 ILE HG12 H -12.270 9.102 14.362 1.00 . A A . 30 ILE HG12 1 1 4 2521 1 1 30 ILE HG13 H -12.093 9.759 12.749 1.00 . A A . 30 ILE HG13 1 1 4 2522 1 1 30 ILE HG21 H -15.997 9.669 14.712 1.00 . A A . 30 ILE HG21 1 1 4 2523 1 1 30 ILE HG22 H -14.575 8.903 15.460 1.00 . A A . 30 ILE HG22 1 1 4 2524 1 1 30 ILE HG23 H -14.729 10.673 15.421 1.00 . A A . 30 ILE HG23 1 1 4 2525 1 1 30 ILE N N -13.957 7.282 13.148 1.00 . A A . 30 ILE N 1 1 4 2526 1 1 30 ILE O O -15.240 9.147 10.386 1.00 . A A . 30 ILE O 1 1 4 2527 1 1 31 GLY C C -11.412 9.624 9.079 1.00 . A A . 31 GLY C 1 1 4 2528 1 1 31 GLY CA C -12.684 8.764 9.227 1.00 . A A . 31 GLY CA 1 1 4 2529 1 1 31 GLY H H -12.424 8.308 11.388 1.00 . A A . 31 GLY H 1 1 4 2530 1 1 31 GLY HA2 H -12.507 7.790 8.736 1.00 . A A . 31 GLY HA2 1 1 4 2531 1 1 31 GLY HA3 H -13.494 9.238 8.639 1.00 . A A . 31 GLY HA3 1 1 4 2532 1 1 31 GLY N N -13.090 8.493 10.630 1.00 . A A . 31 GLY N 1 1 4 2533 1 1 31 GLY O O -10.554 9.304 8.253 1.00 . A A . 31 GLY O 1 1 4 2534 1 1 32 THR C C -9.135 10.987 11.053 1.00 . A A . 32 THR C 1 1 4 2535 1 1 32 THR CA C -10.071 11.544 9.936 1.00 . A A . 32 THR CA 1 1 4 2536 1 1 32 THR CB C -10.409 13.038 10.251 1.00 . A A . 32 THR CB 1 1 4 2537 1 1 32 THR CG2 C -11.202 13.719 9.119 1.00 . A A . 32 THR CG2 1 1 4 2538 1 1 32 THR H H -12.032 10.732 10.592 1.00 . A A . 32 THR H 1 1 4 2539 1 1 32 THR HA H -9.538 11.511 8.963 1.00 . A A . 32 THR HA 1 1 4 2540 1 1 32 THR HB H -9.445 13.569 10.387 1.00 . A A . 32 THR HB 1 1 4 2541 1 1 32 THR HG1 H -11.334 14.082 11.582 1.00 . A A . 32 THR HG1 1 1 4 2542 1 1 32 THR HG21 H -10.657 13.678 8.158 1.00 . A A . 32 THR HG21 1 1 4 2543 1 1 32 THR HG22 H -12.192 13.252 8.960 1.00 . A A . 32 THR HG22 1 1 4 2544 1 1 32 THR HG23 H -11.380 14.787 9.344 1.00 . A A . 32 THR HG23 1 1 4 2545 1 1 32 THR N N -11.306 10.710 9.865 1.00 . A A . 32 THR N 1 1 4 2546 1 1 32 THR O O -9.555 10.283 11.979 1.00 . A A . 32 THR O 1 1 4 2547 1 1 32 THR OG1 O -11.196 13.143 11.437 1.00 . A A . 32 THR OG1 1 1 4 2548 1 1 33 ASN C C -6.564 9.269 11.465 1.00 . A A . 33 ASN C 1 1 4 2549 1 1 33 ASN CA C -6.700 10.797 11.748 1.00 . A A . 33 ASN CA 1 1 4 2550 1 1 33 ASN CB C -6.906 11.075 13.277 1.00 . A A . 33 ASN CB 1 1 4 2551 1 1 33 ASN CG C -6.874 12.562 13.680 1.00 . A A . 33 ASN CG 1 1 4 2552 1 1 33 ASN H H -7.626 11.795 10.032 1.00 . A A . 33 ASN H 1 1 4 2553 1 1 33 ASN HA H -5.764 11.293 11.424 1.00 . A A . 33 ASN HA 1 1 4 2554 1 1 33 ASN HB2 H -7.847 10.633 13.651 1.00 . A A . 33 ASN HB2 1 1 4 2555 1 1 33 ASN HB3 H -6.134 10.525 13.850 1.00 . A A . 33 ASN HB3 1 1 4 2556 1 1 33 ASN HD21 H -4.883 12.489 13.914 1.00 . A A . 33 ASN HD21 1 1 4 2557 1 1 33 ASN HD22 H -5.706 14.097 14.233 1.00 . A A . 33 ASN HD22 1 1 4 2558 1 1 33 ASN N N -7.832 11.324 10.920 1.00 . A A . 33 ASN N 1 1 4 2559 1 1 33 ASN ND2 N -5.702 13.104 13.975 1.00 . A A . 33 ASN ND2 1 1 4 2560 1 1 33 ASN O O -6.894 8.415 12.294 1.00 . A A . 33 ASN O 1 1 4 2561 1 1 33 ASN OD1 O -7.905 13.232 13.723 1.00 . A A . 33 ASN OD1 1 1 4 2562 1 1 34 CYS C C -4.809 6.776 10.559 1.00 . A A . 34 CYS C 1 1 4 2563 1 1 34 CYS CA C -5.921 7.550 9.779 1.00 . A A . 34 CYS CA 1 1 4 2564 1 1 34 CYS CB C -5.567 7.580 8.273 1.00 . A A . 34 CYS CB 1 1 4 2565 1 1 34 CYS H H -6.000 9.776 9.636 1.00 . A A . 34 CYS H 1 1 4 2566 1 1 34 CYS HA H -6.892 7.050 9.908 1.00 . A A . 34 CYS HA 1 1 4 2567 1 1 34 CYS HB2 H -4.577 8.008 8.132 1.00 . A A . 34 CYS HB2 1 1 4 2568 1 1 34 CYS HB3 H -5.512 6.550 7.873 1.00 . A A . 34 CYS HB3 1 1 4 2569 1 1 34 CYS N N -6.062 8.955 10.254 1.00 . A A . 34 CYS N 1 1 4 2570 1 1 34 CYS O O -4.027 7.375 11.307 1.00 . A A . 34 CYS O 1 1 4 2571 1 1 34 CYS SG S -6.824 8.469 7.344 1.00 . A A . 34 CYS SG 1 1 4 2572 1 1 35 GLU C C -3.150 3.527 9.924 1.00 . A A . 35 GLU C 1 1 4 2573 1 1 35 GLU CA C -3.553 4.665 10.924 1.00 . A A . 35 GLU CA 1 1 4 2574 1 1 35 GLU CB C -3.834 4.054 12.344 1.00 . A A . 35 GLU CB 1 1 4 2575 1 1 35 GLU CD C -6.231 3.196 12.700 1.00 . A A . 35 GLU CD 1 1 4 2576 1 1 35 GLU CG C -5.172 4.229 13.095 1.00 . A A . 35 GLU CG 1 1 4 2577 1 1 35 GLU H H -5.473 5.053 9.771 1.00 . A A . 35 GLU H 1 1 4 2578 1 1 35 GLU HA H -2.686 5.347 11.012 1.00 . A A . 35 GLU HA 1 1 4 2579 1 1 35 GLU HB2 H -3.523 2.995 12.389 1.00 . A A . 35 GLU HB2 1 1 4 2580 1 1 35 GLU HB3 H -3.081 4.526 13.003 1.00 . A A . 35 GLU HB3 1 1 4 2581 1 1 35 GLU HE2 H -6.968 1.513 13.342 1.00 . A A . 35 GLU HE2 1 1 4 2582 1 1 35 GLU HG2 H -4.969 4.156 14.179 1.00 . A A . 35 GLU HG2 1 1 4 2583 1 1 35 GLU HG3 H -5.559 5.256 12.957 1.00 . A A . 35 GLU HG3 1 1 4 2584 1 1 35 GLU N N -4.732 5.436 10.387 1.00 . A A . 35 GLU N 1 1 4 2585 1 1 35 GLU O O -3.896 3.122 9.032 1.00 . A A . 35 GLU O 1 1 4 2586 1 1 35 GLU OE1 O -6.931 3.293 11.695 1.00 . A A . 35 GLU OE1 1 1 4 2587 1 1 35 GLU OE2 O -6.303 2.158 13.594 1.00 . A A . 35 GLU OE2 1 1 4 2588 1 1 36 CYS C C -1.845 0.687 9.164 1.00 . A A . 36 CYS C 1 1 4 2589 1 1 36 CYS CA C -1.228 2.115 9.104 1.00 . A A . 36 CYS CA 1 1 4 2590 1 1 36 CYS CB C 0.304 2.125 9.452 1.00 . A A . 36 CYS CB 1 1 4 2591 1 1 36 CYS H H -1.440 3.361 10.932 1.00 . A A . 36 CYS H 1 1 4 2592 1 1 36 CYS HA H -1.361 2.523 8.076 1.00 . A A . 36 CYS HA 1 1 4 2593 1 1 36 CYS HB2 H 0.527 2.193 10.533 1.00 . A A . 36 CYS HB2 1 1 4 2594 1 1 36 CYS HB3 H 0.838 1.188 9.220 1.00 . A A . 36 CYS HB3 1 1 4 2595 1 1 36 CYS N N -1.900 3.035 10.074 1.00 . A A . 36 CYS N 1 1 4 2596 1 1 36 CYS O O -2.574 0.328 10.096 1.00 . A A . 36 CYS O 1 1 4 2597 1 1 36 CYS SG S 1.033 3.418 8.458 1.00 . A A . 36 CYS SG 1 1 4 2598 1 1 37 THR C C -1.080 -2.474 7.492 1.00 . A A . 37 THR C 1 1 4 2599 1 1 37 THR CA C -2.182 -1.489 8.030 1.00 . A A . 37 THR CA 1 1 4 2600 1 1 37 THR CB C -3.467 -1.503 7.135 1.00 . A A . 37 THR CB 1 1 4 2601 1 1 37 THR CG2 C -3.320 -0.921 5.713 1.00 . A A . 37 THR CG2 1 1 4 2602 1 1 37 THR H H -1.113 0.327 7.321 1.00 . A A . 37 THR H 1 1 4 2603 1 1 37 THR HA H -2.485 -1.818 9.039 1.00 . A A . 37 THR HA 1 1 4 2604 1 1 37 THR HB H -4.236 -0.966 7.714 1.00 . A A . 37 THR HB 1 1 4 2605 1 1 37 THR HG1 H -3.198 -3.292 6.481 1.00 . A A . 37 THR HG1 1 1 4 2606 1 1 37 THR HG21 H -2.529 -1.425 5.128 1.00 . A A . 37 THR HG21 1 1 4 2607 1 1 37 THR HG22 H -4.263 -1.021 5.145 1.00 . A A . 37 THR HG22 1 1 4 2608 1 1 37 THR HG23 H -3.086 0.156 5.738 1.00 . A A . 37 THR HG23 1 1 4 2609 1 1 37 THR N N -1.617 -0.110 8.104 1.00 . A A . 37 THR N 1 1 4 2610 1 1 37 THR O O -0.368 -2.140 6.536 1.00 . A A . 37 THR O 1 1 4 2611 1 1 37 THR OG1 O -3.904 -2.846 6.954 1.00 . A A . 37 THR OG1 1 1 4 2612 1 1 38 PRO C C -0.447 -5.414 6.247 1.00 . A A . 38 PRO C 1 1 4 2613 1 1 38 PRO CA C 0.007 -4.743 7.577 1.00 . A A . 38 PRO CA 1 1 4 2614 1 1 38 PRO CB C 0.072 -5.743 8.750 1.00 . A A . 38 PRO CB 1 1 4 2615 1 1 38 PRO CD C -1.723 -4.175 9.224 1.00 . A A . 38 PRO CD 1 1 4 2616 1 1 38 PRO CG C -1.260 -5.607 9.494 1.00 . A A . 38 PRO CG 1 1 4 2617 1 1 38 PRO HA H 1.012 -4.298 7.422 1.00 . A A . 38 PRO HA 1 1 4 2618 1 1 38 PRO HB2 H 0.263 -6.786 8.436 1.00 . A A . 38 PRO HB2 1 1 4 2619 1 1 38 PRO HB3 H 0.900 -5.479 9.429 1.00 . A A . 38 PRO HB3 1 1 4 2620 1 1 38 PRO HD2 H -2.804 -4.129 9.031 1.00 . A A . 38 PRO HD2 1 1 4 2621 1 1 38 PRO HD3 H -1.565 -3.499 10.081 1.00 . A A . 38 PRO HD3 1 1 4 2622 1 1 38 PRO HG2 H -1.996 -6.324 9.083 1.00 . A A . 38 PRO HG2 1 1 4 2623 1 1 38 PRO HG3 H -1.165 -5.823 10.574 1.00 . A A . 38 PRO HG3 1 1 4 2624 1 1 38 PRO N N -0.948 -3.717 8.054 1.00 . A A . 38 PRO N 1 1 4 2625 1 1 38 PRO O O -1.554 -5.958 6.172 1.00 . A A . 38 PRO O 1 1 4 2626 1 1 39 ARG C C 1.301 -7.064 3.699 1.00 . A A . 39 ARG C 1 1 4 2627 1 1 39 ARG CA C 0.152 -6.034 3.915 1.00 . A A . 39 ARG CA 1 1 4 2628 1 1 39 ARG CB C 0.021 -4.947 2.797 1.00 . A A . 39 ARG CB 1 1 4 2629 1 1 39 ARG CD C -2.546 -4.479 2.910 1.00 . A A . 39 ARG CD 1 1 4 2630 1 1 39 ARG CG C -1.114 -3.904 2.933 1.00 . A A . 39 ARG CG 1 1 4 2631 1 1 39 ARG CZ C -4.143 -2.718 2.081 1.00 . A A . 39 ARG CZ 1 1 4 2632 1 1 39 ARG H H 1.304 -4.890 5.416 1.00 . A A . 39 ARG H 1 1 4 2633 1 1 39 ARG HA H -0.793 -6.606 3.931 1.00 . A A . 39 ARG HA 1 1 4 2634 1 1 39 ARG HB2 H 0.970 -4.389 2.707 1.00 . A A . 39 ARG HB2 1 1 4 2635 1 1 39 ARG HB3 H -0.094 -5.455 1.821 1.00 . A A . 39 ARG HB3 1 1 4 2636 1 1 39 ARG HD2 H -2.717 -5.062 1.985 1.00 . A A . 39 ARG HD2 1 1 4 2637 1 1 39 ARG HD3 H -2.670 -5.202 3.735 1.00 . A A . 39 ARG HD3 1 1 4 2638 1 1 39 ARG HG2 H -0.961 -3.312 3.856 1.00 . A A . 39 ARG HG2 1 1 4 2639 1 1 39 ARG HG3 H -1.006 -3.178 2.106 1.00 . A A . 39 ARG HG3 1 1 4 2640 1 1 39 ARG HH11 H -3.141 -3.593 0.570 1.00 . A A . 39 ARG HH11 1 1 4 2641 1 1 39 ARG HH12 H -4.342 -2.277 0.128 1.00 . A A . 39 ARG HH12 1 1 4 2642 1 1 39 ARG HH21 H -5.252 -1.694 3.396 1.00 . A A . 39 ARG HH21 1 1 4 2643 1 1 39 ARG HH22 H -5.454 -1.277 1.621 1.00 . A A . 39 ARG HH22 1 1 4 2644 1 1 39 ARG N N 0.419 -5.370 5.220 1.00 . A A . 39 ARG N 1 1 4 2645 1 1 39 ARG NE N -3.578 -3.425 3.081 1.00 . A A . 39 ARG NE 1 1 4 2646 1 1 39 ARG NH1 N -3.846 -2.881 0.793 1.00 . A A . 39 ARG NH1 1 1 4 2647 1 1 39 ARG NH2 N -5.043 -1.805 2.398 1.00 . A A . 39 ARG NH2 1 1 4 2648 1 1 39 ARG O O 1.151 -8.201 4.158 1.00 . A A . 39 ARG O 1 1 4 2649 1 1 40 LEU C C 4.853 -6.642 3.147 1.00 . A A . 40 LEU C 1 1 4 2650 1 1 40 LEU CA C 3.626 -7.570 2.935 1.00 . A A . 40 LEU CA 1 1 4 2651 1 1 40 LEU CB C 3.712 -8.279 1.546 1.00 . A A . 40 LEU CB 1 1 4 2652 1 1 40 LEU CD1 C 1.392 -8.923 0.590 1.00 . A A . 40 LEU CD1 1 1 4 2653 1 1 40 LEU CD2 C 3.316 -10.522 0.368 1.00 . A A . 40 LEU CD2 1 1 4 2654 1 1 40 LEU CG C 2.693 -9.423 1.256 1.00 . A A . 40 LEU CG 1 1 4 2655 1 1 40 LEU H H 2.410 -5.733 2.707 1.00 . A A . 40 LEU H 1 1 4 2656 1 1 40 LEU HA H 3.610 -8.360 3.715 1.00 . A A . 40 LEU HA 1 1 4 2657 1 1 40 LEU HB2 H 3.694 -7.536 0.724 1.00 . A A . 40 LEU HB2 1 1 4 2658 1 1 40 LEU HB3 H 4.732 -8.709 1.486 1.00 . A A . 40 LEU HB3 1 1 4 2659 1 1 40 LEU HD11 H 0.857 -8.186 1.212 1.00 . A A . 40 LEU HD11 1 1 4 2660 1 1 40 LEU HD12 H 1.584 -8.441 -0.387 1.00 . A A . 40 LEU HD12 1 1 4 2661 1 1 40 LEU HD13 H 0.680 -9.751 0.412 1.00 . A A . 40 LEU HD13 1 1 4 2662 1 1 40 LEU HD21 H 4.215 -10.962 0.838 1.00 . A A . 40 LEU HD21 1 1 4 2663 1 1 40 LEU HD22 H 2.612 -11.357 0.193 1.00 . A A . 40 LEU HD22 1 1 4 2664 1 1 40 LEU HD23 H 3.621 -10.134 -0.622 1.00 . A A . 40 LEU HD23 1 1 4 2665 1 1 40 LEU HG H 2.423 -9.907 2.213 1.00 . A A . 40 LEU HG 1 1 4 2666 1 1 40 LEU N N 2.423 -6.701 3.046 1.00 . A A . 40 LEU N 1 1 4 2667 1 1 40 LEU O O 5.248 -5.902 2.240 1.00 . A A . 40 LEU O 1 1 4 2668 1 1 41 ILE C C 7.892 -6.230 4.040 1.00 . A A . 41 ILE C 1 1 4 2669 1 1 41 ILE CA C 6.572 -5.765 4.741 1.00 . A A . 41 ILE CA 1 1 4 2670 1 1 41 ILE CB C 6.790 -5.725 6.309 1.00 . A A . 41 ILE CB 1 1 4 2671 1 1 41 ILE CD1 C 7.402 -7.144 8.422 1.00 . A A . 41 ILE CD1 1 1 4 2672 1 1 41 ILE CG1 C 6.843 -7.135 6.990 1.00 . A A . 41 ILE CG1 1 1 4 2673 1 1 41 ILE CG2 C 5.631 -4.899 6.931 1.00 . A A . 41 ILE CG2 1 1 4 2674 1 1 41 ILE H H 5.037 -7.345 5.019 1.00 . A A . 41 ILE H 1 1 4 2675 1 1 41 ILE HA H 6.324 -4.741 4.393 1.00 . A A . 41 ILE HA 1 1 4 2676 1 1 41 ILE HB H 7.748 -5.217 6.536 1.00 . A A . 41 ILE HB 1 1 4 2677 1 1 41 ILE HD11 H 8.423 -6.720 8.463 1.00 . A A . 41 ILE HD11 1 1 4 2678 1 1 41 ILE HD12 H 6.770 -6.567 9.120 1.00 . A A . 41 ILE HD12 1 1 4 2679 1 1 41 ILE HD13 H 7.462 -8.175 8.816 1.00 . A A . 41 ILE HD13 1 1 4 2680 1 1 41 ILE HG12 H 5.844 -7.612 6.987 1.00 . A A . 41 ILE HG12 1 1 4 2681 1 1 41 ILE HG13 H 7.480 -7.814 6.397 1.00 . A A . 41 ILE HG13 1 1 4 2682 1 1 41 ILE HG21 H 5.596 -3.875 6.515 1.00 . A A . 41 ILE HG21 1 1 4 2683 1 1 41 ILE HG22 H 4.639 -5.357 6.758 1.00 . A A . 41 ILE HG22 1 1 4 2684 1 1 41 ILE HG23 H 5.748 -4.778 8.023 1.00 . A A . 41 ILE HG23 1 1 4 2685 1 1 41 ILE N N 5.456 -6.688 4.352 1.00 . A A . 41 ILE N 1 1 4 2686 1 1 41 ILE O O 8.254 -7.412 4.033 1.00 . A A . 41 ILE O 1 1 4 2687 1 1 42 MET C C 11.073 -5.486 3.435 1.00 . A A . 42 MET C 1 1 4 2688 1 1 42 MET CA C 9.775 -5.514 2.568 1.00 . A A . 42 MET CA 1 1 4 2689 1 1 42 MET CB C 9.793 -4.449 1.429 1.00 . A A . 42 MET CB 1 1 4 2690 1 1 42 MET CE C 9.895 -3.693 -1.984 1.00 . A A . 42 MET CE 1 1 4 2691 1 1 42 MET CG C 8.672 -4.584 0.380 1.00 . A A . 42 MET CG 1 1 4 2692 1 1 42 MET H H 8.172 -4.319 3.506 1.00 . A A . 42 MET H 1 1 4 2693 1 1 42 MET HA H 9.715 -6.513 2.102 1.00 . A A . 42 MET HA 1 1 4 2694 1 1 42 MET HB2 H 9.765 -3.426 1.852 1.00 . A A . 42 MET HB2 1 1 4 2695 1 1 42 MET HB3 H 10.760 -4.508 0.894 1.00 . A A . 42 MET HB3 1 1 4 2696 1 1 42 MET HE1 H 10.876 -3.912 -1.525 1.00 . A A . 42 MET HE1 1 1 4 2697 1 1 42 MET HE2 H 9.545 -4.602 -2.507 1.00 . A A . 42 MET HE2 1 1 4 2698 1 1 42 MET HE3 H 10.040 -2.898 -2.738 1.00 . A A . 42 MET HE3 1 1 4 2699 1 1 42 MET HG2 H 8.764 -5.529 -0.187 1.00 . A A . 42 MET HG2 1 1 4 2700 1 1 42 MET HG3 H 7.680 -4.610 0.869 1.00 . A A . 42 MET HG3 1 1 4 2701 1 1 42 MET N N 8.586 -5.255 3.428 1.00 . A A . 42 MET N 1 1 4 2702 1 1 42 MET O O 11.681 -6.542 3.623 1.00 . A A . 42 MET O 1 1 4 2703 1 1 42 MET SD S 8.698 -3.167 -0.740 1.00 . A A . 42 MET SD 1 1 4 2704 1 1 43 GLU C C 13.959 -4.215 4.072 1.00 . A A . 43 GLU C 1 1 4 2705 1 1 43 GLU CA C 12.631 -4.066 4.878 1.00 . A A . 43 GLU CA 1 1 4 2706 1 1 43 GLU CB C 12.631 -5.049 6.090 1.00 . A A . 43 GLU CB 1 1 4 2707 1 1 43 GLU CD C 14.886 -4.558 7.333 1.00 . A A . 43 GLU CD 1 1 4 2708 1 1 43 GLU CG C 13.357 -4.592 7.378 1.00 . A A . 43 GLU CG 1 1 4 2709 1 1 43 GLU H H 10.845 -3.537 3.687 1.00 . A A . 43 GLU H 1 1 4 2710 1 1 43 GLU HA H 12.531 -3.026 5.251 1.00 . A A . 43 GLU HA 1 1 4 2711 1 1 43 GLU HB2 H 11.582 -5.158 6.396 1.00 . A A . 43 GLU HB2 1 1 4 2712 1 1 43 GLU HB3 H 12.958 -6.068 5.806 1.00 . A A . 43 GLU HB3 1 1 4 2713 1 1 43 GLU HE2 H 16.396 -5.782 7.237 1.00 . A A . 43 GLU HE2 1 1 4 2714 1 1 43 GLU HG2 H 12.987 -3.593 7.673 1.00 . A A . 43 GLU HG2 1 1 4 2715 1 1 43 GLU HG3 H 13.058 -5.256 8.210 1.00 . A A . 43 GLU HG3 1 1 4 2716 1 1 43 GLU N N 11.470 -4.302 3.960 1.00 . A A . 43 GLU N 1 1 4 2717 1 1 43 GLU O O 14.236 -5.216 3.402 1.00 . A A . 43 GLU O 1 1 4 2718 1 1 43 GLU OE1 O 15.535 -3.515 7.374 1.00 . A A . 43 GLU OE1 1 1 4 2719 1 1 43 GLU OE2 O 15.437 -5.811 7.256 1.00 . A A . 43 GLU OE2 1 1 4 2720 1 1 44 GLY C C 17.073 -2.416 4.612 1.00 . A A . 44 GLY C 1 1 4 2721 1 1 44 GLY CA C 16.125 -3.092 3.612 1.00 . A A . 44 GLY CA 1 1 4 2722 1 1 44 GLY H H 14.425 -2.532 4.934 1.00 . A A . 44 GLY H 1 1 4 2723 1 1 44 GLY HA2 H 16.521 -4.095 3.359 1.00 . A A . 44 GLY HA2 1 1 4 2724 1 1 44 GLY HA3 H 16.084 -2.536 2.655 1.00 . A A . 44 GLY HA3 1 1 4 2725 1 1 44 GLY N N 14.770 -3.167 4.205 1.00 . A A . 44 GLY N 1 1 4 2726 1 1 44 GLY O O 17.741 -3.108 5.385 1.00 . A A . 44 GLY O 1 1 4 2727 1 1 45 LEU C C 16.359 0.446 6.394 1.00 . A A . 45 LEU C 1 1 4 2728 1 1 45 LEU CA C 17.587 -0.285 5.776 1.00 . A A . 45 LEU CA 1 1 4 2729 1 1 45 LEU CB C 18.707 0.687 5.284 1.00 . A A . 45 LEU CB 1 1 4 2730 1 1 45 LEU CD1 C 18.973 2.311 7.308 1.00 . A A . 45 LEU CD1 1 1 4 2731 1 1 45 LEU CD2 C 20.501 0.296 7.110 1.00 . A A . 45 LEU CD2 1 1 4 2732 1 1 45 LEU CG C 19.659 1.331 6.336 1.00 . A A . 45 LEU CG 1 1 4 2733 1 1 45 LEU H H 16.471 -0.641 3.914 1.00 . A A . 45 LEU H 1 1 4 2734 1 1 45 LEU HA H 18.032 -0.951 6.542 1.00 . A A . 45 LEU HA 1 1 4 2735 1 1 45 LEU HB2 H 19.362 0.141 4.576 1.00 . A A . 45 LEU HB2 1 1 4 2736 1 1 45 LEU HB3 H 18.264 1.488 4.660 1.00 . A A . 45 LEU HB3 1 1 4 2737 1 1 45 LEU HD11 H 18.384 3.075 6.768 1.00 . A A . 45 LEU HD11 1 1 4 2738 1 1 45 LEU HD12 H 18.287 1.797 8.006 1.00 . A A . 45 LEU HD12 1 1 4 2739 1 1 45 LEU HD13 H 19.713 2.855 7.925 1.00 . A A . 45 LEU HD13 1 1 4 2740 1 1 45 LEU HD21 H 21.021 -0.401 6.426 1.00 . A A . 45 LEU HD21 1 1 4 2741 1 1 45 LEU HD22 H 21.282 0.783 7.722 1.00 . A A . 45 LEU HD22 1 1 4 2742 1 1 45 LEU HD23 H 19.886 -0.314 7.797 1.00 . A A . 45 LEU HD23 1 1 4 2743 1 1 45 LEU HG H 20.379 1.936 5.754 1.00 . A A . 45 LEU HG 1 1 4 2744 1 1 45 LEU N N 17.075 -1.070 4.623 1.00 . A A . 45 LEU N 1 1 4 2745 1 1 45 LEU O O 16.006 1.566 6.008 1.00 . A A . 45 LEU O 1 1 4 2746 1 1 46 SER C C 14.644 -0.225 9.552 1.00 . A A . 46 SER C 1 1 4 2747 1 1 46 SER CA C 14.536 0.305 8.093 1.00 . A A . 46 SER CA 1 1 4 2748 1 1 46 SER CB C 13.229 -0.104 7.358 1.00 . A A . 46 SER CB 1 1 4 2749 1 1 46 SER H H 16.094 -1.160 7.561 1.00 . A A . 46 SER H 1 1 4 2750 1 1 46 SER HA H 14.579 1.407 8.137 1.00 . A A . 46 SER HA 1 1 4 2751 1 1 46 SER HB2 H 13.242 0.260 6.313 1.00 . A A . 46 SER HB2 1 1 4 2752 1 1 46 SER HB3 H 13.117 -1.203 7.291 1.00 . A A . 46 SER HB3 1 1 4 2753 1 1 46 SER HG H 11.332 0.189 7.480 1.00 . A A . 46 SER HG 1 1 4 2754 1 1 46 SER N N 15.702 -0.236 7.350 1.00 . A A . 46 SER N 1 1 4 2755 1 1 46 SER O O 15.052 0.544 10.423 1.00 . A A . 46 SER O 1 1 4 2756 1 1 46 SER OG O 12.091 0.448 8.009 1.00 . A A . 46 SER OG 1 1 4 2757 1 1 47 PHE C C 13.774 -1.642 12.250 1.00 . A A . 47 PHE C 1 1 4 2758 1 1 47 PHE CA C 14.599 -2.269 11.079 1.00 . A A . 47 PHE CA 1 1 4 2759 1 1 47 PHE CB C 16.127 -2.266 11.433 1.00 . A A . 47 PHE CB 1 1 4 2760 1 1 47 PHE CD1 C 17.050 -4.465 10.535 1.00 . A A . 47 PHE CD1 1 1 4 2761 1 1 47 PHE CD2 C 17.825 -2.410 9.528 1.00 . A A . 47 PHE CD2 1 1 4 2762 1 1 47 PHE CE1 C 17.852 -5.195 9.660 1.00 . A A . 47 PHE CE1 1 1 4 2763 1 1 47 PHE CE2 C 18.627 -3.142 8.656 1.00 . A A . 47 PHE CE2 1 1 4 2764 1 1 47 PHE CG C 17.027 -3.067 10.473 1.00 . A A . 47 PHE CG 1 1 4 2765 1 1 47 PHE CZ C 18.638 -4.533 8.720 1.00 . A A . 47 PHE CZ 1 1 4 2766 1 1 47 PHE H H 14.014 -2.007 8.960 1.00 . A A . 47 PHE H 1 1 4 2767 1 1 47 PHE HA H 14.268 -3.317 10.944 1.00 . A A . 47 PHE HA 1 1 4 2768 1 1 47 PHE HB2 H 16.507 -1.232 11.544 1.00 . A A . 47 PHE HB2 1 1 4 2769 1 1 47 PHE HB3 H 16.257 -2.693 12.447 1.00 . A A . 47 PHE HB3 1 1 4 2770 1 1 47 PHE HD1 H 16.441 -4.992 11.256 1.00 . A A . 47 PHE HD1 1 1 4 2771 1 1 47 PHE HD2 H 17.820 -1.331 9.459 1.00 . A A . 47 PHE HD2 1 1 4 2772 1 1 47 PHE HE1 H 17.859 -6.274 9.708 1.00 . A A . 47 PHE HE1 1 1 4 2773 1 1 47 PHE HE2 H 19.236 -2.635 7.923 1.00 . A A . 47 PHE HE2 1 1 4 2774 1 1 47 PHE HZ H 19.255 -5.100 8.039 1.00 . A A . 47 PHE HZ 1 1 4 2775 1 1 47 PHE N N 14.342 -1.523 9.802 1.00 . A A . 47 PHE N 1 1 4 2776 1 1 47 PHE O O 14.214 -0.702 12.921 1.00 . A A . 47 PHE O 1 1 4 2777 1 1 48 ALA C C 10.812 -2.908 14.049 1.00 . A A . 48 ALA C 1 1 4 2778 1 1 48 ALA CA C 11.646 -1.713 13.543 1.00 . A A . 48 ALA CA 1 1 4 2779 1 1 48 ALA CB C 10.735 -0.598 12.985 1.00 . A A . 48 ALA CB 1 1 4 2780 1 1 48 ALA H H 12.321 -2.968 11.859 1.00 . A A . 48 ALA H 1 1 4 2781 1 1 48 ALA HXT H 9.491 -4.199 13.422 1.00 . A A . 48 ALA HXT 1 1 4 2782 1 1 48 ALA HA H 12.220 -1.304 14.397 1.00 . A A . 48 ALA HA 1 1 4 2783 1 1 48 ALA HB1 H 10.128 -0.933 12.122 1.00 . A A . 48 ALA HB1 1 1 4 2784 1 1 48 ALA HB2 H 10.031 -0.228 13.753 1.00 . A A . 48 ALA HB2 1 1 4 2785 1 1 48 ALA HB3 H 11.323 0.277 12.649 1.00 . A A . 48 ALA HB3 1 1 4 2786 1 1 48 ALA N N 12.566 -2.188 12.480 1.00 . A A . 48 ALA N 1 1 4 2787 1 1 48 ALA O O 10.881 -3.322 15.206 1.00 . A A . 48 ALA O 1 1 4 2788 1 1 48 ALA OXT O 9.996 -3.456 13.085 1.00 . A A . 48 ALA OXT 1 1 5 2789 1 1 1 GLU C C 14.951 10.377 11.251 1.00 . A A . 1 GLU C 1 1 5 2790 1 1 1 GLU CA C 15.642 11.636 11.860 1.00 . A A . 1 GLU CA 1 1 5 2791 1 1 1 GLU CB C 14.999 12.143 13.187 1.00 . A A . 1 GLU CB 1 1 5 2792 1 1 1 GLU CD C 14.450 11.671 15.644 1.00 . A A . 1 GLU CD 1 1 5 2793 1 1 1 GLU CG C 15.146 11.169 14.376 1.00 . A A . 1 GLU CG 1 1 5 2794 1 1 1 GLU H1 H 16.015 12.478 9.983 1.00 . A A . 1 GLU H1 1 1 5 2795 1 1 1 GLU H2 H 16.058 13.580 11.213 1.00 . A A . 1 GLU H2 1 1 5 2796 1 1 1 GLU HA H 16.698 11.377 12.035 1.00 . A A . 1 GLU HA 1 1 5 2797 1 1 1 GLU HB2 H 15.466 13.105 13.479 1.00 . A A . 1 GLU HB2 1 1 5 2798 1 1 1 GLU HB3 H 13.928 12.381 13.030 1.00 . A A . 1 GLU HB3 1 1 5 2799 1 1 1 GLU HE2 H 12.690 11.637 16.477 1.00 . A A . 1 GLU HE2 1 1 5 2800 1 1 1 GLU HG2 H 14.743 10.173 14.112 1.00 . A A . 1 GLU HG2 1 1 5 2801 1 1 1 GLU HG3 H 16.218 11.002 14.594 1.00 . A A . 1 GLU HG3 1 1 5 2802 1 1 1 GLU N N 15.576 12.740 10.873 1.00 . A A . 1 GLU N 1 1 5 2803 1 1 1 GLU O O 15.654 9.433 10.880 1.00 . A A . 1 GLU O 1 1 5 2804 1 1 1 GLU OE1 O 15.024 12.311 16.524 1.00 . A A . 1 GLU OE1 1 1 5 2805 1 1 1 GLU OE2 O 13.124 11.323 15.680 1.00 . A A . 1 GLU OE2 1 1 5 2806 1 1 2 ASP C C 12.135 9.650 9.279 1.00 . A A . 2 ASP C 1 1 5 2807 1 1 2 ASP CA C 12.828 9.216 10.603 1.00 . A A . 2 ASP CA 1 1 5 2808 1 1 2 ASP CB C 11.791 8.738 11.665 1.00 . A A . 2 ASP CB 1 1 5 2809 1 1 2 ASP CG C 12.393 8.016 12.880 1.00 . A A . 2 ASP CG 1 1 5 2810 1 1 2 ASP H H 13.170 11.213 11.522 1.00 . A A . 2 ASP H 1 1 5 2811 1 1 2 ASP HA H 13.484 8.362 10.365 1.00 . A A . 2 ASP HA 1 1 5 2812 1 1 2 ASP HB2 H 11.153 9.578 12.002 1.00 . A A . 2 ASP HB2 1 1 5 2813 1 1 2 ASP HB3 H 11.085 8.030 11.189 1.00 . A A . 2 ASP HB3 1 1 5 2814 1 1 2 ASP HD2 H 11.987 9.656 13.845 1.00 . A A . 2 ASP HD2 1 1 5 2815 1 1 2 ASP N N 13.608 10.362 11.155 1.00 . A A . 2 ASP N 1 1 5 2816 1 1 2 ASP O O 12.443 9.071 8.234 1.00 . A A . 2 ASP O 1 1 5 2817 1 1 2 ASP OD1 O 12.841 6.870 12.833 1.00 . A A . 2 ASP OD1 1 1 5 2818 1 1 2 ASP OD2 O 12.375 8.794 14.009 1.00 . A A . 2 ASP OD2 1 1 5 2819 1 1 3 ASN C C 9.443 10.060 7.473 1.00 . A A . 3 ASN C 1 1 5 2820 1 1 3 ASN CA C 10.362 11.136 8.168 1.00 . A A . 3 ASN CA 1 1 5 2821 1 1 3 ASN CB C 11.311 11.742 7.090 1.00 . A A . 3 ASN CB 1 1 5 2822 1 1 3 ASN CG C 12.233 12.904 7.522 1.00 . A A . 3 ASN CG 1 1 5 2823 1 1 3 ASN H H 10.974 10.887 10.292 1.00 . A A . 3 ASN H 1 1 5 2824 1 1 3 ASN HA H 9.671 11.884 8.577 1.00 . A A . 3 ASN HA 1 1 5 2825 1 1 3 ASN HB2 H 11.914 10.904 6.701 1.00 . A A . 3 ASN HB2 1 1 5 2826 1 1 3 ASN HB3 H 10.722 12.081 6.214 1.00 . A A . 3 ASN HB3 1 1 5 2827 1 1 3 ASN HD21 H 10.763 14.230 7.200 1.00 . A A . 3 ASN HD21 1 1 5 2828 1 1 3 ASN HD22 H 12.368 14.886 7.800 1.00 . A A . 3 ASN HD22 1 1 5 2829 1 1 3 ASN N N 11.202 10.635 9.327 1.00 . A A . 3 ASN N 1 1 5 2830 1 1 3 ASN ND2 N 11.738 14.132 7.506 1.00 . A A . 3 ASN ND2 1 1 5 2831 1 1 3 ASN O O 8.967 10.241 6.347 1.00 . A A . 3 ASN O 1 1 5 2832 1 1 3 ASN OD1 O 13.393 12.698 7.878 1.00 . A A . 3 ASN OD1 1 1 5 2833 1 1 4 CYS C C 7.524 7.249 8.976 1.00 . A A . 4 CYS C 1 1 5 2834 1 1 4 CYS CA C 8.297 7.862 7.759 1.00 . A A . 4 CYS CA 1 1 5 2835 1 1 4 CYS CB C 9.145 6.801 7.066 1.00 . A A . 4 CYS CB 1 1 5 2836 1 1 4 CYS H H 9.753 9.043 9.034 1.00 . A A . 4 CYS H 1 1 5 2837 1 1 4 CYS HA H 7.554 8.187 7.009 1.00 . A A . 4 CYS HA 1 1 5 2838 1 1 4 CYS HB2 H 8.365 6.087 6.892 1.00 . A A . 4 CYS HB2 1 1 5 2839 1 1 4 CYS HB3 H 9.454 7.046 6.039 1.00 . A A . 4 CYS HB3 1 1 5 2840 1 1 4 CYS N N 9.155 8.986 8.202 1.00 . A A . 4 CYS N 1 1 5 2841 1 1 4 CYS O O 7.803 7.549 10.145 1.00 . A A . 4 CYS O 1 1 5 2842 1 1 4 CYS SG S 10.365 5.871 8.011 1.00 . A A . 4 CYS SG 1 1 5 2843 1 1 5 ILE C C 6.197 4.208 9.699 1.00 . A A . 5 ILE C 1 1 5 2844 1 1 5 ILE CA C 5.734 5.675 9.753 1.00 . A A . 5 ILE CA 1 1 5 2845 1 1 5 ILE CB C 4.165 5.788 9.562 1.00 . A A . 5 ILE CB 1 1 5 2846 1 1 5 ILE CD1 C 2.332 7.538 9.167 1.00 . A A . 5 ILE CD1 1 1 5 2847 1 1 5 ILE CG1 C 3.790 7.270 9.429 1.00 . A A . 5 ILE CG1 1 1 5 2848 1 1 5 ILE CG2 C 3.389 5.117 10.752 1.00 . A A . 5 ILE CG2 1 1 5 2849 1 1 5 ILE H H 6.542 6.099 7.653 1.00 . A A . 5 ILE H 1 1 5 2850 1 1 5 ILE HA H 5.961 6.115 10.737 1.00 . A A . 5 ILE HA 1 1 5 2851 1 1 5 ILE HB H 3.812 5.295 8.662 1.00 . A A . 5 ILE HB 1 1 5 2852 1 1 5 ILE HD11 H 1.993 7.030 8.246 1.00 . A A . 5 ILE HD11 1 1 5 2853 1 1 5 ILE HD12 H 1.731 7.179 10.014 1.00 . A A . 5 ILE HD12 1 1 5 2854 1 1 5 ILE HD13 H 2.123 8.613 9.066 1.00 . A A . 5 ILE HD13 1 1 5 2855 1 1 5 ILE HG12 H 4.111 7.810 10.312 1.00 . A A . 5 ILE HG12 1 1 5 2856 1 1 5 ILE HG13 H 4.340 7.701 8.577 1.00 . A A . 5 ILE HG13 1 1 5 2857 1 1 5 ILE HG21 H 3.617 4.041 10.851 1.00 . A A . 5 ILE HG21 1 1 5 2858 1 1 5 ILE HG22 H 3.554 5.583 11.740 1.00 . A A . 5 ILE HG22 1 1 5 2859 1 1 5 ILE HG23 H 2.288 5.119 10.595 1.00 . A A . 5 ILE HG23 1 1 5 2860 1 1 5 ILE N N 6.539 6.362 8.669 1.00 . A A . 5 ILE N 1 1 5 2861 1 1 5 ILE O O 5.710 3.409 8.905 1.00 . A A . 5 ILE O 1 1 5 2862 1 1 6 ALA C C 6.747 1.294 11.074 1.00 . A A . 6 ALA C 1 1 5 2863 1 1 6 ALA CA C 7.693 2.405 10.455 1.00 . A A . 6 ALA CA 1 1 5 2864 1 1 6 ALA CB C 9.043 2.435 11.195 1.00 . A A . 6 ALA CB 1 1 5 2865 1 1 6 ALA H H 7.355 4.478 11.276 1.00 . A A . 6 ALA H 1 1 5 2866 1 1 6 ALA HA H 7.831 2.174 9.368 1.00 . A A . 6 ALA HA 1 1 5 2867 1 1 6 ALA HB1 H 9.732 3.186 10.766 1.00 . A A . 6 ALA HB1 1 1 5 2868 1 1 6 ALA HB2 H 8.925 2.666 12.272 1.00 . A A . 6 ALA HB2 1 1 5 2869 1 1 6 ALA HB3 H 9.559 1.460 11.126 1.00 . A A . 6 ALA HB3 1 1 5 2870 1 1 6 ALA N N 7.142 3.797 10.548 1.00 . A A . 6 ALA N 1 1 5 2871 1 1 6 ALA O O 7.187 0.185 11.395 1.00 . A A . 6 ALA O 1 1 5 2872 1 1 7 GLU C C 3.295 0.281 11.121 1.00 . A A . 7 GLU C 1 1 5 2873 1 1 7 GLU CA C 4.444 0.843 11.976 1.00 . A A . 7 GLU CA 1 1 5 2874 1 1 7 GLU CB C 3.903 1.795 13.086 1.00 . A A . 7 GLU CB 1 1 5 2875 1 1 7 GLU CD C 4.233 3.027 15.292 1.00 . A A . 7 GLU CD 1 1 5 2876 1 1 7 GLU CG C 4.856 2.072 14.269 1.00 . A A . 7 GLU CG 1 1 5 2877 1 1 7 GLU H H 5.389 2.643 11.051 1.00 . A A . 7 GLU H 1 1 5 2878 1 1 7 GLU HA H 4.868 -0.024 12.433 1.00 . A A . 7 GLU HA 1 1 5 2879 1 1 7 GLU HB2 H 3.593 2.752 12.635 1.00 . A A . 7 GLU HB2 1 1 5 2880 1 1 7 GLU HB3 H 2.974 1.371 13.514 1.00 . A A . 7 GLU HB3 1 1 5 2881 1 1 7 GLU HE2 H 3.064 2.972 16.848 1.00 . A A . 7 GLU HE2 1 1 5 2882 1 1 7 GLU HG2 H 5.135 1.123 14.764 1.00 . A A . 7 GLU HG2 1 1 5 2883 1 1 7 GLU HG3 H 5.804 2.509 13.904 1.00 . A A . 7 GLU HG3 1 1 5 2884 1 1 7 GLU N N 5.453 1.627 11.228 1.00 . A A . 7 GLU N 1 1 5 2885 1 1 7 GLU O O 2.964 0.743 10.032 1.00 . A A . 7 GLU O 1 1 5 2886 1 1 7 GLU OE1 O 4.410 4.245 15.276 1.00 . A A . 7 GLU OE1 1 1 5 2887 1 1 7 GLU OE2 O 3.455 2.370 16.211 1.00 . A A . 7 GLU OE2 1 1 5 2888 1 1 8 ASP C C 0.504 -0.889 12.496 1.00 . A A . 8 ASP C 1 1 5 2889 1 1 8 ASP CA C 1.420 -1.366 11.338 1.00 . A A . 8 ASP CA 1 1 5 2890 1 1 8 ASP CB C 1.416 -2.904 11.257 1.00 . A A . 8 ASP CB 1 1 5 2891 1 1 8 ASP CG C 2.522 -3.500 10.369 1.00 . A A . 8 ASP CG 1 1 5 2892 1 1 8 ASP H H 3.131 -0.998 12.638 1.00 . A A . 8 ASP H 1 1 5 2893 1 1 8 ASP HA H 1.110 -0.998 10.334 1.00 . A A . 8 ASP HA 1 1 5 2894 1 1 8 ASP HB2 H 1.420 -3.285 12.283 1.00 . A A . 8 ASP HB2 1 1 5 2895 1 1 8 ASP HB3 H 0.456 -3.235 10.832 1.00 . A A . 8 ASP HB3 1 1 5 2896 1 1 8 ASP HD2 H 1.745 -2.417 8.948 1.00 . A A . 8 ASP HD2 1 1 5 2897 1 1 8 ASP N N 2.698 -0.753 11.741 1.00 . A A . 8 ASP N 1 1 5 2898 1 1 8 ASP O O 0.728 -1.094 13.696 1.00 . A A . 8 ASP O 1 1 5 2899 1 1 8 ASP OD1 O 3.357 -4.303 10.783 1.00 . A A . 8 ASP OD1 1 1 5 2900 1 1 8 ASP OD2 O 2.467 -3.036 9.077 1.00 . A A . 8 ASP OD2 1 1 5 2901 1 1 9 TYR C C -0.770 1.804 13.611 1.00 . A A . 9 TYR C 1 1 5 2902 1 1 9 TYR CA C -1.497 0.611 12.852 1.00 . A A . 9 TYR CA 1 1 5 2903 1 1 9 TYR CB C -2.287 -0.343 13.817 1.00 . A A . 9 TYR CB 1 1 5 2904 1 1 9 TYR CD1 C -4.251 -1.067 12.339 1.00 . A A . 9 TYR CD1 1 1 5 2905 1 1 9 TYR CD2 C -2.608 -2.727 12.957 1.00 . A A . 9 TYR CD2 1 1 5 2906 1 1 9 TYR CE1 C -4.853 -1.985 11.482 1.00 . A A . 9 TYR CE1 1 1 5 2907 1 1 9 TYR CE2 C -3.212 -3.644 12.101 1.00 . A A . 9 TYR CE2 1 1 5 2908 1 1 9 TYR CG C -3.110 -1.424 13.070 1.00 . A A . 9 TYR CG 1 1 5 2909 1 1 9 TYR CZ C -4.330 -3.271 11.358 1.00 . A A . 9 TYR CZ 1 1 5 2910 1 1 9 TYR H H -0.551 -0.327 11.026 1.00 . A A . 9 TYR H 1 1 5 2911 1 1 9 TYR HA H -2.213 1.104 12.172 1.00 . A A . 9 TYR HA 1 1 5 2912 1 1 9 TYR HB2 H -1.617 -0.801 14.569 1.00 . A A . 9 TYR HB2 1 1 5 2913 1 1 9 TYR HB3 H -2.988 0.263 14.423 1.00 . A A . 9 TYR HB3 1 1 5 2914 1 1 9 TYR HD1 H -4.635 -0.057 12.384 1.00 . A A . 9 TYR HD1 1 1 5 2915 1 1 9 TYR HD2 H -1.709 -3.016 13.484 1.00 . A A . 9 TYR HD2 1 1 5 2916 1 1 9 TYR HE1 H -5.706 -1.690 10.888 1.00 . A A . 9 TYR HE1 1 1 5 2917 1 1 9 TYR HE2 H -2.791 -4.633 11.990 1.00 . A A . 9 TYR HE2 1 1 5 2918 1 1 9 TYR HH H -4.412 -4.988 10.518 1.00 . A A . 9 TYR HH 1 1 5 2919 1 1 9 TYR N N -0.531 -0.209 12.040 1.00 . A A . 9 TYR N 1 1 5 2920 1 1 9 TYR O O -1.164 2.190 14.715 1.00 . A A . 9 TYR O 1 1 5 2921 1 1 9 TYR OH O -4.899 -4.161 10.484 1.00 . A A . 9 TYR OH 1 1 5 2922 1 1 10 GLY C C 0.065 4.872 12.789 1.00 . A A . 10 GLY C 1 1 5 2923 1 1 10 GLY CA C 0.857 3.716 13.372 1.00 . A A . 10 GLY CA 1 1 5 2924 1 1 10 GLY H H 0.477 2.004 12.053 1.00 . A A . 10 GLY H 1 1 5 2925 1 1 10 GLY HA2 H 1.053 3.782 14.444 1.00 . A A . 10 GLY HA2 1 1 5 2926 1 1 10 GLY HA3 H 1.854 3.903 12.980 1.00 . A A . 10 GLY HA3 1 1 5 2927 1 1 10 GLY N N 0.238 2.435 12.953 1.00 . A A . 10 GLY N 1 1 5 2928 1 1 10 GLY O O -0.503 4.805 11.697 1.00 . A A . 10 GLY O 1 1 5 2929 1 1 11 LYS C C -0.258 7.890 12.075 1.00 . A A . 11 LYS C 1 1 5 2930 1 1 11 LYS CA C -0.854 7.091 13.272 1.00 . A A . 11 LYS CA 1 1 5 2931 1 1 11 LYS CB C -1.014 8.064 14.458 1.00 . A A . 11 LYS CB 1 1 5 2932 1 1 11 LYS CD C -2.840 6.804 15.813 1.00 . A A . 11 LYS CD 1 1 5 2933 1 1 11 LYS CE C -3.298 6.226 17.166 1.00 . A A . 11 LYS CE 1 1 5 2934 1 1 11 LYS CG C -1.447 7.479 15.825 1.00 . A A . 11 LYS CG 1 1 5 2935 1 1 11 LYS H H 0.734 5.801 14.316 1.00 . A A . 11 LYS H 1 1 5 2936 1 1 11 LYS HA H -1.863 6.688 13.036 1.00 . A A . 11 LYS HA 1 1 5 2937 1 1 11 LYS HB2 H -0.087 8.636 14.540 1.00 . A A . 11 LYS HB2 1 1 5 2938 1 1 11 LYS HB3 H -1.762 8.831 14.177 1.00 . A A . 11 LYS HB3 1 1 5 2939 1 1 11 LYS HD2 H -3.602 7.507 15.426 1.00 . A A . 11 LYS HD2 1 1 5 2940 1 1 11 LYS HD3 H -2.826 5.971 15.085 1.00 . A A . 11 LYS HD3 1 1 5 2941 1 1 11 LYS HE2 H -4.186 5.587 17.006 1.00 . A A . 11 LYS HE2 1 1 5 2942 1 1 11 LYS HE3 H -2.522 5.558 17.584 1.00 . A A . 11 LYS HE3 1 1 5 2943 1 1 11 LYS HG2 H -0.685 6.762 16.182 1.00 . A A . 11 LYS HG2 1 1 5 2944 1 1 11 LYS HG3 H -1.445 8.299 16.567 1.00 . A A . 11 LYS HG3 1 1 5 2945 1 1 11 LYS HZ1 H -3.980 6.827 19.021 1.00 . A A . 11 LYS HZ1 1 1 5 2946 1 1 11 LYS HZ2 H -4.426 7.831 17.811 1.00 . A A . 11 LYS HZ2 1 1 5 2947 1 1 11 LYS N N 0.052 5.944 13.562 1.00 . A A . 11 LYS N 1 1 5 2948 1 1 11 LYS NZ N -3.644 7.264 18.156 1.00 . A A . 11 LYS NZ 1 1 5 2949 1 1 11 LYS O O 0.894 8.335 12.047 1.00 . A A . 11 LYS O 1 1 5 2950 1 1 12 CYS C C -1.967 9.491 9.296 1.00 . A A . 12 CYS C 1 1 5 2951 1 1 12 CYS CA C -0.865 8.501 9.738 1.00 . A A . 12 CYS CA 1 1 5 2952 1 1 12 CYS CB C -0.782 7.281 8.778 1.00 . A A . 12 CYS CB 1 1 5 2953 1 1 12 CYS H H -2.051 7.683 11.461 1.00 . A A . 12 CYS H 1 1 5 2954 1 1 12 CYS HA H 0.105 9.038 9.710 1.00 . A A . 12 CYS HA 1 1 5 2955 1 1 12 CYS HB2 H -0.412 7.584 7.784 1.00 . A A . 12 CYS HB2 1 1 5 2956 1 1 12 CYS HB3 H -0.067 6.529 9.137 1.00 . A A . 12 CYS HB3 1 1 5 2957 1 1 12 CYS N N -1.147 8.000 11.101 1.00 . A A . 12 CYS N 1 1 5 2958 1 1 12 CYS O O -2.869 9.877 10.051 1.00 . A A . 12 CYS O 1 1 5 2959 1 1 12 CYS SG S -2.283 6.369 8.527 1.00 . A A . 12 CYS SG 1 1 5 2960 1 1 13 THR C C -2.999 10.506 5.920 1.00 . A A . 13 THR C 1 1 5 2961 1 1 13 THR CA C -2.818 10.870 7.423 1.00 . A A . 13 THR CA 1 1 5 2962 1 1 13 THR CB C -2.328 12.373 7.549 1.00 . A A . 13 THR CB 1 1 5 2963 1 1 13 THR CG2 C -3.139 13.186 8.550 1.00 . A A . 13 THR CG2 1 1 5 2964 1 1 13 THR H H -0.977 9.584 7.574 1.00 . A A . 13 THR H 1 1 5 2965 1 1 13 THR HA H -3.806 10.734 7.934 1.00 . A A . 13 THR HA 1 1 5 2966 1 1 13 THR HB H -2.454 12.852 6.561 1.00 . A A . 13 THR HB 1 1 5 2967 1 1 13 THR HG1 H -0.965 12.085 8.885 1.00 . A A . 13 THR HG1 1 1 5 2968 1 1 13 THR HG21 H -4.202 13.221 8.262 1.00 . A A . 13 THR HG21 1 1 5 2969 1 1 13 THR HG22 H -3.044 12.781 9.572 1.00 . A A . 13 THR HG22 1 1 5 2970 1 1 13 THR HG23 H -2.766 14.229 8.563 1.00 . A A . 13 THR HG23 1 1 5 2971 1 1 13 THR N N -1.841 9.928 8.035 1.00 . A A . 13 THR N 1 1 5 2972 1 1 13 THR O O -2.086 10.057 5.215 1.00 . A A . 13 THR O 1 1 5 2973 1 1 13 THR OG1 O -0.979 12.487 8.013 1.00 . A A . 13 THR OG1 1 1 5 2974 1 1 14 TRP C C -4.304 12.219 3.529 1.00 . A A . 14 TRP C 1 1 5 2975 1 1 14 TRP CA C -4.588 10.765 4.003 1.00 . A A . 14 TRP CA 1 1 5 2976 1 1 14 TRP CB C -6.062 10.321 3.796 1.00 . A A . 14 TRP CB 1 1 5 2977 1 1 14 TRP CD1 C -5.629 7.836 4.674 1.00 . A A . 14 TRP CD1 1 1 5 2978 1 1 14 TRP CD2 C -7.394 8.101 3.346 1.00 . A A . 14 TRP CD2 1 1 5 2979 1 1 14 TRP CE2 C -7.281 6.739 3.731 1.00 . A A . 14 TRP CE2 1 1 5 2980 1 1 14 TRP CE3 C -8.454 8.518 2.500 1.00 . A A . 14 TRP CE3 1 1 5 2981 1 1 14 TRP CG C -6.352 8.807 3.931 1.00 . A A . 14 TRP CG 1 1 5 2982 1 1 14 TRP CH2 C -9.257 6.220 2.439 1.00 . A A . 14 TRP CH2 1 1 5 2983 1 1 14 TRP CZ2 C -8.224 5.789 3.272 1.00 . A A . 14 TRP CZ2 1 1 5 2984 1 1 14 TRP CZ3 C -9.371 7.563 2.059 1.00 . A A . 14 TRP CZ3 1 1 5 2985 1 1 14 TRP H H -4.781 11.303 6.149 1.00 . A A . 14 TRP H 1 1 5 2986 1 1 14 TRP HA H -3.948 10.047 3.452 1.00 . A A . 14 TRP HA 1 1 5 2987 1 1 14 TRP HB2 H -6.737 10.882 4.472 1.00 . A A . 14 TRP HB2 1 1 5 2988 1 1 14 TRP HB3 H -6.373 10.629 2.779 1.00 . A A . 14 TRP HB3 1 1 5 2989 1 1 14 TRP HD1 H -4.746 8.038 5.262 1.00 . A A . 14 TRP HD1 1 1 5 2990 1 1 14 TRP HE1 H -5.864 5.683 4.992 1.00 . A A . 14 TRP HE1 1 1 5 2991 1 1 14 TRP HE3 H -8.556 9.551 2.199 1.00 . A A . 14 TRP HE3 1 1 5 2992 1 1 14 TRP HH2 H -9.983 5.504 2.082 1.00 . A A . 14 TRP HH2 1 1 5 2993 1 1 14 TRP HZ2 H -8.152 4.751 3.556 1.00 . A A . 14 TRP HZ2 1 1 5 2994 1 1 14 TRP HZ3 H -10.182 7.865 1.413 1.00 . A A . 14 TRP HZ3 1 1 5 2995 1 1 14 TRP N N -4.229 10.791 5.452 1.00 . A A . 14 TRP N 1 1 5 2996 1 1 14 TRP NE1 N -6.189 6.555 4.559 1.00 . A A . 14 TRP NE1 1 1 5 2997 1 1 14 TRP O O -5.065 13.160 3.782 1.00 . A A . 14 TRP O 1 1 5 2998 1 1 15 GLY C C -1.594 13.901 3.879 1.00 . A A . 15 GLY C 1 1 5 2999 1 1 15 GLY CA C -2.487 13.672 2.627 1.00 . A A . 15 GLY CA 1 1 5 3000 1 1 15 GLY H H -2.608 11.482 2.778 1.00 . A A . 15 GLY H 1 1 5 3001 1 1 15 GLY HA2 H -1.889 13.626 1.697 1.00 . A A . 15 GLY HA2 1 1 5 3002 1 1 15 GLY HA3 H -3.223 14.487 2.501 1.00 . A A . 15 GLY HA3 1 1 5 3003 1 1 15 GLY N N -3.125 12.360 2.903 1.00 . A A . 15 GLY N 1 1 5 3004 1 1 15 GLY O O -1.933 14.700 4.756 1.00 . A A . 15 GLY O 1 1 5 3005 1 1 16 GLY C C 1.586 12.153 4.962 1.00 . A A . 16 GLY C 1 1 5 3006 1 1 16 GLY CA C 0.316 12.989 5.172 1.00 . A A . 16 GLY CA 1 1 5 3007 1 1 16 GLY H H -0.369 12.515 3.140 1.00 . A A . 16 GLY H 1 1 5 3008 1 1 16 GLY HA2 H 0.417 13.871 5.833 1.00 . A A . 16 GLY HA2 1 1 5 3009 1 1 16 GLY HA3 H -0.329 12.336 5.776 1.00 . A A . 16 GLY HA3 1 1 5 3010 1 1 16 GLY N N -0.495 13.131 3.950 1.00 . A A . 16 GLY N 1 1 5 3011 1 1 16 GLY O O 2.111 12.010 3.852 1.00 . A A . 16 GLY O 1 1 5 3012 1 1 17 THR C C 2.289 9.149 5.921 1.00 . A A . 17 THR C 1 1 5 3013 1 1 17 THR CA C 3.083 10.496 6.047 1.00 . A A . 17 THR CA 1 1 5 3014 1 1 17 THR CB C 4.005 10.434 7.329 1.00 . A A . 17 THR CB 1 1 5 3015 1 1 17 THR CG2 C 5.374 9.784 7.024 1.00 . A A . 17 THR CG2 1 1 5 3016 1 1 17 THR H H 1.534 11.882 6.918 1.00 . A A . 17 THR H 1 1 5 3017 1 1 17 THR HA H 3.738 10.671 5.167 1.00 . A A . 17 THR HA 1 1 5 3018 1 1 17 THR HB H 3.532 9.804 8.115 1.00 . A A . 17 THR HB 1 1 5 3019 1 1 17 THR HG1 H 4.832 11.636 8.585 1.00 . A A . 17 THR HG1 1 1 5 3020 1 1 17 THR HG21 H 5.275 8.749 6.655 1.00 . A A . 17 THR HG21 1 1 5 3021 1 1 17 THR HG22 H 5.973 10.324 6.270 1.00 . A A . 17 THR HG22 1 1 5 3022 1 1 17 THR HG23 H 5.995 9.702 7.937 1.00 . A A . 17 THR HG23 1 1 5 3023 1 1 17 THR N N 2.034 11.560 6.081 1.00 . A A . 17 THR N 1 1 5 3024 1 1 17 THR O O 1.230 8.929 6.535 1.00 . A A . 17 THR O 1 1 5 3025 1 1 17 THR OG1 O 4.269 11.747 7.815 1.00 . A A . 17 THR OG1 1 1 5 3026 1 1 18 LYS C C 3.662 6.020 5.581 1.00 . A A . 18 LYS C 1 1 5 3027 1 1 18 LYS CA C 2.483 6.838 4.994 1.00 . A A . 18 LYS CA 1 1 5 3028 1 1 18 LYS CB C 2.175 6.430 3.521 1.00 . A A . 18 LYS CB 1 1 5 3029 1 1 18 LYS CD C -0.271 7.175 3.168 1.00 . A A . 18 LYS CD 1 1 5 3030 1 1 18 LYS CE C -1.251 7.971 2.291 1.00 . A A . 18 LYS CE 1 1 5 3031 1 1 18 LYS CG C 1.193 7.290 2.692 1.00 . A A . 18 LYS CG 1 1 5 3032 1 1 18 LYS H H 3.798 8.591 4.785 1.00 . A A . 18 LYS H 1 1 5 3033 1 1 18 LYS HA H 1.578 6.586 5.572 1.00 . A A . 18 LYS HA 1 1 5 3034 1 1 18 LYS HB2 H 3.129 6.269 2.998 1.00 . A A . 18 LYS HB2 1 1 5 3035 1 1 18 LYS HB3 H 1.758 5.404 3.534 1.00 . A A . 18 LYS HB3 1 1 5 3036 1 1 18 LYS HD2 H -0.560 6.105 3.173 1.00 . A A . 18 LYS HD2 1 1 5 3037 1 1 18 LYS HD3 H -0.351 7.515 4.219 1.00 . A A . 18 LYS HD3 1 1 5 3038 1 1 18 LYS HE2 H -1.046 9.055 2.368 1.00 . A A . 18 LYS HE2 1 1 5 3039 1 1 18 LYS HE3 H -1.127 7.703 1.225 1.00 . A A . 18 LYS HE3 1 1 5 3040 1 1 18 LYS HG2 H 1.516 8.348 2.686 1.00 . A A . 18 LYS HG2 1 1 5 3041 1 1 18 LYS HG3 H 1.254 6.962 1.638 1.00 . A A . 18 LYS HG3 1 1 5 3042 1 1 18 LYS HZ1 H -2.874 6.721 2.543 1.00 . A A . 18 LYS HZ1 1 1 5 3043 1 1 18 LYS HZ2 H -3.286 8.233 2.077 1.00 . A A . 18 LYS HZ2 1 1 5 3044 1 1 18 LYS N N 2.880 8.268 5.106 1.00 . A A . 18 LYS N 1 1 5 3045 1 1 18 LYS NZ N -2.646 7.712 2.686 1.00 . A A . 18 LYS NZ 1 1 5 3046 1 1 18 LYS O O 4.695 6.511 6.068 1.00 . A A . 18 LYS O 1 1 5 3047 1 1 19 CYS C C 5.644 3.535 5.415 1.00 . A A . 19 CYS C 1 1 5 3048 1 1 19 CYS CA C 4.383 3.799 6.287 1.00 . A A . 19 CYS CA 1 1 5 3049 1 1 19 CYS CB C 3.626 2.539 6.746 1.00 . A A . 19 CYS CB 1 1 5 3050 1 1 19 CYS H H 2.617 4.498 4.999 1.00 . A A . 19 CYS H 1 1 5 3051 1 1 19 CYS HA H 4.637 4.360 7.214 1.00 . A A . 19 CYS HA 1 1 5 3052 1 1 19 CYS HB2 H 2.828 2.248 6.040 1.00 . A A . 19 CYS HB2 1 1 5 3053 1 1 19 CYS HB3 H 4.300 1.662 6.844 1.00 . A A . 19 CYS HB3 1 1 5 3054 1 1 19 CYS N N 3.457 4.704 5.564 1.00 . A A . 19 CYS N 1 1 5 3055 1 1 19 CYS O O 5.679 3.469 4.183 1.00 . A A . 19 CYS O 1 1 5 3056 1 1 19 CYS SG S 2.932 3.003 8.341 1.00 . A A . 19 CYS SG 1 1 5 3057 1 1 20 CYS C C 8.626 2.695 4.759 1.00 . A A . 20 CYS C 1 1 5 3058 1 1 20 CYS CA C 8.126 3.623 5.905 1.00 . A A . 20 CYS CA 1 1 5 3059 1 1 20 CYS CB C 8.940 3.304 7.182 1.00 . A A . 20 CYS CB 1 1 5 3060 1 1 20 CYS H H 6.416 3.579 7.234 1.00 . A A . 20 CYS H 1 1 5 3061 1 1 20 CYS HA H 8.194 4.693 5.715 1.00 . A A . 20 CYS HA 1 1 5 3062 1 1 20 CYS HB2 H 8.452 3.728 8.065 1.00 . A A . 20 CYS HB2 1 1 5 3063 1 1 20 CYS HB3 H 9.057 2.221 7.379 1.00 . A A . 20 CYS HB3 1 1 5 3064 1 1 20 CYS N N 6.698 3.517 6.249 1.00 . A A . 20 CYS N 1 1 5 3065 1 1 20 CYS O O 9.238 3.202 3.815 1.00 . A A . 20 CYS O 1 1 5 3066 1 1 20 CYS SG S 10.553 4.101 7.064 1.00 . A A . 20 CYS SG 1 1 5 3067 1 1 21 ARG C C 7.815 0.073 2.710 1.00 . A A . 21 ARG C 1 1 5 3068 1 1 21 ARG CA C 8.858 0.373 3.839 1.00 . A A . 21 ARG CA 1 1 5 3069 1 1 21 ARG CB C 9.242 -0.892 4.669 1.00 . A A . 21 ARG CB 1 1 5 3070 1 1 21 ARG CD C 10.568 -3.087 4.823 1.00 . A A . 21 ARG CD 1 1 5 3071 1 1 21 ARG CG C 10.199 -1.871 3.950 1.00 . A A . 21 ARG CG 1 1 5 3072 1 1 21 ARG CZ C 12.778 -4.085 4.087 1.00 . A A . 21 ARG CZ 1 1 5 3073 1 1 21 ARG H H 7.740 1.176 5.612 1.00 . A A . 21 ARG H 1 1 5 3074 1 1 21 ARG HA H 9.724 0.793 3.307 1.00 . A A . 21 ARG HA 1 1 5 3075 1 1 21 ARG HB2 H 9.751 -0.599 5.610 1.00 . A A . 21 ARG HB2 1 1 5 3076 1 1 21 ARG HB3 H 8.327 -1.427 4.993 1.00 . A A . 21 ARG HB3 1 1 5 3077 1 1 21 ARG HD2 H 11.015 -2.760 5.782 1.00 . A A . 21 ARG HD2 1 1 5 3078 1 1 21 ARG HD3 H 9.654 -3.646 5.096 1.00 . A A . 21 ARG HD3 1 1 5 3079 1 1 21 ARG HG2 H 9.748 -2.223 3.005 1.00 . A A . 21 ARG HG2 1 1 5 3080 1 1 21 ARG HG3 H 11.119 -1.329 3.660 1.00 . A A . 21 ARG HG3 1 1 5 3081 1 1 21 ARG HH11 H 13.092 -2.541 5.336 1.00 . A A . 21 ARG HH11 1 1 5 3082 1 1 21 ARG HH12 H 14.574 -3.408 4.689 1.00 . A A . 21 ARG HH12 1 1 5 3083 1 1 21 ARG HH21 H 12.715 -5.643 2.831 1.00 . A A . 21 ARG HH21 1 1 5 3084 1 1 21 ARG HH22 H 14.371 -5.054 3.357 1.00 . A A . 21 ARG HH22 1 1 5 3085 1 1 21 ARG N N 8.390 1.373 4.854 1.00 . A A . 21 ARG N 1 1 5 3086 1 1 21 ARG NE N 11.504 -4.012 4.104 1.00 . A A . 21 ARG NE 1 1 5 3087 1 1 21 ARG NH1 N 13.562 -3.260 4.775 1.00 . A A . 21 ARG NH1 1 1 5 3088 1 1 21 ARG NH2 N 13.346 -5.022 3.350 1.00 . A A . 21 ARG NH2 1 1 5 3089 1 1 21 ARG O O 7.690 -1.041 2.191 1.00 . A A . 21 ARG O 1 1 5 3090 1 1 22 GLY C C 4.778 0.387 1.591 1.00 . A A . 22 GLY C 1 1 5 3091 1 1 22 GLY CA C 6.085 1.111 1.246 1.00 . A A . 22 GLY CA 1 1 5 3092 1 1 22 GLY H H 7.285 1.879 3.006 1.00 . A A . 22 GLY H 1 1 5 3093 1 1 22 GLY HA2 H 5.864 2.155 0.953 1.00 . A A . 22 GLY HA2 1 1 5 3094 1 1 22 GLY HA3 H 6.509 0.655 0.348 1.00 . A A . 22 GLY HA3 1 1 5 3095 1 1 22 GLY N N 7.100 1.128 2.324 1.00 . A A . 22 GLY N 1 1 5 3096 1 1 22 GLY O O 4.409 -0.608 0.962 1.00 . A A . 22 GLY O 1 1 5 3097 1 1 23 ARG C C 1.762 1.367 3.247 1.00 . A A . 23 ARG C 1 1 5 3098 1 1 23 ARG CA C 2.925 0.313 3.236 1.00 . A A . 23 ARG CA 1 1 5 3099 1 1 23 ARG CB C 3.270 -0.146 4.679 1.00 . A A . 23 ARG CB 1 1 5 3100 1 1 23 ARG CD C 3.127 -2.718 4.443 1.00 . A A . 23 ARG CD 1 1 5 3101 1 1 23 ARG CG C 3.971 -1.502 4.871 1.00 . A A . 23 ARG CG 1 1 5 3102 1 1 23 ARG CZ C 3.793 -5.150 4.276 1.00 . A A . 23 ARG CZ 1 1 5 3103 1 1 23 ARG H H 4.709 1.639 3.070 1.00 . A A . 23 ARG H 1 1 5 3104 1 1 23 ARG HA H 2.612 -0.574 2.663 1.00 . A A . 23 ARG HA 1 1 5 3105 1 1 23 ARG HB2 H 3.958 0.589 5.113 1.00 . A A . 23 ARG HB2 1 1 5 3106 1 1 23 ARG HB3 H 2.376 -0.124 5.330 1.00 . A A . 23 ARG HB3 1 1 5 3107 1 1 23 ARG HD2 H 2.129 -2.674 4.915 1.00 . A A . 23 ARG HD2 1 1 5 3108 1 1 23 ARG HD3 H 2.952 -2.692 3.351 1.00 . A A . 23 ARG HD3 1 1 5 3109 1 1 23 ARG HG2 H 4.942 -1.482 4.342 1.00 . A A . 23 ARG HG2 1 1 5 3110 1 1 23 ARG HG3 H 4.225 -1.578 5.947 1.00 . A A . 23 ARG HG3 1 1 5 3111 1 1 23 ARG HH11 H 2.629 -4.632 2.721 1.00 . A A . 23 ARG HH11 1 1 5 3112 1 1 23 ARG HH12 H 3.210 -6.371 2.790 1.00 . A A . 23 ARG HH12 1 1 5 3113 1 1 23 ARG HH21 H 4.959 -5.898 5.722 1.00 . A A . 23 ARG HH21 1 1 5 3114 1 1 23 ARG HH22 H 4.446 -7.039 4.380 1.00 . A A . 23 ARG HH22 1 1 5 3115 1 1 23 ARG N N 4.121 0.929 2.614 1.00 . A A . 23 ARG N 1 1 5 3116 1 1 23 ARG NE N 3.796 -4.001 4.830 1.00 . A A . 23 ARG NE 1 1 5 3117 1 1 23 ARG NH1 N 3.144 -5.411 3.146 1.00 . A A . 23 ARG NH1 1 1 5 3118 1 1 23 ARG NH2 N 4.467 -6.128 4.852 1.00 . A A . 23 ARG NH2 1 1 5 3119 1 1 23 ARG O O 1.989 2.507 3.685 1.00 . A A . 23 ARG O 1 1 5 3120 1 1 24 PRO C C -1.268 2.293 4.147 1.00 . A A . 24 PRO C 1 1 5 3121 1 1 24 PRO CA C -0.619 2.007 2.755 1.00 . A A . 24 PRO CA 1 1 5 3122 1 1 24 PRO CB C -1.570 1.325 1.744 1.00 . A A . 24 PRO CB 1 1 5 3123 1 1 24 PRO CD C 0.140 -0.285 2.249 1.00 . A A . 24 PRO CD 1 1 5 3124 1 1 24 PRO CG C -1.351 -0.175 1.934 1.00 . A A . 24 PRO CG 1 1 5 3125 1 1 24 PRO HA H -0.283 2.985 2.357 1.00 . A A . 24 PRO HA 1 1 5 3126 1 1 24 PRO HB2 H -2.632 1.608 1.862 1.00 . A A . 24 PRO HB2 1 1 5 3127 1 1 24 PRO HB3 H -1.290 1.614 0.712 1.00 . A A . 24 PRO HB3 1 1 5 3128 1 1 24 PRO HD2 H 0.338 -1.107 2.964 1.00 . A A . 24 PRO HD2 1 1 5 3129 1 1 24 PRO HD3 H 0.717 -0.489 1.326 1.00 . A A . 24 PRO HD3 1 1 5 3130 1 1 24 PRO HG2 H -1.952 -0.545 2.786 1.00 . A A . 24 PRO HG2 1 1 5 3131 1 1 24 PRO HG3 H -1.643 -0.765 1.046 1.00 . A A . 24 PRO HG3 1 1 5 3132 1 1 24 PRO N N 0.507 1.037 2.805 1.00 . A A . 24 PRO N 1 1 5 3133 1 1 24 PRO O O -0.848 1.761 5.181 1.00 . A A . 24 PRO O 1 1 5 3134 1 1 25 CYS C C -4.591 3.380 5.064 1.00 . A A . 25 CYS C 1 1 5 3135 1 1 25 CYS CA C -3.067 3.510 5.362 1.00 . A A . 25 CYS CA 1 1 5 3136 1 1 25 CYS CB C -2.714 4.956 5.812 1.00 . A A . 25 CYS CB 1 1 5 3137 1 1 25 CYS H H -2.542 3.533 3.220 1.00 . A A . 25 CYS H 1 1 5 3138 1 1 25 CYS HA H -2.806 2.820 6.190 1.00 . A A . 25 CYS HA 1 1 5 3139 1 1 25 CYS HB2 H -2.141 5.490 5.039 1.00 . A A . 25 CYS HB2 1 1 5 3140 1 1 25 CYS HB3 H -3.623 5.535 6.033 1.00 . A A . 25 CYS HB3 1 1 5 3141 1 1 25 CYS N N -2.295 3.160 4.143 1.00 . A A . 25 CYS N 1 1 5 3142 1 1 25 CYS O O -5.085 3.638 3.961 1.00 . A A . 25 CYS O 1 1 5 3143 1 1 25 CYS SG S -1.750 4.885 7.307 1.00 . A A . 25 CYS SG 1 1 5 3144 1 1 26 ARG C C -7.119 3.655 7.536 1.00 . A A . 26 ARG C 1 1 5 3145 1 1 26 ARG CA C -6.804 2.990 6.174 1.00 . A A . 26 ARG CA 1 1 5 3146 1 1 26 ARG CB C -7.422 1.568 6.086 1.00 . A A . 26 ARG CB 1 1 5 3147 1 1 26 ARG CD C -7.897 1.416 3.525 1.00 . A A . 26 ARG CD 1 1 5 3148 1 1 26 ARG CG C -7.211 0.797 4.761 1.00 . A A . 26 ARG CG 1 1 5 3149 1 1 26 ARG CZ C -6.683 0.695 1.440 1.00 . A A . 26 ARG CZ 1 1 5 3150 1 1 26 ARG H H -4.793 2.967 7.005 1.00 . A A . 26 ARG H 1 1 5 3151 1 1 26 ARG HA H -7.208 3.597 5.340 1.00 . A A . 26 ARG HA 1 1 5 3152 1 1 26 ARG HB2 H -7.039 0.946 6.918 1.00 . A A . 26 ARG HB2 1 1 5 3153 1 1 26 ARG HB3 H -8.511 1.636 6.273 1.00 . A A . 26 ARG HB3 1 1 5 3154 1 1 26 ARG HD2 H -8.982 1.512 3.715 1.00 . A A . 26 ARG HD2 1 1 5 3155 1 1 26 ARG HD3 H -7.542 2.449 3.352 1.00 . A A . 26 ARG HD3 1 1 5 3156 1 1 26 ARG HG2 H -6.127 0.687 4.570 1.00 . A A . 26 ARG HG2 1 1 5 3157 1 1 26 ARG HG3 H -7.584 -0.235 4.903 1.00 . A A . 26 ARG HG3 1 1 5 3158 1 1 26 ARG HH11 H -5.722 2.188 2.386 1.00 . A A . 26 ARG HH11 1 1 5 3159 1 1 26 ARG HH12 H -4.962 1.549 0.843 1.00 . A A . 26 ARG HH12 1 1 5 3160 1 1 26 ARG HH21 H -7.440 -0.782 0.319 1.00 . A A . 26 ARG HH21 1 1 5 3161 1 1 26 ARG HH22 H -5.870 -0.017 -0.245 1.00 . A A . 26 ARG HH22 1 1 5 3162 1 1 26 ARG N N -5.319 2.982 6.120 1.00 . A A . 26 ARG N 1 1 5 3163 1 1 26 ARG NE N -7.712 0.587 2.306 1.00 . A A . 26 ARG NE 1 1 5 3164 1 1 26 ARG NH1 N -5.686 1.567 1.570 1.00 . A A . 26 ARG NH1 1 1 5 3165 1 1 26 ARG NH2 N -6.662 -0.117 0.399 1.00 . A A . 26 ARG NH2 1 1 5 3166 1 1 26 ARG O O -6.544 3.302 8.579 1.00 . A A . 26 ARG O 1 1 5 3167 1 1 27 CYS C C -8.949 4.805 9.901 1.00 . A A . 27 CYS C 1 1 5 3168 1 1 27 CYS CA C -8.175 5.510 8.738 1.00 . A A . 27 CYS CA 1 1 5 3169 1 1 27 CYS CB C -8.928 6.799 8.339 1.00 . A A . 27 CYS CB 1 1 5 3170 1 1 27 CYS H H -8.425 4.896 6.626 1.00 . A A . 27 CYS H 1 1 5 3171 1 1 27 CYS HA H -7.142 5.765 9.016 1.00 . A A . 27 CYS HA 1 1 5 3172 1 1 27 CYS HB2 H -9.962 6.595 8.081 1.00 . A A . 27 CYS HB2 1 1 5 3173 1 1 27 CYS HB3 H -8.984 7.496 9.195 1.00 . A A . 27 CYS HB3 1 1 5 3174 1 1 27 CYS N N -8.019 4.657 7.537 1.00 . A A . 27 CYS N 1 1 5 3175 1 1 27 CYS O O -9.585 3.755 9.750 1.00 . A A . 27 CYS O 1 1 5 3176 1 1 27 CYS SG S -8.085 7.657 7.004 1.00 . A A . 27 CYS SG 1 1 5 3177 1 1 28 SER C C -10.919 4.931 12.464 1.00 . A A . 28 SER C 1 1 5 3178 1 1 28 SER CA C -9.355 4.905 12.376 1.00 . A A . 28 SER CA 1 1 5 3179 1 1 28 SER CB C -8.638 5.778 13.455 1.00 . A A . 28 SER CB 1 1 5 3180 1 1 28 SER H H -8.276 6.291 11.055 1.00 . A A . 28 SER H 1 1 5 3181 1 1 28 SER HA H -9.068 3.852 12.536 1.00 . A A . 28 SER HA 1 1 5 3182 1 1 28 SER HB2 H -7.587 6.006 13.192 1.00 . A A . 28 SER HB2 1 1 5 3183 1 1 28 SER HB3 H -9.146 6.752 13.582 1.00 . A A . 28 SER HB3 1 1 5 3184 1 1 28 SER HG H -8.171 5.707 15.319 1.00 . A A . 28 SER HG 1 1 5 3185 1 1 28 SER N N -8.837 5.433 11.087 1.00 . A A . 28 SER N 1 1 5 3186 1 1 28 SER O O -11.658 5.088 11.486 1.00 . A A . 28 SER O 1 1 5 3187 1 1 28 SER OG O -8.612 5.110 14.710 1.00 . A A . 28 SER OG 1 1 5 3188 1 1 29 MET C C -13.598 6.023 13.871 1.00 . A A . 29 MET C 1 1 5 3189 1 1 29 MET CA C -12.829 4.678 14.081 1.00 . A A . 29 MET CA 1 1 5 3190 1 1 29 MET CB C -12.893 4.291 15.587 1.00 . A A . 29 MET CB 1 1 5 3191 1 1 29 MET CE C -11.077 0.533 15.963 1.00 . A A . 29 MET CE 1 1 5 3192 1 1 29 MET CG C -12.692 2.797 15.904 1.00 . A A . 29 MET CG 1 1 5 3193 1 1 29 MET H H -10.608 4.773 14.364 1.00 . A A . 29 MET H 1 1 5 3194 1 1 29 MET HA H -13.344 3.909 13.473 1.00 . A A . 29 MET HA 1 1 5 3195 1 1 29 MET HB2 H -12.184 4.894 16.187 1.00 . A A . 29 MET HB2 1 1 5 3196 1 1 29 MET HB3 H -13.881 4.581 15.985 1.00 . A A . 29 MET HB3 1 1 5 3197 1 1 29 MET HE1 H -11.404 0.359 17.005 1.00 . A A . 29 MET HE1 1 1 5 3198 1 1 29 MET HE2 H -11.793 0.031 15.286 1.00 . A A . 29 MET HE2 1 1 5 3199 1 1 29 MET HE3 H -10.089 0.057 15.829 1.00 . A A . 29 MET HE3 1 1 5 3200 1 1 29 MET HG2 H -12.937 2.601 16.964 1.00 . A A . 29 MET HG2 1 1 5 3201 1 1 29 MET HG3 H -13.379 2.172 15.303 1.00 . A A . 29 MET HG3 1 1 5 3202 1 1 29 MET N N -11.386 4.729 13.698 1.00 . A A . 29 MET N 1 1 5 3203 1 1 29 MET O O -14.782 5.991 13.526 1.00 . A A . 29 MET O 1 1 5 3204 1 1 29 MET SD S -10.981 2.297 15.604 1.00 . A A . 29 MET SD 1 1 5 3205 1 1 30 ILE C C -13.620 8.810 12.336 1.00 . A A . 30 ILE C 1 1 5 3206 1 1 30 ILE CA C -13.533 8.527 13.880 1.00 . A A . 30 ILE CA 1 1 5 3207 1 1 30 ILE CB C -12.663 9.615 14.640 1.00 . A A . 30 ILE CB 1 1 5 3208 1 1 30 ILE CD1 C -11.384 8.499 16.645 1.00 . A A . 30 ILE CD1 1 1 5 3209 1 1 30 ILE CG1 C -12.571 9.365 16.186 1.00 . A A . 30 ILE CG1 1 1 5 3210 1 1 30 ILE CG2 C -13.294 11.023 14.448 1.00 . A A . 30 ILE CG2 1 1 5 3211 1 1 30 ILE H H -11.931 7.021 14.234 1.00 . A A . 30 ILE H 1 1 5 3212 1 1 30 ILE HA H -14.560 8.540 14.286 1.00 . A A . 30 ILE HA 1 1 5 3213 1 1 30 ILE HB H -11.635 9.651 14.228 1.00 . A A . 30 ILE HB 1 1 5 3214 1 1 30 ILE HD11 H -10.420 8.919 16.304 1.00 . A A . 30 ILE HD11 1 1 5 3215 1 1 30 ILE HD12 H -11.342 8.442 17.748 1.00 . A A . 30 ILE HD12 1 1 5 3216 1 1 30 ILE HD13 H -11.443 7.460 16.275 1.00 . A A . 30 ILE HD13 1 1 5 3217 1 1 30 ILE HG12 H -12.462 10.321 16.733 1.00 . A A . 30 ILE HG12 1 1 5 3218 1 1 30 ILE HG13 H -13.517 8.936 16.568 1.00 . A A . 30 ILE HG13 1 1 5 3219 1 1 30 ILE HG21 H -14.331 11.074 14.830 1.00 . A A . 30 ILE HG21 1 1 5 3220 1 1 30 ILE HG22 H -12.713 11.808 14.967 1.00 . A A . 30 ILE HG22 1 1 5 3221 1 1 30 ILE HG23 H -13.321 11.326 13.385 1.00 . A A . 30 ILE HG23 1 1 5 3222 1 1 30 ILE N N -12.936 7.176 14.084 1.00 . A A . 30 ILE N 1 1 5 3223 1 1 30 ILE O O -14.719 9.053 11.828 1.00 . A A . 30 ILE O 1 1 5 3224 1 1 31 GLY C C -11.097 10.073 9.986 1.00 . A A . 31 GLY C 1 1 5 3225 1 1 31 GLY CA C -12.377 9.250 10.226 1.00 . A A . 31 GLY CA 1 1 5 3226 1 1 31 GLY H H -11.661 8.667 12.242 1.00 . A A . 31 GLY H 1 1 5 3227 1 1 31 GLY HA2 H -12.369 8.365 9.565 1.00 . A A . 31 GLY HA2 1 1 5 3228 1 1 31 GLY HA3 H -13.256 9.850 9.917 1.00 . A A . 31 GLY HA3 1 1 5 3229 1 1 31 GLY N N -12.477 8.788 11.632 1.00 . A A . 31 GLY N 1 1 5 3230 1 1 31 GLY O O -10.303 9.743 9.101 1.00 . A A . 31 GLY O 1 1 5 3231 1 1 32 THR C C -8.692 11.223 11.888 1.00 . A A . 32 THR C 1 1 5 3232 1 1 32 THR CA C -9.632 11.901 10.839 1.00 . A A . 32 THR CA 1 1 5 3233 1 1 32 THR CB C -9.856 13.391 11.247 1.00 . A A . 32 THR CB 1 1 5 3234 1 1 32 THR CG2 C -10.651 14.182 10.190 1.00 . A A . 32 THR CG2 1 1 5 3235 1 1 32 THR H H -11.588 11.152 11.561 1.00 . A A . 32 THR H 1 1 5 3236 1 1 32 THR HA H -9.147 11.886 9.841 1.00 . A A . 32 THR HA 1 1 5 3237 1 1 32 THR HB H -8.853 13.849 11.365 1.00 . A A . 32 THR HB 1 1 5 3238 1 1 32 THR HG1 H -10.656 14.418 12.669 1.00 . A A . 32 THR HG1 1 1 5 3239 1 1 32 THR HG21 H -10.150 14.160 9.204 1.00 . A A . 32 THR HG21 1 1 5 3240 1 1 32 THR HG22 H -11.674 13.786 10.052 1.00 . A A . 32 THR HG22 1 1 5 3241 1 1 32 THR HG23 H -10.750 15.245 10.479 1.00 . A A . 32 THR HG23 1 1 5 3242 1 1 32 THR N N -10.913 11.138 10.787 1.00 . A A . 32 THR N 1 1 5 3243 1 1 32 THR O O -9.129 10.526 12.812 1.00 . A A . 32 THR O 1 1 5 3244 1 1 32 THR OG1 O -10.584 13.481 12.473 1.00 . A A . 32 THR OG1 1 1 5 3245 1 1 33 ASN C C -6.276 9.259 11.962 1.00 . A A . 33 ASN C 1 1 5 3246 1 1 33 ASN CA C -6.253 10.753 12.406 1.00 . A A . 33 ASN CA 1 1 5 3247 1 1 33 ASN CB C -6.349 10.879 13.965 1.00 . A A . 33 ASN CB 1 1 5 3248 1 1 33 ASN CG C -6.097 12.296 14.515 1.00 . A A . 33 ASN CG 1 1 5 3249 1 1 33 ASN H H -7.177 11.964 10.830 1.00 . A A . 33 ASN H 1 1 5 3250 1 1 33 ASN HA H -5.296 11.205 12.078 1.00 . A A . 33 ASN HA 1 1 5 3251 1 1 33 ASN HB2 H -7.295 10.463 14.361 1.00 . A A . 33 ASN HB2 1 1 5 3252 1 1 33 ASN HB3 H -5.586 10.216 14.415 1.00 . A A . 33 ASN HB3 1 1 5 3253 1 1 33 ASN HD21 H -8.053 12.530 14.899 1.00 . A A . 33 ASN HD21 1 1 5 3254 1 1 33 ASN HD22 H -6.942 13.928 15.320 1.00 . A A . 33 ASN HD22 1 1 5 3255 1 1 33 ASN N N -7.374 11.448 11.694 1.00 . A A . 33 ASN N 1 1 5 3256 1 1 33 ASN ND2 N -7.138 12.990 14.952 1.00 . A A . 33 ASN ND2 1 1 5 3257 1 1 33 ASN O O -6.687 8.357 12.699 1.00 . A A . 33 ASN O 1 1 5 3258 1 1 33 ASN OD1 O -4.964 12.774 14.553 1.00 . A A . 33 ASN OD1 1 1 5 3259 1 1 34 CYS C C -4.743 6.741 10.766 1.00 . A A . 34 CYS C 1 1 5 3260 1 1 34 CYS CA C -5.795 7.680 10.090 1.00 . A A . 34 CYS CA 1 1 5 3261 1 1 34 CYS CB C -5.478 7.863 8.587 1.00 . A A . 34 CYS CB 1 1 5 3262 1 1 34 CYS H H -5.674 9.908 10.192 1.00 . A A . 34 CYS H 1 1 5 3263 1 1 34 CYS HA H -6.796 7.243 10.180 1.00 . A A . 34 CYS HA 1 1 5 3264 1 1 34 CYS HB2 H -4.482 8.283 8.456 1.00 . A A . 34 CYS HB2 1 1 5 3265 1 1 34 CYS HB3 H -5.460 6.884 8.073 1.00 . A A . 34 CYS HB3 1 1 5 3266 1 1 34 CYS N N -5.815 9.033 10.716 1.00 . A A . 34 CYS N 1 1 5 3267 1 1 34 CYS O O -3.942 7.194 11.592 1.00 . A A . 34 CYS O 1 1 5 3268 1 1 34 CYS SG S -6.752 8.886 7.829 1.00 . A A . 34 CYS SG 1 1 5 3269 1 1 35 GLU C C -3.155 3.583 9.751 1.00 . A A . 35 GLU C 1 1 5 3270 1 1 35 GLU CA C -3.651 4.512 10.913 1.00 . A A . 35 GLU CA 1 1 5 3271 1 1 35 GLU CB C -4.090 3.600 12.104 1.00 . A A . 35 GLU CB 1 1 5 3272 1 1 35 GLU CD C -5.304 3.153 14.313 1.00 . A A . 35 GLU CD 1 1 5 3273 1 1 35 GLU CG C -5.090 4.130 13.155 1.00 . A A . 35 GLU CG 1 1 5 3274 1 1 35 GLU H H -5.503 5.179 9.770 1.00 . A A . 35 GLU H 1 1 5 3275 1 1 35 GLU HA H -2.794 5.128 11.243 1.00 . A A . 35 GLU HA 1 1 5 3276 1 1 35 GLU HB2 H -4.381 2.603 11.730 1.00 . A A . 35 GLU HB2 1 1 5 3277 1 1 35 GLU HB3 H -3.158 3.368 12.654 1.00 . A A . 35 GLU HB3 1 1 5 3278 1 1 35 GLU HE2 H -4.428 2.597 15.960 1.00 . A A . 35 GLU HE2 1 1 5 3279 1 1 35 GLU HG2 H -4.743 5.103 13.551 1.00 . A A . 35 GLU HG2 1 1 5 3280 1 1 35 GLU HG3 H -6.062 4.330 12.671 1.00 . A A . 35 GLU HG3 1 1 5 3281 1 1 35 GLU N N -4.756 5.425 10.444 1.00 . A A . 35 GLU N 1 1 5 3282 1 1 35 GLU O O -3.740 3.493 8.670 1.00 . A A . 35 GLU O 1 1 5 3283 1 1 35 GLU OE1 O -6.278 2.405 14.396 1.00 . A A . 35 GLU OE1 1 1 5 3284 1 1 35 GLU OE2 O -4.290 3.212 15.235 1.00 . A A . 35 GLU OE2 1 1 5 3285 1 1 36 CYS C C -1.790 0.655 8.941 1.00 . A A . 36 CYS C 1 1 5 3286 1 1 36 CYS CA C -1.249 2.114 9.007 1.00 . A A . 36 CYS CA 1 1 5 3287 1 1 36 CYS CB C 0.280 2.168 9.388 1.00 . A A . 36 CYS CB 1 1 5 3288 1 1 36 CYS H H -1.790 2.966 11.016 1.00 . A A . 36 CYS H 1 1 5 3289 1 1 36 CYS HA H -1.374 2.596 8.005 1.00 . A A . 36 CYS HA 1 1 5 3290 1 1 36 CYS HB2 H 0.483 2.245 10.474 1.00 . A A . 36 CYS HB2 1 1 5 3291 1 1 36 CYS HB3 H 0.841 1.239 9.185 1.00 . A A . 36 CYS HB3 1 1 5 3292 1 1 36 CYS N N -2.028 2.892 10.021 1.00 . A A . 36 CYS N 1 1 5 3293 1 1 36 CYS O O -2.508 0.170 9.824 1.00 . A A . 36 CYS O 1 1 5 3294 1 1 36 CYS SG S 1.012 3.453 8.384 1.00 . A A . 36 CYS SG 1 1 5 3295 1 1 37 THR C C -0.971 -2.288 6.938 1.00 . A A . 37 THR C 1 1 5 3296 1 1 37 THR CA C -2.094 -1.357 7.510 1.00 . A A . 37 THR CA 1 1 5 3297 1 1 37 THR CB C -3.254 -1.260 6.464 1.00 . A A . 37 THR CB 1 1 5 3298 1 1 37 THR CG2 C -4.528 -0.661 7.085 1.00 . A A . 37 THR CG2 1 1 5 3299 1 1 37 THR H H -0.922 0.486 7.139 1.00 . A A . 37 THR H 1 1 5 3300 1 1 37 THR HA H -2.514 -1.800 8.432 1.00 . A A . 37 THR HA 1 1 5 3301 1 1 37 THR HB H -3.479 -2.282 6.110 1.00 . A A . 37 THR HB 1 1 5 3302 1 1 37 THR HG1 H -3.645 -0.439 4.765 1.00 . A A . 37 THR HG1 1 1 5 3303 1 1 37 THR HG21 H -4.846 -1.218 7.986 1.00 . A A . 37 THR HG21 1 1 5 3304 1 1 37 THR HG22 H -4.396 0.398 7.377 1.00 . A A . 37 THR HG22 1 1 5 3305 1 1 37 THR HG23 H -5.367 -0.708 6.371 1.00 . A A . 37 THR HG23 1 1 5 3306 1 1 37 THR N N -1.503 -0.021 7.815 1.00 . A A . 37 THR N 1 1 5 3307 1 1 37 THR O O -0.292 -1.882 5.986 1.00 . A A . 37 THR O 1 1 5 3308 1 1 37 THR OG1 O -2.890 -0.435 5.358 1.00 . A A . 37 THR OG1 1 1 5 3309 1 1 38 PRO C C -0.261 -5.086 5.474 1.00 . A A . 38 PRO C 1 1 5 3310 1 1 38 PRO CA C 0.197 -4.512 6.857 1.00 . A A . 38 PRO CA 1 1 5 3311 1 1 38 PRO CB C 0.347 -5.555 7.994 1.00 . A A . 38 PRO CB 1 1 5 3312 1 1 38 PRO CD C -1.445 -4.067 8.646 1.00 . A A . 38 PRO CD 1 1 5 3313 1 1 38 PRO CG C -0.951 -5.503 8.802 1.00 . A A . 38 PRO CG 1 1 5 3314 1 1 38 PRO HA H 1.175 -4.034 6.678 1.00 . A A . 38 PRO HA 1 1 5 3315 1 1 38 PRO HB2 H 0.564 -6.576 7.632 1.00 . A A . 38 PRO HB2 1 1 5 3316 1 1 38 PRO HB3 H 1.196 -5.283 8.644 1.00 . A A . 38 PRO HB3 1 1 5 3317 1 1 38 PRO HD2 H -2.543 -4.028 8.571 1.00 . A A . 38 PRO HD2 1 1 5 3318 1 1 38 PRO HD3 H -1.178 -3.448 9.518 1.00 . A A . 38 PRO HD3 1 1 5 3319 1 1 38 PRO HG2 H -1.692 -6.207 8.378 1.00 . A A . 38 PRO HG2 1 1 5 3320 1 1 38 PRO HG3 H -0.803 -5.786 9.860 1.00 . A A . 38 PRO HG3 1 1 5 3321 1 1 38 PRO N N -0.783 -3.553 7.430 1.00 . A A . 38 PRO N 1 1 5 3322 1 1 38 PRO O O 0.234 -4.625 4.442 1.00 . A A . 38 PRO O 1 1 5 3323 1 1 39 ARG C C -3.227 -6.934 4.292 1.00 . A A . 39 ARG C 1 1 5 3324 1 1 39 ARG CA C -1.684 -6.722 4.212 1.00 . A A . 39 ARG CA 1 1 5 3325 1 1 39 ARG CB C -0.956 -8.087 4.013 1.00 . A A . 39 ARG CB 1 1 5 3326 1 1 39 ARG CD C 1.199 -9.355 3.385 1.00 . A A . 39 ARG CD 1 1 5 3327 1 1 39 ARG CG C 0.549 -7.989 3.677 1.00 . A A . 39 ARG CG 1 1 5 3328 1 1 39 ARG CZ C 3.262 -8.974 1.994 1.00 . A A . 39 ARG CZ 1 1 5 3329 1 1 39 ARG H H -1.497 -6.347 6.390 1.00 . A A . 39 ARG H 1 1 5 3330 1 1 39 ARG HA H -1.485 -6.086 3.333 1.00 . A A . 39 ARG HA 1 1 5 3331 1 1 39 ARG HB2 H -1.093 -8.732 4.904 1.00 . A A . 39 ARG HB2 1 1 5 3332 1 1 39 ARG HB3 H -1.450 -8.633 3.186 1.00 . A A . 39 ARG HB3 1 1 5 3333 1 1 39 ARG HD2 H 1.029 -10.034 4.242 1.00 . A A . 39 ARG HD2 1 1 5 3334 1 1 39 ARG HD3 H 0.706 -9.847 2.525 1.00 . A A . 39 ARG HD3 1 1 5 3335 1 1 39 ARG HG2 H 0.686 -7.320 2.806 1.00 . A A . 39 ARG HG2 1 1 5 3336 1 1 39 ARG HG3 H 1.082 -7.503 4.516 1.00 . A A . 39 ARG HG3 1 1 5 3337 1 1 39 ARG HH11 H 1.579 -8.800 0.904 1.00 . A A . 39 ARG HH11 1 1 5 3338 1 1 39 ARG HH12 H 3.172 -8.547 0.029 1.00 . A A . 39 ARG HH12 1 1 5 3339 1 1 39 ARG HH21 H 5.066 -9.090 2.854 1.00 . A A . 39 ARG HH21 1 1 5 3340 1 1 39 ARG HH22 H 5.013 -8.700 1.061 1.00 . A A . 39 ARG HH22 1 1 5 3341 1 1 39 ARG N N -1.191 -6.059 5.456 1.00 . A A . 39 ARG N 1 1 5 3342 1 1 39 ARG NE N 2.665 -9.251 3.171 1.00 . A A . 39 ARG NE 1 1 5 3343 1 1 39 ARG NH1 N 2.603 -8.751 0.858 1.00 . A A . 39 ARG NH1 1 1 5 3344 1 1 39 ARG NH2 N 4.581 -8.915 1.967 1.00 . A A . 39 ARG NH2 1 1 5 3345 1 1 39 ARG O O -3.917 -6.529 3.354 1.00 . A A . 39 ARG O 1 1 5 3346 1 1 40 LEU C C -5.627 -9.054 4.717 1.00 . A A . 40 LEU C 1 1 5 3347 1 1 40 LEU CA C -5.186 -7.883 5.657 1.00 . A A . 40 LEU CA 1 1 5 3348 1 1 40 LEU CB C -6.117 -6.623 5.508 1.00 . A A . 40 LEU CB 1 1 5 3349 1 1 40 LEU CD1 C -4.790 -4.812 6.818 1.00 . A A . 40 LEU CD1 1 1 5 3350 1 1 40 LEU CD2 C -7.272 -4.581 6.494 1.00 . A A . 40 LEU CD2 1 1 5 3351 1 1 40 LEU CG C -6.114 -5.586 6.669 1.00 . A A . 40 LEU CG 1 1 5 3352 1 1 40 LEU H H -3.007 -7.828 6.042 1.00 . A A . 40 LEU H 1 1 5 3353 1 1 40 LEU HA H -5.267 -8.257 6.690 1.00 . A A . 40 LEU HA 1 1 5 3354 1 1 40 LEU HB2 H -5.974 -6.107 4.541 1.00 . A A . 40 LEU HB2 1 1 5 3355 1 1 40 LEU HB3 H -7.155 -7.005 5.441 1.00 . A A . 40 LEU HB3 1 1 5 3356 1 1 40 LEU HD11 H -4.488 -4.330 5.870 1.00 . A A . 40 LEU HD11 1 1 5 3357 1 1 40 LEU HD12 H -4.855 -4.021 7.588 1.00 . A A . 40 LEU HD12 1 1 5 3358 1 1 40 LEU HD13 H -3.962 -5.474 7.128 1.00 . A A . 40 LEU HD13 1 1 5 3359 1 1 40 LEU HD21 H -8.253 -5.091 6.451 1.00 . A A . 40 LEU HD21 1 1 5 3360 1 1 40 LEU HD22 H -7.325 -3.866 7.336 1.00 . A A . 40 LEU HD22 1 1 5 3361 1 1 40 LEU HD23 H -7.172 -3.986 5.565 1.00 . A A . 40 LEU HD23 1 1 5 3362 1 1 40 LEU HG H -6.295 -6.128 7.615 1.00 . A A . 40 LEU HG 1 1 5 3363 1 1 40 LEU N N -3.742 -7.572 5.376 1.00 . A A . 40 LEU N 1 1 5 3364 1 1 40 LEU O O -5.683 -10.190 5.195 1.00 . A A . 40 LEU O 1 1 5 3365 1 1 41 ILE C C -7.844 -10.245 2.848 1.00 . A A . 41 ILE C 1 1 5 3366 1 1 41 ILE CA C -6.412 -9.785 2.399 1.00 . A A . 41 ILE CA 1 1 5 3367 1 1 41 ILE CB C -5.418 -11.011 2.234 1.00 . A A . 41 ILE CB 1 1 5 3368 1 1 41 ILE CD1 C -3.645 -9.629 0.786 1.00 . A A . 41 ILE CD1 1 1 5 3369 1 1 41 ILE CG1 C -3.937 -10.579 1.964 1.00 . A A . 41 ILE CG1 1 1 5 3370 1 1 41 ILE CG2 C -5.889 -11.898 1.049 1.00 . A A . 41 ILE CG2 1 1 5 3371 1 1 41 ILE H H -5.862 -7.794 3.209 1.00 . A A . 41 ILE H 1 1 5 3372 1 1 41 ILE HA H -6.490 -9.252 1.430 1.00 . A A . 41 ILE HA 1 1 5 3373 1 1 41 ILE HB H -5.414 -11.637 3.146 1.00 . A A . 41 ILE HB 1 1 5 3374 1 1 41 ILE HD11 H -3.953 -10.063 -0.182 1.00 . A A . 41 ILE HD11 1 1 5 3375 1 1 41 ILE HD12 H -4.164 -8.660 0.901 1.00 . A A . 41 ILE HD12 1 1 5 3376 1 1 41 ILE HD13 H -2.564 -9.410 0.716 1.00 . A A . 41 ILE HD13 1 1 5 3377 1 1 41 ILE HG12 H -3.532 -10.111 2.880 1.00 . A A . 41 ILE HG12 1 1 5 3378 1 1 41 ILE HG13 H -3.314 -11.485 1.838 1.00 . A A . 41 ILE HG13 1 1 5 3379 1 1 41 ILE HG21 H -5.963 -11.336 0.099 1.00 . A A . 41 ILE HG21 1 1 5 3380 1 1 41 ILE HG22 H -5.203 -12.748 0.875 1.00 . A A . 41 ILE HG22 1 1 5 3381 1 1 41 ILE HG23 H -6.884 -12.341 1.238 1.00 . A A . 41 ILE HG23 1 1 5 3382 1 1 41 ILE N N -5.943 -8.792 3.426 1.00 . A A . 41 ILE N 1 1 5 3383 1 1 41 ILE O O -8.002 -11.155 3.669 1.00 . A A . 41 ILE O 1 1 5 3384 1 1 42 MET C C -11.224 -9.794 1.511 1.00 . A A . 42 MET C 1 1 5 3385 1 1 42 MET CA C -10.283 -9.712 2.753 1.00 . A A . 42 MET CA 1 1 5 3386 1 1 42 MET CB C -10.665 -8.510 3.675 1.00 . A A . 42 MET CB 1 1 5 3387 1 1 42 MET CE C -9.063 -4.806 2.536 1.00 . A A . 42 MET CE 1 1 5 3388 1 1 42 MET CG C -10.580 -7.065 3.135 1.00 . A A . 42 MET CG 1 1 5 3389 1 1 42 MET H H -8.590 -8.824 1.651 1.00 . A A . 42 MET H 1 1 5 3390 1 1 42 MET HA H -10.404 -10.648 3.337 1.00 . A A . 42 MET HA 1 1 5 3391 1 1 42 MET HB2 H -11.701 -8.671 4.028 1.00 . A A . 42 MET HB2 1 1 5 3392 1 1 42 MET HB3 H -10.061 -8.564 4.600 1.00 . A A . 42 MET HB3 1 1 5 3393 1 1 42 MET HE1 H -9.624 -4.254 3.311 1.00 . A A . 42 MET HE1 1 1 5 3394 1 1 42 MET HE2 H -8.078 -4.319 2.416 1.00 . A A . 42 MET HE2 1 1 5 3395 1 1 42 MET HE3 H -9.610 -4.715 1.579 1.00 . A A . 42 MET HE3 1 1 5 3396 1 1 42 MET HG2 H -11.087 -6.968 2.157 1.00 . A A . 42 MET HG2 1 1 5 3397 1 1 42 MET HG3 H -11.104 -6.380 3.827 1.00 . A A . 42 MET HG3 1 1 5 3398 1 1 42 MET N N -8.869 -9.558 2.312 1.00 . A A . 42 MET N 1 1 5 3399 1 1 42 MET O O -10.923 -9.274 0.430 1.00 . A A . 42 MET O 1 1 5 3400 1 1 42 MET SD S -8.857 -6.536 2.998 1.00 . A A . 42 MET SD 1 1 5 3401 1 1 43 GLU C C -12.930 -11.830 -0.319 1.00 . A A . 43 GLU C 1 1 5 3402 1 1 43 GLU CA C -13.446 -10.756 0.693 1.00 . A A . 43 GLU CA 1 1 5 3403 1 1 43 GLU CB C -13.880 -9.463 -0.069 1.00 . A A . 43 GLU CB 1 1 5 3404 1 1 43 GLU CD C -15.580 -8.273 -1.569 1.00 . A A . 43 GLU CD 1 1 5 3405 1 1 43 GLU CG C -15.151 -9.599 -0.936 1.00 . A A . 43 GLU CG 1 1 5 3406 1 1 43 GLU H H -12.474 -10.834 2.668 1.00 . A A . 43 GLU H 1 1 5 3407 1 1 43 GLU HA H -14.316 -11.166 1.246 1.00 . A A . 43 GLU HA 1 1 5 3408 1 1 43 GLU HB2 H -14.079 -8.685 0.687 1.00 . A A . 43 GLU HB2 1 1 5 3409 1 1 43 GLU HB3 H -13.061 -9.070 -0.699 1.00 . A A . 43 GLU HB3 1 1 5 3410 1 1 43 GLU HE2 H -16.712 -6.741 -1.168 1.00 . A A . 43 GLU HE2 1 1 5 3411 1 1 43 GLU HG2 H -14.981 -10.334 -1.745 1.00 . A A . 43 GLU HG2 1 1 5 3412 1 1 43 GLU HG3 H -15.983 -10.010 -0.332 1.00 . A A . 43 GLU HG3 1 1 5 3413 1 1 43 GLU N N -12.380 -10.473 1.712 1.00 . A A . 43 GLU N 1 1 5 3414 1 1 43 GLU O O -11.795 -11.799 -0.810 1.00 . A A . 43 GLU O 1 1 5 3415 1 1 43 GLU OE1 O -15.184 -7.885 -2.668 1.00 . A A . 43 GLU OE1 1 1 5 3416 1 1 43 GLU OE2 O -16.447 -7.573 -0.769 1.00 . A A . 43 GLU OE2 1 1 5 3417 1 1 44 GLY C C -13.429 -13.422 -3.057 1.00 . A A . 44 GLY C 1 1 5 3418 1 1 44 GLY CA C -13.573 -13.873 -1.590 1.00 . A A . 44 GLY CA 1 1 5 3419 1 1 44 GLY H H -14.760 -12.592 -0.222 1.00 . A A . 44 GLY H 1 1 5 3420 1 1 44 GLY HA2 H -12.664 -14.422 -1.279 1.00 . A A . 44 GLY HA2 1 1 5 3421 1 1 44 GLY HA3 H -14.389 -14.615 -1.505 1.00 . A A . 44 GLY HA3 1 1 5 3422 1 1 44 GLY N N -13.837 -12.769 -0.636 1.00 . A A . 44 GLY N 1 1 5 3423 1 1 44 GLY O O -12.305 -13.360 -3.564 1.00 . A A . 44 GLY O 1 1 5 3424 1 1 45 LEU C C -14.407 -10.939 -4.917 1.00 . A A . 45 LEU C 1 1 5 3425 1 1 45 LEU CA C -14.543 -12.483 -5.072 1.00 . A A . 45 LEU CA 1 1 5 3426 1 1 45 LEU CB C -15.852 -12.892 -5.818 1.00 . A A . 45 LEU CB 1 1 5 3427 1 1 45 LEU CD1 C -16.101 -11.155 -7.752 1.00 . A A . 45 LEU CD1 1 1 5 3428 1 1 45 LEU CD2 C -14.869 -13.333 -8.177 1.00 . A A . 45 LEU CD2 1 1 5 3429 1 1 45 LEU CG C -15.971 -12.638 -7.352 1.00 . A A . 45 LEU CG 1 1 5 3430 1 1 45 LEU H H -15.420 -13.169 -3.163 1.00 . A A . 45 LEU H 1 1 5 3431 1 1 45 LEU HA H -13.682 -12.878 -5.650 1.00 . A A . 45 LEU HA 1 1 5 3432 1 1 45 LEU HB2 H -16.004 -13.980 -5.677 1.00 . A A . 45 LEU HB2 1 1 5 3433 1 1 45 LEU HB3 H -16.729 -12.440 -5.313 1.00 . A A . 45 LEU HB3 1 1 5 3434 1 1 45 LEU HD11 H -16.894 -10.644 -7.175 1.00 . A A . 45 LEU HD11 1 1 5 3435 1 1 45 LEU HD12 H -15.163 -10.592 -7.591 1.00 . A A . 45 LEU HD12 1 1 5 3436 1 1 45 LEU HD13 H -16.361 -11.043 -8.821 1.00 . A A . 45 LEU HD13 1 1 5 3437 1 1 45 LEU HD21 H -14.798 -14.410 -7.938 1.00 . A A . 45 LEU HD21 1 1 5 3438 1 1 45 LEU HD22 H -15.066 -13.259 -9.263 1.00 . A A . 45 LEU HD22 1 1 5 3439 1 1 45 LEU HD23 H -13.871 -12.889 -7.998 1.00 . A A . 45 LEU HD23 1 1 5 3440 1 1 45 LEU HG H -16.924 -13.111 -7.657 1.00 . A A . 45 LEU HG 1 1 5 3441 1 1 45 LEU N N -14.557 -13.078 -3.709 1.00 . A A . 45 LEU N 1 1 5 3442 1 1 45 LEU O O -15.368 -10.246 -4.561 1.00 . A A . 45 LEU O 1 1 5 3443 1 1 46 SER C C -12.234 -8.617 -6.531 1.00 . A A . 46 SER C 1 1 5 3444 1 1 46 SER CA C -12.894 -8.976 -5.171 1.00 . A A . 46 SER CA 1 1 5 3445 1 1 46 SER CB C -11.979 -8.651 -3.960 1.00 . A A . 46 SER CB 1 1 5 3446 1 1 46 SER H H -12.490 -11.123 -5.469 1.00 . A A . 46 SER H 1 1 5 3447 1 1 46 SER HA H -13.817 -8.373 -5.049 1.00 . A A . 46 SER HA 1 1 5 3448 1 1 46 SER HB2 H -11.735 -7.573 -3.948 1.00 . A A . 46 SER HB2 1 1 5 3449 1 1 46 SER HB3 H -12.524 -8.837 -3.016 1.00 . A A . 46 SER HB3 1 1 5 3450 1 1 46 SER HG H -10.309 -9.186 -4.758 1.00 . A A . 46 SER HG 1 1 5 3451 1 1 46 SER N N -13.193 -10.431 -5.188 1.00 . A A . 46 SER N 1 1 5 3452 1 1 46 SER O O -11.028 -8.803 -6.734 1.00 . A A . 46 SER O 1 1 5 3453 1 1 46 SER OG O -10.768 -9.404 -3.944 1.00 . A A . 46 SER OG 1 1 5 3454 1 1 47 PHE C C -12.325 -6.316 -9.027 1.00 . A A . 47 PHE C 1 1 5 3455 1 1 47 PHE CA C -12.631 -7.838 -8.866 1.00 . A A . 47 PHE CA 1 1 5 3456 1 1 47 PHE CB C -13.761 -8.356 -9.814 1.00 . A A . 47 PHE CB 1 1 5 3457 1 1 47 PHE CD1 C -12.639 -9.227 -11.935 1.00 . A A . 47 PHE CD1 1 1 5 3458 1 1 47 PHE CD2 C -13.945 -7.200 -12.083 1.00 . A A . 47 PHE CD2 1 1 5 3459 1 1 47 PHE CE1 C -12.335 -9.127 -13.291 1.00 . A A . 47 PHE CE1 1 1 5 3460 1 1 47 PHE CE2 C -13.636 -7.101 -13.437 1.00 . A A . 47 PHE CE2 1 1 5 3461 1 1 47 PHE CG C -13.444 -8.261 -11.319 1.00 . A A . 47 PHE CG 1 1 5 3462 1 1 47 PHE CZ C -12.833 -8.064 -14.040 1.00 . A A . 47 PHE CZ 1 1 5 3463 1 1 47 PHE H H -14.042 -8.033 -7.177 1.00 . A A . 47 PHE H 1 1 5 3464 1 1 47 PHE HA H -11.703 -8.380 -9.114 1.00 . A A . 47 PHE HA 1 1 5 3465 1 1 47 PHE HB2 H -13.977 -9.418 -9.580 1.00 . A A . 47 PHE HB2 1 1 5 3466 1 1 47 PHE HB3 H -14.717 -7.840 -9.595 1.00 . A A . 47 PHE HB3 1 1 5 3467 1 1 47 PHE HD1 H -12.240 -10.054 -11.364 1.00 . A A . 47 PHE HD1 1 1 5 3468 1 1 47 PHE HD2 H -14.565 -6.440 -11.628 1.00 . A A . 47 PHE HD2 1 1 5 3469 1 1 47 PHE HE1 H -11.710 -9.873 -13.761 1.00 . A A . 47 PHE HE1 1 1 5 3470 1 1 47 PHE HE2 H -14.020 -6.275 -14.019 1.00 . A A . 47 PHE HE2 1 1 5 3471 1 1 47 PHE HZ H -12.594 -7.987 -15.091 1.00 . A A . 47 PHE HZ 1 1 5 3472 1 1 47 PHE N N -13.064 -8.128 -7.472 1.00 . A A . 47 PHE N 1 1 5 3473 1 1 47 PHE O O -11.164 -5.970 -9.259 1.00 . A A . 47 PHE O 1 1 5 3474 1 1 48 ALA C C -12.841 -3.691 -10.655 1.00 . A A . 48 ALA C 1 1 5 3475 1 1 48 ALA CA C -13.285 -3.963 -9.191 1.00 . A A . 48 ALA CA 1 1 5 3476 1 1 48 ALA CB C -12.318 -3.284 -8.189 1.00 . A A . 48 ALA CB 1 1 5 3477 1 1 48 ALA H H -14.244 -5.908 -8.756 1.00 . A A . 48 ALA H 1 1 5 3478 1 1 48 ALA HXT H -13.647 -3.382 -12.401 1.00 . A A . 48 ALA HXT 1 1 5 3479 1 1 48 ALA HA H -14.296 -3.534 -9.058 1.00 . A A . 48 ALA HA 1 1 5 3480 1 1 48 ALA HB1 H -12.619 -3.475 -7.142 1.00 . A A . 48 ALA HB1 1 1 5 3481 1 1 48 ALA HB2 H -11.269 -3.619 -8.293 1.00 . A A . 48 ALA HB2 1 1 5 3482 1 1 48 ALA HB3 H -12.316 -2.186 -8.319 1.00 . A A . 48 ALA HB3 1 1 5 3483 1 1 48 ALA N N -13.353 -5.435 -8.936 1.00 . A A . 48 ALA N 1 1 5 3484 1 1 48 ALA O O -11.668 -3.629 -11.030 1.00 . A A . 48 ALA O 1 1 5 3485 1 1 48 ALA OXT O -13.917 -3.544 -11.494 1.00 . A A . 48 ALA OXT 1 1 6 3486 1 1 1 GLU C C 10.446 15.452 6.595 1.00 . A A . 1 GLU C 1 1 6 3487 1 1 1 GLU CA C 11.569 16.476 6.249 1.00 . A A . 1 GLU CA 1 1 6 3488 1 1 1 GLU CB C 11.850 16.641 4.724 1.00 . A A . 1 GLU CB 1 1 6 3489 1 1 1 GLU CD C 11.001 17.424 2.439 1.00 . A A . 1 GLU CD 1 1 6 3490 1 1 1 GLU CG C 10.679 17.255 3.926 1.00 . A A . 1 GLU CG 1 1 6 3491 1 1 1 GLU H1 H 12.722 15.939 7.908 1.00 . A A . 1 GLU H1 1 1 6 3492 1 1 1 GLU H2 H 13.590 16.707 6.731 1.00 . A A . 1 GLU H2 1 1 6 3493 1 1 1 GLU HA H 11.268 17.445 6.677 1.00 . A A . 1 GLU HA 1 1 6 3494 1 1 1 GLU HB2 H 12.733 17.297 4.586 1.00 . A A . 1 GLU HB2 1 1 6 3495 1 1 1 GLU HB3 H 12.139 15.671 4.274 1.00 . A A . 1 GLU HB3 1 1 6 3496 1 1 1 GLU HE2 H 11.824 18.721 1.242 1.00 . A A . 1 GLU HE2 1 1 6 3497 1 1 1 GLU HG2 H 9.779 16.618 4.022 1.00 . A A . 1 GLU HG2 1 1 6 3498 1 1 1 GLU HG3 H 10.395 18.233 4.357 1.00 . A A . 1 GLU HG3 1 1 6 3499 1 1 1 GLU N N 12.830 16.037 6.892 1.00 . A A . 1 GLU N 1 1 6 3500 1 1 1 GLU O O 9.583 15.772 7.417 1.00 . A A . 1 GLU O 1 1 6 3501 1 1 1 GLU OE1 O 10.730 16.579 1.586 1.00 . A A . 1 GLU OE1 1 1 6 3502 1 1 1 GLU OE2 O 11.622 18.618 2.175 1.00 . A A . 1 GLU OE2 1 1 6 3503 1 1 2 ASP C C 9.952 12.202 7.297 1.00 . A A . 2 ASP C 1 1 6 3504 1 1 2 ASP CA C 9.425 13.203 6.225 1.00 . A A . 2 ASP CA 1 1 6 3505 1 1 2 ASP CB C 9.129 12.488 4.877 1.00 . A A . 2 ASP CB 1 1 6 3506 1 1 2 ASP CG C 7.936 11.519 4.912 1.00 . A A . 2 ASP CG 1 1 6 3507 1 1 2 ASP H H 11.224 14.140 5.321 1.00 . A A . 2 ASP H 1 1 6 3508 1 1 2 ASP HA H 8.482 13.669 6.580 1.00 . A A . 2 ASP HA 1 1 6 3509 1 1 2 ASP HB2 H 8.925 13.239 4.088 1.00 . A A . 2 ASP HB2 1 1 6 3510 1 1 2 ASP HB3 H 10.024 11.942 4.519 1.00 . A A . 2 ASP HB3 1 1 6 3511 1 1 2 ASP HD2 H 6.845 13.121 4.731 1.00 . A A . 2 ASP HD2 1 1 6 3512 1 1 2 ASP N N 10.455 14.247 5.989 1.00 . A A . 2 ASP N 1 1 6 3513 1 1 2 ASP O O 11.027 11.609 7.147 1.00 . A A . 2 ASP O 1 1 6 3514 1 1 2 ASP OD1 O 8.057 10.300 5.026 1.00 . A A . 2 ASP OD1 1 1 6 3515 1 1 2 ASP OD2 O 6.734 12.171 4.809 1.00 . A A . 2 ASP OD2 1 1 6 3516 1 1 3 ASN C C 9.296 9.504 9.098 1.00 . A A . 3 ASN C 1 1 6 3517 1 1 3 ASN CA C 9.468 11.017 9.451 1.00 . A A . 3 ASN CA 1 1 6 3518 1 1 3 ASN CB C 8.534 11.413 10.635 1.00 . A A . 3 ASN CB 1 1 6 3519 1 1 3 ASN CG C 8.945 10.837 12.005 1.00 . A A . 3 ASN CG 1 1 6 3520 1 1 3 ASN H H 8.285 12.548 8.357 1.00 . A A . 3 ASN H 1 1 6 3521 1 1 3 ASN HA H 10.507 11.121 9.691 1.00 . A A . 3 ASN HA 1 1 6 3522 1 1 3 ASN HB2 H 8.516 12.511 10.749 1.00 . A A . 3 ASN HB2 1 1 6 3523 1 1 3 ASN HB3 H 7.481 11.156 10.397 1.00 . A A . 3 ASN HB3 1 1 6 3524 1 1 3 ASN HD21 H 7.387 9.573 11.981 1.00 . A A . 3 ASN HD21 1 1 6 3525 1 1 3 ASN HD22 H 8.495 9.511 13.442 1.00 . A A . 3 ASN HD22 1 1 6 3526 1 1 3 ASN N N 9.153 12.001 8.360 1.00 . A A . 3 ASN N 1 1 6 3527 1 1 3 ASN ND2 N 8.199 9.876 12.530 1.00 . A A . 3 ASN ND2 1 1 6 3528 1 1 3 ASN O O 9.986 8.634 9.632 1.00 . A A . 3 ASN O 1 1 6 3529 1 1 3 ASN OD1 O 9.937 11.255 12.602 1.00 . A A . 3 ASN OD1 1 1 6 3530 1 1 4 CYS C C 6.936 7.308 9.019 1.00 . A A . 4 CYS C 1 1 6 3531 1 1 4 CYS CA C 7.714 7.975 7.828 1.00 . A A . 4 CYS CA 1 1 6 3532 1 1 4 CYS CB C 8.754 6.996 7.261 1.00 . A A . 4 CYS CB 1 1 6 3533 1 1 4 CYS H H 8.000 10.232 8.047 1.00 . A A . 4 CYS H 1 1 6 3534 1 1 4 CYS HA H 7.025 8.164 6.988 1.00 . A A . 4 CYS HA 1 1 6 3535 1 1 4 CYS HB2 H 8.056 6.220 7.016 1.00 . A A . 4 CYS HB2 1 1 6 3536 1 1 4 CYS HB3 H 9.144 7.247 6.265 1.00 . A A . 4 CYS HB3 1 1 6 3537 1 1 4 CYS N N 8.313 9.275 8.244 1.00 . A A . 4 CYS N 1 1 6 3538 1 1 4 CYS O O 7.117 7.646 10.195 1.00 . A A . 4 CYS O 1 1 6 3539 1 1 4 CYS SG S 9.922 6.100 8.306 1.00 . A A . 4 CYS SG 1 1 6 3540 1 1 5 ILE C C 5.938 4.176 9.729 1.00 . A A . 5 ILE C 1 1 6 3541 1 1 5 ILE CA C 5.281 5.565 9.728 1.00 . A A . 5 ILE CA 1 1 6 3542 1 1 5 ILE CB C 3.726 5.384 9.468 1.00 . A A . 5 ILE CB 1 1 6 3543 1 1 5 ILE CD1 C 3.150 7.864 9.831 1.00 . A A . 5 ILE CD1 1 1 6 3544 1 1 5 ILE CG1 C 3.048 6.658 8.939 1.00 . A A . 5 ILE CG1 1 1 6 3545 1 1 5 ILE CG2 C 3.010 4.922 10.777 1.00 . A A . 5 ILE CG2 1 1 6 3546 1 1 5 ILE H H 6.148 6.063 7.661 1.00 . A A . 5 ILE H 1 1 6 3547 1 1 5 ILE HA H 5.390 6.071 10.706 1.00 . A A . 5 ILE HA 1 1 6 3548 1 1 5 ILE HB H 3.475 4.609 8.759 1.00 . A A . 5 ILE HB 1 1 6 3549 1 1 5 ILE HD11 H 3.083 7.582 10.885 1.00 . A A . 5 ILE HD11 1 1 6 3550 1 1 5 ILE HD12 H 4.120 8.350 9.644 1.00 . A A . 5 ILE HD12 1 1 6 3551 1 1 5 ILE HD13 H 2.327 8.538 9.582 1.00 . A A . 5 ILE HD13 1 1 6 3552 1 1 5 ILE HG12 H 3.436 6.961 7.960 1.00 . A A . 5 ILE HG12 1 1 6 3553 1 1 5 ILE HG13 H 2.011 6.420 8.697 1.00 . A A . 5 ILE HG13 1 1 6 3554 1 1 5 ILE HG21 H 3.167 5.578 11.651 1.00 . A A . 5 ILE HG21 1 1 6 3555 1 1 5 ILE HG22 H 1.913 4.856 10.629 1.00 . A A . 5 ILE HG22 1 1 6 3556 1 1 5 ILE HG23 H 3.318 3.906 11.080 1.00 . A A . 5 ILE HG23 1 1 6 3557 1 1 5 ILE N N 6.048 6.335 8.670 1.00 . A A . 5 ILE N 1 1 6 3558 1 1 5 ILE O O 5.630 3.320 8.900 1.00 . A A . 5 ILE O 1 1 6 3559 1 1 6 ALA C C 6.732 1.375 11.180 1.00 . A A . 6 ALA C 1 1 6 3560 1 1 6 ALA CA C 7.574 2.595 10.637 1.00 . A A . 6 ALA CA 1 1 6 3561 1 1 6 ALA CB C 8.846 2.799 11.484 1.00 . A A . 6 ALA CB 1 1 6 3562 1 1 6 ALA H H 6.910 4.610 11.397 1.00 . A A . 6 ALA H 1 1 6 3563 1 1 6 ALA HA H 7.814 2.376 9.570 1.00 . A A . 6 ALA HA 1 1 6 3564 1 1 6 ALA HB1 H 9.477 3.618 11.090 1.00 . A A . 6 ALA HB1 1 1 6 3565 1 1 6 ALA HB2 H 8.618 3.035 12.541 1.00 . A A . 6 ALA HB2 1 1 6 3566 1 1 6 ALA HB3 H 9.480 1.892 11.484 1.00 . A A . 6 ALA HB3 1 1 6 3567 1 1 6 ALA N N 6.852 3.904 10.661 1.00 . A A . 6 ALA N 1 1 6 3568 1 1 6 ALA O O 7.283 0.292 11.401 1.00 . A A . 6 ALA O 1 1 6 3569 1 1 7 GLU C C 3.173 0.376 11.401 1.00 . A A . 7 GLU C 1 1 6 3570 1 1 7 GLU CA C 4.518 0.606 12.083 1.00 . A A . 7 GLU CA 1 1 6 3571 1 1 7 GLU CB C 4.288 1.146 13.537 1.00 . A A . 7 GLU CB 1 1 6 3572 1 1 7 GLU CD C 6.654 1.569 14.576 1.00 . A A . 7 GLU CD 1 1 6 3573 1 1 7 GLU CG C 5.343 0.775 14.606 1.00 . A A . 7 GLU CG 1 1 6 3574 1 1 7 GLU H H 5.221 2.567 11.228 1.00 . A A . 7 GLU H 1 1 6 3575 1 1 7 GLU HA H 4.961 -0.367 12.065 1.00 . A A . 7 GLU HA 1 1 6 3576 1 1 7 GLU HB2 H 4.111 2.240 13.536 1.00 . A A . 7 GLU HB2 1 1 6 3577 1 1 7 GLU HB3 H 3.330 0.749 13.927 1.00 . A A . 7 GLU HB3 1 1 6 3578 1 1 7 GLU HE2 H 7.284 3.401 14.767 1.00 . A A . 7 GLU HE2 1 1 6 3579 1 1 7 GLU HG2 H 4.895 0.919 15.607 1.00 . A A . 7 GLU HG2 1 1 6 3580 1 1 7 GLU HG3 H 5.564 -0.307 14.551 1.00 . A A . 7 GLU HG3 1 1 6 3581 1 1 7 GLU N N 5.411 1.566 11.384 1.00 . A A . 7 GLU N 1 1 6 3582 1 1 7 GLU O O 2.570 1.300 10.877 1.00 . A A . 7 GLU O 1 1 6 3583 1 1 7 GLU OE1 O 7.754 1.049 14.391 1.00 . A A . 7 GLU OE1 1 1 6 3584 1 1 7 GLU OE2 O 6.459 2.911 14.784 1.00 . A A . 7 GLU OE2 1 1 6 3585 1 1 8 ASP C C 0.480 -0.871 12.371 1.00 . A A . 8 ASP C 1 1 6 3586 1 1 8 ASP CA C 1.348 -1.342 11.173 1.00 . A A . 8 ASP CA 1 1 6 3587 1 1 8 ASP CB C 1.199 -2.873 11.038 1.00 . A A . 8 ASP CB 1 1 6 3588 1 1 8 ASP CG C 2.139 -3.532 10.009 1.00 . A A . 8 ASP CG 1 1 6 3589 1 1 8 ASP H H 3.372 -1.529 11.992 1.00 . A A . 8 ASP H 1 1 6 3590 1 1 8 ASP HA H 1.020 -0.919 10.197 1.00 . A A . 8 ASP HA 1 1 6 3591 1 1 8 ASP HB2 H 1.279 -3.304 12.042 1.00 . A A . 8 ASP HB2 1 1 6 3592 1 1 8 ASP HB3 H 0.172 -3.096 10.708 1.00 . A A . 8 ASP HB3 1 1 6 3593 1 1 8 ASP HD2 H 1.957 -5.109 11.134 1.00 . A A . 8 ASP HD2 1 1 6 3594 1 1 8 ASP N N 2.720 -0.898 11.513 1.00 . A A . 8 ASP N 1 1 6 3595 1 1 8 ASP O O 0.784 -1.059 13.556 1.00 . A A . 8 ASP O 1 1 6 3596 1 1 8 ASP OD1 O 2.592 -2.959 9.017 1.00 . A A . 8 ASP OD1 1 1 6 3597 1 1 8 ASP OD2 O 2.401 -4.839 10.327 1.00 . A A . 8 ASP OD2 1 1 6 3598 1 1 9 TYR C C -0.777 1.723 13.649 1.00 . A A . 9 TYR C 1 1 6 3599 1 1 9 TYR CA C -1.528 0.570 12.857 1.00 . A A . 9 TYR CA 1 1 6 3600 1 1 9 TYR CB C -2.280 -0.422 13.813 1.00 . A A . 9 TYR CB 1 1 6 3601 1 1 9 TYR CD1 C -4.342 -1.051 12.435 1.00 . A A . 9 TYR CD1 1 1 6 3602 1 1 9 TYR CD2 C -2.688 -2.759 12.869 1.00 . A A . 9 TYR CD2 1 1 6 3603 1 1 9 TYR CE1 C -5.030 -1.932 11.603 1.00 . A A . 9 TYR CE1 1 1 6 3604 1 1 9 TYR CE2 C -3.377 -3.637 12.037 1.00 . A A . 9 TYR CE2 1 1 6 3605 1 1 9 TYR CG C -3.158 -1.454 13.064 1.00 . A A . 9 TYR CG 1 1 6 3606 1 1 9 TYR CZ C -4.544 -3.222 11.400 1.00 . A A . 9 TYR CZ 1 1 6 3607 1 1 9 TYR H H -0.704 -0.338 10.966 1.00 . A A . 9 TYR H 1 1 6 3608 1 1 9 TYR HA H -2.263 1.091 12.220 1.00 . A A . 9 TYR HA 1 1 6 3609 1 1 9 TYR HB2 H -1.576 -0.926 14.503 1.00 . A A . 9 TYR HB2 1 1 6 3610 1 1 9 TYR HB3 H -2.940 0.158 14.487 1.00 . A A . 9 TYR HB3 1 1 6 3611 1 1 9 TYR HD1 H -4.706 -0.039 12.549 1.00 . A A . 9 TYR HD1 1 1 6 3612 1 1 9 TYR HD2 H -1.760 -3.081 13.319 1.00 . A A . 9 TYR HD2 1 1 6 3613 1 1 9 TYR HE1 H -5.926 -1.604 11.097 1.00 . A A . 9 TYR HE1 1 1 6 3614 1 1 9 TYR HE2 H -2.989 -4.632 11.867 1.00 . A A . 9 TYR HE2 1 1 6 3615 1 1 9 TYR HH H -5.974 -3.630 10.197 1.00 . A A . 9 TYR HH 1 1 6 3616 1 1 9 TYR N N -0.603 -0.223 11.977 1.00 . A A . 9 TYR N 1 1 6 3617 1 1 9 TYR O O -1.222 2.123 14.729 1.00 . A A . 9 TYR O 1 1 6 3618 1 1 9 TYR OH O -5.204 -4.077 10.555 1.00 . A A . 9 TYR OH 1 1 6 3619 1 1 10 GLY C C 0.181 4.758 13.019 1.00 . A A . 10 GLY C 1 1 6 3620 1 1 10 GLY CA C 0.937 3.557 13.567 1.00 . A A . 10 GLY CA 1 1 6 3621 1 1 10 GLY H H 0.573 1.903 12.168 1.00 . A A . 10 GLY H 1 1 6 3622 1 1 10 GLY HA2 H 1.037 3.572 14.652 1.00 . A A . 10 GLY HA2 1 1 6 3623 1 1 10 GLY HA3 H 1.975 3.705 13.258 1.00 . A A . 10 GLY HA3 1 1 6 3624 1 1 10 GLY N N 0.304 2.312 13.070 1.00 . A A . 10 GLY N 1 1 6 3625 1 1 10 GLY O O -0.411 4.726 11.937 1.00 . A A . 10 GLY O 1 1 6 3626 1 1 11 LYS C C -0.004 7.772 12.325 1.00 . A A . 11 LYS C 1 1 6 3627 1 1 11 LYS CA C -0.657 7.011 13.506 1.00 . A A . 11 LYS CA 1 1 6 3628 1 1 11 LYS CB C -0.818 7.975 14.688 1.00 . A A . 11 LYS CB 1 1 6 3629 1 1 11 LYS CD C -1.720 10.325 13.931 1.00 . A A . 11 LYS CD 1 1 6 3630 1 1 11 LYS CE C -2.998 11.154 13.712 1.00 . A A . 11 LYS CE 1 1 6 3631 1 1 11 LYS CG C -2.006 8.972 14.620 1.00 . A A . 11 LYS CG 1 1 6 3632 1 1 11 LYS H H 0.906 5.671 14.541 1.00 . A A . 11 LYS H 1 1 6 3633 1 1 11 LYS HA H -1.671 6.618 13.257 1.00 . A A . 11 LYS HA 1 1 6 3634 1 1 11 LYS HB2 H -1.046 7.322 15.529 1.00 . A A . 11 LYS HB2 1 1 6 3635 1 1 11 LYS HB3 H 0.126 8.495 14.890 1.00 . A A . 11 LYS HB3 1 1 6 3636 1 1 11 LYS HD2 H -0.992 10.895 14.540 1.00 . A A . 11 LYS HD2 1 1 6 3637 1 1 11 LYS HD3 H -1.227 10.166 12.956 1.00 . A A . 11 LYS HD3 1 1 6 3638 1 1 11 LYS HE2 H -3.719 10.586 13.095 1.00 . A A . 11 LYS HE2 1 1 6 3639 1 1 11 LYS HE3 H -3.502 11.356 14.675 1.00 . A A . 11 LYS HE3 1 1 6 3640 1 1 11 LYS HG2 H -2.873 8.475 14.144 1.00 . A A . 11 LYS HG2 1 1 6 3641 1 1 11 LYS HG3 H -2.340 9.185 15.653 1.00 . A A . 11 LYS HG3 1 1 6 3642 1 1 11 LYS HZ1 H -3.576 12.947 12.871 1.00 . A A . 11 LYS HZ1 1 1 6 3643 1 1 11 LYS HZ2 H -2.302 12.258 12.114 1.00 . A A . 11 LYS HZ2 1 1 6 3644 1 1 11 LYS N N 0.218 5.834 13.796 1.00 . A A . 11 LYS N 1 1 6 3645 1 1 11 LYS NZ N -2.705 12.432 13.041 1.00 . A A . 11 LYS NZ 1 1 6 3646 1 1 11 LYS O O 1.177 8.125 12.275 1.00 . A A . 11 LYS O 1 1 6 3647 1 1 12 CYS C C -1.765 9.371 9.530 1.00 . A A . 12 CYS C 1 1 6 3648 1 1 12 CYS CA C -0.634 8.428 10.022 1.00 . A A . 12 CYS CA 1 1 6 3649 1 1 12 CYS CB C -0.474 7.155 9.137 1.00 . A A . 12 CYS CB 1 1 6 3650 1 1 12 CYS H H -1.799 7.688 11.849 1.00 . A A . 12 CYS H 1 1 6 3651 1 1 12 CYS HA H 0.315 8.995 9.975 1.00 . A A . 12 CYS HA 1 1 6 3652 1 1 12 CYS HB2 H 0.116 7.406 8.242 1.00 . A A . 12 CYS HB2 1 1 6 3653 1 1 12 CYS HB3 H 0.136 6.397 9.655 1.00 . A A . 12 CYS HB3 1 1 6 3654 1 1 12 CYS N N -0.914 7.954 11.395 1.00 . A A . 12 CYS N 1 1 6 3655 1 1 12 CYS O O -2.654 9.820 10.263 1.00 . A A . 12 CYS O 1 1 6 3656 1 1 12 CYS SG S -2.040 6.378 8.673 1.00 . A A . 12 CYS SG 1 1 6 3657 1 1 13 THR C C -2.662 9.806 6.009 1.00 . A A . 13 THR C 1 1 6 3658 1 1 13 THR CA C -2.684 10.403 7.448 1.00 . A A . 13 THR CA 1 1 6 3659 1 1 13 THR CB C -2.396 11.945 7.356 1.00 . A A . 13 THR CB 1 1 6 3660 1 1 13 THR CG2 C -3.090 12.786 8.417 1.00 . A A . 13 THR CG2 1 1 6 3661 1 1 13 THR H H -0.820 9.255 7.811 1.00 . A A . 13 THR H 1 1 6 3662 1 1 13 THR HA H -3.686 10.231 7.914 1.00 . A A . 13 THR HA 1 1 6 3663 1 1 13 THR HB H -2.776 12.283 6.371 1.00 . A A . 13 THR HB 1 1 6 3664 1 1 13 THR HG1 H -0.545 11.770 6.844 1.00 . A A . 13 THR HG1 1 1 6 3665 1 1 13 THR HG21 H -4.184 12.677 8.357 1.00 . A A . 13 THR HG21 1 1 6 3666 1 1 13 THR HG22 H -2.738 12.529 9.430 1.00 . A A . 13 THR HG22 1 1 6 3667 1 1 13 THR HG23 H -2.853 13.855 8.241 1.00 . A A . 13 THR HG23 1 1 6 3668 1 1 13 THR N N -1.658 9.675 8.235 1.00 . A A . 13 THR N 1 1 6 3669 1 1 13 THR O O -1.606 9.533 5.423 1.00 . A A . 13 THR O 1 1 6 3670 1 1 13 THR OG1 O -1.011 12.246 7.535 1.00 . A A . 13 THR OG1 1 1 6 3671 1 1 14 TRP C C -4.171 10.693 3.306 1.00 . A A . 14 TRP C 1 1 6 3672 1 1 14 TRP CA C -4.039 9.304 3.997 1.00 . A A . 14 TRP CA 1 1 6 3673 1 1 14 TRP CB C -5.255 8.374 3.764 1.00 . A A . 14 TRP CB 1 1 6 3674 1 1 14 TRP CD1 C -4.069 6.721 2.098 1.00 . A A . 14 TRP CD1 1 1 6 3675 1 1 14 TRP CD2 C -6.018 7.537 1.385 1.00 . A A . 14 TRP CD2 1 1 6 3676 1 1 14 TRP CE2 C -5.490 6.642 0.419 1.00 . A A . 14 TRP CE2 1 1 6 3677 1 1 14 TRP CE3 C -7.260 8.186 1.160 1.00 . A A . 14 TRP CE3 1 1 6 3678 1 1 14 TRP CG C -5.136 7.588 2.448 1.00 . A A . 14 TRP CG 1 1 6 3679 1 1 14 TRP CH2 C -7.425 7.036 -0.980 1.00 . A A . 14 TRP CH2 1 1 6 3680 1 1 14 TRP CZ2 C -6.206 6.387 -0.776 1.00 . A A . 14 TRP CZ2 1 1 6 3681 1 1 14 TRP CZ3 C -7.943 7.922 -0.027 1.00 . A A . 14 TRP CZ3 1 1 6 3682 1 1 14 TRP H H -4.598 10.078 6.018 1.00 . A A . 14 TRP H 1 1 6 3683 1 1 14 TRP HA H -3.125 8.781 3.643 1.00 . A A . 14 TRP HA 1 1 6 3684 1 1 14 TRP HB2 H -5.320 7.626 4.578 1.00 . A A . 14 TRP HB2 1 1 6 3685 1 1 14 TRP HB3 H -6.207 8.935 3.822 1.00 . A A . 14 TRP HB3 1 1 6 3686 1 1 14 TRP HD1 H -3.218 6.502 2.742 1.00 . A A . 14 TRP HD1 1 1 6 3687 1 1 14 TRP HE1 H -3.678 5.442 0.363 1.00 . A A . 14 TRP HE1 1 1 6 3688 1 1 14 TRP HE3 H -7.673 8.871 1.887 1.00 . A A . 14 TRP HE3 1 1 6 3689 1 1 14 TRP HH2 H -7.979 6.850 -1.889 1.00 . A A . 14 TRP HH2 1 1 6 3690 1 1 14 TRP HZ2 H -5.824 5.704 -1.521 1.00 . A A . 14 TRP HZ2 1 1 6 3691 1 1 14 TRP HZ3 H -8.889 8.409 -0.214 1.00 . A A . 14 TRP HZ3 1 1 6 3692 1 1 14 TRP N N -3.872 9.635 5.445 1.00 . A A . 14 TRP N 1 1 6 3693 1 1 14 TRP NE1 N -4.277 6.122 0.844 1.00 . A A . 14 TRP NE1 1 1 6 3694 1 1 14 TRP O O -5.129 11.448 3.507 1.00 . A A . 14 TRP O 1 1 6 3695 1 1 15 GLY C C -2.039 12.983 3.268 1.00 . A A . 15 GLY C 1 1 6 3696 1 1 15 GLY CA C -2.841 12.405 2.064 1.00 . A A . 15 GLY CA 1 1 6 3697 1 1 15 GLY H H -2.391 10.292 2.497 1.00 . A A . 15 GLY H 1 1 6 3698 1 1 15 GLY HA2 H -2.247 12.385 1.131 1.00 . A A . 15 GLY HA2 1 1 6 3699 1 1 15 GLY HA3 H -3.764 12.979 1.869 1.00 . A A . 15 GLY HA3 1 1 6 3700 1 1 15 GLY N N -3.108 11.024 2.558 1.00 . A A . 15 GLY N 1 1 6 3701 1 1 15 GLY O O -2.571 13.752 4.074 1.00 . A A . 15 GLY O 1 1 6 3702 1 1 16 GLY C C 1.310 11.852 4.559 1.00 . A A . 16 GLY C 1 1 6 3703 1 1 16 GLY CA C 0.008 12.665 4.623 1.00 . A A . 16 GLY CA 1 1 6 3704 1 1 16 GLY H H -0.511 11.860 2.651 1.00 . A A . 16 GLY H 1 1 6 3705 1 1 16 GLY HA2 H 0.030 13.628 5.164 1.00 . A A . 16 GLY HA2 1 1 6 3706 1 1 16 GLY HA3 H -0.631 12.094 5.307 1.00 . A A . 16 GLY HA3 1 1 6 3707 1 1 16 GLY N N -0.789 12.504 3.399 1.00 . A A . 16 GLY N 1 1 6 3708 1 1 16 GLY O O 1.941 11.680 3.509 1.00 . A A . 16 GLY O 1 1 6 3709 1 1 17 THR C C 2.004 8.901 5.743 1.00 . A A . 17 THR C 1 1 6 3710 1 1 17 THR CA C 2.722 10.282 5.868 1.00 . A A . 17 THR CA 1 1 6 3711 1 1 17 THR CB C 3.478 10.282 7.246 1.00 . A A . 17 THR CB 1 1 6 3712 1 1 17 THR CG2 C 4.898 9.706 7.114 1.00 . A A . 17 THR CG2 1 1 6 3713 1 1 17 THR H H 1.073 11.694 6.496 1.00 . A A . 17 THR H 1 1 6 3714 1 1 17 THR HA H 3.469 10.441 5.062 1.00 . A A . 17 THR HA 1 1 6 3715 1 1 17 THR HB H 2.946 9.614 7.960 1.00 . A A . 17 THR HB 1 1 6 3716 1 1 17 THR HG1 H 4.120 12.091 7.099 1.00 . A A . 17 THR HG1 1 1 6 3717 1 1 17 THR HG21 H 5.539 10.245 6.394 1.00 . A A . 17 THR HG21 1 1 6 3718 1 1 17 THR HG22 H 5.429 9.714 8.085 1.00 . A A . 17 THR HG22 1 1 6 3719 1 1 17 THR HG23 H 4.879 8.647 6.797 1.00 . A A . 17 THR HG23 1 1 6 3720 1 1 17 THR N N 1.656 11.319 5.738 1.00 . A A . 17 THR N 1 1 6 3721 1 1 17 THR O O 0.965 8.646 6.364 1.00 . A A . 17 THR O 1 1 6 3722 1 1 17 THR OG1 O 3.614 11.606 7.755 1.00 . A A . 17 THR OG1 1 1 6 3723 1 1 18 LYS C C 3.486 5.817 5.431 1.00 . A A . 18 LYS C 1 1 6 3724 1 1 18 LYS CA C 2.242 6.580 4.907 1.00 . A A . 18 LYS CA 1 1 6 3725 1 1 18 LYS CB C 1.815 6.115 3.482 1.00 . A A . 18 LYS CB 1 1 6 3726 1 1 18 LYS CD C 1.146 8.138 1.942 1.00 . A A . 18 LYS CD 1 1 6 3727 1 1 18 LYS CE C -0.054 8.908 1.358 1.00 . A A . 18 LYS CE 1 1 6 3728 1 1 18 LYS CG C 0.700 6.898 2.743 1.00 . A A . 18 LYS CG 1 1 6 3729 1 1 18 LYS H H 3.540 8.350 4.659 1.00 . A A . 18 LYS H 1 1 6 3730 1 1 18 LYS HA H 1.395 6.329 5.569 1.00 . A A . 18 LYS HA 1 1 6 3731 1 1 18 LYS HB2 H 2.702 5.896 2.870 1.00 . A A . 18 LYS HB2 1 1 6 3732 1 1 18 LYS HB3 H 1.393 5.101 3.617 1.00 . A A . 18 LYS HB3 1 1 6 3733 1 1 18 LYS HD2 H 1.732 8.820 2.583 1.00 . A A . 18 LYS HD2 1 1 6 3734 1 1 18 LYS HD3 H 1.831 7.824 1.131 1.00 . A A . 18 LYS HD3 1 1 6 3735 1 1 18 LYS HE2 H -0.643 8.258 0.684 1.00 . A A . 18 LYS HE2 1 1 6 3736 1 1 18 LYS HE3 H -0.741 9.219 2.167 1.00 . A A . 18 LYS HE3 1 1 6 3737 1 1 18 LYS HG2 H 0.193 6.203 2.046 1.00 . A A . 18 LYS HG2 1 1 6 3738 1 1 18 LYS HG3 H -0.080 7.183 3.475 1.00 . A A . 18 LYS HG3 1 1 6 3739 1 1 18 LYS HZ1 H -0.435 10.583 0.213 1.00 . A A . 18 LYS HZ1 1 1 6 3740 1 1 18 LYS HZ2 H 0.963 9.834 -0.181 1.00 . A A . 18 LYS HZ2 1 1 6 3741 1 1 18 LYS N N 2.616 8.019 4.954 1.00 . A A . 18 LYS N 1 1 6 3742 1 1 18 LYS NZ N 0.379 10.106 0.617 1.00 . A A . 18 LYS NZ 1 1 6 3743 1 1 18 LYS O O 4.547 6.354 5.801 1.00 . A A . 18 LYS O 1 1 6 3744 1 1 19 CYS C C 5.614 3.548 5.379 1.00 . A A . 19 CYS C 1 1 6 3745 1 1 19 CYS CA C 4.302 3.648 6.214 1.00 . A A . 19 CYS CA 1 1 6 3746 1 1 19 CYS CB C 3.714 2.254 6.568 1.00 . A A . 19 CYS CB 1 1 6 3747 1 1 19 CYS H H 2.421 4.256 5.039 1.00 . A A . 19 CYS H 1 1 6 3748 1 1 19 CYS HA H 4.436 4.212 7.172 1.00 . A A . 19 CYS HA 1 1 6 3749 1 1 19 CYS HB2 H 2.922 1.963 5.860 1.00 . A A . 19 CYS HB2 1 1 6 3750 1 1 19 CYS HB3 H 4.493 1.465 6.575 1.00 . A A . 19 CYS HB3 1 1 6 3751 1 1 19 CYS N N 3.303 4.498 5.515 1.00 . A A . 19 CYS N 1 1 6 3752 1 1 19 CYS O O 5.707 3.600 4.149 1.00 . A A . 19 CYS O 1 1 6 3753 1 1 19 CYS SG S 3.001 2.375 8.199 1.00 . A A . 19 CYS SG 1 1 6 3754 1 1 20 CYS C C 8.686 2.903 4.841 1.00 . A A . 20 CYS C 1 1 6 3755 1 1 20 CYS CA C 8.058 3.749 5.987 1.00 . A A . 20 CYS CA 1 1 6 3756 1 1 20 CYS CB C 8.814 3.445 7.296 1.00 . A A . 20 CYS CB 1 1 6 3757 1 1 20 CYS H H 6.302 3.471 7.230 1.00 . A A . 20 CYS H 1 1 6 3758 1 1 20 CYS HA H 8.059 4.821 5.832 1.00 . A A . 20 CYS HA 1 1 6 3759 1 1 20 CYS HB2 H 8.234 3.794 8.151 1.00 . A A . 20 CYS HB2 1 1 6 3760 1 1 20 CYS HB3 H 9.004 2.366 7.456 1.00 . A A . 20 CYS HB3 1 1 6 3761 1 1 20 CYS N N 6.627 3.519 6.258 1.00 . A A . 20 CYS N 1 1 6 3762 1 1 20 CYS O O 9.368 3.477 3.988 1.00 . A A . 20 CYS O 1 1 6 3763 1 1 20 CYS SG S 10.352 4.385 7.324 1.00 . A A . 20 CYS SG 1 1 6 3764 1 1 21 ARG C C 8.053 0.438 2.570 1.00 . A A . 21 ARG C 1 1 6 3765 1 1 21 ARG CA C 9.016 0.652 3.788 1.00 . A A . 21 ARG CA 1 1 6 3766 1 1 21 ARG CB C 9.346 -0.668 4.553 1.00 . A A . 21 ARG CB 1 1 6 3767 1 1 21 ARG CD C 10.692 -2.901 4.619 1.00 . A A . 21 ARG CD 1 1 6 3768 1 1 21 ARG CG C 10.255 -1.672 3.801 1.00 . A A . 21 ARG CG 1 1 6 3769 1 1 21 ARG CZ C 12.432 -3.269 6.413 1.00 . A A . 21 ARG CZ 1 1 6 3770 1 1 21 ARG H H 7.758 1.328 5.523 1.00 . A A . 21 ARG H 1 1 6 3771 1 1 21 ARG HA H 9.914 1.111 3.351 1.00 . A A . 21 ARG HA 1 1 6 3772 1 1 21 ARG HB2 H 9.862 -0.426 5.504 1.00 . A A . 21 ARG HB2 1 1 6 3773 1 1 21 ARG HB3 H 8.410 -1.178 4.856 1.00 . A A . 21 ARG HB3 1 1 6 3774 1 1 21 ARG HD2 H 9.818 -3.385 5.096 1.00 . A A . 21 ARG HD2 1 1 6 3775 1 1 21 ARG HD3 H 11.120 -3.656 3.933 1.00 . A A . 21 ARG HD3 1 1 6 3776 1 1 21 ARG HG2 H 9.730 -2.045 2.905 1.00 . A A . 21 ARG HG2 1 1 6 3777 1 1 21 ARG HG3 H 11.150 -1.156 3.410 1.00 . A A . 21 ARG HG3 1 1 6 3778 1 1 21 ARG HH11 H 11.734 -5.027 5.730 1.00 . A A . 21 ARG HH11 1 1 6 3779 1 1 21 ARG HH12 H 13.014 -5.087 7.044 1.00 . A A . 21 ARG HH12 1 1 6 3780 1 1 21 ARG HH21 H 13.270 -1.652 7.245 1.00 . A A . 21 ARG HH21 1 1 6 3781 1 1 21 ARG HH22 H 13.829 -3.293 7.847 1.00 . A A . 21 ARG HH22 1 1 6 3782 1 1 21 ARG N N 8.470 1.574 4.837 1.00 . A A . 21 ARG N 1 1 6 3783 1 1 21 ARG NE N 11.710 -2.539 5.659 1.00 . A A . 21 ARG NE 1 1 6 3784 1 1 21 ARG NH1 N 12.389 -4.598 6.394 1.00 . A A . 21 ARG NH1 1 1 6 3785 1 1 21 ARG NH2 N 13.262 -2.678 7.253 1.00 . A A . 21 ARG NH2 1 1 6 3786 1 1 21 ARG O O 7.976 -0.631 1.959 1.00 . A A . 21 ARG O 1 1 6 3787 1 1 22 GLY C C 5.121 0.719 1.298 1.00 . A A . 22 GLY C 1 1 6 3788 1 1 22 GLY CA C 6.387 1.554 1.088 1.00 . A A . 22 GLY CA 1 1 6 3789 1 1 22 GLY H H 7.485 2.212 2.958 1.00 . A A . 22 GLY H 1 1 6 3790 1 1 22 GLY HA2 H 6.118 2.607 0.880 1.00 . A A . 22 GLY HA2 1 1 6 3791 1 1 22 GLY HA3 H 6.881 1.199 0.180 1.00 . A A . 22 GLY HA3 1 1 6 3792 1 1 22 GLY N N 7.354 1.514 2.212 1.00 . A A . 22 GLY N 1 1 6 3793 1 1 22 GLY O O 4.838 -0.224 0.555 1.00 . A A . 22 GLY O 1 1 6 3794 1 1 23 ARG C C 2.032 1.253 3.115 1.00 . A A . 23 ARG C 1 1 6 3795 1 1 23 ARG CA C 3.280 0.323 2.905 1.00 . A A . 23 ARG CA 1 1 6 3796 1 1 23 ARG CB C 3.764 -0.307 4.244 1.00 . A A . 23 ARG CB 1 1 6 3797 1 1 23 ARG CD C 4.487 -2.697 3.445 1.00 . A A . 23 ARG CD 1 1 6 3798 1 1 23 ARG CG C 4.849 -1.403 4.198 1.00 . A A . 23 ARG CG 1 1 6 3799 1 1 23 ARG CZ C 6.470 -3.798 2.319 1.00 . A A . 23 ARG CZ 1 1 6 3800 1 1 23 ARG H H 4.933 1.800 2.899 1.00 . A A . 23 ARG H 1 1 6 3801 1 1 23 ARG HA H 3.000 -0.487 2.208 1.00 . A A . 23 ARG HA 1 1 6 3802 1 1 23 ARG HB2 H 4.235 0.493 4.817 1.00 . A A . 23 ARG HB2 1 1 6 3803 1 1 23 ARG HB3 H 2.925 -0.626 4.886 1.00 . A A . 23 ARG HB3 1 1 6 3804 1 1 23 ARG HD2 H 3.702 -3.245 3.993 1.00 . A A . 23 ARG HD2 1 1 6 3805 1 1 23 ARG HD3 H 4.059 -2.476 2.450 1.00 . A A . 23 ARG HD3 1 1 6 3806 1 1 23 ARG HG2 H 5.763 -0.955 3.766 1.00 . A A . 23 ARG HG2 1 1 6 3807 1 1 23 ARG HG3 H 5.127 -1.649 5.241 1.00 . A A . 23 ARG HG3 1 1 6 3808 1 1 23 ARG HH11 H 5.491 -2.622 1.015 1.00 . A A . 23 ARG HH11 1 1 6 3809 1 1 23 ARG HH12 H 6.979 -3.499 0.397 1.00 . A A . 23 ARG HH12 1 1 6 3810 1 1 23 ARG HH21 H 7.606 -5.017 3.429 1.00 . A A . 23 ARG HH21 1 1 6 3811 1 1 23 ARG HH22 H 8.100 -4.769 1.679 1.00 . A A . 23 ARG HH22 1 1 6 3812 1 1 23 ARG N N 4.408 1.107 2.351 1.00 . A A . 23 ARG N 1 1 6 3813 1 1 23 ARG NE N 5.696 -3.574 3.308 1.00 . A A . 23 ARG NE 1 1 6 3814 1 1 23 ARG NH1 N 6.296 -3.250 1.120 1.00 . A A . 23 ARG NH1 1 1 6 3815 1 1 23 ARG NH2 N 7.496 -4.610 2.493 1.00 . A A . 23 ARG NH2 1 1 6 3816 1 1 23 ARG O O 2.206 2.432 3.457 1.00 . A A . 23 ARG O 1 1 6 3817 1 1 24 PRO C C -0.885 2.208 4.307 1.00 . A A . 24 PRO C 1 1 6 3818 1 1 24 PRO CA C -0.432 1.680 2.907 1.00 . A A . 24 PRO CA 1 1 6 3819 1 1 24 PRO CB C -1.490 0.790 2.221 1.00 . A A . 24 PRO CB 1 1 6 3820 1 1 24 PRO CD C 0.451 -0.596 2.506 1.00 . A A . 24 PRO CD 1 1 6 3821 1 1 24 PRO CG C -1.070 -0.654 2.466 1.00 . A A . 24 PRO CG 1 1 6 3822 1 1 24 PRO HA H -0.228 2.576 2.286 1.00 . A A . 24 PRO HA 1 1 6 3823 1 1 24 PRO HB2 H -2.530 0.987 2.543 1.00 . A A . 24 PRO HB2 1 1 6 3824 1 1 24 PRO HB3 H -1.465 0.982 1.134 1.00 . A A . 24 PRO HB3 1 1 6 3825 1 1 24 PRO HD2 H 0.868 -1.350 3.200 1.00 . A A . 24 PRO HD2 1 1 6 3826 1 1 24 PRO HD3 H 0.867 -0.792 1.499 1.00 . A A . 24 PRO HD3 1 1 6 3827 1 1 24 PRO HG2 H -1.469 -1.024 3.428 1.00 . A A . 24 PRO HG2 1 1 6 3828 1 1 24 PRO HG3 H -1.438 -1.329 1.673 1.00 . A A . 24 PRO HG3 1 1 6 3829 1 1 24 PRO N N 0.759 0.786 2.929 1.00 . A A . 24 PRO N 1 1 6 3830 1 1 24 PRO O O -0.423 1.764 5.362 1.00 . A A . 24 PRO O 1 1 6 3831 1 1 25 CYS C C -3.891 4.076 5.128 1.00 . A A . 25 CYS C 1 1 6 3832 1 1 25 CYS CA C -2.388 3.859 5.450 1.00 . A A . 25 CYS CA 1 1 6 3833 1 1 25 CYS CB C -1.592 5.163 5.747 1.00 . A A . 25 CYS CB 1 1 6 3834 1 1 25 CYS H H -2.076 3.463 3.307 1.00 . A A . 25 CYS H 1 1 6 3835 1 1 25 CYS HA H -2.295 3.205 6.331 1.00 . A A . 25 CYS HA 1 1 6 3836 1 1 25 CYS HB2 H -0.639 4.885 6.214 1.00 . A A . 25 CYS HB2 1 1 6 3837 1 1 25 CYS HB3 H -1.337 5.645 4.804 1.00 . A A . 25 CYS HB3 1 1 6 3838 1 1 25 CYS N N -1.795 3.196 4.257 1.00 . A A . 25 CYS N 1 1 6 3839 1 1 25 CYS O O -4.276 4.552 4.058 1.00 . A A . 25 CYS O 1 1 6 3840 1 1 25 CYS SG S -2.483 6.420 6.709 1.00 . A A . 25 CYS SG 1 1 6 3841 1 1 26 ARG C C -6.707 4.109 7.370 1.00 . A A . 26 ARG C 1 1 6 3842 1 1 26 ARG CA C -6.231 3.731 5.950 1.00 . A A . 26 ARG CA 1 1 6 3843 1 1 26 ARG CB C -6.853 2.385 5.482 1.00 . A A . 26 ARG CB 1 1 6 3844 1 1 26 ARG CD C -7.126 0.660 3.567 1.00 . A A . 26 ARG CD 1 1 6 3845 1 1 26 ARG CG C -6.434 1.946 4.060 1.00 . A A . 26 ARG CG 1 1 6 3846 1 1 26 ARG CZ C -5.632 -0.527 1.926 1.00 . A A . 26 ARG CZ 1 1 6 3847 1 1 26 ARG H H -4.329 3.421 6.980 1.00 . A A . 26 ARG H 1 1 6 3848 1 1 26 ARG HA H -6.514 4.517 5.219 1.00 . A A . 26 ARG HA 1 1 6 3849 1 1 26 ARG HB2 H -6.622 1.584 6.207 1.00 . A A . 26 ARG HB2 1 1 6 3850 1 1 26 ARG HB3 H -7.955 2.481 5.505 1.00 . A A . 26 ARG HB3 1 1 6 3851 1 1 26 ARG HD2 H -6.974 -0.170 4.283 1.00 . A A . 26 ARG HD2 1 1 6 3852 1 1 26 ARG HD3 H -8.219 0.819 3.535 1.00 . A A . 26 ARG HD3 1 1 6 3853 1 1 26 ARG HG2 H -6.636 2.770 3.349 1.00 . A A . 26 ARG HG2 1 1 6 3854 1 1 26 ARG HG3 H -5.338 1.793 4.036 1.00 . A A . 26 ARG HG3 1 1 6 3855 1 1 26 ARG HH11 H -5.138 -0.952 3.829 1.00 . A A . 26 ARG HH11 1 1 6 3856 1 1 26 ARG HH12 H -4.126 -1.727 2.509 1.00 . A A . 26 ARG HH12 1 1 6 3857 1 1 26 ARG HH21 H -5.918 -0.263 -0.035 1.00 . A A . 26 ARG HH21 1 1 6 3858 1 1 26 ARG HH22 H -4.539 -1.361 0.473 1.00 . A A . 26 ARG HH22 1 1 6 3859 1 1 26 ARG N N -4.749 3.672 6.074 1.00 . A A . 26 ARG N 1 1 6 3860 1 1 26 ARG NE N -6.669 0.288 2.204 1.00 . A A . 26 ARG NE 1 1 6 3861 1 1 26 ARG NH1 N -4.888 -1.131 2.850 1.00 . A A . 26 ARG NH1 1 1 6 3862 1 1 26 ARG NH2 N -5.332 -0.738 0.660 1.00 . A A . 26 ARG NH2 1 1 6 3863 1 1 26 ARG O O -6.199 3.606 8.387 1.00 . A A . 26 ARG O 1 1 6 3864 1 1 27 CYS C C -8.785 4.699 9.731 1.00 . A A . 27 CYS C 1 1 6 3865 1 1 27 CYS CA C -7.994 5.649 8.763 1.00 . A A . 27 CYS CA 1 1 6 3866 1 1 27 CYS CB C -8.816 6.932 8.491 1.00 . A A . 27 CYS CB 1 1 6 3867 1 1 27 CYS H H -8.017 5.412 6.565 1.00 . A A . 27 CYS H 1 1 6 3868 1 1 27 CYS HA H -7.020 5.930 9.169 1.00 . A A . 27 CYS HA 1 1 6 3869 1 1 27 CYS HB2 H -9.802 6.653 8.193 1.00 . A A . 27 CYS HB2 1 1 6 3870 1 1 27 CYS HB3 H -9.053 7.498 9.412 1.00 . A A . 27 CYS HB3 1 1 6 3871 1 1 27 CYS N N -7.676 5.036 7.457 1.00 . A A . 27 CYS N 1 1 6 3872 1 1 27 CYS O O -9.041 3.515 9.489 1.00 . A A . 27 CYS O 1 1 6 3873 1 1 27 CYS SG S -7.987 8.088 7.400 1.00 . A A . 27 CYS SG 1 1 6 3874 1 1 28 SER C C -11.426 4.568 11.593 1.00 . A A . 28 SER C 1 1 6 3875 1 1 28 SER CA C -9.914 4.699 11.972 1.00 . A A . 28 SER CA 1 1 6 3876 1 1 28 SER CB C -9.604 5.580 13.229 1.00 . A A . 28 SER CB 1 1 6 3877 1 1 28 SER H H -8.944 6.319 10.736 1.00 . A A . 28 SER H 1 1 6 3878 1 1 28 SER HA H -9.591 3.673 12.205 1.00 . A A . 28 SER HA 1 1 6 3879 1 1 28 SER HB2 H -8.534 5.845 13.300 1.00 . A A . 28 SER HB2 1 1 6 3880 1 1 28 SER HB3 H -10.137 6.546 13.247 1.00 . A A . 28 SER HB3 1 1 6 3881 1 1 28 SER HG H -9.396 4.075 14.408 1.00 . A A . 28 SER HG 1 1 6 3882 1 1 28 SER N N -9.134 5.317 10.867 1.00 . A A . 28 SER N 1 1 6 3883 1 1 28 SER O O -11.834 4.584 10.425 1.00 . A A . 28 SER O 1 1 6 3884 1 1 28 SER OG O -9.928 4.874 14.421 1.00 . A A . 28 SER OG 1 1 6 3885 1 1 29 MET C C -14.543 5.149 11.953 1.00 . A A . 29 MET C 1 1 6 3886 1 1 29 MET CA C -13.681 3.975 12.511 1.00 . A A . 29 MET CA 1 1 6 3887 1 1 29 MET CB C -14.151 3.542 13.933 1.00 . A A . 29 MET CB 1 1 6 3888 1 1 29 MET CE C -18.230 2.608 13.725 1.00 . A A . 29 MET CE 1 1 6 3889 1 1 29 MET CG C -15.465 2.741 13.982 1.00 . A A . 29 MET CG 1 1 6 3890 1 1 29 MET H H -11.718 4.483 13.500 1.00 . A A . 29 MET H 1 1 6 3891 1 1 29 MET HA H -13.780 3.124 11.808 1.00 . A A . 29 MET HA 1 1 6 3892 1 1 29 MET HB2 H -13.372 2.913 14.398 1.00 . A A . 29 MET HB2 1 1 6 3893 1 1 29 MET HB3 H -14.230 4.414 14.610 1.00 . A A . 29 MET HB3 1 1 6 3894 1 1 29 MET HE1 H -18.093 1.801 12.982 1.00 . A A . 29 MET HE1 1 1 6 3895 1 1 29 MET HE2 H -18.284 2.150 14.729 1.00 . A A . 29 MET HE2 1 1 6 3896 1 1 29 MET HE3 H -19.198 3.100 13.521 1.00 . A A . 29 MET HE3 1 1 6 3897 1 1 29 MET HG2 H -15.439 1.896 13.270 1.00 . A A . 29 MET HG2 1 1 6 3898 1 1 29 MET HG3 H -15.596 2.299 14.987 1.00 . A A . 29 MET HG3 1 1 6 3899 1 1 29 MET N N -12.238 4.348 12.627 1.00 . A A . 29 MET N 1 1 6 3900 1 1 29 MET O O -15.288 4.964 10.987 1.00 . A A . 29 MET O 1 1 6 3901 1 1 29 MET SD S -16.883 3.804 13.632 1.00 . A A . 29 MET SD 1 1 6 3902 1 1 30 ILE C C -14.132 8.201 10.800 1.00 . A A . 30 ILE C 1 1 6 3903 1 1 30 ILE CA C -14.975 7.611 12.006 1.00 . A A . 30 ILE CA 1 1 6 3904 1 1 30 ILE CB C -15.110 8.591 13.248 1.00 . A A . 30 ILE CB 1 1 6 3905 1 1 30 ILE CD1 C -17.379 9.680 12.525 1.00 . A A . 30 ILE CD1 1 1 6 3906 1 1 30 ILE CG1 C -15.896 9.886 12.873 1.00 . A A . 30 ILE CG1 1 1 6 3907 1 1 30 ILE CG2 C -13.731 9.050 13.806 1.00 . A A . 30 ILE CG2 1 1 6 3908 1 1 30 ILE H H -13.642 6.287 13.259 1.00 . A A . 30 ILE H 1 1 6 3909 1 1 30 ILE HA H -15.972 7.397 11.585 1.00 . A A . 30 ILE HA 1 1 6 3910 1 1 30 ILE HB H -15.656 8.080 14.065 1.00 . A A . 30 ILE HB 1 1 6 3911 1 1 30 ILE HD11 H -17.921 9.159 13.336 1.00 . A A . 30 ILE HD11 1 1 6 3912 1 1 30 ILE HD12 H -17.885 10.649 12.364 1.00 . A A . 30 ILE HD12 1 1 6 3913 1 1 30 ILE HD13 H -17.511 9.091 11.600 1.00 . A A . 30 ILE HD13 1 1 6 3914 1 1 30 ILE HG12 H -15.867 10.591 13.726 1.00 . A A . 30 ILE HG12 1 1 6 3915 1 1 30 ILE HG13 H -15.400 10.427 12.046 1.00 . A A . 30 ILE HG13 1 1 6 3916 1 1 30 ILE HG21 H -13.087 8.197 14.088 1.00 . A A . 30 ILE HG21 1 1 6 3917 1 1 30 ILE HG22 H -13.166 9.659 13.080 1.00 . A A . 30 ILE HG22 1 1 6 3918 1 1 30 ILE HG23 H -13.846 9.665 14.718 1.00 . A A . 30 ILE HG23 1 1 6 3919 1 1 30 ILE N N -14.394 6.341 12.552 1.00 . A A . 30 ILE N 1 1 6 3920 1 1 30 ILE O O -14.724 8.858 9.938 1.00 . A A . 30 ILE O 1 1 6 3921 1 1 31 GLY C C -10.884 9.614 10.191 1.00 . A A . 31 GLY C 1 1 6 3922 1 1 31 GLY CA C -11.911 8.568 9.703 1.00 . A A . 31 GLY CA 1 1 6 3923 1 1 31 GLY H H -12.435 7.496 11.555 1.00 . A A . 31 GLY H 1 1 6 3924 1 1 31 GLY HA2 H -11.340 7.712 9.315 1.00 . A A . 31 GLY HA2 1 1 6 3925 1 1 31 GLY HA3 H -12.410 8.929 8.799 1.00 . A A . 31 GLY HA3 1 1 6 3926 1 1 31 GLY N N -12.806 7.978 10.731 1.00 . A A . 31 GLY N 1 1 6 3927 1 1 31 GLY O O -9.859 9.795 9.531 1.00 . A A . 31 GLY O 1 1 6 3928 1 1 32 THR C C -9.207 10.100 12.856 1.00 . A A . 32 THR C 1 1 6 3929 1 1 32 THR CA C -10.079 11.098 12.018 1.00 . A A . 32 THR CA 1 1 6 3930 1 1 32 THR CB C -10.693 12.191 12.949 1.00 . A A . 32 THR CB 1 1 6 3931 1 1 32 THR CG2 C -11.489 13.253 12.167 1.00 . A A . 32 THR CG2 1 1 6 3932 1 1 32 THR H H -11.974 9.972 11.823 1.00 . A A . 32 THR H 1 1 6 3933 1 1 32 THR HA H -9.449 11.606 11.261 1.00 . A A . 32 THR HA 1 1 6 3934 1 1 32 THR HB H -9.852 12.681 13.478 1.00 . A A . 32 THR HB 1 1 6 3935 1 1 32 THR HG1 H -12.286 11.200 13.384 1.00 . A A . 32 THR HG1 1 1 6 3936 1 1 32 THR HG21 H -10.863 13.752 11.404 1.00 . A A . 32 THR HG21 1 1 6 3937 1 1 32 THR HG22 H -12.365 12.822 11.647 1.00 . A A . 32 THR HG22 1 1 6 3938 1 1 32 THR HG23 H -11.868 14.044 12.841 1.00 . A A . 32 THR HG23 1 1 6 3939 1 1 32 THR N N -11.122 10.276 11.339 1.00 . A A . 32 THR N 1 1 6 3940 1 1 32 THR O O -9.598 8.959 13.121 1.00 . A A . 32 THR O 1 1 6 3941 1 1 32 THR OG1 O -11.587 11.610 13.897 1.00 . A A . 32 THR OG1 1 1 6 3942 1 1 33 ASN C C -6.556 8.481 12.902 1.00 . A A . 33 ASN C 1 1 6 3943 1 1 33 ASN CA C -6.906 9.687 13.835 1.00 . A A . 33 ASN CA 1 1 6 3944 1 1 33 ASN CB C -7.325 9.235 15.289 1.00 . A A . 33 ASN CB 1 1 6 3945 1 1 33 ASN CG C -8.381 8.164 15.669 1.00 . A A . 33 ASN CG 1 1 6 3946 1 1 33 ASN H H -7.744 11.430 12.797 1.00 . A A . 33 ASN H 1 1 6 3947 1 1 33 ASN HA H -5.989 10.300 13.895 1.00 . A A . 33 ASN HA 1 1 6 3948 1 1 33 ASN HB2 H -6.388 8.933 15.782 1.00 . A A . 33 ASN HB2 1 1 6 3949 1 1 33 ASN HB3 H -7.638 10.134 15.835 1.00 . A A . 33 ASN HB3 1 1 6 3950 1 1 33 ASN HD21 H -6.951 6.779 15.917 1.00 . A A . 33 ASN HD21 1 1 6 3951 1 1 33 ASN HD22 H -8.679 6.273 16.271 1.00 . A A . 33 ASN HD22 1 1 6 3952 1 1 33 ASN N N -7.989 10.532 13.225 1.00 . A A . 33 ASN N 1 1 6 3953 1 1 33 ASN ND2 N -7.961 6.947 15.984 1.00 . A A . 33 ASN ND2 1 1 6 3954 1 1 33 ASN O O -6.606 7.315 13.304 1.00 . A A . 33 ASN O 1 1 6 3955 1 1 33 ASN OD1 O -9.575 8.443 15.776 1.00 . A A . 33 ASN OD1 1 1 6 3956 1 1 34 CYS C C -4.679 6.821 11.041 1.00 . A A . 34 CYS C 1 1 6 3957 1 1 34 CYS CA C -5.894 7.716 10.628 1.00 . A A . 34 CYS CA 1 1 6 3958 1 1 34 CYS CB C -5.592 8.306 9.238 1.00 . A A . 34 CYS CB 1 1 6 3959 1 1 34 CYS H H -6.247 9.782 11.433 1.00 . A A . 34 CYS H 1 1 6 3960 1 1 34 CYS HA H -6.829 7.148 10.555 1.00 . A A . 34 CYS HA 1 1 6 3961 1 1 34 CYS HB2 H -4.673 8.867 9.280 1.00 . A A . 34 CYS HB2 1 1 6 3962 1 1 34 CYS HB3 H -5.417 7.491 8.510 1.00 . A A . 34 CYS HB3 1 1 6 3963 1 1 34 CYS N N -6.140 8.780 11.647 1.00 . A A . 34 CYS N 1 1 6 3964 1 1 34 CYS O O -3.786 7.296 11.752 1.00 . A A . 34 CYS O 1 1 6 3965 1 1 34 CYS SG S -6.962 9.285 8.619 1.00 . A A . 34 CYS SG 1 1 6 3966 1 1 35 GLU C C -2.965 3.831 9.803 1.00 . A A . 35 GLU C 1 1 6 3967 1 1 35 GLU CA C -3.535 4.614 11.035 1.00 . A A . 35 GLU CA 1 1 6 3968 1 1 35 GLU CB C -4.011 3.585 12.110 1.00 . A A . 35 GLU CB 1 1 6 3969 1 1 35 GLU CD C -5.266 2.912 14.228 1.00 . A A . 35 GLU CD 1 1 6 3970 1 1 35 GLU CG C -4.963 4.039 13.239 1.00 . A A . 35 GLU CG 1 1 6 3971 1 1 35 GLU H H -5.385 5.296 9.931 1.00 . A A . 35 GLU H 1 1 6 3972 1 1 35 GLU HA H -2.706 5.206 11.466 1.00 . A A . 35 GLU HA 1 1 6 3973 1 1 35 GLU HB2 H -4.368 2.668 11.612 1.00 . A A . 35 GLU HB2 1 1 6 3974 1 1 35 GLU HB3 H -3.090 3.234 12.612 1.00 . A A . 35 GLU HB3 1 1 6 3975 1 1 35 GLU HE2 H -4.476 2.063 15.792 1.00 . A A . 35 GLU HE2 1 1 6 3976 1 1 35 GLU HG2 H -4.524 4.902 13.776 1.00 . A A . 35 GLU HG2 1 1 6 3977 1 1 35 GLU HG3 H -5.915 4.406 12.813 1.00 . A A . 35 GLU HG3 1 1 6 3978 1 1 35 GLU N N -4.653 5.533 10.623 1.00 . A A . 35 GLU N 1 1 6 3979 1 1 35 GLU O O -3.446 3.932 8.674 1.00 . A A . 35 GLU O 1 1 6 3980 1 1 35 GLU OE1 O -6.275 2.210 14.167 1.00 . A A . 35 GLU OE1 1 1 6 3981 1 1 35 GLU OE2 O -4.284 2.774 15.176 1.00 . A A . 35 GLU OE2 1 1 6 3982 1 1 36 CYS C C -1.882 0.872 8.869 1.00 . A A . 36 CYS C 1 1 6 3983 1 1 36 CYS CA C -1.187 2.261 8.997 1.00 . A A . 36 CYS CA 1 1 6 3984 1 1 36 CYS CB C 0.331 2.123 9.344 1.00 . A A . 36 CYS CB 1 1 6 3985 1 1 36 CYS H H -1.743 2.951 11.059 1.00 . A A . 36 CYS H 1 1 6 3986 1 1 36 CYS HA H -1.240 2.824 8.032 1.00 . A A . 36 CYS HA 1 1 6 3987 1 1 36 CYS HB2 H 0.561 2.267 10.413 1.00 . A A . 36 CYS HB2 1 1 6 3988 1 1 36 CYS HB3 H 0.746 1.106 9.177 1.00 . A A . 36 CYS HB3 1 1 6 3989 1 1 36 CYS N N -1.900 3.045 10.048 1.00 . A A . 36 CYS N 1 1 6 3990 1 1 36 CYS O O -2.567 0.374 9.772 1.00 . A A . 36 CYS O 1 1 6 3991 1 1 36 CYS SG S 1.229 3.231 8.276 1.00 . A A . 36 CYS SG 1 1 6 3992 1 1 37 THR C C -1.134 -1.982 6.834 1.00 . A A . 37 THR C 1 1 6 3993 1 1 37 THR CA C -2.292 -1.075 7.377 1.00 . A A . 37 THR CA 1 1 6 3994 1 1 37 THR CB C -3.435 -0.981 6.314 1.00 . A A . 37 THR CB 1 1 6 3995 1 1 37 THR CG2 C -4.729 -0.423 6.929 1.00 . A A . 37 THR CG2 1 1 6 3996 1 1 37 THR H H -1.136 0.775 7.016 1.00 . A A . 37 THR H 1 1 6 3997 1 1 37 THR HA H -2.726 -1.524 8.289 1.00 . A A . 37 THR HA 1 1 6 3998 1 1 37 THR HB H -3.636 -1.999 5.930 1.00 . A A . 37 THR HB 1 1 6 3999 1 1 37 THR HG1 H -2.277 -0.500 4.852 1.00 . A A . 37 THR HG1 1 1 6 4000 1 1 37 THR HG21 H -5.062 -1.020 7.799 1.00 . A A . 37 THR HG21 1 1 6 4001 1 1 37 THR HG22 H -4.613 0.624 7.269 1.00 . A A . 37 THR HG22 1 1 6 4002 1 1 37 THR HG23 H -5.552 -0.445 6.194 1.00 . A A . 37 THR HG23 1 1 6 4003 1 1 37 THR N N -1.714 0.262 7.691 1.00 . A A . 37 THR N 1 1 6 4004 1 1 37 THR O O -0.411 -1.531 5.936 1.00 . A A . 37 THR O 1 1 6 4005 1 1 37 THR OG1 O -3.070 -0.120 5.237 1.00 . A A . 37 THR OG1 1 1 6 4006 1 1 38 PRO C C 0.283 -4.269 5.256 1.00 . A A . 38 PRO C 1 1 6 4007 1 1 38 PRO CA C 0.083 -4.216 6.804 1.00 . A A . 38 PRO CA 1 1 6 4008 1 1 38 PRO CB C -0.408 -5.551 7.411 1.00 . A A . 38 PRO CB 1 1 6 4009 1 1 38 PRO CD C -1.654 -3.793 8.491 1.00 . A A . 38 PRO CD 1 1 6 4010 1 1 38 PRO CG C -1.059 -5.177 8.739 1.00 . A A . 38 PRO CG 1 1 6 4011 1 1 38 PRO HA H 1.068 -3.949 7.212 1.00 . A A . 38 PRO HA 1 1 6 4012 1 1 38 PRO HB2 H -1.163 -6.049 6.771 1.00 . A A . 38 PRO HB2 1 1 6 4013 1 1 38 PRO HB3 H 0.415 -6.275 7.550 1.00 . A A . 38 PRO HB3 1 1 6 4014 1 1 38 PRO HD2 H -2.736 -3.840 8.303 1.00 . A A . 38 PRO HD2 1 1 6 4015 1 1 38 PRO HD3 H -1.528 -3.142 9.374 1.00 . A A . 38 PRO HD3 1 1 6 4016 1 1 38 PRO HG2 H -1.820 -5.913 9.060 1.00 . A A . 38 PRO HG2 1 1 6 4017 1 1 38 PRO HG3 H -0.298 -5.135 9.539 1.00 . A A . 38 PRO HG3 1 1 6 4018 1 1 38 PRO N N -0.947 -3.259 7.309 1.00 . A A . 38 PRO N 1 1 6 4019 1 1 38 PRO O O 1.350 -3.857 4.792 1.00 . A A . 38 PRO O 1 1 6 4020 1 1 39 ARG C C -2.147 -4.569 2.453 1.00 . A A . 39 ARG C 1 1 6 4021 1 1 39 ARG CA C -0.684 -4.578 2.990 1.00 . A A . 39 ARG CA 1 1 6 4022 1 1 39 ARG CB C 0.189 -5.732 2.393 1.00 . A A . 39 ARG CB 1 1 6 4023 1 1 39 ARG CD C 1.445 -6.582 0.269 1.00 . A A . 39 ARG CD 1 1 6 4024 1 1 39 ARG CG C 0.481 -5.551 0.885 1.00 . A A . 39 ARG CG 1 1 6 4025 1 1 39 ARG CZ C 3.894 -7.119 0.286 1.00 . A A . 39 ARG CZ 1 1 6 4026 1 1 39 ARG H H -1.553 -4.983 4.999 1.00 . A A . 39 ARG H 1 1 6 4027 1 1 39 ARG HA H -0.235 -3.610 2.711 1.00 . A A . 39 ARG HA 1 1 6 4028 1 1 39 ARG HB2 H 1.161 -5.768 2.922 1.00 . A A . 39 ARG HB2 1 1 6 4029 1 1 39 ARG HB3 H -0.270 -6.722 2.575 1.00 . A A . 39 ARG HB3 1 1 6 4030 1 1 39 ARG HD2 H 1.104 -7.609 0.503 1.00 . A A . 39 ARG HD2 1 1 6 4031 1 1 39 ARG HD3 H 1.400 -6.492 -0.833 1.00 . A A . 39 ARG HD3 1 1 6 4032 1 1 39 ARG HG2 H -0.473 -5.597 0.327 1.00 . A A . 39 ARG HG2 1 1 6 4033 1 1 39 ARG HG3 H 0.867 -4.530 0.706 1.00 . A A . 39 ARG HG3 1 1 6 4034 1 1 39 ARG HH11 H 2.860 -8.301 -0.972 1.00 . A A . 39 ARG HH11 1 1 6 4035 1 1 39 ARG HH12 H 4.669 -8.587 -0.852 1.00 . A A . 39 ARG HH12 1 1 6 4036 1 1 39 ARG HH21 H 5.138 -6.081 1.462 1.00 . A A . 39 ARG HH21 1 1 6 4037 1 1 39 ARG HH22 H 5.868 -7.413 0.433 1.00 . A A . 39 ARG HH22 1 1 6 4038 1 1 39 ARG N N -0.721 -4.705 4.471 1.00 . A A . 39 ARG N 1 1 6 4039 1 1 39 ARG NE N 2.848 -6.389 0.717 1.00 . A A . 39 ARG NE 1 1 6 4040 1 1 39 ARG NH1 N 3.798 -8.104 -0.605 1.00 . A A . 39 ARG NH1 1 1 6 4041 1 1 39 ARG NH2 N 5.088 -6.843 0.776 1.00 . A A . 39 ARG NH2 1 1 6 4042 1 1 39 ARG O O -2.625 -3.488 2.105 1.00 . A A . 39 ARG O 1 1 6 4043 1 1 40 LEU C C -3.888 -5.771 0.116 1.00 . A A . 40 LEU C 1 1 6 4044 1 1 40 LEU CA C -4.147 -5.948 1.656 1.00 . A A . 40 LEU CA 1 1 6 4045 1 1 40 LEU CB C -5.252 -5.000 2.250 1.00 . A A . 40 LEU CB 1 1 6 4046 1 1 40 LEU CD1 C -7.277 -6.606 2.275 1.00 . A A . 40 LEU CD1 1 1 6 4047 1 1 40 LEU CD2 C -7.638 -4.108 2.205 1.00 . A A . 40 LEU CD2 1 1 6 4048 1 1 40 LEU CG C -6.709 -5.262 1.775 1.00 . A A . 40 LEU CG 1 1 6 4049 1 1 40 LEU H H -2.268 -6.532 2.673 1.00 . A A . 40 LEU H 1 1 6 4050 1 1 40 LEU HA H -4.443 -6.998 1.809 1.00 . A A . 40 LEU HA 1 1 6 4051 1 1 40 LEU HB2 H -5.228 -5.058 3.356 1.00 . A A . 40 LEU HB2 1 1 6 4052 1 1 40 LEU HB3 H -5.003 -3.946 2.026 1.00 . A A . 40 LEU HB3 1 1 6 4053 1 1 40 LEU HD11 H -7.286 -6.668 3.380 1.00 . A A . 40 LEU HD11 1 1 6 4054 1 1 40 LEU HD12 H -8.316 -6.765 1.929 1.00 . A A . 40 LEU HD12 1 1 6 4055 1 1 40 LEU HD13 H -6.691 -7.465 1.903 1.00 . A A . 40 LEU HD13 1 1 6 4056 1 1 40 LEU HD21 H -7.298 -3.139 1.796 1.00 . A A . 40 LEU HD21 1 1 6 4057 1 1 40 LEU HD22 H -8.672 -4.257 1.843 1.00 . A A . 40 LEU HD22 1 1 6 4058 1 1 40 LEU HD23 H -7.687 -4.000 3.305 1.00 . A A . 40 LEU HD23 1 1 6 4059 1 1 40 LEU HG H -6.717 -5.283 0.669 1.00 . A A . 40 LEU HG 1 1 6 4060 1 1 40 LEU N N -2.831 -5.738 2.353 1.00 . A A . 40 LEU N 1 1 6 4061 1 1 40 LEU O O -3.578 -6.767 -0.546 1.00 . A A . 40 LEU O 1 1 6 4062 1 1 41 ILE C C -2.297 -3.016 -1.396 1.00 . A A . 41 ILE C 1 1 6 4063 1 1 41 ILE CA C -3.283 -4.183 -1.724 1.00 . A A . 41 ILE CA 1 1 6 4064 1 1 41 ILE CB C -4.313 -3.760 -2.850 1.00 . A A . 41 ILE CB 1 1 6 4065 1 1 41 ILE CD1 C -6.216 -2.078 -3.515 1.00 . A A . 41 ILE CD1 1 1 6 4066 1 1 41 ILE CG1 C -5.363 -2.692 -2.394 1.00 . A A . 41 ILE CG1 1 1 6 4067 1 1 41 ILE CG2 C -5.053 -5.041 -3.322 1.00 . A A . 41 ILE CG2 1 1 6 4068 1 1 41 ILE H H -4.229 -3.824 0.243 1.00 . A A . 41 ILE H 1 1 6 4069 1 1 41 ILE HA H -2.702 -5.049 -2.105 1.00 . A A . 41 ILE HA 1 1 6 4070 1 1 41 ILE HB H -3.760 -3.328 -3.706 1.00 . A A . 41 ILE HB 1 1 6 4071 1 1 41 ILE HD11 H -5.588 -1.621 -4.302 1.00 . A A . 41 ILE HD11 1 1 6 4072 1 1 41 ILE HD12 H -6.869 -2.827 -3.999 1.00 . A A . 41 ILE HD12 1 1 6 4073 1 1 41 ILE HD13 H -6.875 -1.283 -3.120 1.00 . A A . 41 ILE HD13 1 1 6 4074 1 1 41 ILE HG12 H -6.031 -3.103 -1.613 1.00 . A A . 41 ILE HG12 1 1 6 4075 1 1 41 ILE HG13 H -4.840 -1.850 -1.909 1.00 . A A . 41 ILE HG13 1 1 6 4076 1 1 41 ILE HG21 H -4.345 -5.824 -3.651 1.00 . A A . 41 ILE HG21 1 1 6 4077 1 1 41 ILE HG22 H -5.685 -5.485 -2.529 1.00 . A A . 41 ILE HG22 1 1 6 4078 1 1 41 ILE HG23 H -5.711 -4.842 -4.188 1.00 . A A . 41 ILE HG23 1 1 6 4079 1 1 41 ILE N N -3.944 -4.542 -0.431 1.00 . A A . 41 ILE N 1 1 6 4080 1 1 41 ILE O O -2.647 -2.038 -0.722 1.00 . A A . 41 ILE O 1 1 6 4081 1 1 42 MET C C -0.065 -0.888 -2.340 1.00 . A A . 42 MET C 1 1 6 4082 1 1 42 MET CA C 0.050 -2.195 -1.497 1.00 . A A . 42 MET CA 1 1 6 4083 1 1 42 MET CB C 1.427 -2.871 -1.754 1.00 . A A . 42 MET CB 1 1 6 4084 1 1 42 MET CE C 4.800 -1.811 -2.704 1.00 . A A . 42 MET CE 1 1 6 4085 1 1 42 MET CG C 2.597 -2.191 -1.017 1.00 . A A . 42 MET CG 1 1 6 4086 1 1 42 MET H H -0.860 -3.991 -2.410 1.00 . A A . 42 MET H 1 1 6 4087 1 1 42 MET HA H -0.035 -1.958 -0.415 1.00 . A A . 42 MET HA 1 1 6 4088 1 1 42 MET HB2 H 1.410 -3.928 -1.431 1.00 . A A . 42 MET HB2 1 1 6 4089 1 1 42 MET HB3 H 1.649 -2.917 -2.837 1.00 . A A . 42 MET HB3 1 1 6 4090 1 1 42 MET HE1 H 4.097 -1.694 -3.549 1.00 . A A . 42 MET HE1 1 1 6 4091 1 1 42 MET HE2 H 4.965 -0.816 -2.251 1.00 . A A . 42 MET HE2 1 1 6 4092 1 1 42 MET HE3 H 5.766 -2.166 -3.106 1.00 . A A . 42 MET HE3 1 1 6 4093 1 1 42 MET HG2 H 2.637 -1.106 -1.233 1.00 . A A . 42 MET HG2 1 1 6 4094 1 1 42 MET HG3 H 2.468 -2.282 0.077 1.00 . A A . 42 MET HG3 1 1 6 4095 1 1 42 MET N N -1.040 -3.138 -1.869 1.00 . A A . 42 MET N 1 1 6 4096 1 1 42 MET O O -0.020 -0.924 -3.575 1.00 . A A . 42 MET O 1 1 6 4097 1 1 42 MET SD S 4.157 -2.973 -1.482 1.00 . A A . 42 MET SD 1 1 6 4098 1 1 43 GLU C C 0.922 2.423 -1.406 1.00 . A A . 43 GLU C 1 1 6 4099 1 1 43 GLU CA C -0.073 1.598 -2.275 1.00 . A A . 43 GLU CA 1 1 6 4100 1 1 43 GLU CB C -1.474 2.274 -2.388 1.00 . A A . 43 GLU CB 1 1 6 4101 1 1 43 GLU CD C -3.708 3.120 -1.416 1.00 . A A . 43 GLU CD 1 1 6 4102 1 1 43 GLU CG C -2.379 2.415 -1.137 1.00 . A A . 43 GLU CG 1 1 6 4103 1 1 43 GLU H H -0.204 0.139 -0.625 1.00 . A A . 43 GLU H 1 1 6 4104 1 1 43 GLU HA H 0.326 1.518 -3.308 1.00 . A A . 43 GLU HA 1 1 6 4105 1 1 43 GLU HB2 H -1.326 3.277 -2.833 1.00 . A A . 43 GLU HB2 1 1 6 4106 1 1 43 GLU HB3 H -2.047 1.722 -3.158 1.00 . A A . 43 GLU HB3 1 1 6 4107 1 1 43 GLU HE2 H -4.369 4.864 -1.973 1.00 . A A . 43 GLU HE2 1 1 6 4108 1 1 43 GLU HG2 H -2.598 1.411 -0.729 1.00 . A A . 43 GLU HG2 1 1 6 4109 1 1 43 GLU HG3 H -1.855 2.963 -0.334 1.00 . A A . 43 GLU HG3 1 1 6 4110 1 1 43 GLU N N -0.181 0.256 -1.644 1.00 . A A . 43 GLU N 1 1 6 4111 1 1 43 GLU O O 0.666 2.742 -0.239 1.00 . A A . 43 GLU O 1 1 6 4112 1 1 43 GLU OE1 O -4.804 2.573 -1.297 1.00 . A A . 43 GLU OE1 1 1 6 4113 1 1 43 GLU OE2 O -3.533 4.424 -1.802 1.00 . A A . 43 GLU OE2 1 1 6 4114 1 1 44 GLY C C 4.468 3.377 -2.162 1.00 . A A . 44 GLY C 1 1 6 4115 1 1 44 GLY CA C 3.202 3.382 -1.289 1.00 . A A . 44 GLY CA 1 1 6 4116 1 1 44 GLY H H 2.182 2.389 -2.966 1.00 . A A . 44 GLY H 1 1 6 4117 1 1 44 GLY HA2 H 2.922 4.425 -1.047 1.00 . A A . 44 GLY HA2 1 1 6 4118 1 1 44 GLY HA3 H 3.394 2.889 -0.314 1.00 . A A . 44 GLY HA3 1 1 6 4119 1 1 44 GLY N N 2.089 2.721 -1.999 1.00 . A A . 44 GLY N 1 1 6 4120 1 1 44 GLY O O 4.724 4.349 -2.878 1.00 . A A . 44 GLY O 1 1 6 4121 1 1 45 LEU C C 7.565 3.146 -2.554 1.00 . A A . 45 LEU C 1 1 6 4122 1 1 45 LEU CA C 6.511 2.021 -2.845 1.00 . A A . 45 LEU CA 1 1 6 4123 1 1 45 LEU CB C 6.177 1.908 -4.371 1.00 . A A . 45 LEU CB 1 1 6 4124 1 1 45 LEU CD1 C 7.726 -0.061 -5.021 1.00 . A A . 45 LEU CD1 1 1 6 4125 1 1 45 LEU CD2 C 6.933 1.567 -6.780 1.00 . A A . 45 LEU CD2 1 1 6 4126 1 1 45 LEU CG C 7.321 1.403 -5.297 1.00 . A A . 45 LEU CG 1 1 6 4127 1 1 45 LEU H H 4.878 1.563 -1.438 1.00 . A A . 45 LEU H 1 1 6 4128 1 1 45 LEU HA H 6.935 1.063 -2.487 1.00 . A A . 45 LEU HA 1 1 6 4129 1 1 45 LEU HB2 H 5.308 1.234 -4.506 1.00 . A A . 45 LEU HB2 1 1 6 4130 1 1 45 LEU HB3 H 5.823 2.890 -4.741 1.00 . A A . 45 LEU HB3 1 1 6 4131 1 1 45 LEU HD11 H 6.878 -0.759 -5.154 1.00 . A A . 45 LEU HD11 1 1 6 4132 1 1 45 LEU HD12 H 8.535 -0.395 -5.697 1.00 . A A . 45 LEU HD12 1 1 6 4133 1 1 45 LEU HD13 H 8.104 -0.196 -3.992 1.00 . A A . 45 LEU HD13 1 1 6 4134 1 1 45 LEU HD21 H 6.699 2.620 -7.025 1.00 . A A . 45 LEU HD21 1 1 6 4135 1 1 45 LEU HD22 H 7.754 1.260 -7.454 1.00 . A A . 45 LEU HD22 1 1 6 4136 1 1 45 LEU HD23 H 6.045 0.963 -7.047 1.00 . A A . 45 LEU HD23 1 1 6 4137 1 1 45 LEU HG H 8.213 2.035 -5.127 1.00 . A A . 45 LEU HG 1 1 6 4138 1 1 45 LEU N N 5.242 2.271 -2.086 1.00 . A A . 45 LEU N 1 1 6 4139 1 1 45 LEU O O 7.676 4.141 -3.279 1.00 . A A . 45 LEU O 1 1 6 4140 1 1 46 SER C C 10.306 3.097 -0.058 1.00 . A A . 46 SER C 1 1 6 4141 1 1 46 SER CA C 9.384 3.899 -1.015 1.00 . A A . 46 SER CA 1 1 6 4142 1 1 46 SER CB C 8.777 5.141 -0.303 1.00 . A A . 46 SER CB 1 1 6 4143 1 1 46 SER H H 8.125 2.092 -0.947 1.00 . A A . 46 SER H 1 1 6 4144 1 1 46 SER HA H 9.962 4.253 -1.892 1.00 . A A . 46 SER HA 1 1 6 4145 1 1 46 SER HB2 H 9.585 5.806 0.057 1.00 . A A . 46 SER HB2 1 1 6 4146 1 1 46 SER HB3 H 8.201 5.748 -1.026 1.00 . A A . 46 SER HB3 1 1 6 4147 1 1 46 SER HG H 7.612 5.640 1.149 1.00 . A A . 46 SER HG 1 1 6 4148 1 1 46 SER N N 8.324 2.958 -1.460 1.00 . A A . 46 SER N 1 1 6 4149 1 1 46 SER O O 9.923 2.799 1.077 1.00 . A A . 46 SER O 1 1 6 4150 1 1 46 SER OG O 7.927 4.806 0.792 1.00 . A A . 46 SER OG 1 1 6 4151 1 1 47 PHE C C 11.745 0.337 0.203 1.00 . A A . 47 PHE C 1 1 6 4152 1 1 47 PHE CA C 12.448 1.733 0.094 1.00 . A A . 47 PHE CA 1 1 6 4153 1 1 47 PHE CB C 12.914 2.264 1.495 1.00 . A A . 47 PHE CB 1 1 6 4154 1 1 47 PHE CD1 C 15.258 1.285 1.794 1.00 . A A . 47 PHE CD1 1 1 6 4155 1 1 47 PHE CD2 C 13.540 0.657 3.373 1.00 . A A . 47 PHE CD2 1 1 6 4156 1 1 47 PHE CE1 C 16.166 0.465 2.461 1.00 . A A . 47 PHE CE1 1 1 6 4157 1 1 47 PHE CE2 C 14.449 -0.164 4.036 1.00 . A A . 47 PHE CE2 1 1 6 4158 1 1 47 PHE CG C 13.935 1.382 2.242 1.00 . A A . 47 PHE CG 1 1 6 4159 1 1 47 PHE CZ C 15.761 -0.259 3.579 1.00 . A A . 47 PHE CZ 1 1 6 4160 1 1 47 PHE H H 11.677 3.034 -1.511 1.00 . A A . 47 PHE H 1 1 6 4161 1 1 47 PHE HA H 13.338 1.628 -0.559 1.00 . A A . 47 PHE HA 1 1 6 4162 1 1 47 PHE HB2 H 13.362 3.268 1.363 1.00 . A A . 47 PHE HB2 1 1 6 4163 1 1 47 PHE HB3 H 12.049 2.451 2.158 1.00 . A A . 47 PHE HB3 1 1 6 4164 1 1 47 PHE HD1 H 15.584 1.837 0.924 1.00 . A A . 47 PHE HD1 1 1 6 4165 1 1 47 PHE HD2 H 12.526 0.723 3.741 1.00 . A A . 47 PHE HD2 1 1 6 4166 1 1 47 PHE HE1 H 17.185 0.389 2.108 1.00 . A A . 47 PHE HE1 1 1 6 4167 1 1 47 PHE HE2 H 14.137 -0.724 4.904 1.00 . A A . 47 PHE HE2 1 1 6 4168 1 1 47 PHE HZ H 16.466 -0.895 4.095 1.00 . A A . 47 PHE HZ 1 1 6 4169 1 1 47 PHE N N 11.504 2.704 -0.555 1.00 . A A . 47 PHE N 1 1 6 4170 1 1 47 PHE O O 10.973 0.084 1.131 1.00 . A A . 47 PHE O 1 1 6 4171 1 1 48 ALA C C 9.974 -2.023 -0.797 1.00 . A A . 48 ALA C 1 1 6 4172 1 1 48 ALA CA C 11.528 -1.964 -0.850 1.00 . A A . 48 ALA CA 1 1 6 4173 1 1 48 ALA CB C 12.165 -2.784 0.302 1.00 . A A . 48 ALA CB 1 1 6 4174 1 1 48 ALA H H 12.693 -0.200 -1.474 1.00 . A A . 48 ALA H 1 1 6 4175 1 1 48 ALA HXT H 8.447 -1.591 -1.927 1.00 . A A . 48 ALA HXT 1 1 6 4176 1 1 48 ALA HA H 11.832 -2.401 -1.820 1.00 . A A . 48 ALA HA 1 1 6 4177 1 1 48 ALA HB1 H 13.270 -2.770 0.251 1.00 . A A . 48 ALA HB1 1 1 6 4178 1 1 48 ALA HB2 H 11.880 -2.415 1.305 1.00 . A A . 48 ALA HB2 1 1 6 4179 1 1 48 ALA HB3 H 11.862 -3.846 0.252 1.00 . A A . 48 ALA HB3 1 1 6 4180 1 1 48 ALA N N 12.038 -0.558 -0.770 1.00 . A A . 48 ALA N 1 1 6 4181 1 1 48 ALA O O 9.322 -2.439 0.162 1.00 . A A . 48 ALA O 1 1 6 4182 1 1 48 ALA OXT O 9.406 -1.554 -1.955 1.00 . A A . 48 ALA OXT 1 1 7 4183 1 1 1 GLU C C 13.954 10.800 5.686 1.00 . A A . 1 GLU C 1 1 7 4184 1 1 1 GLU CA C 14.269 11.863 4.602 1.00 . A A . 1 GLU CA 1 1 7 4185 1 1 1 GLU CB C 12.989 12.180 3.774 1.00 . A A . 1 GLU CB 1 1 7 4186 1 1 1 GLU CD C 13.092 14.763 3.669 1.00 . A A . 1 GLU CD 1 1 7 4187 1 1 1 GLU CG C 13.042 13.445 2.887 1.00 . A A . 1 GLU CG 1 1 7 4188 1 1 1 GLU H1 H 16.189 11.119 4.249 1.00 . A A . 1 GLU H1 1 1 7 4189 1 1 1 GLU H2 H 15.588 12.002 2.988 1.00 . A A . 1 GLU H2 1 1 7 4190 1 1 1 GLU HA H 14.638 12.792 5.079 1.00 . A A . 1 GLU HA 1 1 7 4191 1 1 1 GLU HB2 H 12.726 11.313 3.138 1.00 . A A . 1 GLU HB2 1 1 7 4192 1 1 1 GLU HB3 H 12.121 12.286 4.454 1.00 . A A . 1 GLU HB3 1 1 7 4193 1 1 1 GLU HE2 H 11.910 15.923 4.693 1.00 . A A . 1 GLU HE2 1 1 7 4194 1 1 1 GLU HG2 H 13.905 13.390 2.197 1.00 . A A . 1 GLU HG2 1 1 7 4195 1 1 1 GLU HG3 H 12.152 13.461 2.229 1.00 . A A . 1 GLU HG3 1 1 7 4196 1 1 1 GLU N N 15.334 11.331 3.722 1.00 . A A . 1 GLU N 1 1 7 4197 1 1 1 GLU O O 13.429 9.720 5.386 1.00 . A A . 1 GLU O 1 1 7 4198 1 1 1 GLU OE1 O 14.116 15.433 3.801 1.00 . A A . 1 GLU OE1 1 1 7 4199 1 1 1 GLU OE2 O 11.873 15.099 4.201 1.00 . A A . 1 GLU OE2 1 1 7 4200 1 1 2 ASP C C 12.508 10.986 8.681 1.00 . A A . 2 ASP C 1 1 7 4201 1 1 2 ASP CA C 13.815 10.341 8.130 1.00 . A A . 2 ASP CA 1 1 7 4202 1 1 2 ASP CB C 14.971 10.325 9.169 1.00 . A A . 2 ASP CB 1 1 7 4203 1 1 2 ASP CG C 14.745 9.376 10.356 1.00 . A A . 2 ASP CG 1 1 7 4204 1 1 2 ASP H H 14.666 12.074 7.062 1.00 . A A . 2 ASP H 1 1 7 4205 1 1 2 ASP HA H 13.614 9.289 7.839 1.00 . A A . 2 ASP HA 1 1 7 4206 1 1 2 ASP HB2 H 15.909 10.007 8.675 1.00 . A A . 2 ASP HB2 1 1 7 4207 1 1 2 ASP HB3 H 15.183 11.346 9.543 1.00 . A A . 2 ASP HB3 1 1 7 4208 1 1 2 ASP HD2 H 14.061 10.953 11.269 1.00 . A A . 2 ASP HD2 1 1 7 4209 1 1 2 ASP N N 14.243 11.146 6.955 1.00 . A A . 2 ASP N 1 1 7 4210 1 1 2 ASP O O 12.545 11.949 9.455 1.00 . A A . 2 ASP O 1 1 7 4211 1 1 2 ASP OD1 O 15.021 8.177 10.326 1.00 . A A . 2 ASP OD1 1 1 7 4212 1 1 2 ASP OD2 O 14.204 10.019 11.440 1.00 . A A . 2 ASP OD2 1 1 7 4213 1 1 3 ASN C C 9.049 9.938 7.866 1.00 . A A . 3 ASN C 1 1 7 4214 1 1 3 ASN CA C 10.006 10.837 8.703 1.00 . A A . 3 ASN CA 1 1 7 4215 1 1 3 ASN CB C 9.638 12.332 8.494 1.00 . A A . 3 ASN CB 1 1 7 4216 1 1 3 ASN CG C 9.878 13.024 7.128 1.00 . A A . 3 ASN CG 1 1 7 4217 1 1 3 ASN H H 11.433 9.549 7.741 1.00 . A A . 3 ASN H 1 1 7 4218 1 1 3 ASN HA H 9.920 10.627 9.790 1.00 . A A . 3 ASN HA 1 1 7 4219 1 1 3 ASN HB2 H 8.575 12.363 8.794 1.00 . A A . 3 ASN HB2 1 1 7 4220 1 1 3 ASN HB3 H 10.151 12.939 9.262 1.00 . A A . 3 ASN HB3 1 1 7 4221 1 1 3 ASN HD21 H 7.903 13.204 6.832 1.00 . A A . 3 ASN HD21 1 1 7 4222 1 1 3 ASN HD22 H 9.010 13.865 5.527 1.00 . A A . 3 ASN HD22 1 1 7 4223 1 1 3 ASN N N 11.357 10.436 8.250 1.00 . A A . 3 ASN N 1 1 7 4224 1 1 3 ASN ND2 N 8.823 13.405 6.425 1.00 . A A . 3 ASN ND2 1 1 7 4225 1 1 3 ASN O O 8.619 10.228 6.744 1.00 . A A . 3 ASN O 1 1 7 4226 1 1 3 ASN OD1 O 11.016 13.236 6.708 1.00 . A A . 3 ASN OD1 1 1 7 4227 1 1 4 CYS C C 6.995 7.115 9.051 1.00 . A A . 4 CYS C 1 1 7 4228 1 1 4 CYS CA C 7.921 7.724 7.940 1.00 . A A . 4 CYS CA 1 1 7 4229 1 1 4 CYS CB C 8.814 6.661 7.312 1.00 . A A . 4 CYS CB 1 1 7 4230 1 1 4 CYS H H 9.391 8.771 9.309 1.00 . A A . 4 CYS H 1 1 7 4231 1 1 4 CYS HA H 7.277 8.088 7.122 1.00 . A A . 4 CYS HA 1 1 7 4232 1 1 4 CYS HB2 H 8.049 5.948 7.077 1.00 . A A . 4 CYS HB2 1 1 7 4233 1 1 4 CYS HB3 H 9.212 6.924 6.320 1.00 . A A . 4 CYS HB3 1 1 7 4234 1 1 4 CYS N N 8.771 8.806 8.498 1.00 . A A . 4 CYS N 1 1 7 4235 1 1 4 CYS O O 7.142 7.419 10.242 1.00 . A A . 4 CYS O 1 1 7 4236 1 1 4 CYS SG S 9.966 5.710 8.319 1.00 . A A . 4 CYS SG 1 1 7 4237 1 1 5 ILE C C 5.769 4.038 9.614 1.00 . A A . 5 ILE C 1 1 7 4238 1 1 5 ILE CA C 5.206 5.471 9.666 1.00 . A A . 5 ILE CA 1 1 7 4239 1 1 5 ILE CB C 3.641 5.396 9.411 1.00 . A A . 5 ILE CB 1 1 7 4240 1 1 5 ILE CD1 C 3.130 7.895 9.849 1.00 . A A . 5 ILE CD1 1 1 7 4241 1 1 5 ILE CG1 C 3.046 6.725 8.901 1.00 . A A . 5 ILE CG1 1 1 7 4242 1 1 5 ILE CG2 C 2.922 4.971 10.727 1.00 . A A . 5 ILE CG2 1 1 7 4243 1 1 5 ILE H H 6.147 5.960 7.639 1.00 . A A . 5 ILE H 1 1 7 4244 1 1 5 ILE HA H 5.346 5.927 10.664 1.00 . A A . 5 ILE HA 1 1 7 4245 1 1 5 ILE HB H 3.318 4.624 8.712 1.00 . A A . 5 ILE HB 1 1 7 4246 1 1 5 ILE HD11 H 2.947 7.586 10.882 1.00 . A A . 5 ILE HD11 1 1 7 4247 1 1 5 ILE HD12 H 4.136 8.337 9.771 1.00 . A A . 5 ILE HD12 1 1 7 4248 1 1 5 ILE HD13 H 2.364 8.625 9.562 1.00 . A A . 5 ILE HD13 1 1 7 4249 1 1 5 ILE HG12 H 3.482 7.075 7.961 1.00 . A A . 5 ILE HG12 1 1 7 4250 1 1 5 ILE HG13 H 2.022 6.538 8.580 1.00 . A A . 5 ILE HG13 1 1 7 4251 1 1 5 ILE HG21 H 3.188 5.575 11.615 1.00 . A A . 5 ILE HG21 1 1 7 4252 1 1 5 ILE HG22 H 1.822 5.037 10.621 1.00 . A A . 5 ILE HG22 1 1 7 4253 1 1 5 ILE HG23 H 3.130 3.919 10.985 1.00 . A A . 5 ILE HG23 1 1 7 4254 1 1 5 ILE N N 6.027 6.237 8.645 1.00 . A A . 5 ILE N 1 1 7 4255 1 1 5 ILE O O 5.321 3.187 8.839 1.00 . A A . 5 ILE O 1 1 7 4256 1 1 6 ALA C C 6.596 1.306 11.241 1.00 . A A . 6 ALA C 1 1 7 4257 1 1 6 ALA CA C 7.412 2.405 10.459 1.00 . A A . 6 ALA CA 1 1 7 4258 1 1 6 ALA CB C 8.798 2.608 11.099 1.00 . A A . 6 ALA CB 1 1 7 4259 1 1 6 ALA H H 6.924 4.479 11.159 1.00 . A A . 6 ALA H 1 1 7 4260 1 1 6 ALA HA H 7.514 2.072 9.399 1.00 . A A . 6 ALA HA 1 1 7 4261 1 1 6 ALA HB1 H 9.402 3.349 10.543 1.00 . A A . 6 ALA HB1 1 1 7 4262 1 1 6 ALA HB2 H 8.729 2.954 12.148 1.00 . A A . 6 ALA HB2 1 1 7 4263 1 1 6 ALA HB3 H 9.378 1.668 11.105 1.00 . A A . 6 ALA HB3 1 1 7 4264 1 1 6 ALA N N 6.765 3.752 10.460 1.00 . A A . 6 ALA N 1 1 7 4265 1 1 6 ALA O O 7.148 0.290 11.667 1.00 . A A . 6 ALA O 1 1 7 4266 1 1 7 GLU C C 3.228 0.096 11.519 1.00 . A A . 7 GLU C 1 1 7 4267 1 1 7 GLU CA C 4.377 0.778 12.285 1.00 . A A . 7 GLU CA 1 1 7 4268 1 1 7 GLU CB C 3.840 1.782 13.353 1.00 . A A . 7 GLU CB 1 1 7 4269 1 1 7 GLU CD C 5.859 3.228 14.163 1.00 . A A . 7 GLU CD 1 1 7 4270 1 1 7 GLU CG C 4.788 2.186 14.508 1.00 . A A . 7 GLU CG 1 1 7 4271 1 1 7 GLU H H 5.118 2.521 11.120 1.00 . A A . 7 GLU H 1 1 7 4272 1 1 7 GLU HA H 4.884 -0.021 12.780 1.00 . A A . 7 GLU HA 1 1 7 4273 1 1 7 GLU HB2 H 3.454 2.686 12.856 1.00 . A A . 7 GLU HB2 1 1 7 4274 1 1 7 GLU HB3 H 2.950 1.342 13.843 1.00 . A A . 7 GLU HB3 1 1 7 4275 1 1 7 GLU HE2 H 5.994 5.071 13.548 1.00 . A A . 7 GLU HE2 1 1 7 4276 1 1 7 GLU HG2 H 4.180 2.599 15.335 1.00 . A A . 7 GLU HG2 1 1 7 4277 1 1 7 GLU HG3 H 5.268 1.284 14.932 1.00 . A A . 7 GLU HG3 1 1 7 4278 1 1 7 GLU N N 5.286 1.546 11.409 1.00 . A A . 7 GLU N 1 1 7 4279 1 1 7 GLU O O 2.899 0.418 10.376 1.00 . A A . 7 GLU O 1 1 7 4280 1 1 7 GLU OE1 O 7.066 3.006 14.242 1.00 . A A . 7 GLU OE1 1 1 7 4281 1 1 7 GLU OE2 O 5.318 4.424 13.763 1.00 . A A . 7 GLU OE2 1 1 7 4282 1 1 8 ASP C C 0.388 -0.901 12.923 1.00 . A A . 8 ASP C 1 1 7 4283 1 1 8 ASP CA C 1.346 -1.508 11.867 1.00 . A A . 8 ASP CA 1 1 7 4284 1 1 8 ASP CB C 1.294 -3.057 11.953 1.00 . A A . 8 ASP CB 1 1 7 4285 1 1 8 ASP CG C 2.556 -3.796 11.479 1.00 . A A . 8 ASP CG 1 1 7 4286 1 1 8 ASP H H 3.033 -1.006 13.176 1.00 . A A . 8 ASP H 1 1 7 4287 1 1 8 ASP HA H 1.085 -1.234 10.822 1.00 . A A . 8 ASP HA 1 1 7 4288 1 1 8 ASP HB2 H 1.007 -3.328 12.975 1.00 . A A . 8 ASP HB2 1 1 7 4289 1 1 8 ASP HB3 H 0.467 -3.403 11.308 1.00 . A A . 8 ASP HB3 1 1 7 4290 1 1 8 ASP HD2 H 2.476 -2.614 9.934 1.00 . A A . 8 ASP HD2 1 1 7 4291 1 1 8 ASP N N 2.624 -0.863 12.246 1.00 . A A . 8 ASP N 1 1 7 4292 1 1 8 ASP O O 0.568 -0.979 14.146 1.00 . A A . 8 ASP O 1 1 7 4293 1 1 8 ASP OD1 O 3.086 -4.700 12.122 1.00 . A A . 8 ASP OD1 1 1 7 4294 1 1 8 ASP OD2 O 3.021 -3.326 10.277 1.00 . A A . 8 ASP OD2 1 1 7 4295 1 1 9 TYR C C -0.869 1.847 13.770 1.00 . A A . 9 TYR C 1 1 7 4296 1 1 9 TYR CA C -1.608 0.630 13.066 1.00 . A A . 9 TYR CA 1 1 7 4297 1 1 9 TYR CB C -2.461 -0.239 14.062 1.00 . A A . 9 TYR CB 1 1 7 4298 1 1 9 TYR CD1 C -4.345 -1.157 12.591 1.00 . A A . 9 TYR CD1 1 1 7 4299 1 1 9 TYR CD2 C -2.666 -2.698 13.395 1.00 . A A . 9 TYR CD2 1 1 7 4300 1 1 9 TYR CE1 C -4.894 -2.171 11.809 1.00 . A A . 9 TYR CE1 1 1 7 4301 1 1 9 TYR CE2 C -3.216 -3.708 12.612 1.00 . A A . 9 TYR CE2 1 1 7 4302 1 1 9 TYR CG C -3.219 -1.409 13.383 1.00 . A A . 9 TYR CG 1 1 7 4303 1 1 9 TYR CZ C -4.330 -3.444 11.818 1.00 . A A . 9 TYR CZ 1 1 7 4304 1 1 9 TYR H H -0.654 -0.465 11.361 1.00 . A A . 9 TYR H 1 1 7 4305 1 1 9 TYR HA H -2.281 1.083 12.318 1.00 . A A . 9 TYR HA 1 1 7 4306 1 1 9 TYR HB2 H -1.836 -0.611 14.896 1.00 . A A . 9 TYR HB2 1 1 7 4307 1 1 9 TYR HB3 H -3.202 0.415 14.560 1.00 . A A . 9 TYR HB3 1 1 7 4308 1 1 9 TYR HD1 H -4.763 -0.161 12.535 1.00 . A A . 9 TYR HD1 1 1 7 4309 1 1 9 TYR HD2 H -1.777 -2.908 13.972 1.00 . A A . 9 TYR HD2 1 1 7 4310 1 1 9 TYR HE1 H -5.738 -1.959 11.168 1.00 . A A . 9 TYR HE1 1 1 7 4311 1 1 9 TYR HE2 H -2.763 -4.690 12.604 1.00 . A A . 9 TYR HE2 1 1 7 4312 1 1 9 TYR HH H -5.605 -4.074 10.541 1.00 . A A . 9 TYR HH 1 1 7 4313 1 1 9 TYR N N -0.632 -0.266 12.364 1.00 . A A . 9 TYR N 1 1 7 4314 1 1 9 TYR O O -1.265 2.273 14.859 1.00 . A A . 9 TYR O 1 1 7 4315 1 1 9 TYR OH O -4.854 -4.428 11.023 1.00 . A A . 9 TYR OH 1 1 7 4316 1 1 10 GLY C C 0.068 4.945 12.933 1.00 . A A . 10 GLY C 1 1 7 4317 1 1 10 GLY CA C 0.770 3.738 13.522 1.00 . A A . 10 GLY CA 1 1 7 4318 1 1 10 GLY H H 0.433 1.966 12.237 1.00 . A A . 10 GLY H 1 1 7 4319 1 1 10 GLY HA2 H 0.895 3.793 14.606 1.00 . A A . 10 GLY HA2 1 1 7 4320 1 1 10 GLY HA3 H 1.799 3.888 13.203 1.00 . A A . 10 GLY HA3 1 1 7 4321 1 1 10 GLY N N 0.148 2.456 13.096 1.00 . A A . 10 GLY N 1 1 7 4322 1 1 10 GLY O O -0.457 4.917 11.822 1.00 . A A . 10 GLY O 1 1 7 4323 1 1 11 LYS C C -0.104 7.989 12.231 1.00 . A A . 11 LYS C 1 1 7 4324 1 1 11 LYS CA C -0.739 7.220 13.430 1.00 . A A . 11 LYS CA 1 1 7 4325 1 1 11 LYS CB C -0.819 8.210 14.612 1.00 . A A . 11 LYS CB 1 1 7 4326 1 1 11 LYS CD C -1.347 8.728 17.075 1.00 . A A . 11 LYS CD 1 1 7 4327 1 1 11 LYS CE C -1.740 8.153 18.448 1.00 . A A . 11 LYS CE 1 1 7 4328 1 1 11 LYS CG C -1.213 7.640 15.994 1.00 . A A . 11 LYS CG 1 1 7 4329 1 1 11 LYS H H 0.729 5.821 14.498 1.00 . A A . 11 LYS H 1 1 7 4330 1 1 11 LYS HA H -1.777 6.888 13.204 1.00 . A A . 11 LYS HA 1 1 7 4331 1 1 11 LYS HB2 H 0.124 8.764 14.650 1.00 . A A . 11 LYS HB2 1 1 7 4332 1 1 11 LYS HB3 H -1.565 8.984 14.345 1.00 . A A . 11 LYS HB3 1 1 7 4333 1 1 11 LYS HD2 H -0.391 9.280 17.160 1.00 . A A . 11 LYS HD2 1 1 7 4334 1 1 11 LYS HD3 H -2.100 9.474 16.754 1.00 . A A . 11 LYS HD3 1 1 7 4335 1 1 11 LYS HE2 H -2.700 7.608 18.379 1.00 . A A . 11 LYS HE2 1 1 7 4336 1 1 11 LYS HE3 H -0.989 7.416 18.788 1.00 . A A . 11 LYS HE3 1 1 7 4337 1 1 11 LYS HG2 H -2.167 7.087 15.901 1.00 . A A . 11 LYS HG2 1 1 7 4338 1 1 11 LYS HG3 H -0.462 6.894 16.316 1.00 . A A . 11 LYS HG3 1 1 7 4339 1 1 11 LYS HZ1 H -0.961 9.684 19.593 1.00 . A A . 11 LYS HZ1 1 1 7 4340 1 1 11 LYS HZ2 H -2.096 8.805 20.374 1.00 . A A . 11 LYS HZ2 1 1 7 4341 1 1 11 LYS N N 0.085 6.010 13.721 1.00 . A A . 11 LYS N 1 1 7 4342 1 1 11 LYS NZ N -1.864 9.215 19.463 1.00 . A A . 11 LYS NZ 1 1 7 4343 1 1 11 LYS O O 1.065 8.384 12.213 1.00 . A A . 11 LYS O 1 1 7 4344 1 1 12 CYS C C -1.799 9.519 9.345 1.00 . A A . 12 CYS C 1 1 7 4345 1 1 12 CYS CA C -0.643 8.633 9.879 1.00 . A A . 12 CYS CA 1 1 7 4346 1 1 12 CYS CB C -0.392 7.406 8.992 1.00 . A A . 12 CYS CB 1 1 7 4347 1 1 12 CYS H H -1.892 7.855 11.588 1.00 . A A . 12 CYS H 1 1 7 4348 1 1 12 CYS HA H 0.287 9.237 9.863 1.00 . A A . 12 CYS HA 1 1 7 4349 1 1 12 CYS HB2 H 0.171 7.693 8.089 1.00 . A A . 12 CYS HB2 1 1 7 4350 1 1 12 CYS HB3 H 0.260 6.708 9.518 1.00 . A A . 12 CYS HB3 1 1 7 4351 1 1 12 CYS N N -0.972 8.146 11.245 1.00 . A A . 12 CYS N 1 1 7 4352 1 1 12 CYS O O -2.779 9.814 10.043 1.00 . A A . 12 CYS O 1 1 7 4353 1 1 12 CYS SG S -1.845 6.459 8.575 1.00 . A A . 12 CYS SG 1 1 7 4354 1 1 13 THR C C -2.777 10.495 5.909 1.00 . A A . 13 THR C 1 1 7 4355 1 1 13 THR CA C -2.744 10.795 7.443 1.00 . A A . 13 THR CA 1 1 7 4356 1 1 13 THR CB C -2.571 12.368 7.706 1.00 . A A . 13 THR CB 1 1 7 4357 1 1 13 THR CG2 C -1.437 12.820 8.658 1.00 . A A . 13 THR CG2 1 1 7 4358 1 1 13 THR H H -0.790 9.622 7.646 1.00 . A A . 13 THR H 1 1 7 4359 1 1 13 THR HA H -3.728 10.485 7.858 1.00 . A A . 13 THR HA 1 1 7 4360 1 1 13 THR HB H -3.561 12.693 8.075 1.00 . A A . 13 THR HB 1 1 7 4361 1 1 13 THR HG1 H -2.254 14.023 6.771 1.00 . A A . 13 THR HG1 1 1 7 4362 1 1 13 THR HG21 H -1.559 12.401 9.673 1.00 . A A . 13 THR HG21 1 1 7 4363 1 1 13 THR HG22 H -0.439 12.519 8.286 1.00 . A A . 13 THR HG22 1 1 7 4364 1 1 13 THR HG23 H -1.420 13.920 8.768 1.00 . A A . 13 THR HG23 1 1 7 4365 1 1 13 THR N N -1.660 9.976 8.085 1.00 . A A . 13 THR N 1 1 7 4366 1 1 13 THR O O -1.782 10.169 5.250 1.00 . A A . 13 THR O 1 1 7 4367 1 1 13 THR OG1 O -2.269 13.097 6.517 1.00 . A A . 13 THR OG1 1 1 7 4368 1 1 14 TRP C C -3.905 12.209 3.447 1.00 . A A . 14 TRP C 1 1 7 4369 1 1 14 TRP CA C -4.254 10.762 3.901 1.00 . A A . 14 TRP CA 1 1 7 4370 1 1 14 TRP CB C -5.735 10.436 3.566 1.00 . A A . 14 TRP CB 1 1 7 4371 1 1 14 TRP CD1 C -5.495 7.803 3.487 1.00 . A A . 14 TRP CD1 1 1 7 4372 1 1 14 TRP CD2 C -7.470 8.568 4.180 1.00 . A A . 14 TRP CD2 1 1 7 4373 1 1 14 TRP CE2 C -7.496 7.151 4.130 1.00 . A A . 14 TRP CE2 1 1 7 4374 1 1 14 TRP CE3 C -8.621 9.292 4.589 1.00 . A A . 14 TRP CE3 1 1 7 4375 1 1 14 TRP CG C -6.212 8.989 3.775 1.00 . A A . 14 TRP CG 1 1 7 4376 1 1 14 TRP CH2 C -9.794 7.179 4.887 1.00 . A A . 14 TRP CH2 1 1 7 4377 1 1 14 TRP CZ2 C -8.675 6.450 4.483 1.00 . A A . 14 TRP CZ2 1 1 7 4378 1 1 14 TRP CZ3 C -9.767 8.578 4.941 1.00 . A A . 14 TRP CZ3 1 1 7 4379 1 1 14 TRP H H -4.663 11.081 6.062 1.00 . A A . 14 TRP H 1 1 7 4380 1 1 14 TRP HA H -3.614 10.018 3.385 1.00 . A A . 14 TRP HA 1 1 7 4381 1 1 14 TRP HB2 H -6.398 11.128 4.122 1.00 . A A . 14 TRP HB2 1 1 7 4382 1 1 14 TRP HB3 H -5.921 10.677 2.502 1.00 . A A . 14 TRP HB3 1 1 7 4383 1 1 14 TRP HD1 H -4.475 7.769 3.130 1.00 . A A . 14 TRP HD1 1 1 7 4384 1 1 14 TRP HE1 H -6.008 5.676 3.565 1.00 . A A . 14 TRP HE1 1 1 7 4385 1 1 14 TRP HE3 H -8.618 10.372 4.634 1.00 . A A . 14 TRP HE3 1 1 7 4386 1 1 14 TRP HH2 H -10.696 6.654 5.168 1.00 . A A . 14 TRP HH2 1 1 7 4387 1 1 14 TRP HZ2 H -8.711 5.371 4.447 1.00 . A A . 14 TRP HZ2 1 1 7 4388 1 1 14 TRP HZ3 H -10.649 9.113 5.261 1.00 . A A . 14 TRP HZ3 1 1 7 4389 1 1 14 TRP N N -3.993 10.724 5.368 1.00 . A A . 14 TRP N 1 1 7 4390 1 1 14 TRP NE1 N -6.276 6.656 3.705 1.00 . A A . 14 TRP NE1 1 1 7 4391 1 1 14 TRP O O -4.572 13.181 3.825 1.00 . A A . 14 TRP O 1 1 7 4392 1 1 15 GLY C C -1.255 14.018 3.544 1.00 . A A . 15 GLY C 1 1 7 4393 1 1 15 GLY CA C -2.191 13.644 2.367 1.00 . A A . 15 GLY CA 1 1 7 4394 1 1 15 GLY H H -2.341 11.448 2.454 1.00 . A A . 15 GLY H 1 1 7 4395 1 1 15 GLY HA2 H -1.621 13.574 1.421 1.00 . A A . 15 GLY HA2 1 1 7 4396 1 1 15 GLY HA3 H -2.950 14.431 2.204 1.00 . A A . 15 GLY HA3 1 1 7 4397 1 1 15 GLY N N -2.818 12.330 2.669 1.00 . A A . 15 GLY N 1 1 7 4398 1 1 15 GLY O O -1.531 14.951 4.303 1.00 . A A . 15 GLY O 1 1 7 4399 1 1 16 GLY C C 1.783 12.181 4.717 1.00 . A A . 16 GLY C 1 1 7 4400 1 1 16 GLY CA C 0.698 13.248 4.866 1.00 . A A . 16 GLY CA 1 1 7 4401 1 1 16 GLY H H -0.120 12.491 2.976 1.00 . A A . 16 GLY H 1 1 7 4402 1 1 16 GLY HA2 H 1.178 14.209 5.094 1.00 . A A . 16 GLY HA2 1 1 7 4403 1 1 16 GLY HA3 H 0.068 13.032 5.752 1.00 . A A . 16 GLY HA3 1 1 7 4404 1 1 16 GLY N N -0.180 13.233 3.682 1.00 . A A . 16 GLY N 1 1 7 4405 1 1 16 GLY O O 2.234 11.816 3.623 1.00 . A A . 16 GLY O 1 1 7 4406 1 1 17 THR C C 2.268 9.218 5.712 1.00 . A A . 17 THR C 1 1 7 4407 1 1 17 THR CA C 3.104 10.515 5.972 1.00 . A A . 17 THR CA 1 1 7 4408 1 1 17 THR CB C 3.795 10.356 7.375 1.00 . A A . 17 THR CB 1 1 7 4409 1 1 17 THR CG2 C 5.172 9.685 7.247 1.00 . A A . 17 THR CG2 1 1 7 4410 1 1 17 THR H H 1.800 12.233 6.664 1.00 . A A . 17 THR H 1 1 7 4411 1 1 17 THR HA H 3.893 10.652 5.200 1.00 . A A . 17 THR HA 1 1 7 4412 1 1 17 THR HB H 3.179 9.692 8.016 1.00 . A A . 17 THR HB 1 1 7 4413 1 1 17 THR HG1 H 4.590 12.111 7.404 1.00 . A A . 17 THR HG1 1 1 7 4414 1 1 17 THR HG21 H 5.868 10.223 6.579 1.00 . A A . 17 THR HG21 1 1 7 4415 1 1 17 THR HG22 H 5.670 9.591 8.230 1.00 . A A . 17 THR HG22 1 1 7 4416 1 1 17 THR HG23 H 5.088 8.656 6.857 1.00 . A A . 17 THR HG23 1 1 7 4417 1 1 17 THR N N 2.181 11.681 5.887 1.00 . A A . 17 THR N 1 1 7 4418 1 1 17 THR O O 1.181 9.001 6.270 1.00 . A A . 17 THR O 1 1 7 4419 1 1 17 THR OG1 O 4.014 11.621 7.996 1.00 . A A . 17 THR OG1 1 1 7 4420 1 1 18 LYS C C 3.526 6.096 5.282 1.00 . A A . 18 LYS C 1 1 7 4421 1 1 18 LYS CA C 2.437 6.982 4.624 1.00 . A A . 18 LYS CA 1 1 7 4422 1 1 18 LYS CB C 2.246 6.667 3.108 1.00 . A A . 18 LYS CB 1 1 7 4423 1 1 18 LYS CD C 0.084 8.030 2.615 1.00 . A A . 18 LYS CD 1 1 7 4424 1 1 18 LYS CE C -0.573 9.197 1.853 1.00 . A A . 18 LYS CE 1 1 7 4425 1 1 18 LYS CG C 1.544 7.713 2.205 1.00 . A A . 18 LYS CG 1 1 7 4426 1 1 18 LYS H H 3.826 8.689 4.646 1.00 . A A . 18 LYS H 1 1 7 4427 1 1 18 LYS HA H 1.473 6.741 5.107 1.00 . A A . 18 LYS HA 1 1 7 4428 1 1 18 LYS HB2 H 3.214 6.349 2.690 1.00 . A A . 18 LYS HB2 1 1 7 4429 1 1 18 LYS HB3 H 1.654 5.734 3.038 1.00 . A A . 18 LYS HB3 1 1 7 4430 1 1 18 LYS HD2 H -0.539 7.119 2.529 1.00 . A A . 18 LYS HD2 1 1 7 4431 1 1 18 LYS HD3 H 0.060 8.289 3.690 1.00 . A A . 18 LYS HD3 1 1 7 4432 1 1 18 LYS HE2 H -1.527 9.459 2.345 1.00 . A A . 18 LYS HE2 1 1 7 4433 1 1 18 LYS HE3 H 0.054 10.106 1.922 1.00 . A A . 18 LYS HE3 1 1 7 4434 1 1 18 LYS HG2 H 2.141 8.644 2.189 1.00 . A A . 18 LYS HG2 1 1 7 4435 1 1 18 LYS HG3 H 1.557 7.346 1.162 1.00 . A A . 18 LYS HG3 1 1 7 4436 1 1 18 LYS HZ1 H 0.032 8.716 -0.062 1.00 . A A . 18 LYS HZ1 1 1 7 4437 1 1 18 LYS HZ2 H -1.266 9.709 -0.024 1.00 . A A . 18 LYS HZ2 1 1 7 4438 1 1 18 LYS N N 2.871 8.384 4.860 1.00 . A A . 18 LYS N 1 1 7 4439 1 1 18 LYS NZ N -0.848 8.893 0.436 1.00 . A A . 18 LYS NZ 1 1 7 4440 1 1 18 LYS O O 4.562 6.522 5.826 1.00 . A A . 18 LYS O 1 1 7 4441 1 1 19 CYS C C 5.433 3.605 5.337 1.00 . A A . 19 CYS C 1 1 7 4442 1 1 19 CYS CA C 4.054 3.841 6.044 1.00 . A A . 19 CYS CA 1 1 7 4443 1 1 19 CYS CB C 3.219 2.568 6.242 1.00 . A A . 19 CYS CB 1 1 7 4444 1 1 19 CYS H H 2.445 4.615 4.620 1.00 . A A . 19 CYS H 1 1 7 4445 1 1 19 CYS HA H 4.183 4.335 7.041 1.00 . A A . 19 CYS HA 1 1 7 4446 1 1 19 CYS HB2 H 2.783 2.230 5.307 1.00 . A A . 19 CYS HB2 1 1 7 4447 1 1 19 CYS HB3 H 3.842 1.767 6.698 1.00 . A A . 19 CYS HB3 1 1 7 4448 1 1 19 CYS N N 3.250 4.796 5.243 1.00 . A A . 19 CYS N 1 1 7 4449 1 1 19 CYS O O 5.608 3.643 4.114 1.00 . A A . 19 CYS O 1 1 7 4450 1 1 19 CYS SG S 1.832 2.954 7.296 1.00 . A A . 19 CYS SG 1 1 7 4451 1 1 20 CYS C C 8.456 2.647 4.866 1.00 . A A . 20 CYS C 1 1 7 4452 1 1 20 CYS CA C 7.868 3.567 5.978 1.00 . A A . 20 CYS CA 1 1 7 4453 1 1 20 CYS CB C 8.602 3.205 7.284 1.00 . A A . 20 CYS CB 1 1 7 4454 1 1 20 CYS H H 6.068 3.464 7.209 1.00 . A A . 20 CYS H 1 1 7 4455 1 1 20 CYS HA H 7.964 4.635 5.795 1.00 . A A . 20 CYS HA 1 1 7 4456 1 1 20 CYS HB2 H 8.060 3.624 8.128 1.00 . A A . 20 CYS HB2 1 1 7 4457 1 1 20 CYS HB3 H 8.682 2.115 7.460 1.00 . A A . 20 CYS HB3 1 1 7 4458 1 1 20 CYS N N 6.413 3.472 6.243 1.00 . A A . 20 CYS N 1 1 7 4459 1 1 20 CYS O O 9.242 3.135 4.049 1.00 . A A . 20 CYS O 1 1 7 4460 1 1 20 CYS SG S 10.228 3.981 7.311 1.00 . A A . 20 CYS SG 1 1 7 4461 1 1 21 ARG C C 7.990 0.134 2.607 1.00 . A A . 21 ARG C 1 1 7 4462 1 1 21 ARG CA C 8.750 0.320 3.966 1.00 . A A . 21 ARG CA 1 1 7 4463 1 1 21 ARG CB C 8.799 -0.982 4.825 1.00 . A A . 21 ARG CB 1 1 7 4464 1 1 21 ARG CD C 9.664 -3.365 5.195 1.00 . A A . 21 ARG CD 1 1 7 4465 1 1 21 ARG CG C 9.713 -2.112 4.298 1.00 . A A . 21 ARG CG 1 1 7 4466 1 1 21 ARG CZ C 10.188 -5.431 3.828 1.00 . A A . 21 ARG CZ 1 1 7 4467 1 1 21 ARG H H 7.371 1.170 5.526 1.00 . A A . 21 ARG H 1 1 7 4468 1 1 21 ARG HA H 9.760 0.657 3.685 1.00 . A A . 21 ARG HA 1 1 7 4469 1 1 21 ARG HB2 H 9.158 -0.748 5.847 1.00 . A A . 21 ARG HB2 1 1 7 4470 1 1 21 ARG HB3 H 7.773 -1.375 4.968 1.00 . A A . 21 ARG HB3 1 1 7 4471 1 1 21 ARG HD2 H 10.045 -3.120 6.203 1.00 . A A . 21 ARG HD2 1 1 7 4472 1 1 21 ARG HD3 H 8.619 -3.701 5.345 1.00 . A A . 21 ARG HD3 1 1 7 4473 1 1 21 ARG HG2 H 9.419 -2.393 3.271 1.00 . A A . 21 ARG HG2 1 1 7 4474 1 1 21 ARG HG3 H 10.753 -1.741 4.222 1.00 . A A . 21 ARG HG3 1 1 7 4475 1 1 21 ARG HH11 H 8.261 -4.907 3.592 1.00 . A A . 21 ARG HH11 1 1 7 4476 1 1 21 ARG HH12 H 8.843 -6.391 2.682 1.00 . A A . 21 ARG HH12 1 1 7 4477 1 1 21 ARG HH21 H 12.058 -6.141 3.905 1.00 . A A . 21 ARG HH21 1 1 7 4478 1 1 21 ARG HH22 H 10.860 -7.044 2.850 1.00 . A A . 21 ARG HH22 1 1 7 4479 1 1 21 ARG N N 8.125 1.344 4.869 1.00 . A A . 21 ARG N 1 1 7 4480 1 1 21 ARG NE N 10.487 -4.481 4.626 1.00 . A A . 21 ARG NE 1 1 7 4481 1 1 21 ARG NH1 N 8.972 -5.593 3.314 1.00 . A A . 21 ARG NH1 1 1 7 4482 1 1 21 ARG NH2 N 11.131 -6.293 3.494 1.00 . A A . 21 ARG NH2 1 1 7 4483 1 1 21 ARG O O 7.861 -0.960 2.048 1.00 . A A . 21 ARG O 1 1 7 4484 1 1 22 GLY C C 5.217 0.615 1.182 1.00 . A A . 22 GLY C 1 1 7 4485 1 1 22 GLY CA C 6.560 1.327 0.945 1.00 . A A . 22 GLY CA 1 1 7 4486 1 1 22 GLY H H 7.602 1.956 2.861 1.00 . A A . 22 GLY H 1 1 7 4487 1 1 22 GLY HA2 H 6.383 2.387 0.682 1.00 . A A . 22 GLY HA2 1 1 7 4488 1 1 22 GLY HA3 H 7.038 0.891 0.063 1.00 . A A . 22 GLY HA3 1 1 7 4489 1 1 22 GLY N N 7.495 1.264 2.099 1.00 . A A . 22 GLY N 1 1 7 4490 1 1 22 GLY O O 4.855 -0.335 0.485 1.00 . A A . 22 GLY O 1 1 7 4491 1 1 23 ARG C C 2.120 1.454 2.788 1.00 . A A . 23 ARG C 1 1 7 4492 1 1 23 ARG CA C 3.340 0.463 2.793 1.00 . A A . 23 ARG CA 1 1 7 4493 1 1 23 ARG CB C 3.688 0.028 4.247 1.00 . A A . 23 ARG CB 1 1 7 4494 1 1 23 ARG CD C 4.015 -2.518 4.034 1.00 . A A . 23 ARG CD 1 1 7 4495 1 1 23 ARG CG C 4.599 -1.177 4.505 1.00 . A A . 23 ARG CG 1 1 7 4496 1 1 23 ARG CZ C 4.961 -4.520 5.252 1.00 . A A . 23 ARG CZ 1 1 7 4497 1 1 23 ARG H H 5.083 1.841 2.679 1.00 . A A . 23 ARG H 1 1 7 4498 1 1 23 ARG HA H 3.073 -0.438 2.220 1.00 . A A . 23 ARG HA 1 1 7 4499 1 1 23 ARG HB2 H 4.236 0.850 4.726 1.00 . A A . 23 ARG HB2 1 1 7 4500 1 1 23 ARG HB3 H 2.761 -0.117 4.836 1.00 . A A . 23 ARG HB3 1 1 7 4501 1 1 23 ARG HD2 H 3.027 -2.699 4.500 1.00 . A A . 23 ARG HD2 1 1 7 4502 1 1 23 ARG HD3 H 3.827 -2.475 2.950 1.00 . A A . 23 ARG HD3 1 1 7 4503 1 1 23 ARG HG2 H 5.583 -0.977 4.049 1.00 . A A . 23 ARG HG2 1 1 7 4504 1 1 23 ARG HG3 H 4.781 -1.210 5.600 1.00 . A A . 23 ARG HG3 1 1 7 4505 1 1 23 ARG HH11 H 3.339 -3.814 6.206 1.00 . A A . 23 ARG HH11 1 1 7 4506 1 1 23 ARG HH12 H 4.165 -5.282 6.932 1.00 . A A . 23 ARG HH12 1 1 7 4507 1 1 23 ARG HH21 H 6.586 -5.395 4.478 1.00 . A A . 23 ARG HH21 1 1 7 4508 1 1 23 ARG HH22 H 5.891 -6.121 6.013 1.00 . A A . 23 ARG HH22 1 1 7 4509 1 1 23 ARG N N 4.534 1.113 2.210 1.00 . A A . 23 ARG N 1 1 7 4510 1 1 23 ARG NE N 4.949 -3.654 4.317 1.00 . A A . 23 ARG NE 1 1 7 4511 1 1 23 ARG NH1 N 4.063 -4.540 6.231 1.00 . A A . 23 ARG NH1 1 1 7 4512 1 1 23 ARG NH2 N 5.909 -5.438 5.247 1.00 . A A . 23 ARG NH2 1 1 7 4513 1 1 23 ARG O O 2.304 2.663 3.021 1.00 . A A . 23 ARG O 1 1 7 4514 1 1 24 PRO C C -0.822 2.258 4.036 1.00 . A A . 24 PRO C 1 1 7 4515 1 1 24 PRO CA C -0.351 1.857 2.603 1.00 . A A . 24 PRO CA 1 1 7 4516 1 1 24 PRO CB C -1.392 1.003 1.851 1.00 . A A . 24 PRO CB 1 1 7 4517 1 1 24 PRO CD C 0.522 -0.416 2.237 1.00 . A A . 24 PRO CD 1 1 7 4518 1 1 24 PRO CG C -1.004 -0.448 2.140 1.00 . A A . 24 PRO CG 1 1 7 4519 1 1 24 PRO HA H -0.157 2.795 2.043 1.00 . A A . 24 PRO HA 1 1 7 4520 1 1 24 PRO HB2 H -2.439 1.221 2.135 1.00 . A A . 24 PRO HB2 1 1 7 4521 1 1 24 PRO HB3 H -1.321 1.203 0.765 1.00 . A A . 24 PRO HB3 1 1 7 4522 1 1 24 PRO HD2 H 0.889 -1.131 2.997 1.00 . A A . 24 PRO HD2 1 1 7 4523 1 1 24 PRO HD3 H 0.977 -0.689 1.265 1.00 . A A . 24 PRO HD3 1 1 7 4524 1 1 24 PRO HG2 H -1.440 -0.775 3.103 1.00 . A A . 24 PRO HG2 1 1 7 4525 1 1 24 PRO HG3 H -1.366 -1.148 1.365 1.00 . A A . 24 PRO HG3 1 1 7 4526 1 1 24 PRO N N 0.849 0.985 2.586 1.00 . A A . 24 PRO N 1 1 7 4527 1 1 24 PRO O O -0.478 1.624 5.040 1.00 . A A . 24 PRO O 1 1 7 4528 1 1 25 CYS C C -3.910 3.764 4.942 1.00 . A A . 25 CYS C 1 1 7 4529 1 1 25 CYS CA C -2.388 3.727 5.300 1.00 . A A . 25 CYS CA 1 1 7 4530 1 1 25 CYS CB C -1.885 5.109 5.808 1.00 . A A . 25 CYS CB 1 1 7 4531 1 1 25 CYS H H -1.860 3.717 3.160 1.00 . A A . 25 CYS H 1 1 7 4532 1 1 25 CYS HA H -2.225 2.995 6.117 1.00 . A A . 25 CYS HA 1 1 7 4533 1 1 25 CYS HB2 H -1.112 5.527 5.142 1.00 . A A . 25 CYS HB2 1 1 7 4534 1 1 25 CYS HB3 H -2.713 5.824 5.876 1.00 . A A . 25 CYS HB3 1 1 7 4535 1 1 25 CYS N N -1.649 3.313 4.079 1.00 . A A . 25 CYS N 1 1 7 4536 1 1 25 CYS O O -4.319 4.116 3.829 1.00 . A A . 25 CYS O 1 1 7 4537 1 1 25 CYS SG S -1.207 4.947 7.446 1.00 . A A . 25 CYS SG 1 1 7 4538 1 1 26 ARG C C -6.686 3.884 7.277 1.00 . A A . 26 ARG C 1 1 7 4539 1 1 26 ARG CA C -6.227 3.498 5.849 1.00 . A A . 26 ARG CA 1 1 7 4540 1 1 26 ARG CB C -6.876 2.167 5.384 1.00 . A A . 26 ARG CB 1 1 7 4541 1 1 26 ARG CD C -9.000 0.984 4.461 1.00 . A A . 26 ARG CD 1 1 7 4542 1 1 26 ARG CG C -8.329 2.311 4.870 1.00 . A A . 26 ARG CG 1 1 7 4543 1 1 26 ARG CZ C -8.883 -1.132 5.832 1.00 . A A . 26 ARG CZ 1 1 7 4544 1 1 26 ARG H H -4.300 3.282 6.851 1.00 . A A . 26 ARG H 1 1 7 4545 1 1 26 ARG HA H -6.497 4.298 5.133 1.00 . A A . 26 ARG HA 1 1 7 4546 1 1 26 ARG HB2 H -6.272 1.714 4.574 1.00 . A A . 26 ARG HB2 1 1 7 4547 1 1 26 ARG HB3 H -6.857 1.435 6.212 1.00 . A A . 26 ARG HB3 1 1 7 4548 1 1 26 ARG HD2 H -9.948 1.214 3.941 1.00 . A A . 26 ARG HD2 1 1 7 4549 1 1 26 ARG HD3 H -8.380 0.467 3.705 1.00 . A A . 26 ARG HD3 1 1 7 4550 1 1 26 ARG HG2 H -8.956 2.825 5.622 1.00 . A A . 26 ARG HG2 1 1 7 4551 1 1 26 ARG HG3 H -8.325 2.982 3.991 1.00 . A A . 26 ARG HG3 1 1 7 4552 1 1 26 ARG HH11 H -7.825 -1.296 4.129 1.00 . A A . 26 ARG HH11 1 1 7 4553 1 1 26 ARG HH12 H -7.834 -2.747 5.252 1.00 . A A . 26 ARG HH12 1 1 7 4554 1 1 26 ARG HH21 H -9.855 -1.219 7.580 1.00 . A A . 26 ARG HH21 1 1 7 4555 1 1 26 ARG HH22 H -8.905 -2.704 7.071 1.00 . A A . 26 ARG HH22 1 1 7 4556 1 1 26 ARG N N -4.743 3.392 5.928 1.00 . A A . 26 ARG N 1 1 7 4557 1 1 26 ARG NE N -9.324 0.127 5.634 1.00 . A A . 26 ARG NE 1 1 7 4558 1 1 26 ARG NH1 N -8.099 -1.793 4.983 1.00 . A A . 26 ARG NH1 1 1 7 4559 1 1 26 ARG NH2 N -9.252 -1.748 6.940 1.00 . A A . 26 ARG NH2 1 1 7 4560 1 1 26 ARG O O -6.104 3.442 8.283 1.00 . A A . 26 ARG O 1 1 7 4561 1 1 27 CYS C C -8.705 4.345 9.726 1.00 . A A . 27 CYS C 1 1 7 4562 1 1 27 CYS CA C -8.028 5.329 8.717 1.00 . A A . 27 CYS CA 1 1 7 4563 1 1 27 CYS CB C -8.988 6.553 8.556 1.00 . A A . 27 CYS CB 1 1 7 4564 1 1 27 CYS H H -8.134 5.078 6.519 1.00 . A A . 27 CYS H 1 1 7 4565 1 1 27 CYS HA H -7.033 5.645 9.031 1.00 . A A . 27 CYS HA 1 1 7 4566 1 1 27 CYS HB2 H -9.745 6.340 7.816 1.00 . A A . 27 CYS HB2 1 1 7 4567 1 1 27 CYS HB3 H -9.571 6.767 9.472 1.00 . A A . 27 CYS HB3 1 1 7 4568 1 1 27 CYS N N -7.726 4.736 7.396 1.00 . A A . 27 CYS N 1 1 7 4569 1 1 27 CYS O O -9.193 3.254 9.419 1.00 . A A . 27 CYS O 1 1 7 4570 1 1 27 CYS SG S -8.243 8.141 8.147 1.00 . A A . 27 CYS SG 1 1 7 4571 1 1 28 SER C C -10.878 4.117 12.052 1.00 . A A . 28 SER C 1 1 7 4572 1 1 28 SER CA C -9.323 4.273 12.181 1.00 . A A . 28 SER CA 1 1 7 4573 1 1 28 SER CB C -8.858 5.242 13.321 1.00 . A A . 28 SER CB 1 1 7 4574 1 1 28 SER H H -8.293 5.802 10.999 1.00 . A A . 28 SER H 1 1 7 4575 1 1 28 SER HA H -8.950 3.263 12.409 1.00 . A A . 28 SER HA 1 1 7 4576 1 1 28 SER HB2 H -7.806 5.568 13.211 1.00 . A A . 28 SER HB2 1 1 7 4577 1 1 28 SER HB3 H -9.456 6.174 13.338 1.00 . A A . 28 SER HB3 1 1 7 4578 1 1 28 SER HG H -9.885 4.381 14.700 1.00 . A A . 28 SER HG 1 1 7 4579 1 1 28 SER N N -8.678 4.852 10.977 1.00 . A A . 28 SER N 1 1 7 4580 1 1 28 SER O O -11.483 4.134 10.974 1.00 . A A . 28 SER O 1 1 7 4581 1 1 28 SER OG O -8.960 4.612 14.592 1.00 . A A . 28 SER OG 1 1 7 4582 1 1 29 MET C C -13.893 4.796 13.012 1.00 . A A . 29 MET C 1 1 7 4583 1 1 29 MET CA C -12.948 3.608 13.373 1.00 . A A . 29 MET CA 1 1 7 4584 1 1 29 MET CB C -13.180 3.212 14.859 1.00 . A A . 29 MET CB 1 1 7 4585 1 1 29 MET CE C -12.858 -0.956 14.963 1.00 . A A . 29 MET CE 1 1 7 4586 1 1 29 MET CG C -12.700 1.804 15.254 1.00 . A A . 29 MET CG 1 1 7 4587 1 1 29 MET H H -10.837 4.079 13.981 1.00 . A A . 29 MET H 1 1 7 4588 1 1 29 MET HA H -13.220 2.762 12.712 1.00 . A A . 29 MET HA 1 1 7 4589 1 1 29 MET HB2 H -12.719 3.956 15.539 1.00 . A A . 29 MET HB2 1 1 7 4590 1 1 29 MET HB3 H -14.258 3.276 15.090 1.00 . A A . 29 MET HB3 1 1 7 4591 1 1 29 MET HE1 H -11.771 -0.972 14.764 1.00 . A A . 29 MET HE1 1 1 7 4592 1 1 29 MET HE2 H -13.013 -1.039 16.054 1.00 . A A . 29 MET HE2 1 1 7 4593 1 1 29 MET HE3 H -13.307 -1.845 14.484 1.00 . A A . 29 MET HE3 1 1 7 4594 1 1 29 MET HG2 H -11.614 1.691 15.077 1.00 . A A . 29 MET HG2 1 1 7 4595 1 1 29 MET HG3 H -12.862 1.637 16.334 1.00 . A A . 29 MET HG3 1 1 7 4596 1 1 29 MET N N -11.496 3.915 13.215 1.00 . A A . 29 MET N 1 1 7 4597 1 1 29 MET O O -14.967 4.559 12.451 1.00 . A A . 29 MET O 1 1 7 4598 1 1 29 MET SD S -13.607 0.553 14.318 1.00 . A A . 29 MET SD 1 1 7 4599 1 1 30 ILE C C -14.326 7.677 11.583 1.00 . A A . 30 ILE C 1 1 7 4600 1 1 30 ILE CA C -14.355 7.256 13.095 1.00 . A A . 30 ILE CA 1 1 7 4601 1 1 30 ILE CB C -13.884 8.467 14.008 1.00 . A A . 30 ILE CB 1 1 7 4602 1 1 30 ILE CD1 C -11.897 10.065 14.619 1.00 . A A . 30 ILE CD1 1 1 7 4603 1 1 30 ILE CG1 C -12.335 8.708 14.043 1.00 . A A . 30 ILE CG1 1 1 7 4604 1 1 30 ILE CG2 C -14.384 8.188 15.452 1.00 . A A . 30 ILE CG2 1 1 7 4605 1 1 30 ILE H H -12.536 6.065 13.674 1.00 . A A . 30 ILE H 1 1 7 4606 1 1 30 ILE HA H -15.407 7.017 13.326 1.00 . A A . 30 ILE HA 1 1 7 4607 1 1 30 ILE HB H -14.349 9.404 13.646 1.00 . A A . 30 ILE HB 1 1 7 4608 1 1 30 ILE HD11 H -12.329 10.907 14.048 1.00 . A A . 30 ILE HD11 1 1 7 4609 1 1 30 ILE HD12 H -12.196 10.186 15.676 1.00 . A A . 30 ILE HD12 1 1 7 4610 1 1 30 ILE HD13 H -10.798 10.176 14.580 1.00 . A A . 30 ILE HD13 1 1 7 4611 1 1 30 ILE HG12 H -11.823 7.897 14.596 1.00 . A A . 30 ILE HG12 1 1 7 4612 1 1 30 ILE HG13 H -11.924 8.651 13.023 1.00 . A A . 30 ILE HG13 1 1 7 4613 1 1 30 ILE HG21 H -15.479 8.037 15.482 1.00 . A A . 30 ILE HG21 1 1 7 4614 1 1 30 ILE HG22 H -13.918 7.289 15.898 1.00 . A A . 30 ILE HG22 1 1 7 4615 1 1 30 ILE HG23 H -14.174 9.033 16.133 1.00 . A A . 30 ILE HG23 1 1 7 4616 1 1 30 ILE N N -13.512 6.041 13.348 1.00 . A A . 30 ILE N 1 1 7 4617 1 1 30 ILE O O -15.394 8.001 11.054 1.00 . A A . 30 ILE O 1 1 7 4618 1 1 31 GLY C C -11.829 9.081 9.232 1.00 . A A . 31 GLY C 1 1 7 4619 1 1 31 GLY CA C -13.039 8.160 9.503 1.00 . A A . 31 GLY CA 1 1 7 4620 1 1 31 GLY H H -12.366 7.480 11.518 1.00 . A A . 31 GLY H 1 1 7 4621 1 1 31 GLY HA2 H -12.963 7.275 8.845 1.00 . A A . 31 GLY HA2 1 1 7 4622 1 1 31 GLY HA3 H -13.950 8.689 9.164 1.00 . A A . 31 GLY HA3 1 1 7 4623 1 1 31 GLY N N -13.165 7.674 10.904 1.00 . A A . 31 GLY N 1 1 7 4624 1 1 31 GLY O O -11.145 8.908 8.222 1.00 . A A . 31 GLY O 1 1 7 4625 1 1 32 THR C C -9.386 10.477 11.183 1.00 . A A . 32 THR C 1 1 7 4626 1 1 32 THR CA C -10.398 10.951 10.088 1.00 . A A . 32 THR CA 1 1 7 4627 1 1 32 THR CB C -10.807 12.443 10.344 1.00 . A A . 32 THR CB 1 1 7 4628 1 1 32 THR CG2 C -11.674 13.021 9.208 1.00 . A A . 32 THR CG2 1 1 7 4629 1 1 32 THR H H -12.189 9.974 10.956 1.00 . A A . 32 THR H 1 1 7 4630 1 1 32 THR HA H -9.899 10.894 9.100 1.00 . A A . 32 THR HA 1 1 7 4631 1 1 32 THR HB H -9.879 13.040 10.423 1.00 . A A . 32 THR HB 1 1 7 4632 1 1 32 THR HG1 H -10.994 12.218 12.250 1.00 . A A . 32 THR HG1 1 1 7 4633 1 1 32 THR HG21 H -11.157 12.962 8.232 1.00 . A A . 32 THR HG21 1 1 7 4634 1 1 32 THR HG22 H -12.640 12.492 9.104 1.00 . A A . 32 THR HG22 1 1 7 4635 1 1 32 THR HG23 H -11.906 14.087 9.387 1.00 . A A . 32 THR HG23 1 1 7 4636 1 1 32 THR N N -11.606 10.068 10.115 1.00 . A A . 32 THR N 1 1 7 4637 1 1 32 THR O O -9.722 9.691 12.076 1.00 . A A . 32 THR O 1 1 7 4638 1 1 32 THR OG1 O -11.560 12.558 11.553 1.00 . A A . 32 THR OG1 1 1 7 4639 1 1 33 ASN C C -6.599 9.139 11.688 1.00 . A A . 33 ASN C 1 1 7 4640 1 1 33 ASN CA C -6.978 10.612 11.999 1.00 . A A . 33 ASN CA 1 1 7 4641 1 1 33 ASN CB C -7.316 10.799 13.520 1.00 . A A . 33 ASN CB 1 1 7 4642 1 1 33 ASN CG C -7.445 12.265 13.973 1.00 . A A . 33 ASN CG 1 1 7 4643 1 1 33 ASN H H -7.920 11.479 10.231 1.00 . A A . 33 ASN H 1 1 7 4644 1 1 33 ASN HA H -6.116 11.260 11.747 1.00 . A A . 33 ASN HA 1 1 7 4645 1 1 33 ASN HB2 H -8.239 10.271 13.813 1.00 . A A . 33 ASN HB2 1 1 7 4646 1 1 33 ASN HB3 H -6.555 10.274 14.131 1.00 . A A . 33 ASN HB3 1 1 7 4647 1 1 33 ASN HD21 H -5.517 12.300 14.527 1.00 . A A . 33 ASN HD21 1 1 7 4648 1 1 33 ASN HD22 H -6.487 13.838 14.768 1.00 . A A . 33 ASN HD22 1 1 7 4649 1 1 33 ASN N N -8.125 10.972 11.099 1.00 . A A . 33 ASN N 1 1 7 4650 1 1 33 ASN ND2 N -6.373 12.862 14.473 1.00 . A A . 33 ASN ND2 1 1 7 4651 1 1 33 ASN O O -6.907 8.216 12.453 1.00 . A A . 33 ASN O 1 1 7 4652 1 1 33 ASN OD1 O -8.513 12.870 13.875 1.00 . A A . 33 ASN OD1 1 1 7 4653 1 1 34 CYS C C -4.646 6.764 10.819 1.00 . A A . 34 CYS C 1 1 7 4654 1 1 34 CYS CA C -5.717 7.562 10.011 1.00 . A A . 34 CYS CA 1 1 7 4655 1 1 34 CYS CB C -5.212 7.593 8.533 1.00 . A A . 34 CYS CB 1 1 7 4656 1 1 34 CYS H H -5.912 9.787 9.948 1.00 . A A . 34 CYS H 1 1 7 4657 1 1 34 CYS HA H -6.696 7.086 10.082 1.00 . A A . 34 CYS HA 1 1 7 4658 1 1 34 CYS HB2 H -4.379 8.279 8.475 1.00 . A A . 34 CYS HB2 1 1 7 4659 1 1 34 CYS HB3 H -4.823 6.603 8.226 1.00 . A A . 34 CYS HB3 1 1 7 4660 1 1 34 CYS N N -5.930 8.938 10.531 1.00 . A A . 34 CYS N 1 1 7 4661 1 1 34 CYS O O -3.893 7.325 11.623 1.00 . A A . 34 CYS O 1 1 7 4662 1 1 34 CYS SG S -6.472 7.948 7.305 1.00 . A A . 34 CYS SG 1 1 7 4663 1 1 35 GLU C C -2.877 3.712 9.920 1.00 . A A . 35 GLU C 1 1 7 4664 1 1 35 GLU CA C -3.478 4.583 11.087 1.00 . A A . 35 GLU CA 1 1 7 4665 1 1 35 GLU CB C -3.945 3.629 12.229 1.00 . A A . 35 GLU CB 1 1 7 4666 1 1 35 GLU CD C -5.208 3.095 14.378 1.00 . A A . 35 GLU CD 1 1 7 4667 1 1 35 GLU CG C -4.935 4.141 13.295 1.00 . A A . 35 GLU CG 1 1 7 4668 1 1 35 GLU H H -5.249 5.148 9.813 1.00 . A A . 35 GLU H 1 1 7 4669 1 1 35 GLU HA H -2.689 5.253 11.474 1.00 . A A . 35 GLU HA 1 1 7 4670 1 1 35 GLU HB2 H -4.271 2.665 11.801 1.00 . A A . 35 GLU HB2 1 1 7 4671 1 1 35 GLU HB3 H -3.026 3.347 12.774 1.00 . A A . 35 GLU HB3 1 1 7 4672 1 1 35 GLU HE2 H -6.484 1.681 14.782 1.00 . A A . 35 GLU HE2 1 1 7 4673 1 1 35 GLU HG2 H -4.539 5.061 13.765 1.00 . A A . 35 GLU HG2 1 1 7 4674 1 1 35 GLU HG3 H -5.885 4.433 12.814 1.00 . A A . 35 GLU HG3 1 1 7 4675 1 1 35 GLU N N -4.599 5.433 10.569 1.00 . A A . 35 GLU N 1 1 7 4676 1 1 35 GLU O O -3.343 3.743 8.776 1.00 . A A . 35 GLU O 1 1 7 4677 1 1 35 GLU OE1 O -4.500 2.952 15.375 1.00 . A A . 35 GLU OE1 1 1 7 4678 1 1 35 GLU OE2 O -6.319 2.338 14.102 1.00 . A A . 35 GLU OE2 1 1 7 4679 1 1 36 CYS C C -1.834 0.794 8.942 1.00 . A A . 36 CYS C 1 1 7 4680 1 1 36 CYS CA C -1.067 2.131 9.201 1.00 . A A . 36 CYS CA 1 1 7 4681 1 1 36 CYS CB C 0.406 1.771 9.635 1.00 . A A . 36 CYS CB 1 1 7 4682 1 1 36 CYS H H -1.657 2.882 11.237 1.00 . A A . 36 CYS H 1 1 7 4683 1 1 36 CYS HA H -1.012 2.737 8.261 1.00 . A A . 36 CYS HA 1 1 7 4684 1 1 36 CYS HB2 H 1.005 2.584 10.097 1.00 . A A . 36 CYS HB2 1 1 7 4685 1 1 36 CYS HB3 H 0.418 0.962 10.382 1.00 . A A . 36 CYS HB3 1 1 7 4686 1 1 36 CYS N N -1.815 2.924 10.223 1.00 . A A . 36 CYS N 1 1 7 4687 1 1 36 CYS O O -2.317 0.139 9.873 1.00 . A A . 36 CYS O 1 1 7 4688 1 1 36 CYS SG S 1.182 1.269 8.108 1.00 . A A . 36 CYS SG 1 1 7 4689 1 1 37 THR C C -1.218 -1.812 6.738 1.00 . A A . 37 THR C 1 1 7 4690 1 1 37 THR CA C -2.424 -0.968 7.284 1.00 . A A . 37 THR CA 1 1 7 4691 1 1 37 THR CB C -3.529 -0.905 6.189 1.00 . A A . 37 THR CB 1 1 7 4692 1 1 37 THR CG2 C -4.862 -0.409 6.768 1.00 . A A . 37 THR CG2 1 1 7 4693 1 1 37 THR H H -1.464 1.004 6.980 1.00 . A A . 37 THR H 1 1 7 4694 1 1 37 THR HA H -2.880 -1.467 8.158 1.00 . A A . 37 THR HA 1 1 7 4695 1 1 37 THR HB H -3.676 -1.932 5.803 1.00 . A A . 37 THR HB 1 1 7 4696 1 1 37 THR HG1 H -2.350 -0.369 4.762 1.00 . A A . 37 THR HG1 1 1 7 4697 1 1 37 THR HG21 H -5.208 -1.042 7.606 1.00 . A A . 37 THR HG21 1 1 7 4698 1 1 37 THR HG22 H -4.793 0.630 7.143 1.00 . A A . 37 THR HG22 1 1 7 4699 1 1 37 THR HG23 H -5.652 -0.440 5.998 1.00 . A A . 37 THR HG23 1 1 7 4700 1 1 37 THR N N -1.909 0.381 7.663 1.00 . A A . 37 THR N 1 1 7 4701 1 1 37 THR O O -0.585 -1.387 5.762 1.00 . A A . 37 THR O 1 1 7 4702 1 1 37 THR OG1 O -3.167 -0.022 5.127 1.00 . A A . 37 THR OG1 1 1 7 4703 1 1 38 PRO C C -0.027 -4.745 5.628 1.00 . A A . 38 PRO C 1 1 7 4704 1 1 38 PRO CA C 0.269 -3.830 6.855 1.00 . A A . 38 PRO CA 1 1 7 4705 1 1 38 PRO CB C 0.601 -4.645 8.119 1.00 . A A . 38 PRO CB 1 1 7 4706 1 1 38 PRO CD C -1.492 -3.529 8.547 1.00 . A A . 38 PRO CD 1 1 7 4707 1 1 38 PRO CG C -0.728 -4.816 8.855 1.00 . A A . 38 PRO CG 1 1 7 4708 1 1 38 PRO HA H 1.132 -3.181 6.596 1.00 . A A . 38 PRO HA 1 1 7 4709 1 1 38 PRO HB2 H 1.091 -5.615 7.920 1.00 . A A . 38 PRO HB2 1 1 7 4710 1 1 38 PRO HB3 H 1.299 -4.069 8.749 1.00 . A A . 38 PRO HB3 1 1 7 4711 1 1 38 PRO HD2 H -2.572 -3.727 8.436 1.00 . A A . 38 PRO HD2 1 1 7 4712 1 1 38 PRO HD3 H -1.378 -2.787 9.358 1.00 . A A . 38 PRO HD3 1 1 7 4713 1 1 38 PRO HG2 H -1.274 -5.691 8.455 1.00 . A A . 38 PRO HG2 1 1 7 4714 1 1 38 PRO HG3 H -0.598 -4.981 9.938 1.00 . A A . 38 PRO HG3 1 1 7 4715 1 1 38 PRO N N -0.888 -3.013 7.300 1.00 . A A . 38 PRO N 1 1 7 4716 1 1 38 PRO O O -1.135 -5.274 5.480 1.00 . A A . 38 PRO O 1 1 7 4717 1 1 39 ARG C C 1.342 -7.388 4.327 1.00 . A A . 39 ARG C 1 1 7 4718 1 1 39 ARG CA C 0.956 -6.003 3.712 1.00 . A A . 39 ARG CA 1 1 7 4719 1 1 39 ARG CB C 1.917 -5.617 2.548 1.00 . A A . 39 ARG CB 1 1 7 4720 1 1 39 ARG CD C 2.340 -4.137 0.437 1.00 . A A . 39 ARG CD 1 1 7 4721 1 1 39 ARG CG C 1.522 -4.364 1.728 1.00 . A A . 39 ARG CG 1 1 7 4722 1 1 39 ARG CZ C 4.687 -3.550 -0.238 1.00 . A A . 39 ARG CZ 1 1 7 4723 1 1 39 ARG H H 1.871 -4.481 5.033 1.00 . A A . 39 ARG H 1 1 7 4724 1 1 39 ARG HA H -0.062 -6.082 3.299 1.00 . A A . 39 ARG HA 1 1 7 4725 1 1 39 ARG HB2 H 2.950 -5.493 2.927 1.00 . A A . 39 ARG HB2 1 1 7 4726 1 1 39 ARG HB3 H 1.973 -6.473 1.848 1.00 . A A . 39 ARG HB3 1 1 7 4727 1 1 39 ARG HD2 H 2.201 -4.995 -0.248 1.00 . A A . 39 ARG HD2 1 1 7 4728 1 1 39 ARG HD3 H 1.924 -3.258 -0.091 1.00 . A A . 39 ARG HD3 1 1 7 4729 1 1 39 ARG HG2 H 0.456 -4.442 1.445 1.00 . A A . 39 ARG HG2 1 1 7 4730 1 1 39 ARG HG3 H 1.583 -3.464 2.368 1.00 . A A . 39 ARG HG3 1 1 7 4731 1 1 39 ARG HH11 H 3.398 -3.404 -1.776 1.00 . A A . 39 ARG HH11 1 1 7 4732 1 1 39 ARG HH12 H 5.157 -3.010 -2.119 1.00 . A A . 39 ARG HH12 1 1 7 4733 1 1 39 ARG HH21 H 6.155 -3.619 1.122 1.00 . A A . 39 ARG HH21 1 1 7 4734 1 1 39 ARG HH22 H 6.614 -3.125 -0.584 1.00 . A A . 39 ARG HH22 1 1 7 4735 1 1 39 ARG N N 1.003 -4.971 4.791 1.00 . A A . 39 ARG N 1 1 7 4736 1 1 39 ARG NE N 3.789 -3.931 0.688 1.00 . A A . 39 ARG NE 1 1 7 4737 1 1 39 ARG NH1 N 4.383 -3.296 -1.509 1.00 . A A . 39 ARG NH1 1 1 7 4738 1 1 39 ARG NH2 N 5.947 -3.418 0.138 1.00 . A A . 39 ARG NH2 1 1 7 4739 1 1 39 ARG O O 0.496 -8.287 4.348 1.00 . A A . 39 ARG O 1 1 7 4740 1 1 40 LEU C C 3.097 -8.255 7.144 1.00 . A A . 40 LEU C 1 1 7 4741 1 1 40 LEU CA C 2.998 -8.715 5.652 1.00 . A A . 40 LEU CA 1 1 7 4742 1 1 40 LEU CB C 4.319 -9.264 5.019 1.00 . A A . 40 LEU CB 1 1 7 4743 1 1 40 LEU CD1 C 3.999 -11.808 5.337 1.00 . A A . 40 LEU CD1 1 1 7 4744 1 1 40 LEU CD2 C 6.320 -10.837 5.119 1.00 . A A . 40 LEU CD2 1 1 7 4745 1 1 40 LEU CG C 4.887 -10.580 5.624 1.00 . A A . 40 LEU CG 1 1 7 4746 1 1 40 LEU H H 3.142 -6.687 4.769 1.00 . A A . 40 LEU H 1 1 7 4747 1 1 40 LEU HA H 2.239 -9.515 5.614 1.00 . A A . 40 LEU HA 1 1 7 4748 1 1 40 LEU HB2 H 4.168 -9.424 3.932 1.00 . A A . 40 LEU HB2 1 1 7 4749 1 1 40 LEU HB3 H 5.096 -8.475 5.071 1.00 . A A . 40 LEU HB3 1 1 7 4750 1 1 40 LEU HD11 H 3.872 -11.985 4.252 1.00 . A A . 40 LEU HD11 1 1 7 4751 1 1 40 LEU HD12 H 4.425 -12.731 5.772 1.00 . A A . 40 LEU HD12 1 1 7 4752 1 1 40 LEU HD13 H 2.989 -11.696 5.772 1.00 . A A . 40 LEU HD13 1 1 7 4753 1 1 40 LEU HD21 H 6.997 -10.000 5.373 1.00 . A A . 40 LEU HD21 1 1 7 4754 1 1 40 LEU HD22 H 6.758 -11.746 5.573 1.00 . A A . 40 LEU HD22 1 1 7 4755 1 1 40 LEU HD23 H 6.358 -10.968 4.020 1.00 . A A . 40 LEU HD23 1 1 7 4756 1 1 40 LEU HG H 4.952 -10.463 6.722 1.00 . A A . 40 LEU HG 1 1 7 4757 1 1 40 LEU N N 2.577 -7.537 4.851 1.00 . A A . 40 LEU N 1 1 7 4758 1 1 40 LEU O O 2.090 -8.344 7.853 1.00 . A A . 40 LEU O 1 1 7 4759 1 1 41 ILE C C 5.629 -6.216 8.963 1.00 . A A . 41 ILE C 1 1 7 4760 1 1 41 ILE CA C 4.432 -7.232 9.002 1.00 . A A . 41 ILE CA 1 1 7 4761 1 1 41 ILE CB C 4.642 -8.434 10.018 1.00 . A A . 41 ILE CB 1 1 7 4762 1 1 41 ILE CD1 C 4.489 -8.938 12.587 1.00 . A A . 41 ILE CD1 1 1 7 4763 1 1 41 ILE CG1 C 4.593 -7.881 11.476 1.00 . A A . 41 ILE CG1 1 1 7 4764 1 1 41 ILE CG2 C 5.993 -9.180 9.797 1.00 . A A . 41 ILE CG2 1 1 7 4765 1 1 41 ILE H H 5.019 -7.759 6.928 1.00 . A A . 41 ILE H 1 1 7 4766 1 1 41 ILE HA H 3.511 -6.676 9.279 1.00 . A A . 41 ILE HA 1 1 7 4767 1 1 41 ILE HB H 3.813 -9.156 9.891 1.00 . A A . 41 ILE HB 1 1 7 4768 1 1 41 ILE HD11 H 3.615 -9.599 12.443 1.00 . A A . 41 ILE HD11 1 1 7 4769 1 1 41 ILE HD12 H 5.389 -9.578 12.636 1.00 . A A . 41 ILE HD12 1 1 7 4770 1 1 41 ILE HD13 H 4.378 -8.460 13.578 1.00 . A A . 41 ILE HD13 1 1 7 4771 1 1 41 ILE HG12 H 5.461 -7.226 11.680 1.00 . A A . 41 ILE HG12 1 1 7 4772 1 1 41 ILE HG13 H 3.709 -7.224 11.581 1.00 . A A . 41 ILE HG13 1 1 7 4773 1 1 41 ILE HG21 H 6.113 -9.515 8.751 1.00 . A A . 41 ILE HG21 1 1 7 4774 1 1 41 ILE HG22 H 6.873 -8.558 10.045 1.00 . A A . 41 ILE HG22 1 1 7 4775 1 1 41 ILE HG23 H 6.059 -10.091 10.419 1.00 . A A . 41 ILE HG23 1 1 7 4776 1 1 41 ILE N N 4.261 -7.761 7.617 1.00 . A A . 41 ILE N 1 1 7 4777 1 1 41 ILE O O 6.706 -6.494 8.422 1.00 . A A . 41 ILE O 1 1 7 4778 1 1 42 MET C C 6.300 -3.394 11.175 1.00 . A A . 42 MET C 1 1 7 4779 1 1 42 MET CA C 6.459 -3.993 9.744 1.00 . A A . 42 MET CA 1 1 7 4780 1 1 42 MET CB C 6.299 -2.940 8.603 1.00 . A A . 42 MET CB 1 1 7 4781 1 1 42 MET CE C 9.891 -0.834 8.893 1.00 . A A . 42 MET CE 1 1 7 4782 1 1 42 MET CG C 7.294 -1.767 8.602 1.00 . A A . 42 MET CG 1 1 7 4783 1 1 42 MET H H 4.475 -4.929 9.973 1.00 . A A . 42 MET H 1 1 7 4784 1 1 42 MET HA H 7.473 -4.436 9.666 1.00 . A A . 42 MET HA 1 1 7 4785 1 1 42 MET HB2 H 6.404 -3.451 7.629 1.00 . A A . 42 MET HB2 1 1 7 4786 1 1 42 MET HB3 H 5.272 -2.525 8.602 1.00 . A A . 42 MET HB3 1 1 7 4787 1 1 42 MET HE1 H 9.664 -0.092 8.107 1.00 . A A . 42 MET HE1 1 1 7 4788 1 1 42 MET HE2 H 9.620 -0.396 9.870 1.00 . A A . 42 MET HE2 1 1 7 4789 1 1 42 MET HE3 H 10.981 -1.016 8.888 1.00 . A A . 42 MET HE3 1 1 7 4790 1 1 42 MET HG2 H 7.137 -1.132 7.711 1.00 . A A . 42 MET HG2 1 1 7 4791 1 1 42 MET HG3 H 7.128 -1.116 9.477 1.00 . A A . 42 MET HG3 1 1 7 4792 1 1 42 MET N N 5.410 -5.034 9.566 1.00 . A A . 42 MET N 1 1 7 4793 1 1 42 MET O O 5.702 -2.329 11.357 1.00 . A A . 42 MET O 1 1 7 4794 1 1 42 MET SD S 8.993 -2.372 8.612 1.00 . A A . 42 MET SD 1 1 7 4795 1 1 43 GLU C C 5.586 -3.469 14.281 1.00 . A A . 43 GLU C 1 1 7 4796 1 1 43 GLU CA C 6.983 -3.705 13.621 1.00 . A A . 43 GLU CA 1 1 7 4797 1 1 43 GLU CB C 7.845 -2.417 13.736 1.00 . A A . 43 GLU CB 1 1 7 4798 1 1 43 GLU CD C 9.029 -0.657 15.151 1.00 . A A . 43 GLU CD 1 1 7 4799 1 1 43 GLU CG C 8.187 -1.936 15.163 1.00 . A A . 43 GLU CG 1 1 7 4800 1 1 43 GLU H H 7.309 -4.976 11.854 1.00 . A A . 43 GLU H 1 1 7 4801 1 1 43 GLU HA H 7.496 -4.531 14.155 1.00 . A A . 43 GLU HA 1 1 7 4802 1 1 43 GLU HB2 H 8.798 -2.635 13.230 1.00 . A A . 43 GLU HB2 1 1 7 4803 1 1 43 GLU HB3 H 7.375 -1.589 13.180 1.00 . A A . 43 GLU HB3 1 1 7 4804 1 1 43 GLU HE2 H 10.900 -0.116 15.182 1.00 . A A . 43 GLU HE2 1 1 7 4805 1 1 43 GLU HG2 H 7.261 -1.738 15.733 1.00 . A A . 43 GLU HG2 1 1 7 4806 1 1 43 GLU HG3 H 8.714 -2.734 15.719 1.00 . A A . 43 GLU HG3 1 1 7 4807 1 1 43 GLU N N 6.865 -4.110 12.180 1.00 . A A . 43 GLU N 1 1 7 4808 1 1 43 GLU O O 4.811 -2.581 13.911 1.00 . A A . 43 GLU O 1 1 7 4809 1 1 43 GLU OE1 O 8.543 0.472 15.105 1.00 . A A . 43 GLU OE1 1 1 7 4810 1 1 43 GLU OE2 O 10.375 -0.920 15.191 1.00 . A A . 43 GLU OE2 1 1 7 4811 1 1 44 GLY C C 2.811 -4.249 15.680 1.00 . A A . 44 GLY C 1 1 7 4812 1 1 44 GLY CA C 4.217 -4.039 16.275 1.00 . A A . 44 GLY CA 1 1 7 4813 1 1 44 GLY H H 6.186 -4.792 15.583 1.00 . A A . 44 GLY H 1 1 7 4814 1 1 44 GLY HA2 H 4.359 -4.702 17.150 1.00 . A A . 44 GLY HA2 1 1 7 4815 1 1 44 GLY HA3 H 4.285 -3.017 16.695 1.00 . A A . 44 GLY HA3 1 1 7 4816 1 1 44 GLY N N 5.346 -4.256 15.338 1.00 . A A . 44 GLY N 1 1 7 4817 1 1 44 GLY O O 2.155 -3.270 15.317 1.00 . A A . 44 GLY O 1 1 7 4818 1 1 45 LEU C C -0.027 -5.950 16.066 1.00 . A A . 45 LEU C 1 1 7 4819 1 1 45 LEU CA C 1.067 -5.865 14.962 1.00 . A A . 45 LEU CA 1 1 7 4820 1 1 45 LEU CB C 1.247 -7.212 14.200 1.00 . A A . 45 LEU CB 1 1 7 4821 1 1 45 LEU CD1 C -0.291 -6.770 12.167 1.00 . A A . 45 LEU CD1 1 1 7 4822 1 1 45 LEU CD2 C 0.282 -9.133 12.831 1.00 . A A . 45 LEU CD2 1 1 7 4823 1 1 45 LEU CG C 0.040 -7.703 13.350 1.00 . A A . 45 LEU CG 1 1 7 4824 1 1 45 LEU H H 3.017 -6.231 15.934 1.00 . A A . 45 LEU H 1 1 7 4825 1 1 45 LEU HA H 0.775 -5.096 14.223 1.00 . A A . 45 LEU HA 1 1 7 4826 1 1 45 LEU HB2 H 2.125 -7.134 13.528 1.00 . A A . 45 LEU HB2 1 1 7 4827 1 1 45 LEU HB3 H 1.523 -8.003 14.926 1.00 . A A . 45 LEU HB3 1 1 7 4828 1 1 45 LEU HD11 H 0.562 -6.664 11.471 1.00 . A A . 45 LEU HD11 1 1 7 4829 1 1 45 LEU HD12 H -1.152 -7.141 11.581 1.00 . A A . 45 LEU HD12 1 1 7 4830 1 1 45 LEU HD13 H -0.563 -5.754 12.507 1.00 . A A . 45 LEU HD13 1 1 7 4831 1 1 45 LEU HD21 H 0.473 -9.841 13.659 1.00 . A A . 45 LEU HD21 1 1 7 4832 1 1 45 LEU HD22 H -0.596 -9.521 12.280 1.00 . A A . 45 LEU HD22 1 1 7 4833 1 1 45 LEU HD23 H 1.150 -9.187 12.147 1.00 . A A . 45 LEU HD23 1 1 7 4834 1 1 45 LEU HG H -0.849 -7.745 14.007 1.00 . A A . 45 LEU HG 1 1 7 4835 1 1 45 LEU N N 2.367 -5.515 15.591 1.00 . A A . 45 LEU N 1 1 7 4836 1 1 45 LEU O O -0.085 -6.920 16.831 1.00 . A A . 45 LEU O 1 1 7 4837 1 1 46 SER C C -3.366 -5.040 16.199 1.00 . A A . 46 SER C 1 1 7 4838 1 1 46 SER CA C -2.062 -4.883 17.038 1.00 . A A . 46 SER CA 1 1 7 4839 1 1 46 SER CB C -2.016 -3.552 17.834 1.00 . A A . 46 SER CB 1 1 7 4840 1 1 46 SER H H -0.726 -4.183 15.424 1.00 . A A . 46 SER H 1 1 7 4841 1 1 46 SER HA H -2.029 -5.705 17.781 1.00 . A A . 46 SER HA 1 1 7 4842 1 1 46 SER HB2 H -2.872 -3.500 18.533 1.00 . A A . 46 SER HB2 1 1 7 4843 1 1 46 SER HB3 H -1.115 -3.522 18.476 1.00 . A A . 46 SER HB3 1 1 7 4844 1 1 46 SER HG H -1.247 -2.460 16.445 1.00 . A A . 46 SER HG 1 1 7 4845 1 1 46 SER N N -0.891 -4.919 16.119 1.00 . A A . 46 SER N 1 1 7 4846 1 1 46 SER O O -4.058 -4.067 15.876 1.00 . A A . 46 SER O 1 1 7 4847 1 1 46 SER OG O -2.028 -2.394 17.000 1.00 . A A . 46 SER OG 1 1 7 4848 1 1 47 PHE C C -6.125 -6.756 15.500 1.00 . A A . 47 PHE C 1 1 7 4849 1 1 47 PHE CA C -4.728 -6.604 14.820 1.00 . A A . 47 PHE CA 1 1 7 4850 1 1 47 PHE CB C -4.254 -7.886 14.063 1.00 . A A . 47 PHE CB 1 1 7 4851 1 1 47 PHE CD1 C -4.633 -7.627 11.559 1.00 . A A . 47 PHE CD1 1 1 7 4852 1 1 47 PHE CD2 C -6.139 -9.053 12.799 1.00 . A A . 47 PHE CD2 1 1 7 4853 1 1 47 PHE CE1 C -5.338 -7.901 10.389 1.00 . A A . 47 PHE CE1 1 1 7 4854 1 1 47 PHE CE2 C -6.842 -9.325 11.628 1.00 . A A . 47 PHE CE2 1 1 7 4855 1 1 47 PHE CG C -5.032 -8.197 12.774 1.00 . A A . 47 PHE CG 1 1 7 4856 1 1 47 PHE CZ C -6.442 -8.749 10.425 1.00 . A A . 47 PHE CZ 1 1 7 4857 1 1 47 PHE H H -3.028 -7.016 16.165 1.00 . A A . 47 PHE H 1 1 7 4858 1 1 47 PHE HA H -4.817 -5.779 14.094 1.00 . A A . 47 PHE HA 1 1 7 4859 1 1 47 PHE HB2 H -3.185 -7.783 13.789 1.00 . A A . 47 PHE HB2 1 1 7 4860 1 1 47 PHE HB3 H -4.263 -8.765 14.737 1.00 . A A . 47 PHE HB3 1 1 7 4861 1 1 47 PHE HD1 H -3.779 -6.965 11.517 1.00 . A A . 47 PHE HD1 1 1 7 4862 1 1 47 PHE HD2 H -6.463 -9.505 13.726 1.00 . A A . 47 PHE HD2 1 1 7 4863 1 1 47 PHE HE1 H -5.029 -7.454 9.456 1.00 . A A . 47 PHE HE1 1 1 7 4864 1 1 47 PHE HE2 H -7.698 -9.984 11.653 1.00 . A A . 47 PHE HE2 1 1 7 4865 1 1 47 PHE HZ H -6.988 -8.962 9.517 1.00 . A A . 47 PHE HZ 1 1 7 4866 1 1 47 PHE N N -3.679 -6.297 15.830 1.00 . A A . 47 PHE N 1 1 7 4867 1 1 47 PHE O O -7.008 -5.934 15.237 1.00 . A A . 47 PHE O 1 1 7 4868 1 1 48 ALA C C -7.631 -7.348 18.423 1.00 . A A . 48 ALA C 1 1 7 4869 1 1 48 ALA CA C -7.607 -8.040 17.040 1.00 . A A . 48 ALA CA 1 1 7 4870 1 1 48 ALA CB C -7.781 -9.565 17.179 1.00 . A A . 48 ALA CB 1 1 7 4871 1 1 48 ALA H H -5.492 -8.376 16.458 1.00 . A A . 48 ALA H 1 1 7 4872 1 1 48 ALA HXT H -6.680 -7.351 20.126 1.00 . A A . 48 ALA HXT 1 1 7 4873 1 1 48 ALA HA H -8.458 -7.652 16.446 1.00 . A A . 48 ALA HA 1 1 7 4874 1 1 48 ALA HB1 H -6.967 -10.037 17.763 1.00 . A A . 48 ALA HB1 1 1 7 4875 1 1 48 ALA HB2 H -8.732 -9.818 17.683 1.00 . A A . 48 ALA HB2 1 1 7 4876 1 1 48 ALA HB3 H -7.806 -10.063 16.191 1.00 . A A . 48 ALA HB3 1 1 7 4877 1 1 48 ALA N N -6.318 -7.779 16.355 1.00 . A A . 48 ALA N 1 1 7 4878 1 1 48 ALA O O -8.454 -6.481 18.717 1.00 . A A . 48 ALA O 1 1 7 4879 1 1 48 ALA OXT O -6.647 -7.795 19.276 1.00 . A A . 48 ALA OXT 1 1 8 4880 1 1 1 GLU C C 7.584 11.502 4.062 1.00 . A A . 1 GLU C 1 1 8 4881 1 1 1 GLU CA C 6.315 10.999 3.311 1.00 . A A . 1 GLU CA 1 1 8 4882 1 1 1 GLU CB C 6.085 9.470 3.505 1.00 . A A . 1 GLU CB 1 1 8 4883 1 1 1 GLU CD C 6.724 7.003 3.252 1.00 . A A . 1 GLU CD 1 1 8 4884 1 1 1 GLU CG C 7.127 8.453 2.976 1.00 . A A . 1 GLU CG 1 1 8 4885 1 1 1 GLU H1 H 6.600 12.306 1.705 1.00 . A A . 1 GLU H1 1 1 8 4886 1 1 1 GLU H2 H 5.652 11.006 1.329 1.00 . A A . 1 GLU H2 1 1 8 4887 1 1 1 GLU HA H 5.428 11.545 3.688 1.00 . A A . 1 GLU HA 1 1 8 4888 1 1 1 GLU HB2 H 5.942 9.287 4.586 1.00 . A A . 1 GLU HB2 1 1 8 4889 1 1 1 GLU HB3 H 5.102 9.220 3.061 1.00 . A A . 1 GLU HB3 1 1 8 4890 1 1 1 GLU HE2 H 6.821 5.694 4.687 1.00 . A A . 1 GLU HE2 1 1 8 4891 1 1 1 GLU HG2 H 7.268 8.584 1.887 1.00 . A A . 1 GLU HG2 1 1 8 4892 1 1 1 GLU HG3 H 8.118 8.640 3.428 1.00 . A A . 1 GLU HG3 1 1 8 4893 1 1 1 GLU N N 6.473 11.301 1.869 1.00 . A A . 1 GLU N 1 1 8 4894 1 1 1 GLU O O 8.711 11.080 3.777 1.00 . A A . 1 GLU O 1 1 8 4895 1 1 1 GLU OE1 O 6.150 6.286 2.433 1.00 . A A . 1 GLU OE1 1 1 8 4896 1 1 1 GLU OE2 O 7.076 6.603 4.513 1.00 . A A . 1 GLU OE2 1 1 8 4897 1 1 2 ASP C C 8.440 12.517 7.251 1.00 . A A . 2 ASP C 1 1 8 4898 1 1 2 ASP CA C 8.476 13.065 5.795 1.00 . A A . 2 ASP CA 1 1 8 4899 1 1 2 ASP CB C 8.276 14.606 5.750 1.00 . A A . 2 ASP CB 1 1 8 4900 1 1 2 ASP CG C 9.428 15.424 6.352 1.00 . A A . 2 ASP CG 1 1 8 4901 1 1 2 ASP H H 6.396 12.693 5.156 1.00 . A A . 2 ASP H 1 1 8 4902 1 1 2 ASP HA H 9.463 12.840 5.339 1.00 . A A . 2 ASP HA 1 1 8 4903 1 1 2 ASP HB2 H 8.147 14.937 4.701 1.00 . A A . 2 ASP HB2 1 1 8 4904 1 1 2 ASP HB3 H 7.332 14.893 6.253 1.00 . A A . 2 ASP HB3 1 1 8 4905 1 1 2 ASP HD2 H 10.331 15.082 4.662 1.00 . A A . 2 ASP HD2 1 1 8 4906 1 1 2 ASP N N 7.377 12.426 5.021 1.00 . A A . 2 ASP N 1 1 8 4907 1 1 2 ASP O O 7.456 12.719 7.971 1.00 . A A . 2 ASP O 1 1 8 4908 1 1 2 ASP OD1 O 9.391 15.917 7.479 1.00 . A A . 2 ASP OD1 1 1 8 4909 1 1 2 ASP OD2 O 10.493 15.534 5.494 1.00 . A A . 2 ASP OD2 1 1 8 4910 1 1 3 ASN C C 8.540 9.976 9.039 1.00 . A A . 3 ASN C 1 1 8 4911 1 1 3 ASN CA C 9.661 11.070 8.964 1.00 . A A . 3 ASN CA 1 1 8 4912 1 1 3 ASN CB C 9.538 11.991 10.192 1.00 . A A . 3 ASN CB 1 1 8 4913 1 1 3 ASN CG C 10.445 13.235 10.272 1.00 . A A . 3 ASN CG 1 1 8 4914 1 1 3 ASN H H 10.200 11.626 6.907 1.00 . A A . 3 ASN H 1 1 8 4915 1 1 3 ASN HA H 10.663 10.595 8.998 1.00 . A A . 3 ASN HA 1 1 8 4916 1 1 3 ASN HB2 H 8.489 12.276 10.162 1.00 . A A . 3 ASN HB2 1 1 8 4917 1 1 3 ASN HB3 H 9.646 11.401 11.123 1.00 . A A . 3 ASN HB3 1 1 8 4918 1 1 3 ASN HD21 H 11.991 12.105 10.872 1.00 . A A . 3 ASN HD21 1 1 8 4919 1 1 3 ASN HD22 H 12.284 13.909 10.702 1.00 . A A . 3 ASN HD22 1 1 8 4920 1 1 3 ASN N N 9.525 11.812 7.657 1.00 . A A . 3 ASN N 1 1 8 4921 1 1 3 ASN ND2 N 11.701 13.066 10.657 1.00 . A A . 3 ASN ND2 1 1 8 4922 1 1 3 ASN O O 7.471 10.094 9.645 1.00 . A A . 3 ASN O 1 1 8 4923 1 1 3 ASN OD1 O 10.019 14.354 9.989 1.00 . A A . 3 ASN OD1 1 1 8 4924 1 1 4 CYS C C 7.299 7.051 9.114 1.00 . A A . 4 CYS C 1 1 8 4925 1 1 4 CYS CA C 8.052 7.777 7.942 1.00 . A A . 4 CYS CA 1 1 8 4926 1 1 4 CYS CB C 8.969 6.782 7.248 1.00 . A A . 4 CYS CB 1 1 8 4927 1 1 4 CYS H H 9.738 9.309 7.875 1.00 . A A . 4 CYS H 1 1 8 4928 1 1 4 CYS HA H 7.309 8.113 7.200 1.00 . A A . 4 CYS HA 1 1 8 4929 1 1 4 CYS HB2 H 8.208 6.079 6.992 1.00 . A A . 4 CYS HB2 1 1 8 4930 1 1 4 CYS HB3 H 9.317 7.069 6.247 1.00 . A A . 4 CYS HB3 1 1 8 4931 1 1 4 CYS N N 8.909 8.927 8.333 1.00 . A A . 4 CYS N 1 1 8 4932 1 1 4 CYS O O 7.586 7.264 10.298 1.00 . A A . 4 CYS O 1 1 8 4933 1 1 4 CYS SG S 10.137 5.813 8.226 1.00 . A A . 4 CYS SG 1 1 8 4934 1 1 5 ILE C C 5.880 3.973 9.648 1.00 . A A . 5 ILE C 1 1 8 4935 1 1 5 ILE CA C 5.470 5.461 9.753 1.00 . A A . 5 ILE CA 1 1 8 4936 1 1 5 ILE CB C 3.909 5.543 9.541 1.00 . A A . 5 ILE CB 1 1 8 4937 1 1 5 ILE CD1 C 2.054 6.962 8.548 1.00 . A A . 5 ILE CD1 1 1 8 4938 1 1 5 ILE CG1 C 3.442 6.962 9.168 1.00 . A A . 5 ILE CG1 1 1 8 4939 1 1 5 ILE CG2 C 3.195 5.081 10.848 1.00 . A A . 5 ILE CG2 1 1 8 4940 1 1 5 ILE H H 6.322 5.993 7.703 1.00 . A A . 5 ILE H 1 1 8 4941 1 1 5 ILE HA H 5.669 5.876 10.747 1.00 . A A . 5 ILE HA 1 1 8 4942 1 1 5 ILE HB H 3.544 4.868 8.762 1.00 . A A . 5 ILE HB 1 1 8 4943 1 1 5 ILE HD11 H 1.348 6.423 9.192 1.00 . A A . 5 ILE HD11 1 1 8 4944 1 1 5 ILE HD12 H 1.687 7.990 8.421 1.00 . A A . 5 ILE HD12 1 1 8 4945 1 1 5 ILE HD13 H 2.026 6.466 7.565 1.00 . A A . 5 ILE HD13 1 1 8 4946 1 1 5 ILE HG12 H 3.496 7.623 10.039 1.00 . A A . 5 ILE HG12 1 1 8 4947 1 1 5 ILE HG13 H 4.105 7.418 8.419 1.00 . A A . 5 ILE HG13 1 1 8 4948 1 1 5 ILE HG21 H 3.472 4.043 11.108 1.00 . A A . 5 ILE HG21 1 1 8 4949 1 1 5 ILE HG22 H 3.426 5.711 11.725 1.00 . A A . 5 ILE HG22 1 1 8 4950 1 1 5 ILE HG23 H 2.094 5.058 10.746 1.00 . A A . 5 ILE HG23 1 1 8 4951 1 1 5 ILE N N 6.319 6.181 8.732 1.00 . A A . 5 ILE N 1 1 8 4952 1 1 5 ILE O O 5.351 3.208 8.838 1.00 . A A . 5 ILE O 1 1 8 4953 1 1 6 ALA C C 6.437 1.031 11.037 1.00 . A A . 6 ALA C 1 1 8 4954 1 1 6 ALA CA C 7.350 2.130 10.349 1.00 . A A . 6 ALA CA 1 1 8 4955 1 1 6 ALA CB C 8.745 2.142 11.000 1.00 . A A . 6 ALA CB 1 1 8 4956 1 1 6 ALA H H 7.058 4.193 11.214 1.00 . A A . 6 ALA H 1 1 8 4957 1 1 6 ALA HA H 7.423 1.901 9.256 1.00 . A A . 6 ALA HA 1 1 8 4958 1 1 6 ALA HB1 H 9.412 2.889 10.529 1.00 . A A . 6 ALA HB1 1 1 8 4959 1 1 6 ALA HB2 H 8.700 2.370 12.083 1.00 . A A . 6 ALA HB2 1 1 8 4960 1 1 6 ALA HB3 H 9.246 1.163 10.893 1.00 . A A . 6 ALA HB3 1 1 8 4961 1 1 6 ALA N N 6.822 3.526 10.478 1.00 . A A . 6 ALA N 1 1 8 4962 1 1 6 ALA O O 6.890 -0.078 11.338 1.00 . A A . 6 ALA O 1 1 8 4963 1 1 7 GLU C C 3.060 -0.094 11.324 1.00 . A A . 7 GLU C 1 1 8 4964 1 1 7 GLU CA C 4.206 0.597 12.115 1.00 . A A . 7 GLU CA 1 1 8 4965 1 1 7 GLU CB C 3.632 1.619 13.147 1.00 . A A . 7 GLU CB 1 1 8 4966 1 1 7 GLU CD C 3.979 3.171 15.150 1.00 . A A . 7 GLU CD 1 1 8 4967 1 1 7 GLU CG C 4.620 2.140 14.218 1.00 . A A . 7 GLU CG 1 1 8 4968 1 1 7 GLU H H 5.088 2.387 11.100 1.00 . A A . 7 GLU H 1 1 8 4969 1 1 7 GLU HA H 4.697 -0.191 12.661 1.00 . A A . 7 GLU HA 1 1 8 4970 1 1 7 GLU HB2 H 3.178 2.469 12.610 1.00 . A A . 7 GLU HB2 1 1 8 4971 1 1 7 GLU HB3 H 2.786 1.157 13.693 1.00 . A A . 7 GLU HB3 1 1 8 4972 1 1 7 GLU HE2 H 3.606 5.081 15.210 1.00 . A A . 7 GLU HE2 1 1 8 4973 1 1 7 GLU HG2 H 5.002 1.293 14.818 1.00 . A A . 7 GLU HG2 1 1 8 4974 1 1 7 GLU HG3 H 5.511 2.591 13.741 1.00 . A A . 7 GLU HG3 1 1 8 4975 1 1 7 GLU N N 5.160 1.374 11.280 1.00 . A A . 7 GLU N 1 1 8 4976 1 1 7 GLU O O 2.810 0.157 10.147 1.00 . A A . 7 GLU O 1 1 8 4977 1 1 7 GLU OE1 O 3.489 2.885 16.242 1.00 . A A . 7 GLU OE1 1 1 8 4978 1 1 7 GLU OE2 O 4.010 4.437 14.623 1.00 . A A . 7 GLU OE2 1 1 8 4979 1 1 8 ASP C C 0.120 -0.966 12.757 1.00 . A A . 8 ASP C 1 1 8 4980 1 1 8 ASP CA C 1.058 -1.582 11.681 1.00 . A A . 8 ASP CA 1 1 8 4981 1 1 8 ASP CB C 0.979 -3.114 11.753 1.00 . A A . 8 ASP CB 1 1 8 4982 1 1 8 ASP CG C 2.086 -3.861 10.992 1.00 . A A . 8 ASP CG 1 1 8 4983 1 1 8 ASP H H 2.727 -1.074 13.022 1.00 . A A . 8 ASP H 1 1 8 4984 1 1 8 ASP HA H 0.773 -1.314 10.625 1.00 . A A . 8 ASP HA 1 1 8 4985 1 1 8 ASP HB2 H 0.917 -3.394 12.810 1.00 . A A . 8 ASP HB2 1 1 8 4986 1 1 8 ASP HB3 H 0.016 -3.421 11.312 1.00 . A A . 8 ASP HB3 1 1 8 4987 1 1 8 ASP HD2 H 1.120 -3.327 9.389 1.00 . A A . 8 ASP HD2 1 1 8 4988 1 1 8 ASP N N 2.357 -0.967 12.071 1.00 . A A . 8 ASP N 1 1 8 4989 1 1 8 ASP O O 0.277 -1.070 13.980 1.00 . A A . 8 ASP O 1 1 8 4990 1 1 8 ASP OD1 O 3.016 -4.438 11.553 1.00 . A A . 8 ASP OD1 1 1 8 4991 1 1 8 ASP OD2 O 1.908 -3.818 9.633 1.00 . A A . 8 ASP OD2 1 1 8 4992 1 1 9 TYR C C -1.023 1.773 13.681 1.00 . A A . 9 TYR C 1 1 8 4993 1 1 9 TYR CA C -1.787 0.683 12.833 1.00 . A A . 9 TYR CA 1 1 8 4994 1 1 9 TYR CB C -2.839 -0.126 13.655 1.00 . A A . 9 TYR CB 1 1 8 4995 1 1 9 TYR CD1 C -4.660 -0.163 11.827 1.00 . A A . 9 TYR CD1 1 1 8 4996 1 1 9 TYR CD2 C -4.052 -2.235 12.897 1.00 . A A . 9 TYR CD2 1 1 8 4997 1 1 9 TYR CE1 C -5.549 -0.844 11.002 1.00 . A A . 9 TYR CE1 1 1 8 4998 1 1 9 TYR CE2 C -4.988 -2.908 12.116 1.00 . A A . 9 TYR CE2 1 1 8 4999 1 1 9 TYR CG C -3.893 -0.853 12.779 1.00 . A A . 9 TYR CG 1 1 8 5000 1 1 9 TYR CZ C -5.724 -2.215 11.156 1.00 . A A . 9 TYR CZ 1 1 8 5001 1 1 9 TYR H H -0.806 -0.477 11.183 1.00 . A A . 9 TYR H 1 1 8 5002 1 1 9 TYR HA H -2.298 1.259 12.047 1.00 . A A . 9 TYR HA 1 1 8 5003 1 1 9 TYR HB2 H -2.345 -0.815 14.368 1.00 . A A . 9 TYR HB2 1 1 8 5004 1 1 9 TYR HB3 H -3.402 0.570 14.304 1.00 . A A . 9 TYR HB3 1 1 8 5005 1 1 9 TYR HD1 H -4.499 0.887 11.640 1.00 . A A . 9 TYR HD1 1 1 8 5006 1 1 9 TYR HD2 H -3.399 -2.798 13.541 1.00 . A A . 9 TYR HD2 1 1 8 5007 1 1 9 TYR HE1 H -6.056 -0.310 10.209 1.00 . A A . 9 TYR HE1 1 1 8 5008 1 1 9 TYR HE2 H -5.060 -3.983 12.181 1.00 . A A . 9 TYR HE2 1 1 8 5009 1 1 9 TYR HH H -6.961 -2.274 9.699 1.00 . A A . 9 TYR HH 1 1 8 5010 1 1 9 TYR N N -0.841 -0.271 12.183 1.00 . A A . 9 TYR N 1 1 8 5011 1 1 9 TYR O O -1.352 2.067 14.834 1.00 . A A . 9 TYR O 1 1 8 5012 1 1 9 TYR OH O -6.562 -2.896 10.312 1.00 . A A . 9 TYR OH 1 1 8 5013 1 1 10 GLY C C -0.282 4.875 13.391 1.00 . A A . 10 GLY C 1 1 8 5014 1 1 10 GLY CA C 0.644 3.653 13.500 1.00 . A A . 10 GLY CA 1 1 8 5015 1 1 10 GLY H H 0.189 1.976 12.109 1.00 . A A . 10 GLY H 1 1 8 5016 1 1 10 GLY HA2 H 1.116 3.583 14.485 1.00 . A A . 10 GLY HA2 1 1 8 5017 1 1 10 GLY HA3 H 1.496 3.854 12.829 1.00 . A A . 10 GLY HA3 1 1 8 5018 1 1 10 GLY N N -0.030 2.416 13.018 1.00 . A A . 10 GLY N 1 1 8 5019 1 1 10 GLY O O -1.489 4.738 13.211 1.00 . A A . 10 GLY O 1 1 8 5020 1 1 11 LYS C C -0.140 7.688 11.677 1.00 . A A . 11 LYS C 1 1 8 5021 1 1 11 LYS CA C -0.497 7.320 13.148 1.00 . A A . 11 LYS CA 1 1 8 5022 1 1 11 LYS CB C -0.167 8.529 14.052 1.00 . A A . 11 LYS CB 1 1 8 5023 1 1 11 LYS CD C -0.020 9.589 16.396 1.00 . A A . 11 LYS CD 1 1 8 5024 1 1 11 LYS CE C -0.096 9.405 17.926 1.00 . A A . 11 LYS CE 1 1 8 5025 1 1 11 LYS CG C -0.263 8.303 15.578 1.00 . A A . 11 LYS CG 1 1 8 5026 1 1 11 LYS H H 1.292 6.017 13.613 1.00 . A A . 11 LYS H 1 1 8 5027 1 1 11 LYS HA H -1.593 7.122 13.239 1.00 . A A . 11 LYS HA 1 1 8 5028 1 1 11 LYS HB2 H 0.810 8.929 13.755 1.00 . A A . 11 LYS HB2 1 1 8 5029 1 1 11 LYS HB3 H -0.872 9.341 13.788 1.00 . A A . 11 LYS HB3 1 1 8 5030 1 1 11 LYS HD2 H 0.984 9.981 16.147 1.00 . A A . 11 LYS HD2 1 1 8 5031 1 1 11 LYS HD3 H -0.725 10.382 16.079 1.00 . A A . 11 LYS HD3 1 1 8 5032 1 1 11 LYS HE2 H 0.568 8.583 18.251 1.00 . A A . 11 LYS HE2 1 1 8 5033 1 1 11 LYS HE3 H 0.293 10.314 18.421 1.00 . A A . 11 LYS HE3 1 1 8 5034 1 1 11 LYS HG2 H -1.260 7.890 15.820 1.00 . A A . 11 LYS HG2 1 1 8 5035 1 1 11 LYS HG3 H 0.466 7.530 15.887 1.00 . A A . 11 LYS HG3 1 1 8 5036 1 1 11 LYS HZ1 H -1.851 8.316 17.977 1.00 . A A . 11 LYS HZ1 1 1 8 5037 1 1 11 LYS HZ2 H -2.085 9.925 18.136 1.00 . A A . 11 LYS HZ2 1 1 8 5038 1 1 11 LYS N N 0.274 6.081 13.495 1.00 . A A . 11 LYS N 1 1 8 5039 1 1 11 LYS NZ N -1.465 9.158 18.418 1.00 . A A . 11 LYS NZ 1 1 8 5040 1 1 11 LYS O O 1.033 7.690 11.291 1.00 . A A . 11 LYS O 1 1 8 5041 1 1 12 CYS C C -2.078 9.563 9.123 1.00 . A A . 12 CYS C 1 1 8 5042 1 1 12 CYS CA C -1.009 8.512 9.490 1.00 . A A . 12 CYS CA 1 1 8 5043 1 1 12 CYS CB C -1.176 7.323 8.494 1.00 . A A . 12 CYS CB 1 1 8 5044 1 1 12 CYS H H -2.009 8.133 11.467 1.00 . A A . 12 CYS H 1 1 8 5045 1 1 12 CYS HA H -0.012 8.975 9.360 1.00 . A A . 12 CYS HA 1 1 8 5046 1 1 12 CYS HB2 H -0.701 7.570 7.527 1.00 . A A . 12 CYS HB2 1 1 8 5047 1 1 12 CYS HB3 H -0.676 6.415 8.839 1.00 . A A . 12 CYS HB3 1 1 8 5048 1 1 12 CYS N N -1.163 8.041 10.898 1.00 . A A . 12 CYS N 1 1 8 5049 1 1 12 CYS O O -3.005 9.872 9.883 1.00 . A A . 12 CYS O 1 1 8 5050 1 1 12 CYS SG S -2.888 6.882 8.154 1.00 . A A . 12 CYS SG 1 1 8 5051 1 1 13 THR C C -2.966 10.571 5.752 1.00 . A A . 13 THR C 1 1 8 5052 1 1 13 THR CA C -3.018 10.906 7.274 1.00 . A A . 13 THR CA 1 1 8 5053 1 1 13 THR CB C -2.892 12.473 7.528 1.00 . A A . 13 THR CB 1 1 8 5054 1 1 13 THR CG2 C -1.950 12.927 8.666 1.00 . A A . 13 THR CG2 1 1 8 5055 1 1 13 THR H H -1.133 9.674 7.366 1.00 . A A . 13 THR H 1 1 8 5056 1 1 13 THR HA H -4.003 10.560 7.682 1.00 . A A . 13 THR HA 1 1 8 5057 1 1 13 THR HB H -3.930 12.812 7.702 1.00 . A A . 13 THR HB 1 1 8 5058 1 1 13 THR HG1 H -1.483 12.837 6.273 1.00 . A A . 13 THR HG1 1 1 8 5059 1 1 13 THR HG21 H -2.248 12.509 9.643 1.00 . A A . 13 THR HG21 1 1 8 5060 1 1 13 THR HG22 H -0.901 12.628 8.475 1.00 . A A . 13 THR HG22 1 1 8 5061 1 1 13 THR HG23 H -1.950 14.028 8.768 1.00 . A A . 13 THR HG23 1 1 8 5062 1 1 13 THR N N -1.936 10.083 7.890 1.00 . A A . 13 THR N 1 1 8 5063 1 1 13 THR O O -1.919 10.312 5.141 1.00 . A A . 13 THR O 1 1 8 5064 1 1 13 THR OG1 O -2.375 13.167 6.400 1.00 . A A . 13 THR OG1 1 1 8 5065 1 1 14 TRP C C -4.006 12.084 3.157 1.00 . A A . 14 TRP C 1 1 8 5066 1 1 14 TRP CA C -4.309 10.639 3.661 1.00 . A A . 14 TRP CA 1 1 8 5067 1 1 14 TRP CB C -5.733 10.152 3.286 1.00 . A A . 14 TRP CB 1 1 8 5068 1 1 14 TRP CD1 C -5.269 7.649 4.144 1.00 . A A . 14 TRP CD1 1 1 8 5069 1 1 14 TRP CD2 C -7.330 8.087 3.413 1.00 . A A . 14 TRP CD2 1 1 8 5070 1 1 14 TRP CE2 C -7.245 6.734 3.830 1.00 . A A . 14 TRP CE2 1 1 8 5071 1 1 14 TRP CE3 C -8.557 8.607 2.922 1.00 . A A . 14 TRP CE3 1 1 8 5072 1 1 14 TRP CG C -6.090 8.680 3.602 1.00 . A A . 14 TRP CG 1 1 8 5073 1 1 14 TRP CH2 C -9.579 6.425 3.279 1.00 . A A . 14 TRP CH2 1 1 8 5074 1 1 14 TRP CZ2 C -8.382 5.894 3.763 1.00 . A A . 14 TRP CZ2 1 1 8 5075 1 1 14 TRP CZ3 C -9.665 7.760 2.864 1.00 . A A . 14 TRP CZ3 1 1 8 5076 1 1 14 TRP H H -4.891 11.001 5.790 1.00 . A A . 14 TRP H 1 1 8 5077 1 1 14 TRP HA H -3.587 9.922 3.216 1.00 . A A . 14 TRP HA 1 1 8 5078 1 1 14 TRP HB2 H -6.491 10.812 3.751 1.00 . A A . 14 TRP HB2 1 1 8 5079 1 1 14 TRP HB3 H -5.873 10.295 2.197 1.00 . A A . 14 TRP HB3 1 1 8 5080 1 1 14 TRP HD1 H -4.226 7.740 4.436 1.00 . A A . 14 TRP HD1 1 1 8 5081 1 1 14 TRP HE1 H -5.630 5.557 4.670 1.00 . A A . 14 TRP HE1 1 1 8 5082 1 1 14 TRP HE3 H -8.639 9.636 2.604 1.00 . A A . 14 TRP HE3 1 1 8 5083 1 1 14 TRP HH2 H -10.455 5.795 3.225 1.00 . A A . 14 TRP HH2 1 1 8 5084 1 1 14 TRP HZ2 H -8.332 4.865 4.089 1.00 . A A . 14 TRP HZ2 1 1 8 5085 1 1 14 TRP HZ3 H -10.606 8.142 2.496 1.00 . A A . 14 TRP HZ3 1 1 8 5086 1 1 14 TRP N N -4.155 10.686 5.144 1.00 . A A . 14 TRP N 1 1 8 5087 1 1 14 TRP NE1 N -5.976 6.447 4.296 1.00 . A A . 14 TRP NE1 1 1 8 5088 1 1 14 TRP O O -4.812 13.011 3.293 1.00 . A A . 14 TRP O 1 1 8 5089 1 1 15 GLY C C -1.277 13.950 3.555 1.00 . A A . 15 GLY C 1 1 8 5090 1 1 15 GLY CA C -2.159 13.554 2.340 1.00 . A A . 15 GLY CA 1 1 8 5091 1 1 15 GLY H H -2.228 11.371 2.590 1.00 . A A . 15 GLY H 1 1 8 5092 1 1 15 GLY HA2 H -1.548 13.482 1.421 1.00 . A A . 15 GLY HA2 1 1 8 5093 1 1 15 GLY HA3 H -2.916 14.333 2.140 1.00 . A A . 15 GLY HA3 1 1 8 5094 1 1 15 GLY N N -2.777 12.236 2.635 1.00 . A A . 15 GLY N 1 1 8 5095 1 1 15 GLY O O -1.582 14.906 4.272 1.00 . A A . 15 GLY O 1 1 8 5096 1 1 16 GLY C C 1.784 12.224 4.877 1.00 . A A . 16 GLY C 1 1 8 5097 1 1 16 GLY CA C 0.617 13.207 4.999 1.00 . A A . 16 GLY CA 1 1 8 5098 1 1 16 GLY H H -0.103 12.420 3.077 1.00 . A A . 16 GLY H 1 1 8 5099 1 1 16 GLY HA2 H 0.996 14.187 5.313 1.00 . A A . 16 GLY HA2 1 1 8 5100 1 1 16 GLY HA3 H -0.036 12.903 5.838 1.00 . A A . 16 GLY HA3 1 1 8 5101 1 1 16 GLY N N -0.207 13.167 3.772 1.00 . A A . 16 GLY N 1 1 8 5102 1 1 16 GLY O O 2.330 11.956 3.799 1.00 . A A . 16 GLY O 1 1 8 5103 1 1 17 THR C C 2.255 9.236 5.795 1.00 . A A . 17 THR C 1 1 8 5104 1 1 17 THR CA C 3.088 10.530 6.113 1.00 . A A . 17 THR CA 1 1 8 5105 1 1 17 THR CB C 3.788 10.345 7.517 1.00 . A A . 17 THR CB 1 1 8 5106 1 1 17 THR CG2 C 5.174 9.692 7.353 1.00 . A A . 17 THR CG2 1 1 8 5107 1 1 17 THR H H 1.663 12.155 6.820 1.00 . A A . 17 THR H 1 1 8 5108 1 1 17 THR HA H 3.877 10.700 5.350 1.00 . A A . 17 THR HA 1 1 8 5109 1 1 17 THR HB H 3.198 9.659 8.167 1.00 . A A . 17 THR HB 1 1 8 5110 1 1 17 THR HG1 H 4.533 12.120 7.558 1.00 . A A . 17 THR HG1 1 1 8 5111 1 1 17 THR HG21 H 5.145 8.778 6.736 1.00 . A A . 17 THR HG21 1 1 8 5112 1 1 17 THR HG22 H 5.934 10.351 6.894 1.00 . A A . 17 THR HG22 1 1 8 5113 1 1 17 THR HG23 H 5.569 9.359 8.327 1.00 . A A . 17 THR HG23 1 1 8 5114 1 1 17 THR N N 2.137 11.678 6.045 1.00 . A A . 17 THR N 1 1 8 5115 1 1 17 THR O O 1.112 9.028 6.248 1.00 . A A . 17 THR O 1 1 8 5116 1 1 17 THR OG1 O 3.991 11.602 8.158 1.00 . A A . 17 THR OG1 1 1 8 5117 1 1 18 LYS C C 3.631 6.110 5.392 1.00 . A A . 18 LYS C 1 1 8 5118 1 1 18 LYS CA C 2.561 6.999 4.698 1.00 . A A . 18 LYS CA 1 1 8 5119 1 1 18 LYS CB C 2.487 6.725 3.163 1.00 . A A . 18 LYS CB 1 1 8 5120 1 1 18 LYS CD C 0.348 8.106 2.510 1.00 . A A . 18 LYS CD 1 1 8 5121 1 1 18 LYS CE C -0.633 6.952 2.224 1.00 . A A . 18 LYS CE 1 1 8 5122 1 1 18 LYS CG C 1.830 7.770 2.225 1.00 . A A . 18 LYS CG 1 1 8 5123 1 1 18 LYS H H 3.893 8.738 4.816 1.00 . A A . 18 LYS H 1 1 8 5124 1 1 18 LYS HA H 1.573 6.722 5.104 1.00 . A A . 18 LYS HA 1 1 8 5125 1 1 18 LYS HB2 H 3.493 6.453 2.807 1.00 . A A . 18 LYS HB2 1 1 8 5126 1 1 18 LYS HB3 H 1.941 5.773 3.023 1.00 . A A . 18 LYS HB3 1 1 8 5127 1 1 18 LYS HD2 H 0.240 8.448 3.557 1.00 . A A . 18 LYS HD2 1 1 8 5128 1 1 18 LYS HD3 H 0.069 8.981 1.892 1.00 . A A . 18 LYS HD3 1 1 8 5129 1 1 18 LYS HE2 H -0.553 6.631 1.169 1.00 . A A . 18 LYS HE2 1 1 8 5130 1 1 18 LYS HE3 H -0.385 6.066 2.836 1.00 . A A . 18 LYS HE3 1 1 8 5131 1 1 18 LYS HG2 H 2.418 8.706 2.264 1.00 . A A . 18 LYS HG2 1 1 8 5132 1 1 18 LYS HG3 H 1.928 7.425 1.179 1.00 . A A . 18 LYS HG3 1 1 8 5133 1 1 18 LYS HZ1 H -2.132 7.576 3.496 1.00 . A A . 18 LYS HZ1 1 1 8 5134 1 1 18 LYS HZ2 H -2.655 6.557 2.331 1.00 . A A . 18 LYS HZ2 1 1 8 5135 1 1 18 LYS N N 2.941 8.403 5.000 1.00 . A A . 18 LYS N 1 1 8 5136 1 1 18 LYS NZ N -2.024 7.347 2.502 1.00 . A A . 18 LYS NZ 1 1 8 5137 1 1 18 LYS O O 4.607 6.540 6.029 1.00 . A A . 18 LYS O 1 1 8 5138 1 1 19 CYS C C 5.548 3.579 5.366 1.00 . A A . 19 CYS C 1 1 8 5139 1 1 19 CYS CA C 4.182 3.831 6.085 1.00 . A A . 19 CYS CA 1 1 8 5140 1 1 19 CYS CB C 3.305 2.603 6.317 1.00 . A A . 19 CYS CB 1 1 8 5141 1 1 19 CYS H H 2.639 4.632 4.601 1.00 . A A . 19 CYS H 1 1 8 5142 1 1 19 CYS HA H 4.335 4.293 7.087 1.00 . A A . 19 CYS HA 1 1 8 5143 1 1 19 CYS HB2 H 2.786 2.275 5.420 1.00 . A A . 19 CYS HB2 1 1 8 5144 1 1 19 CYS HB3 H 3.912 1.767 6.730 1.00 . A A . 19 CYS HB3 1 1 8 5145 1 1 19 CYS N N 3.400 4.805 5.280 1.00 . A A . 19 CYS N 1 1 8 5146 1 1 19 CYS O O 5.704 3.560 4.140 1.00 . A A . 19 CYS O 1 1 8 5147 1 1 19 CYS SG S 2.032 3.126 7.448 1.00 . A A . 19 CYS SG 1 1 8 5148 1 1 20 CYS C C 8.566 2.731 4.866 1.00 . A A . 20 CYS C 1 1 8 5149 1 1 20 CYS CA C 7.989 3.616 6.007 1.00 . A A . 20 CYS CA 1 1 8 5150 1 1 20 CYS CB C 8.742 3.250 7.306 1.00 . A A . 20 CYS CB 1 1 8 5151 1 1 20 CYS H H 6.194 3.542 7.239 1.00 . A A . 20 CYS H 1 1 8 5152 1 1 20 CYS HA H 8.086 4.680 5.843 1.00 . A A . 20 CYS HA 1 1 8 5153 1 1 20 CYS HB2 H 8.219 3.643 8.180 1.00 . A A . 20 CYS HB2 1 1 8 5154 1 1 20 CYS HB3 H 8.854 2.161 7.471 1.00 . A A . 20 CYS HB3 1 1 8 5155 1 1 20 CYS N N 6.537 3.510 6.272 1.00 . A A . 20 CYS N 1 1 8 5156 1 1 20 CYS O O 9.239 3.276 3.987 1.00 . A A . 20 CYS O 1 1 8 5157 1 1 20 CYS SG S 10.359 4.051 7.269 1.00 . A A . 20 CYS SG 1 1 8 5158 1 1 21 ARG C C 8.113 0.154 2.657 1.00 . A A . 21 ARG C 1 1 8 5159 1 1 21 ARG CA C 8.971 0.441 3.933 1.00 . A A . 21 ARG CA 1 1 8 5160 1 1 21 ARG CB C 9.270 -0.841 4.772 1.00 . A A . 21 ARG CB 1 1 8 5161 1 1 21 ARG CD C 8.443 -2.686 6.432 1.00 . A A . 21 ARG CD 1 1 8 5162 1 1 21 ARG CG C 8.075 -1.641 5.362 1.00 . A A . 21 ARG CG 1 1 8 5163 1 1 21 ARG CZ C 9.089 -2.527 8.871 1.00 . A A . 21 ARG CZ 1 1 8 5164 1 1 21 ARG H H 7.655 1.169 5.602 1.00 . A A . 21 ARG H 1 1 8 5165 1 1 21 ARG HA H 9.900 0.877 3.536 1.00 . A A . 21 ARG HA 1 1 8 5166 1 1 21 ARG HB2 H 9.873 -1.533 4.154 1.00 . A A . 21 ARG HB2 1 1 8 5167 1 1 21 ARG HB3 H 9.960 -0.561 5.592 1.00 . A A . 21 ARG HB3 1 1 8 5168 1 1 21 ARG HD2 H 7.569 -3.340 6.614 1.00 . A A . 21 ARG HD2 1 1 8 5169 1 1 21 ARG HD3 H 9.251 -3.349 6.070 1.00 . A A . 21 ARG HD3 1 1 8 5170 1 1 21 ARG HG2 H 7.318 -0.953 5.782 1.00 . A A . 21 ARG HG2 1 1 8 5171 1 1 21 ARG HG3 H 7.559 -2.159 4.533 1.00 . A A . 21 ARG HG3 1 1 8 5172 1 1 21 ARG HH11 H 8.719 -4.436 8.361 1.00 . A A . 21 ARG HH11 1 1 8 5173 1 1 21 ARG HH12 H 9.210 -4.113 10.100 1.00 . A A . 21 ARG HH12 1 1 8 5174 1 1 21 ARG HH21 H 9.507 -0.712 9.605 1.00 . A A . 21 ARG HH21 1 1 8 5175 1 1 21 ARG HH22 H 9.628 -2.134 10.759 1.00 . A A . 21 ARG HH22 1 1 8 5176 1 1 21 ARG N N 8.345 1.408 4.897 1.00 . A A . 21 ARG N 1 1 8 5177 1 1 21 ARG NE N 8.853 -2.034 7.720 1.00 . A A . 21 ARG NE 1 1 8 5178 1 1 21 ARG NH1 N 8.996 -3.826 9.138 1.00 . A A . 21 ARG NH1 1 1 8 5179 1 1 21 ARG NH2 N 9.443 -1.708 9.844 1.00 . A A . 21 ARG NH2 1 1 8 5180 1 1 21 ARG O O 8.097 -0.947 2.098 1.00 . A A . 21 ARG O 1 1 8 5181 1 1 22 GLY C C 5.187 0.464 1.340 1.00 . A A . 22 GLY C 1 1 8 5182 1 1 22 GLY CA C 6.504 1.196 1.057 1.00 . A A . 22 GLY CA 1 1 8 5183 1 1 22 GLY H H 7.519 1.930 2.946 1.00 . A A . 22 GLY H 1 1 8 5184 1 1 22 GLY HA2 H 6.299 2.238 0.747 1.00 . A A . 22 GLY HA2 1 1 8 5185 1 1 22 GLY HA3 H 6.986 0.735 0.189 1.00 . A A . 22 GLY HA3 1 1 8 5186 1 1 22 GLY N N 7.439 1.213 2.207 1.00 . A A . 22 GLY N 1 1 8 5187 1 1 22 GLY O O 4.893 -0.579 0.751 1.00 . A A . 22 GLY O 1 1 8 5188 1 1 23 ARG C C 2.041 1.423 2.927 1.00 . A A . 23 ARG C 1 1 8 5189 1 1 23 ARG CA C 3.250 0.416 2.884 1.00 . A A . 23 ARG CA 1 1 8 5190 1 1 23 ARG CB C 3.616 -0.042 4.324 1.00 . A A . 23 ARG CB 1 1 8 5191 1 1 23 ARG CD C 4.032 -2.644 4.277 1.00 . A A . 23 ARG CD 1 1 8 5192 1 1 23 ARG CG C 4.567 -1.227 4.559 1.00 . A A . 23 ARG CG 1 1 8 5193 1 1 23 ARG CZ C 3.062 -3.494 2.096 1.00 . A A . 23 ARG CZ 1 1 8 5194 1 1 23 ARG H H 4.974 1.821 2.704 1.00 . A A . 23 ARG H 1 1 8 5195 1 1 23 ARG HA H 2.953 -0.469 2.304 1.00 . A A . 23 ARG HA 1 1 8 5196 1 1 23 ARG HB2 H 4.145 0.790 4.805 1.00 . A A . 23 ARG HB2 1 1 8 5197 1 1 23 ARG HB3 H 2.702 -0.210 4.924 1.00 . A A . 23 ARG HB3 1 1 8 5198 1 1 23 ARG HD2 H 4.700 -3.382 4.758 1.00 . A A . 23 ARG HD2 1 1 8 5199 1 1 23 ARG HD3 H 3.046 -2.782 4.758 1.00 . A A . 23 ARG HD3 1 1 8 5200 1 1 23 ARG HG2 H 5.519 -1.034 4.036 1.00 . A A . 23 ARG HG2 1 1 8 5201 1 1 23 ARG HG3 H 4.829 -1.182 5.636 1.00 . A A . 23 ARG HG3 1 1 8 5202 1 1 23 ARG HH11 H 1.769 -3.814 3.601 1.00 . A A . 23 ARG HH11 1 1 8 5203 1 1 23 ARG HH12 H 1.255 -4.358 1.925 1.00 . A A . 23 ARG HH12 1 1 8 5204 1 1 23 ARG HH21 H 4.177 -3.275 0.448 1.00 . A A . 23 ARG HH21 1 1 8 5205 1 1 23 ARG HH22 H 2.535 -4.071 0.253 1.00 . A A . 23 ARG HH22 1 1 8 5206 1 1 23 ARG N N 4.444 1.053 2.276 1.00 . A A . 23 ARG N 1 1 8 5207 1 1 23 ARG NE N 3.966 -2.947 2.810 1.00 . A A . 23 ARG NE 1 1 8 5208 1 1 23 ARG NH1 N 1.910 -3.935 2.592 1.00 . A A . 23 ARG NH1 1 1 8 5209 1 1 23 ARG NH2 N 3.280 -3.627 0.801 1.00 . A A . 23 ARG NH2 1 1 8 5210 1 1 23 ARG O O 2.251 2.630 3.139 1.00 . A A . 23 ARG O 1 1 8 5211 1 1 24 PRO C C -0.881 2.208 4.325 1.00 . A A . 24 PRO C 1 1 8 5212 1 1 24 PRO CA C -0.436 1.849 2.866 1.00 . A A . 24 PRO CA 1 1 8 5213 1 1 24 PRO CB C -1.484 1.028 2.079 1.00 . A A . 24 PRO CB 1 1 8 5214 1 1 24 PRO CD C 0.407 -0.417 2.387 1.00 . A A . 24 PRO CD 1 1 8 5215 1 1 24 PRO CG C -1.118 -0.435 2.318 1.00 . A A . 24 PRO CG 1 1 8 5216 1 1 24 PRO HA H -0.247 2.811 2.348 1.00 . A A . 24 PRO HA 1 1 8 5217 1 1 24 PRO HB2 H -2.531 1.246 2.361 1.00 . A A . 24 PRO HB2 1 1 8 5218 1 1 24 PRO HB3 H -1.405 1.258 0.998 1.00 . A A . 24 PRO HB3 1 1 8 5219 1 1 24 PRO HD2 H 0.788 -1.168 3.103 1.00 . A A . 24 PRO HD2 1 1 8 5220 1 1 24 PRO HD3 H 0.839 -0.649 1.394 1.00 . A A . 24 PRO HD3 1 1 8 5221 1 1 24 PRO HG2 H -1.548 -0.782 3.276 1.00 . A A . 24 PRO HG2 1 1 8 5222 1 1 24 PRO HG3 H -1.500 -1.105 1.526 1.00 . A A . 24 PRO HG3 1 1 8 5223 1 1 24 PRO N N 0.755 0.965 2.791 1.00 . A A . 24 PRO N 1 1 8 5224 1 1 24 PRO O O -0.328 1.760 5.340 1.00 . A A . 24 PRO O 1 1 8 5225 1 1 25 CYS C C -3.986 3.428 5.591 1.00 . A A . 25 CYS C 1 1 8 5226 1 1 25 CYS CA C -2.442 3.610 5.662 1.00 . A A . 25 CYS CA 1 1 8 5227 1 1 25 CYS CB C -1.912 5.067 5.844 1.00 . A A . 25 CYS CB 1 1 8 5228 1 1 25 CYS H H -2.273 3.371 3.479 1.00 . A A . 25 CYS H 1 1 8 5229 1 1 25 CYS HA H -2.043 3.032 6.515 1.00 . A A . 25 CYS HA 1 1 8 5230 1 1 25 CYS HB2 H -1.131 5.051 6.612 1.00 . A A . 25 CYS HB2 1 1 8 5231 1 1 25 CYS HB3 H -1.457 5.427 4.914 1.00 . A A . 25 CYS HB3 1 1 8 5232 1 1 25 CYS N N -1.905 3.072 4.388 1.00 . A A . 25 CYS N 1 1 8 5233 1 1 25 CYS O O -4.655 3.762 4.608 1.00 . A A . 25 CYS O 1 1 8 5234 1 1 25 CYS SG S -3.153 6.301 6.256 1.00 . A A . 25 CYS SG 1 1 8 5235 1 1 26 ARG C C -6.453 3.250 8.048 1.00 . A A . 26 ARG C 1 1 8 5236 1 1 26 ARG CA C -5.940 2.455 6.834 1.00 . A A . 26 ARG CA 1 1 8 5237 1 1 26 ARG CB C -6.103 0.935 7.103 1.00 . A A . 26 ARG CB 1 1 8 5238 1 1 26 ARG CD C -5.930 -1.500 6.250 1.00 . A A . 26 ARG CD 1 1 8 5239 1 1 26 ARG CG C -5.801 -0.001 5.911 1.00 . A A . 26 ARG CG 1 1 8 5240 1 1 26 ARG CZ C -7.712 -3.176 6.808 1.00 . A A . 26 ARG CZ 1 1 8 5241 1 1 26 ARG H H -3.867 2.748 7.473 1.00 . A A . 26 ARG H 1 1 8 5242 1 1 26 ARG HA H -6.515 2.703 5.918 1.00 . A A . 26 ARG HA 1 1 8 5243 1 1 26 ARG HB2 H -5.475 0.635 7.965 1.00 . A A . 26 ARG HB2 1 1 8 5244 1 1 26 ARG HB3 H -7.144 0.743 7.429 1.00 . A A . 26 ARG HB3 1 1 8 5245 1 1 26 ARG HD2 H -5.531 -2.093 5.405 1.00 . A A . 26 ARG HD2 1 1 8 5246 1 1 26 ARG HD3 H -5.289 -1.738 7.121 1.00 . A A . 26 ARG HD3 1 1 8 5247 1 1 26 ARG HG2 H -6.452 0.253 5.053 1.00 . A A . 26 ARG HG2 1 1 8 5248 1 1 26 ARG HG3 H -4.769 0.185 5.559 1.00 . A A . 26 ARG HG3 1 1 8 5249 1 1 26 ARG HH11 H -5.895 -4.024 6.639 1.00 . A A . 26 ARG HH11 1 1 8 5250 1 1 26 ARG HH12 H -7.298 -5.128 7.065 1.00 . A A . 26 ARG HH12 1 1 8 5251 1 1 26 ARG HH21 H -9.609 -2.578 7.033 1.00 . A A . 26 ARG HH21 1 1 8 5252 1 1 26 ARG HH22 H -9.256 -4.363 7.272 1.00 . A A . 26 ARG HH22 1 1 8 5253 1 1 26 ARG N N -4.514 2.839 6.678 1.00 . A A . 26 ARG N 1 1 8 5254 1 1 26 ARG NE N -7.328 -1.916 6.530 1.00 . A A . 26 ARG NE 1 1 8 5255 1 1 26 ARG NH1 N -6.883 -4.216 6.841 1.00 . A A . 26 ARG NH1 1 1 8 5256 1 1 26 ARG NH2 N -8.989 -3.395 7.063 1.00 . A A . 26 ARG NH2 1 1 8 5257 1 1 26 ARG O O -5.877 3.142 9.141 1.00 . A A . 26 ARG O 1 1 8 5258 1 1 27 CYS C C -8.590 4.330 10.161 1.00 . A A . 27 CYS C 1 1 8 5259 1 1 27 CYS CA C -7.901 5.022 8.931 1.00 . A A . 27 CYS CA 1 1 8 5260 1 1 27 CYS CB C -8.870 6.073 8.343 1.00 . A A . 27 CYS CB 1 1 8 5261 1 1 27 CYS H H -7.910 4.081 6.926 1.00 . A A . 27 CYS H 1 1 8 5262 1 1 27 CYS HA H -6.959 5.519 9.195 1.00 . A A . 27 CYS HA 1 1 8 5263 1 1 27 CYS HB2 H -9.816 5.627 8.064 1.00 . A A . 27 CYS HB2 1 1 8 5264 1 1 27 CYS HB3 H -9.133 6.822 9.111 1.00 . A A . 27 CYS HB3 1 1 8 5265 1 1 27 CYS N N -7.517 4.056 7.874 1.00 . A A . 27 CYS N 1 1 8 5266 1 1 27 CYS O O -8.926 3.140 10.157 1.00 . A A . 27 CYS O 1 1 8 5267 1 1 27 CYS SG S -8.154 6.982 6.972 1.00 . A A . 27 CYS SG 1 1 8 5268 1 1 28 SER C C -11.003 4.351 12.247 1.00 . A A . 28 SER C 1 1 8 5269 1 1 28 SER CA C -9.494 4.725 12.474 1.00 . A A . 28 SER CA 1 1 8 5270 1 1 28 SER CB C -9.306 5.922 13.459 1.00 . A A . 28 SER CB 1 1 8 5271 1 1 28 SER H H -8.405 6.078 11.090 1.00 . A A . 28 SER H 1 1 8 5272 1 1 28 SER HA H -9.027 3.829 12.916 1.00 . A A . 28 SER HA 1 1 8 5273 1 1 28 SER HB2 H -8.320 6.408 13.362 1.00 . A A . 28 SER HB2 1 1 8 5274 1 1 28 SER HB3 H -10.065 6.708 13.288 1.00 . A A . 28 SER HB3 1 1 8 5275 1 1 28 SER HG H -9.306 6.266 15.351 1.00 . A A . 28 SER HG 1 1 8 5276 1 1 28 SER N N -8.797 5.138 11.221 1.00 . A A . 28 SER N 1 1 8 5277 1 1 28 SER O O -11.511 4.201 11.130 1.00 . A A . 28 SER O 1 1 8 5278 1 1 28 SER OG O -9.415 5.482 14.807 1.00 . A A . 28 SER OG 1 1 8 5279 1 1 29 MET C C -14.145 4.747 12.935 1.00 . A A . 29 MET C 1 1 8 5280 1 1 29 MET CA C -13.107 3.701 13.452 1.00 . A A . 29 MET CA 1 1 8 5281 1 1 29 MET CB C -13.419 3.368 14.938 1.00 . A A . 29 MET CB 1 1 8 5282 1 1 29 MET CE C -14.882 0.931 16.969 1.00 . A A . 29 MET CE 1 1 8 5283 1 1 29 MET CG C -12.800 2.057 15.458 1.00 . A A . 29 MET CG 1 1 8 5284 1 1 29 MET H H -11.133 4.492 14.177 1.00 . A A . 29 MET H 1 1 8 5285 1 1 29 MET HA H -13.226 2.790 12.834 1.00 . A A . 29 MET HA 1 1 8 5286 1 1 29 MET HB2 H -13.121 4.204 15.602 1.00 . A A . 29 MET HB2 1 1 8 5287 1 1 29 MET HB3 H -14.514 3.297 15.070 1.00 . A A . 29 MET HB3 1 1 8 5288 1 1 29 MET HE1 H -14.764 -0.002 16.388 1.00 . A A . 29 MET HE1 1 1 8 5289 1 1 29 MET HE2 H -15.310 0.669 17.953 1.00 . A A . 29 MET HE2 1 1 8 5290 1 1 29 MET HE3 H -15.609 1.577 16.443 1.00 . A A . 29 MET HE3 1 1 8 5291 1 1 29 MET HG2 H -13.097 1.196 14.830 1.00 . A A . 29 MET HG2 1 1 8 5292 1 1 29 MET HG3 H -11.696 2.108 15.416 1.00 . A A . 29 MET HG3 1 1 8 5293 1 1 29 MET N N -11.691 4.173 13.378 1.00 . A A . 29 MET N 1 1 8 5294 1 1 29 MET O O -15.119 4.356 12.284 1.00 . A A . 29 MET O 1 1 8 5295 1 1 29 MET SD S -13.296 1.770 17.173 1.00 . A A . 29 MET SD 1 1 8 5296 1 1 30 ILE C C -14.491 7.389 11.193 1.00 . A A . 30 ILE C 1 1 8 5297 1 1 30 ILE CA C -14.809 7.152 12.714 1.00 . A A . 30 ILE CA 1 1 8 5298 1 1 30 ILE CB C -14.570 8.440 13.605 1.00 . A A . 30 ILE CB 1 1 8 5299 1 1 30 ILE CD1 C -14.530 9.255 16.100 1.00 . A A . 30 ILE CD1 1 1 8 5300 1 1 30 ILE CG1 C -15.011 8.200 15.089 1.00 . A A . 30 ILE CG1 1 1 8 5301 1 1 30 ILE CG2 C -15.390 9.644 13.056 1.00 . A A . 30 ILE CG2 1 1 8 5302 1 1 30 ILE H H -13.022 6.200 13.660 1.00 . A A . 30 ILE H 1 1 8 5303 1 1 30 ILE HA H -15.869 6.854 12.788 1.00 . A A . 30 ILE HA 1 1 8 5304 1 1 30 ILE HB H -13.495 8.707 13.589 1.00 . A A . 30 ILE HB 1 1 8 5305 1 1 30 ILE HD11 H -13.429 9.358 16.088 1.00 . A A . 30 ILE HD11 1 1 8 5306 1 1 30 ILE HD12 H -14.962 10.253 15.902 1.00 . A A . 30 ILE HD12 1 1 8 5307 1 1 30 ILE HD13 H -14.820 8.978 17.129 1.00 . A A . 30 ILE HD13 1 1 8 5308 1 1 30 ILE HG12 H -16.111 8.098 15.157 1.00 . A A . 30 ILE HG12 1 1 8 5309 1 1 30 ILE HG13 H -14.621 7.232 15.452 1.00 . A A . 30 ILE HG13 1 1 8 5310 1 1 30 ILE HG21 H -16.477 9.435 13.032 1.00 . A A . 30 ILE HG21 1 1 8 5311 1 1 30 ILE HG22 H -15.245 10.560 13.657 1.00 . A A . 30 ILE HG22 1 1 8 5312 1 1 30 ILE HG23 H -15.089 9.916 12.028 1.00 . A A . 30 ILE HG23 1 1 8 5313 1 1 30 ILE N N -13.939 6.045 13.220 1.00 . A A . 30 ILE N 1 1 8 5314 1 1 30 ILE O O -15.406 7.308 10.368 1.00 . A A . 30 ILE O 1 1 8 5315 1 1 31 GLY C C -11.636 9.104 9.493 1.00 . A A . 31 GLY C 1 1 8 5316 1 1 31 GLY CA C -12.847 8.152 9.494 1.00 . A A . 31 GLY CA 1 1 8 5317 1 1 31 GLY H H -12.610 7.757 11.668 1.00 . A A . 31 GLY H 1 1 8 5318 1 1 31 GLY HA2 H -12.607 7.266 8.881 1.00 . A A . 31 GLY HA2 1 1 8 5319 1 1 31 GLY HA3 H -13.691 8.652 8.981 1.00 . A A . 31 GLY HA3 1 1 8 5320 1 1 31 GLY N N -13.229 7.696 10.852 1.00 . A A . 31 GLY N 1 1 8 5321 1 1 31 GLY O O -10.657 8.863 8.783 1.00 . A A . 31 GLY O 1 1 8 5322 1 1 32 THR C C -9.621 10.526 11.608 1.00 . A A . 32 THR C 1 1 8 5323 1 1 32 THR CA C -10.581 11.118 10.523 1.00 . A A . 32 THR CA 1 1 8 5324 1 1 32 THR CB C -11.104 12.516 11.000 1.00 . A A . 32 THR CB 1 1 8 5325 1 1 32 THR CG2 C -11.928 13.242 9.918 1.00 . A A . 32 THR CG2 1 1 8 5326 1 1 32 THR H H -12.552 10.170 10.889 1.00 . A A . 32 THR H 1 1 8 5327 1 1 32 THR HA H -10.015 11.256 9.579 1.00 . A A . 32 THR HA 1 1 8 5328 1 1 32 THR HB H -10.218 13.133 11.251 1.00 . A A . 32 THR HB 1 1 8 5329 1 1 32 THR HG1 H -12.687 11.841 11.867 1.00 . A A . 32 THR HG1 1 1 8 5330 1 1 32 THR HG21 H -11.347 13.378 8.987 1.00 . A A . 32 THR HG21 1 1 8 5331 1 1 32 THR HG22 H -12.852 12.695 9.657 1.00 . A A . 32 THR HG22 1 1 8 5332 1 1 32 THR HG23 H -12.232 14.249 10.260 1.00 . A A . 32 THR HG23 1 1 8 5333 1 1 32 THR N N -11.721 10.185 10.288 1.00 . A A . 32 THR N 1 1 8 5334 1 1 32 THR O O -9.982 9.654 12.408 1.00 . A A . 32 THR O 1 1 8 5335 1 1 32 THR OG1 O -11.943 12.379 12.147 1.00 . A A . 32 THR OG1 1 1 8 5336 1 1 33 ASN C C -6.774 9.157 11.939 1.00 . A A . 33 ASN C 1 1 8 5337 1 1 33 ASN CA C -7.218 10.571 12.434 1.00 . A A . 33 ASN CA 1 1 8 5338 1 1 33 ASN CB C -7.602 10.557 13.957 1.00 . A A . 33 ASN CB 1 1 8 5339 1 1 33 ASN CG C -6.392 10.624 14.907 1.00 . A A . 33 ASN CG 1 1 8 5340 1 1 33 ASN H H -8.196 11.665 10.804 1.00 . A A . 33 ASN H 1 1 8 5341 1 1 33 ASN HA H -6.377 11.272 12.267 1.00 . A A . 33 ASN HA 1 1 8 5342 1 1 33 ASN HB2 H -8.313 11.369 14.190 1.00 . A A . 33 ASN HB2 1 1 8 5343 1 1 33 ASN HB3 H -8.186 9.652 14.211 1.00 . A A . 33 ASN HB3 1 1 8 5344 1 1 33 ASN HD21 H -6.562 12.619 15.031 1.00 . A A . 33 ASN HD21 1 1 8 5345 1 1 33 ASN HD22 H -5.206 11.831 15.984 1.00 . A A . 33 ASN HD22 1 1 8 5346 1 1 33 ASN N N -8.370 11.038 11.597 1.00 . A A . 33 ASN N 1 1 8 5347 1 1 33 ASN ND2 N -6.014 11.813 15.353 1.00 . A A . 33 ASN ND2 1 1 8 5348 1 1 33 ASN O O -6.868 8.167 12.670 1.00 . A A . 33 ASN O 1 1 8 5349 1 1 33 ASN OD1 O -5.787 9.607 15.246 1.00 . A A . 33 ASN OD1 1 1 8 5350 1 1 34 CYS C C -4.782 7.025 10.707 1.00 . A A . 34 CYS C 1 1 8 5351 1 1 34 CYS CA C -6.011 7.747 10.048 1.00 . A A . 34 CYS CA 1 1 8 5352 1 1 34 CYS CB C -5.773 7.949 8.540 1.00 . A A . 34 CYS CB 1 1 8 5353 1 1 34 CYS H H -6.385 9.938 10.152 1.00 . A A . 34 CYS H 1 1 8 5354 1 1 34 CYS HA H -6.917 7.141 10.153 1.00 . A A . 34 CYS HA 1 1 8 5355 1 1 34 CYS HB2 H -4.912 8.585 8.385 1.00 . A A . 34 CYS HB2 1 1 8 5356 1 1 34 CYS HB3 H -5.523 6.986 8.057 1.00 . A A . 34 CYS HB3 1 1 8 5357 1 1 34 CYS N N -6.272 9.067 10.688 1.00 . A A . 34 CYS N 1 1 8 5358 1 1 34 CYS O O -4.046 7.609 11.511 1.00 . A A . 34 CYS O 1 1 8 5359 1 1 34 CYS SG S -7.251 8.578 7.745 1.00 . A A . 34 CYS SG 1 1 8 5360 1 1 35 GLU C C -2.712 4.123 9.849 1.00 . A A . 35 GLU C 1 1 8 5361 1 1 35 GLU CA C -3.492 4.899 10.969 1.00 . A A . 35 GLU CA 1 1 8 5362 1 1 35 GLU CB C -4.082 3.878 11.990 1.00 . A A . 35 GLU CB 1 1 8 5363 1 1 35 GLU CD C -5.476 3.279 14.033 1.00 . A A . 35 GLU CD 1 1 8 5364 1 1 35 GLU CG C -4.973 4.409 13.133 1.00 . A A . 35 GLU CG 1 1 8 5365 1 1 35 GLU H H -5.277 5.366 9.694 1.00 . A A . 35 GLU H 1 1 8 5366 1 1 35 GLU HA H -2.769 5.573 11.473 1.00 . A A . 35 GLU HA 1 1 8 5367 1 1 35 GLU HB2 H -4.547 3.062 11.423 1.00 . A A . 35 GLU HB2 1 1 8 5368 1 1 35 GLU HB3 H -3.250 3.342 12.476 1.00 . A A . 35 GLU HB3 1 1 8 5369 1 1 35 GLU HE2 H -6.925 1.981 14.105 1.00 . A A . 35 GLU HE2 1 1 8 5370 1 1 35 GLU HG2 H -4.396 5.136 13.738 1.00 . A A . 35 GLU HG2 1 1 8 5371 1 1 35 GLU HG3 H -5.834 4.974 12.732 1.00 . A A . 35 GLU HG3 1 1 8 5372 1 1 35 GLU N N -4.606 5.722 10.395 1.00 . A A . 35 GLU N 1 1 8 5373 1 1 35 GLU O O -2.965 4.293 8.660 1.00 . A A . 35 GLU O 1 1 8 5374 1 1 35 GLU OE1 O -4.910 2.935 15.070 1.00 . A A . 35 GLU OE1 1 1 8 5375 1 1 35 GLU OE2 O -6.615 2.693 13.541 1.00 . A A . 35 GLU OE2 1 1 8 5376 1 1 36 CYS C C -1.790 1.035 9.024 1.00 . A A . 36 CYS C 1 1 8 5377 1 1 36 CYS CA C -1.005 2.393 9.254 1.00 . A A . 36 CYS CA 1 1 8 5378 1 1 36 CYS CB C 0.450 2.058 9.768 1.00 . A A . 36 CYS CB 1 1 8 5379 1 1 36 CYS H H -1.808 3.115 11.248 1.00 . A A . 36 CYS H 1 1 8 5380 1 1 36 CYS HA H -0.900 2.934 8.284 1.00 . A A . 36 CYS HA 1 1 8 5381 1 1 36 CYS HB2 H 1.031 2.884 10.217 1.00 . A A . 36 CYS HB2 1 1 8 5382 1 1 36 CYS HB3 H 0.393 1.270 10.530 1.00 . A A . 36 CYS HB3 1 1 8 5383 1 1 36 CYS N N -1.753 3.255 10.229 1.00 . A A . 36 CYS N 1 1 8 5384 1 1 36 CYS O O -2.827 0.734 9.616 1.00 . A A . 36 CYS O 1 1 8 5385 1 1 36 CYS SG S 1.338 1.514 8.318 1.00 . A A . 36 CYS SG 1 1 8 5386 1 1 37 THR C C -2.104 -2.175 8.937 1.00 . A A . 37 THR C 1 1 8 5387 1 1 37 THR CA C -1.519 -1.217 7.819 1.00 . A A . 37 THR CA 1 1 8 5388 1 1 37 THR CB C -0.130 -1.845 7.381 1.00 . A A . 37 THR CB 1 1 8 5389 1 1 37 THR CG2 C 0.151 -1.447 5.943 1.00 . A A . 37 THR CG2 1 1 8 5390 1 1 37 THR H H -0.457 0.700 7.615 1.00 . A A . 37 THR H 1 1 8 5391 1 1 37 THR HA H -2.255 -1.236 6.992 1.00 . A A . 37 THR HA 1 1 8 5392 1 1 37 THR HB H -0.161 -2.945 7.459 1.00 . A A . 37 THR HB 1 1 8 5393 1 1 37 THR HG1 H 0.982 -0.446 8.104 1.00 . A A . 37 THR HG1 1 1 8 5394 1 1 37 THR HG21 H -0.743 -1.612 5.313 1.00 . A A . 37 THR HG21 1 1 8 5395 1 1 37 THR HG22 H 0.415 -0.382 5.896 1.00 . A A . 37 THR HG22 1 1 8 5396 1 1 37 THR HG23 H 0.983 -2.034 5.539 1.00 . A A . 37 THR HG23 1 1 8 5397 1 1 37 THR N N -1.215 0.222 8.130 1.00 . A A . 37 THR N 1 1 8 5398 1 1 37 THR O O -2.007 -1.889 10.129 1.00 . A A . 37 THR O 1 1 8 5399 1 1 37 THR OG1 O 0.962 -1.402 8.188 1.00 . A A . 37 THR OG1 1 1 8 5400 1 1 38 PRO C C -1.789 -5.169 10.159 1.00 . A A . 38 PRO C 1 1 8 5401 1 1 38 PRO CA C -3.021 -4.467 9.511 1.00 . A A . 38 PRO CA 1 1 8 5402 1 1 38 PRO CB C -3.842 -5.431 8.636 1.00 . A A . 38 PRO CB 1 1 8 5403 1 1 38 PRO CD C -2.830 -3.803 7.172 1.00 . A A . 38 PRO CD 1 1 8 5404 1 1 38 PRO CG C -3.257 -5.272 7.231 1.00 . A A . 38 PRO CG 1 1 8 5405 1 1 38 PRO HA H -3.648 -4.075 10.318 1.00 . A A . 38 PRO HA 1 1 8 5406 1 1 38 PRO HB2 H -3.824 -6.481 8.986 1.00 . A A . 38 PRO HB2 1 1 8 5407 1 1 38 PRO HB3 H -4.905 -5.123 8.642 1.00 . A A . 38 PRO HB3 1 1 8 5408 1 1 38 PRO HD2 H -1.870 -3.658 6.654 1.00 . A A . 38 PRO HD2 1 1 8 5409 1 1 38 PRO HD3 H -3.592 -3.187 6.664 1.00 . A A . 38 PRO HD3 1 1 8 5410 1 1 38 PRO HG2 H -2.377 -5.932 7.107 1.00 . A A . 38 PRO HG2 1 1 8 5411 1 1 38 PRO HG3 H -3.980 -5.537 6.438 1.00 . A A . 38 PRO HG3 1 1 8 5412 1 1 38 PRO N N -2.655 -3.381 8.569 1.00 . A A . 38 PRO N 1 1 8 5413 1 1 38 PRO O O -0.712 -5.250 9.557 1.00 . A A . 38 PRO O 1 1 8 5414 1 1 39 ARG C C -0.398 -7.655 11.566 1.00 . A A . 39 ARG C 1 1 8 5415 1 1 39 ARG CA C -0.870 -6.301 12.184 1.00 . A A . 39 ARG CA 1 1 8 5416 1 1 39 ARG CB C -1.368 -6.531 13.638 1.00 . A A . 39 ARG CB 1 1 8 5417 1 1 39 ARG CD C -2.138 -5.450 15.898 1.00 . A A . 39 ARG CD 1 1 8 5418 1 1 39 ARG CG C -1.808 -5.259 14.406 1.00 . A A . 39 ARG CG 1 1 8 5419 1 1 39 ARG CZ C -3.632 -6.906 17.296 1.00 . A A . 39 ARG CZ 1 1 8 5420 1 1 39 ARG H H -2.916 -5.566 11.770 1.00 . A A . 39 ARG H 1 1 8 5421 1 1 39 ARG HA H -0.009 -5.609 12.209 1.00 . A A . 39 ARG HA 1 1 8 5422 1 1 39 ARG HB2 H -2.194 -7.265 13.646 1.00 . A A . 39 ARG HB2 1 1 8 5423 1 1 39 ARG HB3 H -0.553 -7.010 14.212 1.00 . A A . 39 ARG HB3 1 1 8 5424 1 1 39 ARG HD2 H -1.247 -5.833 16.427 1.00 . A A . 39 ARG HD2 1 1 8 5425 1 1 39 ARG HD3 H -2.339 -4.460 16.348 1.00 . A A . 39 ARG HD3 1 1 8 5426 1 1 39 ARG HG2 H -1.013 -4.494 14.323 1.00 . A A . 39 ARG HG2 1 1 8 5427 1 1 39 ARG HG3 H -2.687 -4.822 13.902 1.00 . A A . 39 ARG HG3 1 1 8 5428 1 1 39 ARG HH11 H -2.055 -6.214 18.337 1.00 . A A . 39 ARG HH11 1 1 8 5429 1 1 39 ARG HH12 H -3.245 -7.284 19.235 1.00 . A A . 39 ARG HH12 1 1 8 5430 1 1 39 ARG HH21 H -5.273 -7.717 16.486 1.00 . A A . 39 ARG HH21 1 1 8 5431 1 1 39 ARG HH22 H -4.943 -8.077 18.254 1.00 . A A . 39 ARG HH22 1 1 8 5432 1 1 39 ARG N N -1.975 -5.696 11.383 1.00 . A A . 39 ARG N 1 1 8 5433 1 1 39 ARG NE N -3.321 -6.320 16.124 1.00 . A A . 39 ARG NE 1 1 8 5434 1 1 39 ARG NH1 N -2.902 -6.789 18.404 1.00 . A A . 39 ARG NH1 1 1 8 5435 1 1 39 ARG NH2 N -4.727 -7.641 17.351 1.00 . A A . 39 ARG NH2 1 1 8 5436 1 1 39 ARG O O -1.157 -8.349 10.880 1.00 . A A . 39 ARG O 1 1 8 5437 1 1 40 LEU C C 0.885 -10.514 11.420 1.00 . A A . 40 LEU C 1 1 8 5438 1 1 40 LEU CA C 1.583 -9.140 11.146 1.00 . A A . 40 LEU CA 1 1 8 5439 1 1 40 LEU CB C 3.061 -9.174 11.652 1.00 . A A . 40 LEU CB 1 1 8 5440 1 1 40 LEU CD1 C 4.814 -10.062 13.286 1.00 . A A . 40 LEU CD1 1 1 8 5441 1 1 40 LEU CD2 C 3.287 -8.225 14.063 1.00 . A A . 40 LEU CD2 1 1 8 5442 1 1 40 LEU CG C 3.399 -9.466 13.151 1.00 . A A . 40 LEU CG 1 1 8 5443 1 1 40 LEU H H 1.396 -7.333 12.400 1.00 . A A . 40 LEU H 1 1 8 5444 1 1 40 LEU HA H 1.574 -8.963 10.051 1.00 . A A . 40 LEU HA 1 1 8 5445 1 1 40 LEU HB2 H 3.564 -9.938 11.027 1.00 . A A . 40 LEU HB2 1 1 8 5446 1 1 40 LEU HB3 H 3.567 -8.237 11.344 1.00 . A A . 40 LEU HB3 1 1 8 5447 1 1 40 LEU HD11 H 4.919 -10.998 12.706 1.00 . A A . 40 LEU HD11 1 1 8 5448 1 1 40 LEU HD12 H 5.598 -9.366 12.933 1.00 . A A . 40 LEU HD12 1 1 8 5449 1 1 40 LEU HD13 H 5.048 -10.318 14.335 1.00 . A A . 40 LEU HD13 1 1 8 5450 1 1 40 LEU HD21 H 3.945 -7.401 13.728 1.00 . A A . 40 LEU HD21 1 1 8 5451 1 1 40 LEU HD22 H 2.258 -7.825 14.104 1.00 . A A . 40 LEU HD22 1 1 8 5452 1 1 40 LEU HD23 H 3.563 -8.460 15.108 1.00 . A A . 40 LEU HD23 1 1 8 5453 1 1 40 LEU HG H 2.702 -10.233 13.532 1.00 . A A . 40 LEU HG 1 1 8 5454 1 1 40 LEU N N 0.885 -7.999 11.811 1.00 . A A . 40 LEU N 1 1 8 5455 1 1 40 LEU O O 0.248 -10.709 12.459 1.00 . A A . 40 LEU O 1 1 8 5456 1 1 41 ILE C C -1.277 -11.948 9.573 1.00 . A A . 41 ILE C 1 1 8 5457 1 1 41 ILE CA C 0.027 -12.577 10.182 1.00 . A A . 41 ILE CA 1 1 8 5458 1 1 41 ILE CB C -0.315 -13.421 11.482 1.00 . A A . 41 ILE CB 1 1 8 5459 1 1 41 ILE CD1 C 1.999 -14.758 11.462 1.00 . A A . 41 ILE CD1 1 1 8 5460 1 1 41 ILE CG1 C 0.962 -13.923 12.235 1.00 . A A . 41 ILE CG1 1 1 8 5461 1 1 41 ILE CG2 C -1.165 -14.662 11.096 1.00 . A A . 41 ILE CG2 1 1 8 5462 1 1 41 ILE H H 1.564 -11.098 9.643 1.00 . A A . 41 ILE H 1 1 8 5463 1 1 41 ILE HA H 0.513 -13.235 9.435 1.00 . A A . 41 ILE HA 1 1 8 5464 1 1 41 ILE HB H -0.911 -12.825 12.197 1.00 . A A . 41 ILE HB 1 1 8 5465 1 1 41 ILE HD11 H 1.561 -15.685 11.048 1.00 . A A . 41 ILE HD11 1 1 8 5466 1 1 41 ILE HD12 H 2.440 -14.191 10.622 1.00 . A A . 41 ILE HD12 1 1 8 5467 1 1 41 ILE HD13 H 2.832 -15.060 12.122 1.00 . A A . 41 ILE HD13 1 1 8 5468 1 1 41 ILE HG12 H 1.488 -13.057 12.675 1.00 . A A . 41 ILE HG12 1 1 8 5469 1 1 41 ILE HG13 H 0.642 -14.504 13.118 1.00 . A A . 41 ILE HG13 1 1 8 5470 1 1 41 ILE HG21 H -0.682 -15.289 10.323 1.00 . A A . 41 ILE HG21 1 1 8 5471 1 1 41 ILE HG22 H -1.366 -15.312 11.967 1.00 . A A . 41 ILE HG22 1 1 8 5472 1 1 41 ILE HG23 H -2.157 -14.371 10.703 1.00 . A A . 41 ILE HG23 1 1 8 5473 1 1 41 ILE N N 0.960 -11.414 10.409 1.00 . A A . 41 ILE N 1 1 8 5474 1 1 41 ILE O O -1.833 -10.985 10.111 1.00 . A A . 41 ILE O 1 1 8 5475 1 1 42 MET C C -4.212 -11.842 8.507 1.00 . A A . 42 MET C 1 1 8 5476 1 1 42 MET CA C -2.899 -11.952 7.656 1.00 . A A . 42 MET CA 1 1 8 5477 1 1 42 MET CB C -3.107 -12.887 6.432 1.00 . A A . 42 MET CB 1 1 8 5478 1 1 42 MET CE C -5.146 -12.569 2.811 1.00 . A A . 42 MET CE 1 1 8 5479 1 1 42 MET CG C -4.042 -12.331 5.344 1.00 . A A . 42 MET CG 1 1 8 5480 1 1 42 MET H H -1.219 -13.316 8.108 1.00 . A A . 42 MET H 1 1 8 5481 1 1 42 MET HA H -2.612 -10.939 7.309 1.00 . A A . 42 MET HA 1 1 8 5482 1 1 42 MET HB2 H -2.134 -13.085 5.942 1.00 . A A . 42 MET HB2 1 1 8 5483 1 1 42 MET HB3 H -3.474 -13.881 6.755 1.00 . A A . 42 MET HB3 1 1 8 5484 1 1 42 MET HE1 H -4.709 -11.583 2.567 1.00 . A A . 42 MET HE1 1 1 8 5485 1 1 42 MET HE2 H -5.271 -13.130 1.867 1.00 . A A . 42 MET HE2 1 1 8 5486 1 1 42 MET HE3 H -6.148 -12.405 3.247 1.00 . A A . 42 MET HE3 1 1 8 5487 1 1 42 MET HG2 H -5.067 -12.190 5.734 1.00 . A A . 42 MET HG2 1 1 8 5488 1 1 42 MET HG3 H -3.689 -11.343 4.994 1.00 . A A . 42 MET HG3 1 1 8 5489 1 1 42 MET N N -1.765 -12.517 8.450 1.00 . A A . 42 MET N 1 1 8 5490 1 1 42 MET O O -4.557 -12.767 9.248 1.00 . A A . 42 MET O 1 1 8 5491 1 1 42 MET SD S -4.087 -13.478 3.952 1.00 . A A . 42 MET SD 1 1 8 5492 1 1 43 GLU C C -5.231 -9.697 10.692 1.00 . A A . 43 GLU C 1 1 8 5493 1 1 43 GLU CA C -5.924 -10.145 9.363 1.00 . A A . 43 GLU CA 1 1 8 5494 1 1 43 GLU CB C -7.024 -11.211 9.670 1.00 . A A . 43 GLU CB 1 1 8 5495 1 1 43 GLU CD C -9.358 -11.754 10.575 1.00 . A A . 43 GLU CD 1 1 8 5496 1 1 43 GLU CG C -8.316 -10.663 10.317 1.00 . A A . 43 GLU CG 1 1 8 5497 1 1 43 GLU H H -4.455 -10.022 7.729 1.00 . A A . 43 GLU H 1 1 8 5498 1 1 43 GLU HA H -6.388 -9.264 8.877 1.00 . A A . 43 GLU HA 1 1 8 5499 1 1 43 GLU HB2 H -7.314 -11.681 8.716 1.00 . A A . 43 GLU HB2 1 1 8 5500 1 1 43 GLU HB3 H -6.625 -12.027 10.302 1.00 . A A . 43 GLU HB3 1 1 8 5501 1 1 43 GLU HE2 H -10.739 -12.737 9.619 1.00 . A A . 43 GLU HE2 1 1 8 5502 1 1 43 GLU HG2 H -8.082 -10.171 11.279 1.00 . A A . 43 GLU HG2 1 1 8 5503 1 1 43 GLU HG3 H -8.756 -9.874 9.680 1.00 . A A . 43 GLU HG3 1 1 8 5504 1 1 43 GLU N N -4.870 -10.658 8.419 1.00 . A A . 43 GLU N 1 1 8 5505 1 1 43 GLU O O -4.286 -10.325 11.180 1.00 . A A . 43 GLU O 1 1 8 5506 1 1 43 GLU OE1 O -9.513 -12.297 11.668 1.00 . A A . 43 GLU OE1 1 1 8 5507 1 1 43 GLU OE2 O -10.090 -12.050 9.453 1.00 . A A . 43 GLU OE2 1 1 8 5508 1 1 44 GLY C C -5.129 -8.874 13.744 1.00 . A A . 44 GLY C 1 1 8 5509 1 1 44 GLY CA C -5.175 -7.967 12.492 1.00 . A A . 44 GLY CA 1 1 8 5510 1 1 44 GLY H H -6.592 -8.256 10.804 1.00 . A A . 44 GLY H 1 1 8 5511 1 1 44 GLY HA2 H -4.175 -7.555 12.247 1.00 . A A . 44 GLY HA2 1 1 8 5512 1 1 44 GLY HA3 H -5.783 -7.076 12.733 1.00 . A A . 44 GLY HA3 1 1 8 5513 1 1 44 GLY N N -5.747 -8.600 11.276 1.00 . A A . 44 GLY N 1 1 8 5514 1 1 44 GLY O O -6.161 -9.144 14.365 1.00 . A A . 44 GLY O 1 1 8 5515 1 1 45 LEU C C -2.409 -10.264 15.821 1.00 . A A . 45 LEU C 1 1 8 5516 1 1 45 LEU CA C -3.706 -10.508 14.990 1.00 . A A . 45 LEU CA 1 1 8 5517 1 1 45 LEU CB C -3.663 -11.822 14.137 1.00 . A A . 45 LEU CB 1 1 8 5518 1 1 45 LEU CD1 C -4.201 -14.305 13.952 1.00 . A A . 45 LEU CD1 1 1 8 5519 1 1 45 LEU CD2 C -2.345 -13.603 15.491 1.00 . A A . 45 LEU CD2 1 1 8 5520 1 1 45 LEU CG C -3.703 -13.184 14.889 1.00 . A A . 45 LEU CG 1 1 8 5521 1 1 45 LEU H H -3.166 -9.051 13.429 1.00 . A A . 45 LEU H 1 1 8 5522 1 1 45 LEU HA H -4.541 -10.572 15.708 1.00 . A A . 45 LEU HA 1 1 8 5523 1 1 45 LEU HB2 H -4.550 -11.799 13.472 1.00 . A A . 45 LEU HB2 1 1 8 5524 1 1 45 LEU HB3 H -2.805 -11.805 13.435 1.00 . A A . 45 LEU HB3 1 1 8 5525 1 1 45 LEU HD11 H -5.212 -14.088 13.560 1.00 . A A . 45 LEU HD11 1 1 8 5526 1 1 45 LEU HD12 H -3.536 -14.444 13.079 1.00 . A A . 45 LEU HD12 1 1 8 5527 1 1 45 LEU HD13 H -4.268 -15.279 14.473 1.00 . A A . 45 LEU HD13 1 1 8 5528 1 1 45 LEU HD21 H -1.542 -13.630 14.730 1.00 . A A . 45 LEU HD21 1 1 8 5529 1 1 45 LEU HD22 H -2.015 -12.920 16.292 1.00 . A A . 45 LEU HD22 1 1 8 5530 1 1 45 LEU HD23 H -2.392 -14.607 15.952 1.00 . A A . 45 LEU HD23 1 1 8 5531 1 1 45 LEU HG H -4.434 -13.106 15.716 1.00 . A A . 45 LEU HG 1 1 8 5532 1 1 45 LEU N N -3.919 -9.374 14.046 1.00 . A A . 45 LEU N 1 1 8 5533 1 1 45 LEU O O -2.487 -10.247 17.051 1.00 . A A . 45 LEU O 1 1 8 5534 1 1 46 SER C C 0.583 -11.219 16.452 1.00 . A A . 46 SER C 1 1 8 5535 1 1 46 SER CA C 0.118 -9.904 15.751 1.00 . A A . 46 SER CA 1 1 8 5536 1 1 46 SER CB C 0.122 -8.724 16.763 1.00 . A A . 46 SER CB 1 1 8 5537 1 1 46 SER H H -1.372 -10.158 14.139 1.00 . A A . 46 SER H 1 1 8 5538 1 1 46 SER HA H 0.817 -9.666 14.928 1.00 . A A . 46 SER HA 1 1 8 5539 1 1 46 SER HB2 H -0.397 -7.852 16.335 1.00 . A A . 46 SER HB2 1 1 8 5540 1 1 46 SER HB3 H -0.413 -8.960 17.701 1.00 . A A . 46 SER HB3 1 1 8 5541 1 1 46 SER HG H 1.879 -9.117 17.438 1.00 . A A . 46 SER HG 1 1 8 5542 1 1 46 SER N N -1.239 -10.108 15.154 1.00 . A A . 46 SER N 1 1 8 5543 1 1 46 SER O O 0.194 -11.507 17.589 1.00 . A A . 46 SER O 1 1 8 5544 1 1 46 SER OG O 1.456 -8.338 17.071 1.00 . A A . 46 SER OG 1 1 8 5545 1 1 47 PHE C C 1.139 -14.350 16.574 1.00 . A A . 47 PHE C 1 1 8 5546 1 1 47 PHE CA C 2.161 -13.211 16.245 1.00 . A A . 47 PHE CA 1 1 8 5547 1 1 47 PHE CB C 3.012 -12.903 17.525 1.00 . A A . 47 PHE CB 1 1 8 5548 1 1 47 PHE CD1 C 5.400 -12.329 16.816 1.00 . A A . 47 PHE CD1 1 1 8 5549 1 1 47 PHE CD2 C 4.015 -10.566 17.716 1.00 . A A . 47 PHE CD2 1 1 8 5550 1 1 47 PHE CE1 C 6.451 -11.427 16.672 1.00 . A A . 47 PHE CE1 1 1 8 5551 1 1 47 PHE CE2 C 5.065 -9.665 17.564 1.00 . A A . 47 PHE CE2 1 1 8 5552 1 1 47 PHE CG C 4.172 -11.906 17.340 1.00 . A A . 47 PHE CG 1 1 8 5553 1 1 47 PHE CZ C 6.283 -10.095 17.044 1.00 . A A . 47 PHE CZ 1 1 8 5554 1 1 47 PHE H H 1.654 -11.611 14.815 1.00 . A A . 47 PHE H 1 1 8 5555 1 1 47 PHE HA H 2.842 -13.559 15.442 1.00 . A A . 47 PHE HA 1 1 8 5556 1 1 47 PHE HB2 H 2.363 -12.575 18.360 1.00 . A A . 47 PHE HB2 1 1 8 5557 1 1 47 PHE HB3 H 3.440 -13.854 17.899 1.00 . A A . 47 PHE HB3 1 1 8 5558 1 1 47 PHE HD1 H 5.544 -13.359 16.522 1.00 . A A . 47 PHE HD1 1 1 8 5559 1 1 47 PHE HD2 H 3.078 -10.220 18.129 1.00 . A A . 47 PHE HD2 1 1 8 5560 1 1 47 PHE HE1 H 7.397 -11.758 16.267 1.00 . A A . 47 PHE HE1 1 1 8 5561 1 1 47 PHE HE2 H 4.935 -8.631 17.852 1.00 . A A . 47 PHE HE2 1 1 8 5562 1 1 47 PHE HZ H 7.097 -9.395 16.928 1.00 . A A . 47 PHE HZ 1 1 8 5563 1 1 47 PHE N N 1.440 -11.992 15.743 1.00 . A A . 47 PHE N 1 1 8 5564 1 1 47 PHE O O 0.414 -14.294 17.574 1.00 . A A . 47 PHE O 1 1 8 5565 1 1 48 ALA C C 0.995 -17.752 16.483 1.00 . A A . 48 ALA C 1 1 8 5566 1 1 48 ALA CA C 0.209 -16.559 15.897 1.00 . A A . 48 ALA CA 1 1 8 5567 1 1 48 ALA CB C -0.404 -16.914 14.528 1.00 . A A . 48 ALA CB 1 1 8 5568 1 1 48 ALA H H 1.769 -15.327 14.937 1.00 . A A . 48 ALA H 1 1 8 5569 1 1 48 ALA HXT H 2.451 -18.968 16.029 1.00 . A A . 48 ALA HXT 1 1 8 5570 1 1 48 ALA HA H -0.626 -16.326 16.586 1.00 . A A . 48 ALA HA 1 1 8 5571 1 1 48 ALA HB1 H 0.360 -17.141 13.759 1.00 . A A . 48 ALA HB1 1 1 8 5572 1 1 48 ALA HB2 H -1.069 -17.794 14.597 1.00 . A A . 48 ALA HB2 1 1 8 5573 1 1 48 ALA HB3 H -1.024 -16.085 14.139 1.00 . A A . 48 ALA HB3 1 1 8 5574 1 1 48 ALA N N 1.113 -15.393 15.723 1.00 . A A . 48 ALA N 1 1 8 5575 1 1 48 ALA O O 0.750 -18.226 17.592 1.00 . A A . 48 ALA O 1 1 8 5576 1 1 48 ALA OXT O 1.983 -18.222 15.648 1.00 . A A . 48 ALA OXT 1 1 9 5577 1 1 1 GLU C C 13.855 8.029 5.671 1.00 . A A . 1 GLU C 1 1 9 5578 1 1 1 GLU CA C 13.869 7.947 4.116 1.00 . A A . 1 GLU CA 1 1 9 5579 1 1 1 GLU CB C 12.425 7.973 3.529 1.00 . A A . 1 GLU CB 1 1 9 5580 1 1 1 GLU CD C 10.058 7.006 3.247 1.00 . A A . 1 GLU CD 1 1 9 5581 1 1 1 GLU CG C 11.431 6.844 3.908 1.00 . A A . 1 GLU CG 1 1 9 5582 1 1 1 GLU H1 H 15.514 6.657 4.069 1.00 . A A . 1 GLU H1 1 1 9 5583 1 1 1 GLU H2 H 14.063 5.867 4.052 1.00 . A A . 1 GLU H2 1 1 9 5584 1 1 1 GLU HA H 14.441 8.806 3.711 1.00 . A A . 1 GLU HA 1 1 9 5585 1 1 1 GLU HB2 H 11.969 8.945 3.798 1.00 . A A . 1 GLU HB2 1 1 9 5586 1 1 1 GLU HB3 H 12.506 8.011 2.425 1.00 . A A . 1 GLU HB3 1 1 9 5587 1 1 1 GLU HE2 H 9.024 6.254 1.779 1.00 . A A . 1 GLU HE2 1 1 9 5588 1 1 1 GLU HG2 H 11.857 5.857 3.650 1.00 . A A . 1 GLU HG2 1 1 9 5589 1 1 1 GLU HG3 H 11.286 6.821 5.002 1.00 . A A . 1 GLU HG3 1 1 9 5590 1 1 1 GLU N N 14.555 6.698 3.707 1.00 . A A . 1 GLU N 1 1 9 5591 1 1 1 GLU O O 13.446 7.086 6.360 1.00 . A A . 1 GLU O 1 1 9 5592 1 1 1 GLU OE1 O 9.213 7.815 3.630 1.00 . A A . 1 GLU OE1 1 1 9 5593 1 1 1 GLU OE2 O 9.885 6.148 2.191 1.00 . A A . 1 GLU OE2 1 1 9 5594 1 1 2 ASP C C 13.086 10.473 8.016 1.00 . A A . 2 ASP C 1 1 9 5595 1 1 2 ASP CA C 14.239 9.465 7.679 1.00 . A A . 2 ASP CA 1 1 9 5596 1 1 2 ASP CB C 15.652 9.985 8.102 1.00 . A A . 2 ASP CB 1 1 9 5597 1 1 2 ASP CG C 16.236 11.283 7.495 1.00 . A A . 2 ASP CG 1 1 9 5598 1 1 2 ASP H H 14.592 9.892 5.531 1.00 . A A . 2 ASP H 1 1 9 5599 1 1 2 ASP HA H 14.039 8.546 8.265 1.00 . A A . 2 ASP HA 1 1 9 5600 1 1 2 ASP HB2 H 15.651 10.108 9.201 1.00 . A A . 2 ASP HB2 1 1 9 5601 1 1 2 ASP HB3 H 16.390 9.178 7.929 1.00 . A A . 2 ASP HB3 1 1 9 5602 1 1 2 ASP HD2 H 17.709 10.969 8.727 1.00 . A A . 2 ASP HD2 1 1 9 5603 1 1 2 ASP N N 14.287 9.186 6.210 1.00 . A A . 2 ASP N 1 1 9 5604 1 1 2 ASP O O 13.312 11.574 8.527 1.00 . A A . 2 ASP O 1 1 9 5605 1 1 2 ASP OD1 O 15.687 11.949 6.617 1.00 . A A . 2 ASP OD1 1 1 9 5606 1 1 2 ASP OD2 O 17.444 11.604 8.058 1.00 . A A . 2 ASP OD2 1 1 9 5607 1 1 3 ASN C C 9.469 9.881 7.498 1.00 . A A . 3 ASN C 1 1 9 5608 1 1 3 ASN CA C 10.588 10.746 8.149 1.00 . A A . 3 ASN CA 1 1 9 5609 1 1 3 ASN CB C 10.441 12.229 7.708 1.00 . A A . 3 ASN CB 1 1 9 5610 1 1 3 ASN CG C 10.633 12.655 6.231 1.00 . A A . 3 ASN CG 1 1 9 5611 1 1 3 ASN H H 11.746 9.073 7.464 1.00 . A A . 3 ASN H 1 1 9 5612 1 1 3 ASN HA H 10.530 10.724 9.257 1.00 . A A . 3 ASN HA 1 1 9 5613 1 1 3 ASN HB2 H 9.412 12.468 8.028 1.00 . A A . 3 ASN HB2 1 1 9 5614 1 1 3 ASN HB3 H 11.073 12.866 8.356 1.00 . A A . 3 ASN HB3 1 1 9 5615 1 1 3 ASN HD21 H 12.593 12.949 6.533 1.00 . A A . 3 ASN HD21 1 1 9 5616 1 1 3 ASN HD22 H 11.946 13.284 4.850 1.00 . A A . 3 ASN HD22 1 1 9 5617 1 1 3 ASN N N 11.834 10.060 7.728 1.00 . A A . 3 ASN N 1 1 9 5618 1 1 3 ASN ND2 N 11.849 12.992 5.829 1.00 . A A . 3 ASN ND2 1 1 9 5619 1 1 3 ASN O O 9.054 10.033 6.343 1.00 . A A . 3 ASN O 1 1 9 5620 1 1 3 ASN OD1 O 9.684 12.704 5.449 1.00 . A A . 3 ASN OD1 1 1 9 5621 1 1 4 CYS C C 7.363 7.205 9.074 1.00 . A A . 4 CYS C 1 1 9 5622 1 1 4 CYS CA C 8.153 7.815 7.870 1.00 . A A . 4 CYS CA 1 1 9 5623 1 1 4 CYS CB C 8.981 6.743 7.172 1.00 . A A . 4 CYS CB 1 1 9 5624 1 1 4 CYS H H 9.671 8.923 9.119 1.00 . A A . 4 CYS H 1 1 9 5625 1 1 4 CYS HA H 7.420 8.164 7.123 1.00 . A A . 4 CYS HA 1 1 9 5626 1 1 4 CYS HB2 H 8.189 6.045 6.982 1.00 . A A . 4 CYS HB2 1 1 9 5627 1 1 4 CYS HB3 H 9.301 7.026 6.161 1.00 . A A . 4 CYS HB3 1 1 9 5628 1 1 4 CYS N N 9.049 8.914 8.308 1.00 . A A . 4 CYS N 1 1 9 5629 1 1 4 CYS O O 7.600 7.529 10.244 1.00 . A A . 4 CYS O 1 1 9 5630 1 1 4 CYS SG S 10.209 5.794 8.093 1.00 . A A . 4 CYS SG 1 1 9 5631 1 1 5 ILE C C 6.153 4.115 9.745 1.00 . A A . 5 ILE C 1 1 9 5632 1 1 5 ILE CA C 5.621 5.558 9.810 1.00 . A A . 5 ILE CA 1 1 9 5633 1 1 5 ILE CB C 4.055 5.567 9.601 1.00 . A A . 5 ILE CB 1 1 9 5634 1 1 5 ILE CD1 C 2.101 7.076 8.946 1.00 . A A . 5 ILE CD1 1 1 9 5635 1 1 5 ILE CG1 C 3.560 6.996 9.347 1.00 . A A . 5 ILE CG1 1 1 9 5636 1 1 5 ILE CG2 C 3.324 4.964 10.846 1.00 . A A . 5 ILE CG2 1 1 9 5637 1 1 5 ILE H H 6.444 6.020 7.733 1.00 . A A . 5 ILE H 1 1 9 5638 1 1 5 ILE HA H 5.808 6.007 10.796 1.00 . A A . 5 ILE HA 1 1 9 5639 1 1 5 ILE HB H 3.742 4.967 8.753 1.00 . A A . 5 ILE HB 1 1 9 5640 1 1 5 ILE HD11 H 1.891 6.514 8.019 1.00 . A A . 5 ILE HD11 1 1 9 5641 1 1 5 ILE HD12 H 1.452 6.671 9.735 1.00 . A A . 5 ILE HD12 1 1 9 5642 1 1 5 ILE HD13 H 1.814 8.122 8.781 1.00 . A A . 5 ILE HD13 1 1 9 5643 1 1 5 ILE HG12 H 3.781 7.610 10.218 1.00 . A A . 5 ILE HG12 1 1 9 5644 1 1 5 ILE HG13 H 4.122 7.453 8.519 1.00 . A A . 5 ILE HG13 1 1 9 5645 1 1 5 ILE HG21 H 3.669 3.946 11.104 1.00 . A A . 5 ILE HG21 1 1 9 5646 1 1 5 ILE HG22 H 3.396 5.586 11.757 1.00 . A A . 5 ILE HG22 1 1 9 5647 1 1 5 ILE HG23 H 2.239 4.830 10.655 1.00 . A A . 5 ILE HG23 1 1 9 5648 1 1 5 ILE N N 6.406 6.291 8.747 1.00 . A A . 5 ILE N 1 1 9 5649 1 1 5 ILE O O 5.757 3.320 8.897 1.00 . A A . 5 ILE O 1 1 9 5650 1 1 6 ALA C C 6.770 1.200 11.102 1.00 . A A . 6 ALA C 1 1 9 5651 1 1 6 ALA CA C 7.676 2.366 10.537 1.00 . A A . 6 ALA CA 1 1 9 5652 1 1 6 ALA CB C 9.002 2.449 11.314 1.00 . A A . 6 ALA CB 1 1 9 5653 1 1 6 ALA H H 7.193 4.389 11.403 1.00 . A A . 6 ALA H 1 1 9 5654 1 1 6 ALA HA H 7.852 2.163 9.451 1.00 . A A . 6 ALA HA 1 1 9 5655 1 1 6 ALA HB1 H 9.660 3.250 10.926 1.00 . A A . 6 ALA HB1 1 1 9 5656 1 1 6 ALA HB2 H 8.844 2.638 12.394 1.00 . A A . 6 ALA HB2 1 1 9 5657 1 1 6 ALA HB3 H 9.572 1.506 11.228 1.00 . A A . 6 ALA HB3 1 1 9 5658 1 1 6 ALA N N 7.057 3.724 10.642 1.00 . A A . 6 ALA N 1 1 9 5659 1 1 6 ALA O O 7.265 0.101 11.377 1.00 . A A . 6 ALA O 1 1 9 5660 1 1 7 GLU C C 3.141 0.374 11.316 1.00 . A A . 7 GLU C 1 1 9 5661 1 1 7 GLU CA C 4.506 0.559 11.975 1.00 . A A . 7 GLU CA 1 1 9 5662 1 1 7 GLU CB C 4.304 1.147 13.415 1.00 . A A . 7 GLU CB 1 1 9 5663 1 1 7 GLU CD C 5.494 -0.716 14.750 1.00 . A A . 7 GLU CD 1 1 9 5664 1 1 7 GLU CG C 5.385 0.786 14.455 1.00 . A A . 7 GLU CG 1 1 9 5665 1 1 7 GLU H H 5.336 2.473 11.128 1.00 . A A . 7 GLU H 1 1 9 5666 1 1 7 GLU HA H 4.904 -0.435 11.988 1.00 . A A . 7 GLU HA 1 1 9 5667 1 1 7 GLU HB2 H 4.205 2.250 13.372 1.00 . A A . 7 GLU HB2 1 1 9 5668 1 1 7 GLU HB3 H 3.327 0.837 13.837 1.00 . A A . 7 GLU HB3 1 1 9 5669 1 1 7 GLU HE2 H 4.636 -2.080 15.843 1.00 . A A . 7 GLU HE2 1 1 9 5670 1 1 7 GLU HG2 H 6.365 1.169 14.120 1.00 . A A . 7 GLU HG2 1 1 9 5671 1 1 7 GLU HG3 H 5.176 1.325 15.397 1.00 . A A . 7 GLU HG3 1 1 9 5672 1 1 7 GLU N N 5.453 1.457 11.262 1.00 . A A . 7 GLU N 1 1 9 5673 1 1 7 GLU O O 2.560 1.318 10.807 1.00 . A A . 7 GLU O 1 1 9 5674 1 1 7 GLU OE1 O 6.321 -1.449 14.211 1.00 . A A . 7 GLU OE1 1 1 9 5675 1 1 7 GLU OE2 O 4.564 -1.139 15.666 1.00 . A A . 7 GLU OE2 1 1 9 5676 1 1 8 ASP C C 0.430 -0.756 12.347 1.00 . A A . 8 ASP C 1 1 9 5677 1 1 8 ASP CA C 1.266 -1.326 11.164 1.00 . A A . 8 ASP CA 1 1 9 5678 1 1 8 ASP CB C 1.106 -2.861 11.141 1.00 . A A . 8 ASP CB 1 1 9 5679 1 1 8 ASP CG C 2.069 -3.583 10.184 1.00 . A A . 8 ASP CG 1 1 9 5680 1 1 8 ASP H H 3.312 -1.524 11.912 1.00 . A A . 8 ASP H 1 1 9 5681 1 1 8 ASP HA H 0.904 -0.994 10.154 1.00 . A A . 8 ASP HA 1 1 9 5682 1 1 8 ASP HB2 H 1.162 -3.220 12.175 1.00 . A A . 8 ASP HB2 1 1 9 5683 1 1 8 ASP HB3 H 0.087 -3.107 10.809 1.00 . A A . 8 ASP HB3 1 1 9 5684 1 1 8 ASP HD2 H 3.233 -3.712 11.737 1.00 . A A . 8 ASP HD2 1 1 9 5685 1 1 8 ASP N N 2.654 -0.884 11.454 1.00 . A A . 8 ASP N 1 1 9 5686 1 1 8 ASP O O 0.747 -0.883 13.536 1.00 . A A . 8 ASP O 1 1 9 5687 1 1 8 ASP OD1 O 1.827 -3.786 8.995 1.00 . A A . 8 ASP OD1 1 1 9 5688 1 1 8 ASP OD2 O 3.225 -3.965 10.811 1.00 . A A . 8 ASP OD2 1 1 9 5689 1 1 9 TYR C C -0.761 1.961 13.512 1.00 . A A . 9 TYR C 1 1 9 5690 1 1 9 TYR CA C -1.517 0.786 12.769 1.00 . A A . 9 TYR CA 1 1 9 5691 1 1 9 TYR CB C -2.296 -0.123 13.774 1.00 . A A . 9 TYR CB 1 1 9 5692 1 1 9 TYR CD1 C -4.335 -0.582 12.287 1.00 . A A . 9 TYR CD1 1 1 9 5693 1 1 9 TYR CD2 C -3.189 -2.457 13.289 1.00 . A A . 9 TYR CD2 1 1 9 5694 1 1 9 TYR CE1 C -5.244 -1.450 11.694 1.00 . A A . 9 TYR CE1 1 1 9 5695 1 1 9 TYR CE2 C -4.126 -3.320 12.733 1.00 . A A . 9 TYR CE2 1 1 9 5696 1 1 9 TYR CG C -3.311 -1.077 13.110 1.00 . A A . 9 TYR CG 1 1 9 5697 1 1 9 TYR CZ C -5.161 -2.817 11.945 1.00 . A A . 9 TYR CZ 1 1 9 5698 1 1 9 TYR H H -0.740 -0.253 10.933 1.00 . A A . 9 TYR H 1 1 9 5699 1 1 9 TYR HA H -2.226 1.297 12.098 1.00 . A A . 9 TYR HA 1 1 9 5700 1 1 9 TYR HB2 H -1.602 -0.664 14.446 1.00 . A A . 9 TYR HB2 1 1 9 5701 1 1 9 TYR HB3 H -2.878 0.517 14.464 1.00 . A A . 9 TYR HB3 1 1 9 5702 1 1 9 TYR HD1 H -4.387 0.467 12.031 1.00 . A A . 9 TYR HD1 1 1 9 5703 1 1 9 TYR HD2 H -2.332 -2.874 13.799 1.00 . A A . 9 TYR HD2 1 1 9 5704 1 1 9 TYR HE1 H -5.973 -1.063 10.996 1.00 . A A . 9 TYR HE1 1 1 9 5705 1 1 9 TYR HE2 H -3.990 -4.387 12.830 1.00 . A A . 9 TYR HE2 1 1 9 5706 1 1 9 TYR HH H -6.674 -3.167 10.830 1.00 . A A . 9 TYR HH 1 1 9 5707 1 1 9 TYR N N -0.628 -0.086 11.935 1.00 . A A . 9 TYR N 1 1 9 5708 1 1 9 TYR O O -1.279 2.485 14.505 1.00 . A A . 9 TYR O 1 1 9 5709 1 1 9 TYR OH O -6.042 -3.676 11.343 1.00 . A A . 9 TYR OH 1 1 9 5710 1 1 10 GLY C C 0.253 4.882 12.809 1.00 . A A . 10 GLY C 1 1 9 5711 1 1 10 GLY CA C 1.018 3.718 13.448 1.00 . A A . 10 GLY CA 1 1 9 5712 1 1 10 GLY H H 0.742 1.927 12.175 1.00 . A A . 10 GLY H 1 1 9 5713 1 1 10 GLY HA2 H 1.059 3.784 14.540 1.00 . A A . 10 GLY HA2 1 1 9 5714 1 1 10 GLY HA3 H 2.066 3.855 13.178 1.00 . A A . 10 GLY HA3 1 1 9 5715 1 1 10 GLY N N 0.396 2.447 12.993 1.00 . A A . 10 GLY N 1 1 9 5716 1 1 10 GLY O O -0.307 4.788 11.713 1.00 . A A . 10 GLY O 1 1 9 5717 1 1 11 LYS C C -0.127 7.828 11.882 1.00 . A A . 11 LYS C 1 1 9 5718 1 1 11 LYS CA C -0.665 7.130 13.164 1.00 . A A . 11 LYS CA 1 1 9 5719 1 1 11 LYS CB C -0.764 8.174 14.285 1.00 . A A . 11 LYS CB 1 1 9 5720 1 1 11 LYS CD C -2.118 10.139 15.348 1.00 . A A . 11 LYS CD 1 1 9 5721 1 1 11 LYS CE C -0.979 11.140 15.623 1.00 . A A . 11 LYS CE 1 1 9 5722 1 1 11 LYS CG C -1.888 9.231 14.123 1.00 . A A . 11 LYS CG 1 1 9 5723 1 1 11 LYS H H 0.903 5.878 14.303 1.00 . A A . 11 LYS H 1 1 9 5724 1 1 11 LYS HA H -1.683 6.709 12.996 1.00 . A A . 11 LYS HA 1 1 9 5725 1 1 11 LYS HB2 H -1.000 7.612 15.191 1.00 . A A . 11 LYS HB2 1 1 9 5726 1 1 11 LYS HB3 H 0.206 8.669 14.411 1.00 . A A . 11 LYS HB3 1 1 9 5727 1 1 11 LYS HD2 H -3.059 10.697 15.183 1.00 . A A . 11 LYS HD2 1 1 9 5728 1 1 11 LYS HD3 H -2.304 9.512 16.241 1.00 . A A . 11 LYS HD3 1 1 9 5729 1 1 11 LYS HE2 H -0.035 10.606 15.840 1.00 . A A . 11 LYS HE2 1 1 9 5730 1 1 11 LYS HE3 H -0.786 11.761 14.729 1.00 . A A . 11 LYS HE3 1 1 9 5731 1 1 11 LYS HG2 H -1.697 9.859 13.232 1.00 . A A . 11 LYS HG2 1 1 9 5732 1 1 11 LYS HG3 H -2.838 8.707 13.905 1.00 . A A . 11 LYS HG3 1 1 9 5733 1 1 11 LYS HZ1 H -1.485 11.460 17.599 1.00 . A A . 11 LYS HZ1 1 1 9 5734 1 1 11 LYS HZ2 H -2.169 12.533 16.573 1.00 . A A . 11 LYS HZ2 1 1 9 5735 1 1 11 LYS N N 0.236 5.993 13.530 1.00 . A A . 11 LYS N 1 1 9 5736 1 1 11 LYS NZ N -1.300 12.021 16.760 1.00 . A A . 11 LYS NZ 1 1 9 5737 1 1 11 LYS O O 1.054 8.134 11.694 1.00 . A A . 11 LYS O 1 1 9 5738 1 1 12 CYS C C -2.056 9.515 9.266 1.00 . A A . 12 CYS C 1 1 9 5739 1 1 12 CYS CA C -0.986 8.461 9.633 1.00 . A A . 12 CYS CA 1 1 9 5740 1 1 12 CYS CB C -1.119 7.214 8.699 1.00 . A A . 12 CYS CB 1 1 9 5741 1 1 12 CYS H H -1.979 7.814 11.589 1.00 . A A . 12 CYS H 1 1 9 5742 1 1 12 CYS HA H 0.006 8.921 9.483 1.00 . A A . 12 CYS HA 1 1 9 5743 1 1 12 CYS HB2 H -0.679 7.435 7.712 1.00 . A A . 12 CYS HB2 1 1 9 5744 1 1 12 CYS HB3 H -0.552 6.350 9.070 1.00 . A A . 12 CYS HB3 1 1 9 5745 1 1 12 CYS N N -1.132 8.025 11.043 1.00 . A A . 12 CYS N 1 1 9 5746 1 1 12 CYS O O -2.895 9.947 10.067 1.00 . A A . 12 CYS O 1 1 9 5747 1 1 12 CYS SG S -2.802 6.661 8.401 1.00 . A A . 12 CYS SG 1 1 9 5748 1 1 13 THR C C -3.143 10.374 5.869 1.00 . A A . 13 THR C 1 1 9 5749 1 1 13 THR CA C -3.004 10.795 7.362 1.00 . A A . 13 THR CA 1 1 9 5750 1 1 13 THR CB C -2.600 12.327 7.441 1.00 . A A . 13 THR CB 1 1 9 5751 1 1 13 THR CG2 C -3.596 13.169 8.226 1.00 . A A . 13 THR CG2 1 1 9 5752 1 1 13 THR H H -1.198 9.479 7.474 1.00 . A A . 13 THR H 1 1 9 5753 1 1 13 THR HA H -3.983 10.618 7.875 1.00 . A A . 13 THR HA 1 1 9 5754 1 1 13 THR HB H -2.586 12.726 6.412 1.00 . A A . 13 THR HB 1 1 9 5755 1 1 13 THR HG1 H -1.465 12.219 8.998 1.00 . A A . 13 THR HG1 1 1 9 5756 1 1 13 THR HG21 H -4.596 13.128 7.764 1.00 . A A . 13 THR HG21 1 1 9 5757 1 1 13 THR HG22 H -3.656 12.848 9.279 1.00 . A A . 13 THR HG22 1 1 9 5758 1 1 13 THR HG23 H -3.270 14.228 8.210 1.00 . A A . 13 THR HG23 1 1 9 5759 1 1 13 THR N N -1.981 9.919 7.991 1.00 . A A . 13 THR N 1 1 9 5760 1 1 13 THR O O -2.211 9.908 5.202 1.00 . A A . 13 THR O 1 1 9 5761 1 1 13 THR OG1 O -1.350 12.545 8.103 1.00 . A A . 13 THR OG1 1 1 9 5762 1 1 14 TRP C C -4.369 12.000 3.393 1.00 . A A . 14 TRP C 1 1 9 5763 1 1 14 TRP CA C -4.662 10.556 3.897 1.00 . A A . 14 TRP CA 1 1 9 5764 1 1 14 TRP CB C -6.122 10.104 3.639 1.00 . A A . 14 TRP CB 1 1 9 5765 1 1 14 TRP CD1 C -5.653 7.601 4.493 1.00 . A A . 14 TRP CD1 1 1 9 5766 1 1 14 TRP CD2 C -7.721 8.044 3.778 1.00 . A A . 14 TRP CD2 1 1 9 5767 1 1 14 TRP CE2 C -7.640 6.696 4.205 1.00 . A A . 14 TRP CE2 1 1 9 5768 1 1 14 TRP CE3 C -8.951 8.566 3.297 1.00 . A A . 14 TRP CE3 1 1 9 5769 1 1 14 TRP CG C -6.476 8.633 3.957 1.00 . A A . 14 TRP CG 1 1 9 5770 1 1 14 TRP CH2 C -9.981 6.392 3.686 1.00 . A A . 14 TRP CH2 1 1 9 5771 1 1 14 TRP CZ2 C -8.782 5.862 4.164 1.00 . A A . 14 TRP CZ2 1 1 9 5772 1 1 14 TRP CZ3 C -10.064 7.724 3.258 1.00 . A A . 14 TRP CZ3 1 1 9 5773 1 1 14 TRP H H -4.923 11.165 6.029 1.00 . A A . 14 TRP H 1 1 9 5774 1 1 14 TRP HA H -3.999 9.820 3.395 1.00 . A A . 14 TRP HA 1 1 9 5775 1 1 14 TRP HB2 H -6.824 10.765 4.183 1.00 . A A . 14 TRP HB2 1 1 9 5776 1 1 14 TRP HB3 H -6.353 10.272 2.570 1.00 . A A . 14 TRP HB3 1 1 9 5777 1 1 14 TRP HD1 H -4.598 7.677 4.750 1.00 . A A . 14 TRP HD1 1 1 9 5778 1 1 14 TRP HE1 H -6.028 5.521 5.045 1.00 . A A . 14 TRP HE1 1 1 9 5779 1 1 14 TRP HE3 H -9.032 9.594 2.973 1.00 . A A . 14 TRP HE3 1 1 9 5780 1 1 14 TRP HH2 H -10.860 5.766 3.650 1.00 . A A . 14 TRP HH2 1 1 9 5781 1 1 14 TRP HZ2 H -8.735 4.837 4.504 1.00 . A A . 14 TRP HZ2 1 1 9 5782 1 1 14 TRP HZ3 H -11.008 8.107 2.898 1.00 . A A . 14 TRP HZ3 1 1 9 5783 1 1 14 TRP N N -4.357 10.633 5.358 1.00 . A A . 14 TRP N 1 1 9 5784 1 1 14 TRP NE1 N -6.373 6.413 4.672 1.00 . A A . 14 TRP NE1 1 1 9 5785 1 1 14 TRP O O -5.154 12.937 3.572 1.00 . A A . 14 TRP O 1 1 9 5786 1 1 15 GLY C C -1.694 13.743 3.834 1.00 . A A . 15 GLY C 1 1 9 5787 1 1 15 GLY CA C -2.525 13.455 2.551 1.00 . A A . 15 GLY CA 1 1 9 5788 1 1 15 GLY H H -2.624 11.267 2.756 1.00 . A A . 15 GLY H 1 1 9 5789 1 1 15 GLY HA2 H -1.882 13.391 1.653 1.00 . A A . 15 GLY HA2 1 1 9 5790 1 1 15 GLY HA3 H -3.266 14.252 2.361 1.00 . A A . 15 GLY HA3 1 1 9 5791 1 1 15 GLY N N -3.158 12.140 2.830 1.00 . A A . 15 GLY N 1 1 9 5792 1 1 15 GLY O O -2.069 14.585 4.654 1.00 . A A . 15 GLY O 1 1 9 5793 1 1 16 GLY C C 1.449 12.063 5.076 1.00 . A A . 16 GLY C 1 1 9 5794 1 1 16 GLY CA C 0.162 12.883 5.249 1.00 . A A . 16 GLY CA 1 1 9 5795 1 1 16 GLY H H -0.443 12.325 3.217 1.00 . A A . 16 GLY H 1 1 9 5796 1 1 16 GLY HA2 H 0.238 13.786 5.881 1.00 . A A . 16 GLY HA2 1 1 9 5797 1 1 16 GLY HA3 H -0.487 12.245 5.867 1.00 . A A . 16 GLY HA3 1 1 9 5798 1 1 16 GLY N N -0.604 12.975 3.993 1.00 . A A . 16 GLY N 1 1 9 5799 1 1 16 GLY O O 2.027 11.951 3.987 1.00 . A A . 16 GLY O 1 1 9 5800 1 1 17 THR C C 2.128 9.040 5.992 1.00 . A A . 17 THR C 1 1 9 5801 1 1 17 THR CA C 2.908 10.390 6.186 1.00 . A A . 17 THR CA 1 1 9 5802 1 1 17 THR CB C 3.775 10.308 7.505 1.00 . A A . 17 THR CB 1 1 9 5803 1 1 17 THR CG2 C 5.163 9.678 7.235 1.00 . A A . 17 THR CG2 1 1 9 5804 1 1 17 THR H H 1.316 11.767 7.015 1.00 . A A . 17 THR H 1 1 9 5805 1 1 17 THR HA H 3.597 10.587 5.337 1.00 . A A . 17 THR HA 1 1 9 5806 1 1 17 THR HB H 3.268 9.664 8.260 1.00 . A A . 17 THR HB 1 1 9 5807 1 1 17 THR HG1 H 4.466 12.097 7.344 1.00 . A A . 17 THR HG1 1 1 9 5808 1 1 17 THR HG21 H 5.094 8.654 6.827 1.00 . A A . 17 THR HG21 1 1 9 5809 1 1 17 THR HG22 H 5.785 10.248 6.521 1.00 . A A . 17 THR HG22 1 1 9 5810 1 1 17 THR HG23 H 5.754 9.576 8.166 1.00 . A A . 17 THR HG23 1 1 9 5811 1 1 17 THR N N 1.850 11.448 6.198 1.00 . A A . 17 THR N 1 1 9 5812 1 1 17 THR O O 1.020 8.819 6.509 1.00 . A A . 17 THR O 1 1 9 5813 1 1 17 THR OG1 O 4.005 11.611 8.032 1.00 . A A . 17 THR OG1 1 1 9 5814 1 1 18 LYS C C 3.592 5.896 5.618 1.00 . A A . 18 LYS C 1 1 9 5815 1 1 18 LYS CA C 2.391 6.726 5.090 1.00 . A A . 18 LYS CA 1 1 9 5816 1 1 18 LYS CB C 2.033 6.357 3.618 1.00 . A A . 18 LYS CB 1 1 9 5817 1 1 18 LYS CD C 0.714 6.853 1.415 1.00 . A A . 18 LYS CD 1 1 9 5818 1 1 18 LYS CE C -0.203 5.614 1.384 1.00 . A A . 18 LYS CE 1 1 9 5819 1 1 18 LYS CG C 1.109 7.320 2.831 1.00 . A A . 18 LYS CG 1 1 9 5820 1 1 18 LYS H H 3.715 8.482 4.955 1.00 . A A . 18 LYS H 1 1 9 5821 1 1 18 LYS HA H 1.505 6.453 5.689 1.00 . A A . 18 LYS HA 1 1 9 5822 1 1 18 LYS HB2 H 2.956 6.112 3.069 1.00 . A A . 18 LYS HB2 1 1 9 5823 1 1 18 LYS HB3 H 1.518 5.378 3.662 1.00 . A A . 18 LYS HB3 1 1 9 5824 1 1 18 LYS HD2 H 0.203 7.696 0.911 1.00 . A A . 18 LYS HD2 1 1 9 5825 1 1 18 LYS HD3 H 1.628 6.666 0.820 1.00 . A A . 18 LYS HD3 1 1 9 5826 1 1 18 LYS HE2 H 0.332 4.742 1.798 1.00 . A A . 18 LYS HE2 1 1 9 5827 1 1 18 LYS HE3 H -1.091 5.769 2.025 1.00 . A A . 18 LYS HE3 1 1 9 5828 1 1 18 LYS HG2 H 0.195 7.522 3.421 1.00 . A A . 18 LYS HG2 1 1 9 5829 1 1 18 LYS HG3 H 1.612 8.300 2.735 1.00 . A A . 18 LYS HG3 1 1 9 5830 1 1 18 LYS HZ1 H -1.220 4.441 0.025 1.00 . A A . 18 LYS HZ1 1 1 9 5831 1 1 18 LYS HZ2 H 0.165 5.072 -0.574 1.00 . A A . 18 LYS HZ2 1 1 9 5832 1 1 18 LYS N N 2.784 8.155 5.233 1.00 . A A . 18 LYS N 1 1 9 5833 1 1 18 LYS NZ N -0.645 5.291 0.017 1.00 . A A . 18 LYS NZ 1 1 9 5834 1 1 18 LYS O O 4.644 6.385 6.071 1.00 . A A . 18 LYS O 1 1 9 5835 1 1 19 CYS C C 5.612 3.491 5.374 1.00 . A A . 19 CYS C 1 1 9 5836 1 1 19 CYS CA C 4.355 3.669 6.277 1.00 . A A . 19 CYS CA 1 1 9 5837 1 1 19 CYS CB C 3.680 2.351 6.699 1.00 . A A . 19 CYS CB 1 1 9 5838 1 1 19 CYS H H 2.525 4.367 5.081 1.00 . A A . 19 CYS H 1 1 9 5839 1 1 19 CYS HA H 4.602 4.194 7.221 1.00 . A A . 19 CYS HA 1 1 9 5840 1 1 19 CYS HB2 H 2.885 2.047 5.998 1.00 . A A . 19 CYS HB2 1 1 9 5841 1 1 19 CYS HB3 H 4.406 1.514 6.743 1.00 . A A . 19 CYS HB3 1 1 9 5842 1 1 19 CYS N N 3.389 4.576 5.605 1.00 . A A . 19 CYS N 1 1 9 5843 1 1 19 CYS O O 5.642 3.515 4.140 1.00 . A A . 19 CYS O 1 1 9 5844 1 1 19 CYS SG S 3.003 2.667 8.332 1.00 . A A . 19 CYS SG 1 1 9 5845 1 1 20 CYS C C 8.621 2.788 4.654 1.00 . A A . 20 CYS C 1 1 9 5846 1 1 20 CYS CA C 8.091 3.609 5.868 1.00 . A A . 20 CYS CA 1 1 9 5847 1 1 20 CYS CB C 8.901 3.211 7.120 1.00 . A A . 20 CYS CB 1 1 9 5848 1 1 20 CYS H H 6.386 3.429 7.189 1.00 . A A . 20 CYS H 1 1 9 5849 1 1 20 CYS HA H 8.128 4.689 5.763 1.00 . A A . 20 CYS HA 1 1 9 5850 1 1 20 CYS HB2 H 8.392 3.550 8.024 1.00 . A A . 20 CYS HB2 1 1 9 5851 1 1 20 CYS HB3 H 9.050 2.120 7.232 1.00 . A A . 20 CYS HB3 1 1 9 5852 1 1 20 CYS N N 6.667 3.441 6.202 1.00 . A A . 20 CYS N 1 1 9 5853 1 1 20 CYS O O 9.269 3.378 3.785 1.00 . A A . 20 CYS O 1 1 9 5854 1 1 20 CYS SG S 10.484 4.075 7.069 1.00 . A A . 20 CYS SG 1 1 9 5855 1 1 21 ARG C C 7.866 0.400 2.323 1.00 . A A . 21 ARG C 1 1 9 5856 1 1 21 ARG CA C 8.865 0.563 3.520 1.00 . A A . 21 ARG CA 1 1 9 5857 1 1 21 ARG CB C 9.187 -0.785 4.237 1.00 . A A . 21 ARG CB 1 1 9 5858 1 1 21 ARG CD C 10.368 -3.064 4.230 1.00 . A A . 21 ARG CD 1 1 9 5859 1 1 21 ARG CG C 10.078 -1.770 3.445 1.00 . A A . 21 ARG CG 1 1 9 5860 1 1 21 ARG CZ C 12.380 -4.320 3.331 1.00 . A A . 21 ARG CZ 1 1 9 5861 1 1 21 ARG H H 7.697 1.208 5.330 1.00 . A A . 21 ARG H 1 1 9 5862 1 1 21 ARG HA H 9.761 1.015 3.069 1.00 . A A . 21 ARG HA 1 1 9 5863 1 1 21 ARG HB2 H 9.715 -0.591 5.193 1.00 . A A . 21 ARG HB2 1 1 9 5864 1 1 21 ARG HB3 H 8.244 -1.290 4.527 1.00 . A A . 21 ARG HB3 1 1 9 5865 1 1 21 ARG HD2 H 10.915 -2.839 5.165 1.00 . A A . 21 ARG HD2 1 1 9 5866 1 1 21 ARG HD3 H 9.419 -3.535 4.546 1.00 . A A . 21 ARG HD3 1 1 9 5867 1 1 21 ARG HG2 H 9.599 -2.031 2.484 1.00 . A A . 21 ARG HG2 1 1 9 5868 1 1 21 ARG HG3 H 11.030 -1.272 3.179 1.00 . A A . 21 ARG HG3 1 1 9 5869 1 1 21 ARG HH11 H 12.960 -2.991 4.723 1.00 . A A . 21 ARG HH11 1 1 9 5870 1 1 21 ARG HH12 H 14.270 -4.012 3.943 1.00 . A A . 21 ARG HH12 1 1 9 5871 1 1 21 ARG HH21 H 12.043 -5.703 1.923 1.00 . A A . 21 ARG HH21 1 1 9 5872 1 1 21 ARG HH22 H 13.781 -5.452 2.455 1.00 . A A . 21 ARG HH22 1 1 9 5873 1 1 21 ARG N N 8.371 1.466 4.613 1.00 . A A . 21 ARG N 1 1 9 5874 1 1 21 ARG NE N 11.136 -4.045 3.395 1.00 . A A . 21 ARG NE 1 1 9 5875 1 1 21 ARG NH1 N 13.298 -3.711 4.075 1.00 . A A . 21 ARG NH1 1 1 9 5876 1 1 21 ARG NH2 N 12.775 -5.253 2.484 1.00 . A A . 21 ARG NH2 1 1 9 5877 1 1 21 ARG O O 7.748 -0.652 1.687 1.00 . A A . 21 ARG O 1 1 9 5878 1 1 22 GLY C C 4.856 0.705 1.318 1.00 . A A . 22 GLY C 1 1 9 5879 1 1 22 GLY CA C 6.095 1.553 1.001 1.00 . A A . 22 GLY CA 1 1 9 5880 1 1 22 GLY H H 7.333 2.156 2.799 1.00 . A A . 22 GLY H 1 1 9 5881 1 1 22 GLY HA2 H 5.800 2.610 0.855 1.00 . A A . 22 GLY HA2 1 1 9 5882 1 1 22 GLY HA3 H 6.495 1.238 0.034 1.00 . A A . 22 GLY HA3 1 1 9 5883 1 1 22 GLY N N 7.167 1.495 2.025 1.00 . A A . 22 GLY N 1 1 9 5884 1 1 22 GLY O O 4.525 -0.250 0.610 1.00 . A A . 22 GLY O 1 1 9 5885 1 1 23 ARG C C 1.905 1.250 3.260 1.00 . A A . 23 ARG C 1 1 9 5886 1 1 23 ARG CA C 3.146 0.310 3.068 1.00 . A A . 23 ARG CA 1 1 9 5887 1 1 23 ARG CB C 3.666 -0.233 4.426 1.00 . A A . 23 ARG CB 1 1 9 5888 1 1 23 ARG CD C 4.221 -2.724 3.929 1.00 . A A . 23 ARG CD 1 1 9 5889 1 1 23 ARG CG C 4.724 -1.352 4.415 1.00 . A A . 23 ARG CG 1 1 9 5890 1 1 23 ARG CZ C 6.176 -4.090 3.074 1.00 . A A . 23 ARG CZ 1 1 9 5891 1 1 23 ARG H H 4.777 1.797 2.928 1.00 . A A . 23 ARG H 1 1 9 5892 1 1 23 ARG HA H 2.864 -0.553 2.440 1.00 . A A . 23 ARG HA 1 1 9 5893 1 1 23 ARG HB2 H 4.165 0.598 4.930 1.00 . A A . 23 ARG HB2 1 1 9 5894 1 1 23 ARG HB3 H 2.834 -0.517 5.098 1.00 . A A . 23 ARG HB3 1 1 9 5895 1 1 23 ARG HD2 H 3.395 -3.073 4.576 1.00 . A A . 23 ARG HD2 1 1 9 5896 1 1 23 ARG HD3 H 3.797 -2.652 2.910 1.00 . A A . 23 ARG HD3 1 1 9 5897 1 1 23 ARG HG2 H 5.591 -1.018 3.814 1.00 . A A . 23 ARG HG2 1 1 9 5898 1 1 23 ARG HG3 H 5.116 -1.446 5.446 1.00 . A A . 23 ARG HG3 1 1 9 5899 1 1 23 ARG HH11 H 5.519 -2.838 1.646 1.00 . A A . 23 ARG HH11 1 1 9 5900 1 1 23 ARG HH12 H 6.941 -3.918 1.222 1.00 . A A . 23 ARG HH12 1 1 9 5901 1 1 23 ARG HH21 H 7.000 -5.412 4.332 1.00 . A A . 23 ARG HH21 1 1 9 5902 1 1 23 ARG HH22 H 7.727 -5.284 2.652 1.00 . A A . 23 ARG HH22 1 1 9 5903 1 1 23 ARG N N 4.227 1.090 2.425 1.00 . A A . 23 ARG N 1 1 9 5904 1 1 23 ARG NE N 5.326 -3.738 3.958 1.00 . A A . 23 ARG NE 1 1 9 5905 1 1 23 ARG NH1 N 6.218 -3.559 1.856 1.00 . A A . 23 ARG NH1 1 1 9 5906 1 1 23 ARG NH2 N 7.056 -5.024 3.384 1.00 . A A . 23 ARG NH2 1 1 9 5907 1 1 23 ARG O O 2.088 2.397 3.702 1.00 . A A . 23 ARG O 1 1 9 5908 1 1 24 PRO C C -1.015 2.227 4.350 1.00 . A A . 24 PRO C 1 1 9 5909 1 1 24 PRO CA C -0.521 1.775 2.935 1.00 . A A . 24 PRO CA 1 1 9 5910 1 1 24 PRO CB C -1.579 0.978 2.134 1.00 . A A . 24 PRO CB 1 1 9 5911 1 1 24 PRO CD C 0.319 -0.471 2.347 1.00 . A A . 24 PRO CD 1 1 9 5912 1 1 24 PRO CG C -1.204 -0.494 2.267 1.00 . A A . 24 PRO CG 1 1 9 5913 1 1 24 PRO HA H -0.255 2.699 2.389 1.00 . A A . 24 PRO HA 1 1 9 5914 1 1 24 PRO HB2 H -2.622 1.168 2.450 1.00 . A A . 24 PRO HB2 1 1 9 5915 1 1 24 PRO HB3 H -1.529 1.273 1.068 1.00 . A A . 24 PRO HB3 1 1 9 5916 1 1 24 PRO HD2 H 0.705 -1.318 2.943 1.00 . A A . 24 PRO HD2 1 1 9 5917 1 1 24 PRO HD3 H 0.763 -0.541 1.335 1.00 . A A . 24 PRO HD3 1 1 9 5918 1 1 24 PRO HG2 H -1.640 -0.912 3.193 1.00 . A A . 24 PRO HG2 1 1 9 5919 1 1 24 PRO HG3 H -1.577 -1.107 1.426 1.00 . A A . 24 PRO HG3 1 1 9 5920 1 1 24 PRO N N 0.636 0.840 2.954 1.00 . A A . 24 PRO N 1 1 9 5921 1 1 24 PRO O O -0.546 1.796 5.412 1.00 . A A . 24 PRO O 1 1 9 5922 1 1 25 CYS C C -4.131 3.711 5.236 1.00 . A A . 25 CYS C 1 1 9 5923 1 1 25 CYS CA C -2.610 3.751 5.507 1.00 . A A . 25 CYS CA 1 1 9 5924 1 1 25 CYS CB C -2.013 5.164 5.769 1.00 . A A . 25 CYS CB 1 1 9 5925 1 1 25 CYS H H -2.245 3.449 3.360 1.00 . A A . 25 CYS H 1 1 9 5926 1 1 25 CYS HA H -2.383 3.141 6.392 1.00 . A A . 25 CYS HA 1 1 9 5927 1 1 25 CYS HB2 H -1.147 5.058 6.431 1.00 . A A . 25 CYS HB2 1 1 9 5928 1 1 25 CYS HB3 H -1.661 5.593 4.827 1.00 . A A . 25 CYS HB3 1 1 9 5929 1 1 25 CYS N N -1.964 3.171 4.306 1.00 . A A . 25 CYS N 1 1 9 5930 1 1 25 CYS O O -4.623 4.157 4.194 1.00 . A A . 25 CYS O 1 1 9 5931 1 1 25 CYS SG S -3.164 6.376 6.450 1.00 . A A . 25 CYS SG 1 1 9 5932 1 1 26 ARG C C -6.752 3.642 7.589 1.00 . A A . 26 ARG C 1 1 9 5933 1 1 26 ARG CA C -6.330 3.038 6.229 1.00 . A A . 26 ARG CA 1 1 9 5934 1 1 26 ARG CB C -6.835 1.575 6.086 1.00 . A A . 26 ARG CB 1 1 9 5935 1 1 26 ARG CD C -6.990 1.542 3.443 1.00 . A A . 26 ARG CD 1 1 9 5936 1 1 26 ARG CG C -6.534 0.851 4.746 1.00 . A A . 26 ARG CG 1 1 9 5937 1 1 26 ARG CZ C -9.074 2.524 2.452 1.00 . A A . 26 ARG CZ 1 1 9 5938 1 1 26 ARG H H -4.303 2.916 7.063 1.00 . A A . 26 ARG H 1 1 9 5939 1 1 26 ARG HA H -6.760 3.630 5.397 1.00 . A A . 26 ARG HA 1 1 9 5940 1 1 26 ARG HB2 H -6.434 0.956 6.912 1.00 . A A . 26 ARG HB2 1 1 9 5941 1 1 26 ARG HB3 H -7.932 1.563 6.238 1.00 . A A . 26 ARG HB3 1 1 9 5942 1 1 26 ARG HD2 H -6.465 2.509 3.335 1.00 . A A . 26 ARG HD2 1 1 9 5943 1 1 26 ARG HD3 H -6.661 0.933 2.580 1.00 . A A . 26 ARG HD3 1 1 9 5944 1 1 26 ARG HG2 H -5.444 0.680 4.679 1.00 . A A . 26 ARG HG2 1 1 9 5945 1 1 26 ARG HG3 H -6.971 -0.165 4.788 1.00 . A A . 26 ARG HG3 1 1 9 5946 1 1 26 ARG HH11 H -7.412 3.135 1.496 1.00 . A A . 26 ARG HH11 1 1 9 5947 1 1 26 ARG HH12 H -9.015 3.781 0.880 1.00 . A A . 26 ARG HH12 1 1 9 5948 1 1 26 ARG HH21 H -10.861 2.071 3.232 1.00 . A A . 26 ARG HH21 1 1 9 5949 1 1 26 ARG HH22 H -10.835 3.217 1.799 1.00 . A A . 26 ARG HH22 1 1 9 5950 1 1 26 ARG N N -4.846 3.112 6.206 1.00 . A A . 26 ARG N 1 1 9 5951 1 1 26 ARG NE N -8.459 1.739 3.359 1.00 . A A . 26 ARG NE 1 1 9 5952 1 1 26 ARG NH1 N -8.434 3.218 1.512 1.00 . A A . 26 ARG NH1 1 1 9 5953 1 1 26 ARG NH2 N -10.390 2.614 2.500 1.00 . A A . 26 ARG NH2 1 1 9 5954 1 1 26 ARG O O -6.188 3.304 8.642 1.00 . A A . 26 ARG O 1 1 9 5955 1 1 27 CYS C C -8.763 4.559 9.908 1.00 . A A . 27 CYS C 1 1 9 5956 1 1 27 CYS CA C -8.016 5.367 8.792 1.00 . A A . 27 CYS CA 1 1 9 5957 1 1 27 CYS CB C -8.894 6.586 8.414 1.00 . A A . 27 CYS CB 1 1 9 5958 1 1 27 CYS H H -8.122 4.794 6.658 1.00 . A A . 27 CYS H 1 1 9 5959 1 1 27 CYS HA H -7.023 5.718 9.109 1.00 . A A . 27 CYS HA 1 1 9 5960 1 1 27 CYS HB2 H -9.886 6.282 8.094 1.00 . A A . 27 CYS HB2 1 1 9 5961 1 1 27 CYS HB3 H -9.072 7.221 9.301 1.00 . A A . 27 CYS HB3 1 1 9 5962 1 1 27 CYS N N -7.735 4.564 7.580 1.00 . A A . 27 CYS N 1 1 9 5963 1 1 27 CYS O O -9.301 3.466 9.701 1.00 . A A . 27 CYS O 1 1 9 5964 1 1 27 CYS SG S -8.123 7.640 7.186 1.00 . A A . 27 CYS SG 1 1 9 5965 1 1 28 SER C C -11.168 4.657 11.954 1.00 . A A . 28 SER C 1 1 9 5966 1 1 28 SER CA C -9.633 4.743 12.269 1.00 . A A . 28 SER CA 1 1 9 5967 1 1 28 SER CB C -9.319 5.776 13.392 1.00 . A A . 28 SER CB 1 1 9 5968 1 1 28 SER H H -8.297 6.072 11.122 1.00 . A A . 28 SER H 1 1 9 5969 1 1 28 SER HA H -9.326 3.733 12.600 1.00 . A A . 28 SER HA 1 1 9 5970 1 1 28 SER HB2 H -9.400 6.821 13.032 1.00 . A A . 28 SER HB2 1 1 9 5971 1 1 28 SER HB3 H -10.029 5.724 14.234 1.00 . A A . 28 SER HB3 1 1 9 5972 1 1 28 SER HG H -7.408 5.665 13.208 1.00 . A A . 28 SER HG 1 1 9 5973 1 1 28 SER N N -8.808 5.183 11.105 1.00 . A A . 28 SER N 1 1 9 5974 1 1 28 SER O O -11.650 4.992 10.866 1.00 . A A . 28 SER O 1 1 9 5975 1 1 28 SER OG O -8.025 5.545 13.934 1.00 . A A . 28 SER OG 1 1 9 5976 1 1 29 MET C C -14.279 5.159 12.609 1.00 . A A . 29 MET C 1 1 9 5977 1 1 29 MET CA C -13.391 3.897 12.849 1.00 . A A . 29 MET CA 1 1 9 5978 1 1 29 MET CB C -13.827 3.228 14.183 1.00 . A A . 29 MET CB 1 1 9 5979 1 1 29 MET CE C -13.721 -0.654 15.698 1.00 . A A . 29 MET CE 1 1 9 5980 1 1 29 MET CG C -13.488 1.732 14.296 1.00 . A A . 29 MET CG 1 1 9 5981 1 1 29 MET H H -11.425 4.095 13.842 1.00 . A A . 29 MET H 1 1 9 5982 1 1 29 MET HA H -13.574 3.207 12.002 1.00 . A A . 29 MET HA 1 1 9 5983 1 1 29 MET HB2 H -13.413 3.769 15.057 1.00 . A A . 29 MET HB2 1 1 9 5984 1 1 29 MET HB3 H -14.918 3.336 14.302 1.00 . A A . 29 MET HB3 1 1 9 5985 1 1 29 MET HE1 H -12.632 -0.797 15.579 1.00 . A A . 29 MET HE1 1 1 9 5986 1 1 29 MET HE2 H -14.044 -1.211 16.596 1.00 . A A . 29 MET HE2 1 1 9 5987 1 1 29 MET HE3 H -14.227 -1.098 14.821 1.00 . A A . 29 MET HE3 1 1 9 5988 1 1 29 MET HG2 H -13.936 1.166 13.458 1.00 . A A . 29 MET HG2 1 1 9 5989 1 1 29 MET HG3 H -12.395 1.567 14.252 1.00 . A A . 29 MET HG3 1 1 9 5990 1 1 29 MET N N -11.925 4.178 12.955 1.00 . A A . 29 MET N 1 1 9 5991 1 1 29 MET O O -15.307 5.052 11.933 1.00 . A A . 29 MET O 1 1 9 5992 1 1 29 MET SD S -14.128 1.096 15.858 1.00 . A A . 29 MET SD 1 1 9 5993 1 1 30 ILE C C -14.291 8.126 11.487 1.00 . A A . 30 ILE C 1 1 9 5994 1 1 30 ILE CA C -14.605 7.618 12.940 1.00 . A A . 30 ILE CA 1 1 9 5995 1 1 30 ILE CB C -14.170 8.641 14.068 1.00 . A A . 30 ILE CB 1 1 9 5996 1 1 30 ILE CD1 C -13.965 8.886 16.674 1.00 . A A . 30 ILE CD1 1 1 9 5997 1 1 30 ILE CG1 C -14.602 8.142 15.489 1.00 . A A . 30 ILE CG1 1 1 9 5998 1 1 30 ILE CG2 C -14.829 10.030 13.828 1.00 . A A . 30 ILE CG2 1 1 9 5999 1 1 30 ILE H H -12.950 6.245 13.568 1.00 . A A . 30 ILE H 1 1 9 6000 1 1 30 ILE HA H -15.695 7.455 13.005 1.00 . A A . 30 ILE HA 1 1 9 6001 1 1 30 ILE HB H -13.069 8.764 14.053 1.00 . A A . 30 ILE HB 1 1 9 6002 1 1 30 ILE HD11 H -12.861 8.865 16.623 1.00 . A A . 30 ILE HD11 1 1 9 6003 1 1 30 ILE HD12 H -14.278 9.945 16.722 1.00 . A A . 30 ILE HD12 1 1 9 6004 1 1 30 ILE HD13 H -14.257 8.423 17.635 1.00 . A A . 30 ILE HD13 1 1 9 6005 1 1 30 ILE HG12 H -15.705 8.162 15.589 1.00 . A A . 30 ILE HG12 1 1 9 6006 1 1 30 ILE HG13 H -14.332 7.078 15.618 1.00 . A A . 30 ILE HG13 1 1 9 6007 1 1 30 ILE HG21 H -15.934 9.972 13.814 1.00 . A A . 30 ILE HG21 1 1 9 6008 1 1 30 ILE HG22 H -14.548 10.766 14.602 1.00 . A A . 30 ILE HG22 1 1 9 6009 1 1 30 ILE HG23 H -14.514 10.477 12.867 1.00 . A A . 30 ILE HG23 1 1 9 6010 1 1 30 ILE N N -13.888 6.324 13.153 1.00 . A A . 30 ILE N 1 1 9 6011 1 1 30 ILE O O -15.224 8.301 10.698 1.00 . A A . 30 ILE O 1 1 9 6012 1 1 31 GLY C C -11.309 9.785 9.961 1.00 . A A . 31 GLY C 1 1 9 6013 1 1 31 GLY CA C -12.599 8.951 9.865 1.00 . A A . 31 GLY CA 1 1 9 6014 1 1 31 GLY H H -12.375 8.206 11.954 1.00 . A A . 31 GLY H 1 1 9 6015 1 1 31 GLY HA2 H -12.450 8.135 9.135 1.00 . A A . 31 GLY HA2 1 1 9 6016 1 1 31 GLY HA3 H -13.399 9.587 9.438 1.00 . A A . 31 GLY HA3 1 1 9 6017 1 1 31 GLY N N -13.009 8.355 11.160 1.00 . A A . 31 GLY N 1 1 9 6018 1 1 31 GLY O O -10.350 9.534 9.227 1.00 . A A . 31 GLY O 1 1 9 6019 1 1 32 THR C C -9.223 10.722 12.252 1.00 . A A . 32 THR C 1 1 9 6020 1 1 32 THR CA C -10.075 11.543 11.230 1.00 . A A . 32 THR CA 1 1 9 6021 1 1 32 THR CB C -10.443 12.929 11.858 1.00 . A A . 32 THR CB 1 1 9 6022 1 1 32 THR CG2 C -11.127 13.870 10.846 1.00 . A A . 32 THR CG2 1 1 9 6023 1 1 32 THR H H -12.118 10.723 11.496 1.00 . A A . 32 THR H 1 1 9 6024 1 1 32 THR HA H -9.470 11.720 10.317 1.00 . A A . 32 THR HA 1 1 9 6025 1 1 32 THR HB H -9.502 13.399 12.204 1.00 . A A . 32 THR HB 1 1 9 6026 1 1 32 THR HG1 H -12.123 12.342 12.600 1.00 . A A . 32 THR HG1 1 1 9 6027 1 1 32 THR HG21 H -10.491 14.042 9.958 1.00 . A A . 32 THR HG21 1 1 9 6028 1 1 32 THR HG22 H -12.095 13.471 10.489 1.00 . A A . 32 THR HG22 1 1 9 6029 1 1 32 THR HG23 H -11.328 14.859 11.296 1.00 . A A . 32 THR HG23 1 1 9 6030 1 1 32 THR N N -11.304 10.774 10.873 1.00 . A A . 32 THR N 1 1 9 6031 1 1 32 THR O O -9.708 9.798 12.916 1.00 . A A . 32 THR O 1 1 9 6032 1 1 32 THR OG1 O -11.339 12.765 12.958 1.00 . A A . 32 THR OG1 1 1 9 6033 1 1 33 ASN C C -6.659 8.943 12.355 1.00 . A A . 33 ASN C 1 1 9 6034 1 1 33 ASN CA C -6.847 10.322 13.057 1.00 . A A . 33 ASN CA 1 1 9 6035 1 1 33 ASN CB C -7.184 10.146 14.581 1.00 . A A . 33 ASN CB 1 1 9 6036 1 1 33 ASN CG C -7.054 11.434 15.415 1.00 . A A . 33 ASN CG 1 1 9 6037 1 1 33 ASN H H -7.648 11.763 11.616 1.00 . A A . 33 ASN H 1 1 9 6038 1 1 33 ASN HA H -5.896 10.882 12.965 1.00 . A A . 33 ASN HA 1 1 9 6039 1 1 33 ASN HB2 H -8.196 9.735 14.739 1.00 . A A . 33 ASN HB2 1 1 9 6040 1 1 33 ASN HB3 H -6.550 9.349 15.019 1.00 . A A . 33 ASN HB3 1 1 9 6041 1 1 33 ASN HD21 H -5.122 11.039 15.787 1.00 . A A . 33 ASN HD21 1 1 9 6042 1 1 33 ASN HD22 H -5.817 12.579 16.503 1.00 . A A . 33 ASN HD22 1 1 9 6043 1 1 33 ASN N N -7.919 11.077 12.328 1.00 . A A . 33 ASN N 1 1 9 6044 1 1 33 ASN ND2 N -5.879 11.710 15.961 1.00 . A A . 33 ASN ND2 1 1 9 6045 1 1 33 ASN O O -6.975 7.888 12.912 1.00 . A A . 33 ASN O 1 1 9 6046 1 1 33 ASN OD1 O -8.012 12.191 15.571 1.00 . A A . 33 ASN OD1 1 1 9 6047 1 1 34 CYS C C -4.770 6.857 10.899 1.00 . A A . 34 CYS C 1 1 9 6048 1 1 34 CYS CA C -5.933 7.721 10.317 1.00 . A A . 34 CYS CA 1 1 9 6049 1 1 34 CYS CB C -5.648 8.090 8.849 1.00 . A A . 34 CYS CB 1 1 9 6050 1 1 34 CYS H H -6.053 9.915 10.726 1.00 . A A . 34 CYS H 1 1 9 6051 1 1 34 CYS HA H -6.871 7.159 10.334 1.00 . A A . 34 CYS HA 1 1 9 6052 1 1 34 CYS HB2 H -4.718 8.640 8.775 1.00 . A A . 34 CYS HB2 1 1 9 6053 1 1 34 CYS HB3 H -5.499 7.175 8.246 1.00 . A A . 34 CYS HB3 1 1 9 6054 1 1 34 CYS N N -6.121 8.965 11.117 1.00 . A A . 34 CYS N 1 1 9 6055 1 1 34 CYS O O -3.961 7.344 11.698 1.00 . A A . 34 CYS O 1 1 9 6056 1 1 34 CYS SG S -7.038 8.990 8.161 1.00 . A A . 34 CYS SG 1 1 9 6057 1 1 35 GLU C C -2.977 3.900 9.753 1.00 . A A . 35 GLU C 1 1 9 6058 1 1 35 GLU CA C -3.573 4.681 10.969 1.00 . A A . 35 GLU CA 1 1 9 6059 1 1 35 GLU CB C -4.046 3.668 12.057 1.00 . A A . 35 GLU CB 1 1 9 6060 1 1 35 GLU CD C -5.308 3.009 14.168 1.00 . A A . 35 GLU CD 1 1 9 6061 1 1 35 GLU CG C -4.991 4.135 13.182 1.00 . A A . 35 GLU CG 1 1 9 6062 1 1 35 GLU H H -5.364 5.290 9.766 1.00 . A A . 35 GLU H 1 1 9 6063 1 1 35 GLU HA H -2.760 5.293 11.405 1.00 . A A . 35 GLU HA 1 1 9 6064 1 1 35 GLU HB2 H -4.416 2.754 11.563 1.00 . A A . 35 GLU HB2 1 1 9 6065 1 1 35 GLU HB3 H -3.128 3.317 12.561 1.00 . A A . 35 GLU HB3 1 1 9 6066 1 1 35 GLU HE2 H -6.617 1.592 14.423 1.00 . A A . 35 GLU HE2 1 1 9 6067 1 1 35 GLU HG2 H -4.533 4.984 13.725 1.00 . A A . 35 GLU HG2 1 1 9 6068 1 1 35 GLU HG3 H -5.931 4.527 12.752 1.00 . A A . 35 GLU HG3 1 1 9 6069 1 1 35 GLU N N -4.704 5.559 10.520 1.00 . A A . 35 GLU N 1 1 9 6070 1 1 35 GLU O O -3.432 3.993 8.613 1.00 . A A . 35 GLU O 1 1 9 6071 1 1 35 GLU OE1 O -4.623 2.766 15.161 1.00 . A A . 35 GLU OE1 1 1 9 6072 1 1 35 GLU OE2 O -6.427 2.303 13.807 1.00 . A A . 35 GLU OE2 1 1 9 6073 1 1 36 CYS C C -1.921 0.882 8.967 1.00 . A A . 36 CYS C 1 1 9 6074 1 1 36 CYS CA C -1.222 2.286 9.019 1.00 . A A . 36 CYS CA 1 1 9 6075 1 1 36 CYS CB C 0.304 2.222 9.382 1.00 . A A . 36 CYS CB 1 1 9 6076 1 1 36 CYS H H -1.795 3.030 11.045 1.00 . A A . 36 CYS H 1 1 9 6077 1 1 36 CYS HA H -1.280 2.776 8.021 1.00 . A A . 36 CYS HA 1 1 9 6078 1 1 36 CYS HB2 H 0.501 2.273 10.465 1.00 . A A . 36 CYS HB2 1 1 9 6079 1 1 36 CYS HB3 H 0.788 1.251 9.158 1.00 . A A . 36 CYS HB3 1 1 9 6080 1 1 36 CYS N N -1.926 3.117 10.030 1.00 . A A . 36 CYS N 1 1 9 6081 1 1 36 CYS O O -2.913 0.561 9.630 1.00 . A A . 36 CYS O 1 1 9 6082 1 1 36 CYS SG S 1.179 3.428 8.400 1.00 . A A . 36 CYS SG 1 1 9 6083 1 1 37 THR C C -2.121 -2.334 8.966 1.00 . A A . 37 THR C 1 1 9 6084 1 1 37 THR CA C -1.650 -1.362 7.807 1.00 . A A . 37 THR CA 1 1 9 6085 1 1 37 THR CB C -0.306 -1.924 7.183 1.00 . A A . 37 THR CB 1 1 9 6086 1 1 37 THR CG2 C -0.369 -1.624 5.693 1.00 . A A . 37 THR CG2 1 1 9 6087 1 1 37 THR H H -0.638 0.564 7.525 1.00 . A A . 37 THR H 1 1 9 6088 1 1 37 THR HA H -2.490 -1.370 7.085 1.00 . A A . 37 THR HA 1 1 9 6089 1 1 37 THR HB H -0.231 -3.013 7.344 1.00 . A A . 37 THR HB 1 1 9 6090 1 1 37 THR HG1 H 0.917 -1.590 8.640 1.00 . A A . 37 THR HG1 1 1 9 6091 1 1 37 THR HG21 H -1.286 -2.059 5.253 1.00 . A A . 37 THR HG21 1 1 9 6092 1 1 37 THR HG22 H -0.433 -0.538 5.531 1.00 . A A . 37 THR HG22 1 1 9 6093 1 1 37 THR HG23 H 0.511 -2.015 5.174 1.00 . A A . 37 THR HG23 1 1 9 6094 1 1 37 THR N N -1.336 0.068 8.099 1.00 . A A . 37 THR N 1 1 9 6095 1 1 37 THR O O -1.981 -2.027 10.150 1.00 . A A . 37 THR O 1 1 9 6096 1 1 37 THR OG1 O 0.891 -1.341 7.713 1.00 . A A . 37 THR OG1 1 1 9 6097 1 1 38 PRO C C -1.677 -5.295 10.188 1.00 . A A . 38 PRO C 1 1 9 6098 1 1 38 PRO CA C -2.960 -4.657 9.573 1.00 . A A . 38 PRO CA 1 1 9 6099 1 1 38 PRO CB C -3.763 -5.655 8.717 1.00 . A A . 38 PRO CB 1 1 9 6100 1 1 38 PRO CD C -2.923 -3.964 7.235 1.00 . A A . 38 PRO CD 1 1 9 6101 1 1 38 PRO CG C -3.246 -5.457 7.293 1.00 . A A . 38 PRO CG 1 1 9 6102 1 1 38 PRO HA H -3.585 -4.302 10.398 1.00 . A A . 38 PRO HA 1 1 9 6103 1 1 38 PRO HB2 H -3.680 -6.705 9.055 1.00 . A A . 38 PRO HB2 1 1 9 6104 1 1 38 PRO HB3 H -4.840 -5.401 8.760 1.00 . A A . 38 PRO HB3 1 1 9 6105 1 1 38 PRO HD2 H -2.013 -3.756 6.654 1.00 . A A . 38 PRO HD2 1 1 9 6106 1 1 38 PRO HD3 H -3.760 -3.386 6.800 1.00 . A A . 38 PRO HD3 1 1 9 6107 1 1 38 PRO HG2 H -2.329 -6.056 7.133 1.00 . A A . 38 PRO HG2 1 1 9 6108 1 1 38 PRO HG3 H -3.980 -5.764 6.526 1.00 . A A . 38 PRO HG3 1 1 9 6109 1 1 38 PRO N N -2.674 -3.550 8.625 1.00 . A A . 38 PRO N 1 1 9 6110 1 1 38 PRO O O -0.605 -5.260 9.575 1.00 . A A . 38 PRO O 1 1 9 6111 1 1 39 ARG C C 0.233 -7.389 11.493 1.00 . A A . 39 ARG C 1 1 9 6112 1 1 39 ARG CA C -0.652 -6.326 12.230 1.00 . A A . 39 ARG CA 1 1 9 6113 1 1 39 ARG CB C -1.239 -6.915 13.546 1.00 . A A . 39 ARG CB 1 1 9 6114 1 1 39 ARG CD C 0.719 -6.141 15.146 1.00 . A A . 39 ARG CD 1 1 9 6115 1 1 39 ARG CG C -0.224 -7.268 14.667 1.00 . A A . 39 ARG CG 1 1 9 6116 1 1 39 ARG CZ C 0.475 -3.723 15.777 1.00 . A A . 39 ARG CZ 1 1 9 6117 1 1 39 ARG H H -2.756 -5.832 11.787 1.00 . A A . 39 ARG H 1 1 9 6118 1 1 39 ARG HA H -0.029 -5.439 12.465 1.00 . A A . 39 ARG HA 1 1 9 6119 1 1 39 ARG HB2 H -1.964 -6.197 13.979 1.00 . A A . 39 ARG HB2 1 1 9 6120 1 1 39 ARG HB3 H -1.843 -7.816 13.324 1.00 . A A . 39 ARG HB3 1 1 9 6121 1 1 39 ARG HD2 H 1.403 -6.545 15.916 1.00 . A A . 39 ARG HD2 1 1 9 6122 1 1 39 ARG HD3 H 1.371 -5.834 14.306 1.00 . A A . 39 ARG HD3 1 1 9 6123 1 1 39 ARG HG2 H -0.781 -7.667 15.535 1.00 . A A . 39 ARG HG2 1 1 9 6124 1 1 39 ARG HG3 H 0.399 -8.116 14.326 1.00 . A A . 39 ARG HG3 1 1 9 6125 1 1 39 ARG HH11 H 2.256 -4.105 14.922 1.00 . A A . 39 ARG HH11 1 1 9 6126 1 1 39 ARG HH12 H 1.923 -2.373 15.428 1.00 . A A . 39 ARG HH12 1 1 9 6127 1 1 39 ARG HH21 H -1.218 -3.092 16.640 1.00 . A A . 39 ARG HH21 1 1 9 6128 1 1 39 ARG HH22 H 0.087 -1.839 16.336 1.00 . A A . 39 ARG HH22 1 1 9 6129 1 1 39 ARG N N -1.806 -5.871 11.401 1.00 . A A . 39 ARG N 1 1 9 6130 1 1 39 ARG NE N -0.006 -4.979 15.720 1.00 . A A . 39 ARG NE 1 1 9 6131 1 1 39 ARG NH1 N 1.678 -3.364 15.333 1.00 . A A . 39 ARG NH1 1 1 9 6132 1 1 39 ARG NH2 N -0.296 -2.790 16.304 1.00 . A A . 39 ARG NH2 1 1 9 6133 1 1 39 ARG O O -0.221 -8.473 11.114 1.00 . A A . 39 ARG O 1 1 9 6134 1 1 40 LEU C C 3.908 -7.520 11.153 1.00 . A A . 40 LEU C 1 1 9 6135 1 1 40 LEU CA C 2.509 -7.768 10.508 1.00 . A A . 40 LEU CA 1 1 9 6136 1 1 40 LEU CB C 2.452 -7.302 9.019 1.00 . A A . 40 LEU CB 1 1 9 6137 1 1 40 LEU CD1 C 2.924 -9.559 7.843 1.00 . A A . 40 LEU CD1 1 1 9 6138 1 1 40 LEU CD2 C 3.205 -7.382 6.592 1.00 . A A . 40 LEU CD2 1 1 9 6139 1 1 40 LEU CG C 3.306 -8.069 7.969 1.00 . A A . 40 LEU CG 1 1 9 6140 1 1 40 LEU H H 1.718 -6.066 11.656 1.00 . A A . 40 LEU H 1 1 9 6141 1 1 40 LEU HA H 2.271 -8.848 10.574 1.00 . A A . 40 LEU HA 1 1 9 6142 1 1 40 LEU HB2 H 1.398 -7.324 8.676 1.00 . A A . 40 LEU HB2 1 1 9 6143 1 1 40 LEU HB3 H 2.734 -6.232 8.977 1.00 . A A . 40 LEU HB3 1 1 9 6144 1 1 40 LEU HD11 H 1.864 -9.695 7.556 1.00 . A A . 40 LEU HD11 1 1 9 6145 1 1 40 LEU HD12 H 3.540 -10.075 7.083 1.00 . A A . 40 LEU HD12 1 1 9 6146 1 1 40 LEU HD13 H 3.081 -10.104 8.792 1.00 . A A . 40 LEU HD13 1 1 9 6147 1 1 40 LEU HD21 H 3.528 -6.325 6.638 1.00 . A A . 40 LEU HD21 1 1 9 6148 1 1 40 LEU HD22 H 3.849 -7.876 5.840 1.00 . A A . 40 LEU HD22 1 1 9 6149 1 1 40 LEU HD23 H 2.172 -7.391 6.196 1.00 . A A . 40 LEU HD23 1 1 9 6150 1 1 40 LEU HG H 4.366 -8.017 8.276 1.00 . A A . 40 LEU HG 1 1 9 6151 1 1 40 LEU N N 1.500 -6.997 11.282 1.00 . A A . 40 LEU N 1 1 9 6152 1 1 40 LEU O O 4.159 -6.472 11.759 1.00 . A A . 40 LEU O 1 1 9 6153 1 1 41 ILE C C 7.048 -7.356 11.430 1.00 . A A . 41 ILE C 1 1 9 6154 1 1 41 ILE CA C 6.101 -8.551 11.814 1.00 . A A . 41 ILE CA 1 1 9 6155 1 1 41 ILE CB C 6.858 -9.934 11.588 1.00 . A A . 41 ILE CB 1 1 9 6156 1 1 41 ILE CD1 C 7.347 -9.940 8.977 1.00 . A A . 41 ILE CD1 1 1 9 6157 1 1 41 ILE CG1 C 6.710 -10.633 10.188 1.00 . A A . 41 ILE CG1 1 1 9 6158 1 1 41 ILE CG2 C 6.307 -10.929 12.642 1.00 . A A . 41 ILE CG2 1 1 9 6159 1 1 41 ILE H H 4.506 -9.309 10.482 1.00 . A A . 41 ILE H 1 1 9 6160 1 1 41 ILE HA H 5.838 -8.443 12.885 1.00 . A A . 41 ILE HA 1 1 9 6161 1 1 41 ILE HB H 7.945 -9.824 11.770 1.00 . A A . 41 ILE HB 1 1 9 6162 1 1 41 ILE HD11 H 8.405 -9.680 9.162 1.00 . A A . 41 ILE HD11 1 1 9 6163 1 1 41 ILE HD12 H 7.323 -10.598 8.088 1.00 . A A . 41 ILE HD12 1 1 9 6164 1 1 41 ILE HD13 H 6.808 -9.016 8.702 1.00 . A A . 41 ILE HD13 1 1 9 6165 1 1 41 ILE HG12 H 7.175 -11.635 10.245 1.00 . A A . 41 ILE HG12 1 1 9 6166 1 1 41 ILE HG13 H 5.647 -10.839 9.960 1.00 . A A . 41 ILE HG13 1 1 9 6167 1 1 41 ILE HG21 H 6.471 -10.563 13.673 1.00 . A A . 41 ILE HG21 1 1 9 6168 1 1 41 ILE HG22 H 5.221 -11.109 12.527 1.00 . A A . 41 ILE HG22 1 1 9 6169 1 1 41 ILE HG23 H 6.810 -11.913 12.584 1.00 . A A . 41 ILE HG23 1 1 9 6170 1 1 41 ILE N N 4.828 -8.499 11.023 1.00 . A A . 41 ILE N 1 1 9 6171 1 1 41 ILE O O 7.660 -7.311 10.360 1.00 . A A . 41 ILE O 1 1 9 6172 1 1 42 MET C C 8.238 -4.559 13.550 1.00 . A A . 42 MET C 1 1 9 6173 1 1 42 MET CA C 7.862 -5.093 12.140 1.00 . A A . 42 MET CA 1 1 9 6174 1 1 42 MET CB C 7.008 -4.010 11.408 1.00 . A A . 42 MET CB 1 1 9 6175 1 1 42 MET CE C 5.127 -3.557 7.747 1.00 . A A . 42 MET CE 1 1 9 6176 1 1 42 MET CG C 6.684 -4.266 9.929 1.00 . A A . 42 MET CG 1 1 9 6177 1 1 42 MET H H 6.570 -6.532 13.194 1.00 . A A . 42 MET H 1 1 9 6178 1 1 42 MET HA H 8.773 -5.284 11.536 1.00 . A A . 42 MET HA 1 1 9 6179 1 1 42 MET HB2 H 6.057 -3.841 11.950 1.00 . A A . 42 MET HB2 1 1 9 6180 1 1 42 MET HB3 H 7.539 -3.039 11.458 1.00 . A A . 42 MET HB3 1 1 9 6181 1 1 42 MET HE1 H 4.534 -4.465 7.957 1.00 . A A . 42 MET HE1 1 1 9 6182 1 1 42 MET HE2 H 4.466 -2.833 7.240 1.00 . A A . 42 MET HE2 1 1 9 6183 1 1 42 MET HE3 H 5.944 -3.827 7.053 1.00 . A A . 42 MET HE3 1 1 9 6184 1 1 42 MET HG2 H 7.606 -4.423 9.339 1.00 . A A . 42 MET HG2 1 1 9 6185 1 1 42 MET HG3 H 6.066 -5.176 9.817 1.00 . A A . 42 MET HG3 1 1 9 6186 1 1 42 MET N N 7.117 -6.364 12.342 1.00 . A A . 42 MET N 1 1 9 6187 1 1 42 MET O O 7.359 -4.131 14.307 1.00 . A A . 42 MET O 1 1 9 6188 1 1 42 MET SD S 5.781 -2.850 9.271 1.00 . A A . 42 MET SD 1 1 9 6189 1 1 43 GLU C C 9.693 -4.485 16.429 1.00 . A A . 43 GLU C 1 1 9 6190 1 1 43 GLU CA C 10.163 -3.863 15.067 1.00 . A A . 43 GLU CA 1 1 9 6191 1 1 43 GLU CB C 9.798 -2.336 15.070 1.00 . A A . 43 GLU CB 1 1 9 6192 1 1 43 GLU CD C 9.943 -0.033 13.928 1.00 . A A . 43 GLU CD 1 1 9 6193 1 1 43 GLU CG C 10.289 -1.525 13.849 1.00 . A A . 43 GLU CG 1 1 9 6194 1 1 43 GLU H H 10.153 -4.965 13.152 1.00 . A A . 43 GLU H 1 1 9 6195 1 1 43 GLU HA H 11.261 -3.982 14.999 1.00 . A A . 43 GLU HA 1 1 9 6196 1 1 43 GLU HB2 H 8.709 -2.195 15.196 1.00 . A A . 43 GLU HB2 1 1 9 6197 1 1 43 GLU HB3 H 10.239 -1.869 15.972 1.00 . A A . 43 GLU HB3 1 1 9 6198 1 1 43 GLU HE2 H 10.786 1.697 13.641 1.00 . A A . 43 GLU HE2 1 1 9 6199 1 1 43 GLU HG2 H 11.382 -1.656 13.737 1.00 . A A . 43 GLU HG2 1 1 9 6200 1 1 43 GLU HG3 H 9.845 -1.928 12.921 1.00 . A A . 43 GLU HG3 1 1 9 6201 1 1 43 GLU N N 9.552 -4.556 13.876 1.00 . A A . 43 GLU N 1 1 9 6202 1 1 43 GLU O O 8.636 -5.112 16.545 1.00 . A A . 43 GLU O 1 1 9 6203 1 1 43 GLU OE1 O 8.828 0.395 14.224 1.00 . A A . 43 GLU OE1 1 1 9 6204 1 1 43 GLU OE2 O 11.012 0.765 13.610 1.00 . A A . 43 GLU OE2 1 1 9 6205 1 1 44 GLY C C 9.390 -3.099 19.428 1.00 . A A . 44 GLY C 1 1 9 6206 1 1 44 GLY CA C 10.004 -4.407 18.887 1.00 . A A . 44 GLY CA 1 1 9 6207 1 1 44 GLY H H 11.339 -3.717 17.279 1.00 . A A . 44 GLY H 1 1 9 6208 1 1 44 GLY HA2 H 9.296 -5.254 18.985 1.00 . A A . 44 GLY HA2 1 1 9 6209 1 1 44 GLY HA3 H 10.867 -4.690 19.518 1.00 . A A . 44 GLY HA3 1 1 9 6210 1 1 44 GLY N N 10.481 -4.237 17.493 1.00 . A A . 44 GLY N 1 1 9 6211 1 1 44 GLY O O 10.078 -2.339 20.115 1.00 . A A . 44 GLY O 1 1 9 6212 1 1 45 LEU C C 6.023 -1.895 19.971 1.00 . A A . 45 LEU C 1 1 9 6213 1 1 45 LEU CA C 7.431 -1.554 19.402 1.00 . A A . 45 LEU CA 1 1 9 6214 1 1 45 LEU CB C 7.444 -0.676 18.101 1.00 . A A . 45 LEU CB 1 1 9 6215 1 1 45 LEU CD1 C 5.588 1.120 18.464 1.00 . A A . 45 LEU CD1 1 1 9 6216 1 1 45 LEU CD2 C 7.973 1.621 19.170 1.00 . A A . 45 LEU CD2 1 1 9 6217 1 1 45 LEU CG C 7.077 0.834 18.192 1.00 . A A . 45 LEU CG 1 1 9 6218 1 1 45 LEU H H 7.669 -3.558 18.500 1.00 . A A . 45 LEU H 1 1 9 6219 1 1 45 LEU HA H 7.969 -1.014 20.197 1.00 . A A . 45 LEU HA 1 1 9 6220 1 1 45 LEU HB2 H 8.465 -0.708 17.671 1.00 . A A . 45 LEU HB2 1 1 9 6221 1 1 45 LEU HB3 H 6.826 -1.152 17.316 1.00 . A A . 45 LEU HB3 1 1 9 6222 1 1 45 LEU HD11 H 4.932 0.576 17.760 1.00 . A A . 45 LEU HD11 1 1 9 6223 1 1 45 LEU HD12 H 5.284 0.831 19.487 1.00 . A A . 45 LEU HD12 1 1 9 6224 1 1 45 LEU HD13 H 5.354 2.195 18.349 1.00 . A A . 45 LEU HD13 1 1 9 6225 1 1 45 LEU HD21 H 9.047 1.455 18.964 1.00 . A A . 45 LEU HD21 1 1 9 6226 1 1 45 LEU HD22 H 7.798 2.710 19.096 1.00 . A A . 45 LEU HD22 1 1 9 6227 1 1 45 LEU HD23 H 7.792 1.335 20.223 1.00 . A A . 45 LEU HD23 1 1 9 6228 1 1 45 LEU HG H 7.282 1.249 17.187 1.00 . A A . 45 LEU HG 1 1 9 6229 1 1 45 LEU N N 8.111 -2.841 19.087 1.00 . A A . 45 LEU N 1 1 9 6230 1 1 45 LEU O O 5.878 -1.910 21.197 1.00 . A A . 45 LEU O 1 1 9 6231 1 1 46 SER C C 3.624 -4.229 19.216 1.00 . A A . 46 SER C 1 1 9 6232 1 1 46 SER CA C 3.699 -2.717 19.575 1.00 . A A . 46 SER CA 1 1 9 6233 1 1 46 SER CB C 2.593 -1.872 18.898 1.00 . A A . 46 SER CB 1 1 9 6234 1 1 46 SER H H 5.285 -2.127 18.136 1.00 . A A . 46 SER H 1 1 9 6235 1 1 46 SER HA H 3.567 -2.607 20.671 1.00 . A A . 46 SER HA 1 1 9 6236 1 1 46 SER HB2 H 2.725 -0.799 19.133 1.00 . A A . 46 SER HB2 1 1 9 6237 1 1 46 SER HB3 H 2.636 -1.950 17.795 1.00 . A A . 46 SER HB3 1 1 9 6238 1 1 46 SER HG H 0.684 -1.651 18.966 1.00 . A A . 46 SER HG 1 1 9 6239 1 1 46 SER N N 5.019 -2.198 19.123 1.00 . A A . 46 SER N 1 1 9 6240 1 1 46 SER O O 3.063 -4.621 18.187 1.00 . A A . 46 SER O 1 1 9 6241 1 1 46 SER OG O 1.305 -2.275 19.348 1.00 . A A . 46 SER OG 1 1 9 6242 1 1 47 PHE C C 5.489 -6.608 18.538 1.00 . A A . 47 PHE C 1 1 9 6243 1 1 47 PHE CA C 4.606 -6.498 19.836 1.00 . A A . 47 PHE CA 1 1 9 6244 1 1 47 PHE CB C 3.273 -7.330 19.819 1.00 . A A . 47 PHE CB 1 1 9 6245 1 1 47 PHE CD1 C 3.848 -9.446 21.121 1.00 . A A . 47 PHE CD1 1 1 9 6246 1 1 47 PHE CD2 C 3.324 -9.661 18.772 1.00 . A A . 47 PHE CD2 1 1 9 6247 1 1 47 PHE CE1 C 4.065 -10.820 21.197 1.00 . A A . 47 PHE CE1 1 1 9 6248 1 1 47 PHE CE2 C 3.541 -11.035 18.852 1.00 . A A . 47 PHE CE2 1 1 9 6249 1 1 47 PHE CG C 3.483 -8.854 19.905 1.00 . A A . 47 PHE CG 1 1 9 6250 1 1 47 PHE CZ C 3.912 -11.613 20.063 1.00 . A A . 47 PHE CZ 1 1 9 6251 1 1 47 PHE H H 4.666 -4.567 20.884 1.00 . A A . 47 PHE H 1 1 9 6252 1 1 47 PHE HA H 5.247 -6.844 20.666 1.00 . A A . 47 PHE HA 1 1 9 6253 1 1 47 PHE HB2 H 2.642 -7.032 20.681 1.00 . A A . 47 PHE HB2 1 1 9 6254 1 1 47 PHE HB3 H 2.652 -7.071 18.939 1.00 . A A . 47 PHE HB3 1 1 9 6255 1 1 47 PHE HD1 H 3.978 -8.842 22.008 1.00 . A A . 47 PHE HD1 1 1 9 6256 1 1 47 PHE HD2 H 3.042 -9.227 17.823 1.00 . A A . 47 PHE HD2 1 1 9 6257 1 1 47 PHE HE1 H 4.355 -11.270 22.136 1.00 . A A . 47 PHE HE1 1 1 9 6258 1 1 47 PHE HE2 H 3.424 -11.652 17.973 1.00 . A A . 47 PHE HE2 1 1 9 6259 1 1 47 PHE HZ H 4.083 -12.678 20.123 1.00 . A A . 47 PHE HZ 1 1 9 6260 1 1 47 PHE N N 4.266 -5.059 20.077 1.00 . A A . 47 PHE N 1 1 9 6261 1 1 47 PHE O O 6.701 -6.395 18.641 1.00 . A A . 47 PHE O 1 1 9 6262 1 1 48 ALA C C 4.606 -6.443 14.973 1.00 . A A . 48 ALA C 1 1 9 6263 1 1 48 ALA CA C 5.633 -6.817 16.060 1.00 . A A . 48 ALA CA 1 1 9 6264 1 1 48 ALA CB C 6.335 -8.163 15.773 1.00 . A A . 48 ALA CB 1 1 9 6265 1 1 48 ALA H H 3.905 -7.063 17.408 1.00 . A A . 48 ALA H 1 1 9 6266 1 1 48 ALA HXT H 3.113 -7.207 13.979 1.00 . A A . 48 ALA HXT 1 1 9 6267 1 1 48 ALA HA H 6.394 -6.018 16.095 1.00 . A A . 48 ALA HA 1 1 9 6268 1 1 48 ALA HB1 H 7.042 -8.436 16.580 1.00 . A A . 48 ALA HB1 1 1 9 6269 1 1 48 ALA HB2 H 5.625 -9.006 15.665 1.00 . A A . 48 ALA HB2 1 1 9 6270 1 1 48 ALA HB3 H 6.934 -8.113 14.846 1.00 . A A . 48 ALA HB3 1 1 9 6271 1 1 48 ALA N N 4.915 -6.894 17.352 1.00 . A A . 48 ALA N 1 1 9 6272 1 1 48 ALA O O 4.560 -5.324 14.463 1.00 . A A . 48 ALA O 1 1 9 6273 1 1 48 ALA OXT O 3.747 -7.468 14.650 1.00 . A A . 48 ALA OXT 1 1 10 6274 1 1 1 GLU C C 8.237 13.149 12.708 1.00 . A A . 1 GLU C 1 1 10 6275 1 1 1 GLU CA C 8.396 14.633 13.136 1.00 . A A . 1 GLU CA 1 1 10 6276 1 1 1 GLU CB C 9.893 15.038 13.284 1.00 . A A . 1 GLU CB 1 1 10 6277 1 1 1 GLU CD C 11.044 13.993 11.177 1.00 . A A . 1 GLU CD 1 1 10 6278 1 1 1 GLU CG C 10.686 15.258 11.972 1.00 . A A . 1 GLU CG 1 1 10 6279 1 1 1 GLU H1 H 6.714 14.575 14.374 1.00 . A A . 1 GLU H1 1 1 10 6280 1 1 1 GLU H2 H 8.118 14.202 15.161 1.00 . A A . 1 GLU H2 1 1 10 6281 1 1 1 GLU HA H 7.904 15.297 12.397 1.00 . A A . 1 GLU HA 1 1 10 6282 1 1 1 GLU HB2 H 9.945 15.999 13.831 1.00 . A A . 1 GLU HB2 1 1 10 6283 1 1 1 GLU HB3 H 10.434 14.324 13.935 1.00 . A A . 1 GLU HB3 1 1 10 6284 1 1 1 GLU HE2 H 10.820 13.258 9.389 1.00 . A A . 1 GLU HE2 1 1 10 6285 1 1 1 GLU HG2 H 10.141 15.976 11.330 1.00 . A A . 1 GLU HG2 1 1 10 6286 1 1 1 GLU HG3 H 11.635 15.768 12.219 1.00 . A A . 1 GLU HG3 1 1 10 6287 1 1 1 GLU N N 7.712 14.805 14.437 1.00 . A A . 1 GLU N 1 1 10 6288 1 1 1 GLU O O 8.740 12.240 13.380 1.00 . A A . 1 GLU O 1 1 10 6289 1 1 1 GLU OE1 O 11.666 13.043 11.652 1.00 . A A . 1 GLU OE1 1 1 10 6290 1 1 1 GLU OE2 O 10.593 14.049 9.883 1.00 . A A . 1 GLU OE2 1 1 10 6291 1 1 2 ASP C C 8.018 11.688 9.496 1.00 . A A . 2 ASP C 1 1 10 6292 1 1 2 ASP CA C 7.454 11.582 10.937 1.00 . A A . 2 ASP CA 1 1 10 6293 1 1 2 ASP CB C 5.973 11.105 10.905 1.00 . A A . 2 ASP CB 1 1 10 6294 1 1 2 ASP CG C 5.411 10.655 12.261 1.00 . A A . 2 ASP CG 1 1 10 6295 1 1 2 ASP H H 7.204 13.770 11.104 1.00 . A A . 2 ASP H 1 1 10 6296 1 1 2 ASP HA H 8.031 10.823 11.506 1.00 . A A . 2 ASP HA 1 1 10 6297 1 1 2 ASP HB2 H 5.315 11.889 10.483 1.00 . A A . 2 ASP HB2 1 1 10 6298 1 1 2 ASP HB3 H 5.872 10.253 10.204 1.00 . A A . 2 ASP HB3 1 1 10 6299 1 1 2 ASP HD2 H 6.106 8.901 11.777 1.00 . A A . 2 ASP HD2 1 1 10 6300 1 1 2 ASP N N 7.564 12.926 11.565 1.00 . A A . 2 ASP N 1 1 10 6301 1 1 2 ASP O O 7.375 12.235 8.593 1.00 . A A . 2 ASP O 1 1 10 6302 1 1 2 ASP OD1 O 4.830 11.411 13.038 1.00 . A A . 2 ASP OD1 1 1 10 6303 1 1 2 ASP OD2 O 5.636 9.322 12.500 1.00 . A A . 2 ASP OD2 1 1 10 6304 1 1 3 ASN C C 9.154 9.773 7.112 1.00 . A A . 3 ASN C 1 1 10 6305 1 1 3 ASN CA C 9.815 10.940 7.922 1.00 . A A . 3 ASN CA 1 1 10 6306 1 1 3 ASN CB C 11.354 10.736 8.101 1.00 . A A . 3 ASN CB 1 1 10 6307 1 1 3 ASN CG C 11.902 9.559 8.948 1.00 . A A . 3 ASN CG 1 1 10 6308 1 1 3 ASN H H 9.652 10.711 10.127 1.00 . A A . 3 ASN H 1 1 10 6309 1 1 3 ASN HA H 9.608 11.817 7.339 1.00 . A A . 3 ASN HA 1 1 10 6310 1 1 3 ASN HB2 H 11.788 10.629 7.091 1.00 . A A . 3 ASN HB2 1 1 10 6311 1 1 3 ASN HB3 H 11.794 11.686 8.466 1.00 . A A . 3 ASN HB3 1 1 10 6312 1 1 3 ASN HD21 H 12.031 10.738 10.566 1.00 . A A . 3 ASN HD21 1 1 10 6313 1 1 3 ASN HD22 H 12.559 8.991 10.757 1.00 . A A . 3 ASN HD22 1 1 10 6314 1 1 3 ASN N N 9.227 11.131 9.293 1.00 . A A . 3 ASN N 1 1 10 6315 1 1 3 ASN ND2 N 12.196 9.786 10.220 1.00 . A A . 3 ASN ND2 1 1 10 6316 1 1 3 ASN O O 8.878 9.884 5.915 1.00 . A A . 3 ASN O 1 1 10 6317 1 1 3 ASN OD1 O 12.072 8.443 8.458 1.00 . A A . 3 ASN OD1 1 1 10 6318 1 1 4 CYS C C 7.391 6.937 8.680 1.00 . A A . 4 CYS C 1 1 10 6319 1 1 4 CYS CA C 8.087 7.545 7.413 1.00 . A A . 4 CYS CA 1 1 10 6320 1 1 4 CYS CB C 8.916 6.493 6.683 1.00 . A A . 4 CYS CB 1 1 10 6321 1 1 4 CYS H H 9.108 9.052 8.775 1.00 . A A . 4 CYS H 1 1 10 6322 1 1 4 CYS HA H 7.308 7.849 6.693 1.00 . A A . 4 CYS HA 1 1 10 6323 1 1 4 CYS HB2 H 8.144 5.760 6.587 1.00 . A A . 4 CYS HB2 1 1 10 6324 1 1 4 CYS HB3 H 9.131 6.690 5.623 1.00 . A A . 4 CYS HB3 1 1 10 6325 1 1 4 CYS N N 8.910 8.698 7.835 1.00 . A A . 4 CYS N 1 1 10 6326 1 1 4 CYS O O 7.788 7.185 9.827 1.00 . A A . 4 CYS O 1 1 10 6327 1 1 4 CYS SG S 10.199 5.583 7.547 1.00 . A A . 4 CYS SG 1 1 10 6328 1 1 5 ILE C C 5.811 3.999 9.522 1.00 . A A . 5 ILE C 1 1 10 6329 1 1 5 ILE CA C 5.540 5.517 9.596 1.00 . A A . 5 ILE CA 1 1 10 6330 1 1 5 ILE CB C 3.985 5.816 9.550 1.00 . A A . 5 ILE CB 1 1 10 6331 1 1 5 ILE CD1 C 2.374 7.814 9.300 1.00 . A A . 5 ILE CD1 1 1 10 6332 1 1 5 ILE CG1 C 3.786 7.334 9.439 1.00 . A A . 5 ILE CG1 1 1 10 6333 1 1 5 ILE CG2 C 3.261 5.248 10.821 1.00 . A A . 5 ILE CG2 1 1 10 6334 1 1 5 ILE H H 6.239 5.888 7.430 1.00 . A A . 5 ILE H 1 1 10 6335 1 1 5 ILE HA H 5.893 5.922 10.554 1.00 . A A . 5 ILE HA 1 1 10 6336 1 1 5 ILE HB H 3.479 5.355 8.703 1.00 . A A . 5 ILE HB 1 1 10 6337 1 1 5 ILE HD11 H 1.772 7.442 10.138 1.00 . A A . 5 ILE HD11 1 1 10 6338 1 1 5 ILE HD12 H 2.293 8.912 9.334 1.00 . A A . 5 ILE HD12 1 1 10 6339 1 1 5 ILE HD13 H 1.951 7.454 8.347 1.00 . A A . 5 ILE HD13 1 1 10 6340 1 1 5 ILE HG12 H 4.212 7.821 10.302 1.00 . A A . 5 ILE HG12 1 1 10 6341 1 1 5 ILE HG13 H 4.326 7.698 8.551 1.00 . A A . 5 ILE HG13 1 1 10 6342 1 1 5 ILE HG21 H 3.366 4.151 10.911 1.00 . A A . 5 ILE HG21 1 1 10 6343 1 1 5 ILE HG22 H 3.601 5.686 11.778 1.00 . A A . 5 ILE HG22 1 1 10 6344 1 1 5 ILE HG23 H 2.162 5.394 10.789 1.00 . A A . 5 ILE HG23 1 1 10 6345 1 1 5 ILE N N 6.329 6.120 8.446 1.00 . A A . 5 ILE N 1 1 10 6346 1 1 5 ILE O O 5.075 3.230 8.900 1.00 . A A . 5 ILE O 1 1 10 6347 1 1 6 ALA C C 6.477 1.104 10.940 1.00 . A A . 6 ALA C 1 1 10 6348 1 1 6 ALA CA C 7.326 2.117 10.076 1.00 . A A . 6 ALA CA 1 1 10 6349 1 1 6 ALA CB C 8.799 2.094 10.538 1.00 . A A . 6 ALA CB 1 1 10 6350 1 1 6 ALA H H 7.302 4.243 10.796 1.00 . A A . 6 ALA H 1 1 10 6351 1 1 6 ALA HA H 7.243 1.817 9.005 1.00 . A A . 6 ALA HA 1 1 10 6352 1 1 6 ALA HB1 H 9.433 2.783 9.948 1.00 . A A . 6 ALA HB1 1 1 10 6353 1 1 6 ALA HB2 H 8.909 2.376 11.603 1.00 . A A . 6 ALA HB2 1 1 10 6354 1 1 6 ALA HB3 H 9.241 1.088 10.420 1.00 . A A . 6 ALA HB3 1 1 10 6355 1 1 6 ALA N N 6.883 3.545 10.184 1.00 . A A . 6 ALA N 1 1 10 6356 1 1 6 ALA O O 6.907 -0.017 11.230 1.00 . A A . 6 ALA O 1 1 10 6357 1 1 7 GLU C C 3.257 0.051 11.696 1.00 . A A . 7 GLU C 1 1 10 6358 1 1 7 GLU CA C 4.402 0.874 12.320 1.00 . A A . 7 GLU CA 1 1 10 6359 1 1 7 GLU CB C 3.847 2.006 13.232 1.00 . A A . 7 GLU CB 1 1 10 6360 1 1 7 GLU CD C 5.518 1.901 15.203 1.00 . A A . 7 GLU CD 1 1 10 6361 1 1 7 GLU CG C 4.844 2.771 14.137 1.00 . A A . 7 GLU CG 1 1 10 6362 1 1 7 GLU H H 5.231 2.548 11.114 1.00 . A A . 7 GLU H 1 1 10 6363 1 1 7 GLU HA H 4.953 0.187 12.925 1.00 . A A . 7 GLU HA 1 1 10 6364 1 1 7 GLU HB2 H 3.333 2.735 12.589 1.00 . A A . 7 GLU HB2 1 1 10 6365 1 1 7 GLU HB3 H 3.051 1.606 13.889 1.00 . A A . 7 GLU HB3 1 1 10 6366 1 1 7 GLU HE2 H 7.154 0.876 15.457 1.00 . A A . 7 GLU HE2 1 1 10 6367 1 1 7 GLU HG2 H 5.611 3.278 13.521 1.00 . A A . 7 GLU HG2 1 1 10 6368 1 1 7 GLU HG3 H 4.305 3.591 14.646 1.00 . A A . 7 GLU HG3 1 1 10 6369 1 1 7 GLU N N 5.274 1.540 11.334 1.00 . A A . 7 GLU N 1 1 10 6370 1 1 7 GLU O O 2.878 0.203 10.533 1.00 . A A . 7 GLU O 1 1 10 6371 1 1 7 GLU OE1 O 5.015 1.661 16.300 1.00 . A A . 7 GLU OE1 1 1 10 6372 1 1 7 GLU OE2 O 6.736 1.423 14.788 1.00 . A A . 7 GLU OE2 1 1 10 6373 1 1 8 ASP C C 0.477 -0.817 13.270 1.00 . A A . 8 ASP C 1 1 10 6374 1 1 8 ASP CA C 1.449 -1.554 12.311 1.00 . A A . 8 ASP CA 1 1 10 6375 1 1 8 ASP CB C 1.454 -3.077 12.636 1.00 . A A . 8 ASP CB 1 1 10 6376 1 1 8 ASP CG C 2.767 -3.835 12.343 1.00 . A A . 8 ASP CG 1 1 10 6377 1 1 8 ASP H H 3.155 -0.829 13.490 1.00 . A A . 8 ASP H 1 1 10 6378 1 1 8 ASP HA H 1.167 -1.441 11.241 1.00 . A A . 8 ASP HA 1 1 10 6379 1 1 8 ASP HB2 H 1.122 -3.200 13.677 1.00 . A A . 8 ASP HB2 1 1 10 6380 1 1 8 ASP HB3 H 0.676 -3.555 12.015 1.00 . A A . 8 ASP HB3 1 1 10 6381 1 1 8 ASP HD2 H 2.656 -3.051 10.564 1.00 . A A . 8 ASP HD2 1 1 10 6382 1 1 8 ASP N N 2.712 -0.822 12.564 1.00 . A A . 8 ASP N 1 1 10 6383 1 1 8 ASP O O 0.649 -0.738 14.494 1.00 . A A . 8 ASP O 1 1 10 6384 1 1 8 ASP OD1 O 3.329 -4.541 13.179 1.00 . A A . 8 ASP OD1 1 1 10 6385 1 1 8 ASP OD2 O 3.230 -3.634 11.067 1.00 . A A . 8 ASP OD2 1 1 10 6386 1 1 9 TYR C C -0.817 2.008 13.795 1.00 . A A . 9 TYR C 1 1 10 6387 1 1 9 TYR CA C -1.521 0.717 13.203 1.00 . A A . 9 TYR CA 1 1 10 6388 1 1 9 TYR CB C -2.390 -0.018 14.282 1.00 . A A . 9 TYR CB 1 1 10 6389 1 1 9 TYR CD1 C -3.988 -1.257 12.709 1.00 . A A . 9 TYR CD1 1 1 10 6390 1 1 9 TYR CD2 C -2.866 -2.521 14.436 1.00 . A A . 9 TYR CD2 1 1 10 6391 1 1 9 TYR CE1 C -4.585 -2.425 12.247 1.00 . A A . 9 TYR CE1 1 1 10 6392 1 1 9 TYR CE2 C -3.491 -3.683 13.990 1.00 . A A . 9 TYR CE2 1 1 10 6393 1 1 9 TYR CG C -3.123 -1.295 13.810 1.00 . A A . 9 TYR CG 1 1 10 6394 1 1 9 TYR CZ C -4.363 -3.630 12.906 1.00 . A A . 9 TYR CZ 1 1 10 6395 1 1 9 TYR H H -0.547 -0.587 11.658 1.00 . A A . 9 TYR H 1 1 10 6396 1 1 9 TYR HA H -2.177 1.079 12.392 1.00 . A A . 9 TYR HA 1 1 10 6397 1 1 9 TYR HB2 H -1.781 -0.227 15.184 1.00 . A A . 9 TYR HB2 1 1 10 6398 1 1 9 TYR HB3 H -3.161 0.686 14.647 1.00 . A A . 9 TYR HB3 1 1 10 6399 1 1 9 TYR HD1 H -4.183 -0.327 12.193 1.00 . A A . 9 TYR HD1 1 1 10 6400 1 1 9 TYR HD2 H -2.183 -2.579 15.271 1.00 . A A . 9 TYR HD2 1 1 10 6401 1 1 9 TYR HE1 H -5.220 -2.397 11.378 1.00 . A A . 9 TYR HE1 1 1 10 6402 1 1 9 TYR HE2 H -3.289 -4.624 14.481 1.00 . A A . 9 TYR HE2 1 1 10 6403 1 1 9 TYR HH H -5.587 -4.534 11.751 1.00 . A A . 9 TYR HH 1 1 10 6404 1 1 9 TYR N N -0.539 -0.259 12.626 1.00 . A A . 9 TYR N 1 1 10 6405 1 1 9 TYR O O -1.300 2.578 14.780 1.00 . A A . 9 TYR O 1 1 10 6406 1 1 9 TYR OH O -5.028 -4.754 12.501 1.00 . A A . 9 TYR OH 1 1 10 6407 1 1 10 GLY C C 0.068 4.992 12.859 1.00 . A A . 10 GLY C 1 1 10 6408 1 1 10 GLY CA C 0.846 3.855 13.483 1.00 . A A . 10 GLY CA 1 1 10 6409 1 1 10 GLY H H 0.632 1.921 12.398 1.00 . A A . 10 GLY H 1 1 10 6410 1 1 10 GLY HA2 H 1.022 3.966 14.558 1.00 . A A . 10 GLY HA2 1 1 10 6411 1 1 10 GLY HA3 H 1.848 4.050 13.121 1.00 . A A . 10 GLY HA3 1 1 10 6412 1 1 10 GLY N N 0.264 2.525 13.148 1.00 . A A . 10 GLY N 1 1 10 6413 1 1 10 GLY O O -0.405 4.924 11.725 1.00 . A A . 10 GLY O 1 1 10 6414 1 1 11 LYS C C -0.314 7.986 12.152 1.00 . A A . 11 LYS C 1 1 10 6415 1 1 11 LYS CA C -0.945 7.179 13.324 1.00 . A A . 11 LYS CA 1 1 10 6416 1 1 11 LYS CB C -1.162 8.161 14.491 1.00 . A A . 11 LYS CB 1 1 10 6417 1 1 11 LYS CD C -3.122 6.931 15.746 1.00 . A A . 11 LYS CD 1 1 10 6418 1 1 11 LYS CE C -4.272 7.876 15.336 1.00 . A A . 11 LYS CE 1 1 10 6419 1 1 11 LYS CG C -1.725 7.595 15.819 1.00 . A A . 11 LYS CG 1 1 10 6420 1 1 11 LYS H H 0.593 5.895 14.448 1.00 . A A . 11 LYS H 1 1 10 6421 1 1 11 LYS HA H -1.939 6.758 13.056 1.00 . A A . 11 LYS HA 1 1 10 6422 1 1 11 LYS HB2 H -0.221 8.692 14.642 1.00 . A A . 11 LYS HB2 1 1 10 6423 1 1 11 LYS HB3 H -1.849 8.961 14.155 1.00 . A A . 11 LYS HB3 1 1 10 6424 1 1 11 LYS HD2 H -3.080 6.064 15.059 1.00 . A A . 11 LYS HD2 1 1 10 6425 1 1 11 LYS HD3 H -3.344 6.499 16.740 1.00 . A A . 11 LYS HD3 1 1 10 6426 1 1 11 LYS HE2 H -4.311 8.751 16.010 1.00 . A A . 11 LYS HE2 1 1 10 6427 1 1 11 LYS HE3 H -4.104 8.275 14.319 1.00 . A A . 11 LYS HE3 1 1 10 6428 1 1 11 LYS HG2 H -1.006 6.863 16.231 1.00 . A A . 11 LYS HG2 1 1 10 6429 1 1 11 LYS HG3 H -1.754 8.409 16.566 1.00 . A A . 11 LYS HG3 1 1 10 6430 1 1 11 LYS HZ1 H -5.755 6.812 16.300 1.00 . A A . 11 LYS HZ1 1 1 10 6431 1 1 11 LYS HZ2 H -5.562 6.381 14.735 1.00 . A A . 11 LYS HZ2 1 1 10 6432 1 1 11 LYS N N -0.036 6.046 13.651 1.00 . A A . 11 LYS N 1 1 10 6433 1 1 11 LYS NZ N -5.577 7.191 15.363 1.00 . A A . 11 LYS NZ 1 1 10 6434 1 1 11 LYS O O 0.825 8.466 12.174 1.00 . A A . 11 LYS O 1 1 10 6435 1 1 12 CYS C C -1.943 9.521 9.301 1.00 . A A . 12 CYS C 1 1 10 6436 1 1 12 CYS CA C -0.834 8.557 9.787 1.00 . A A . 12 CYS CA 1 1 10 6437 1 1 12 CYS CB C -0.673 7.330 8.848 1.00 . A A . 12 CYS CB 1 1 10 6438 1 1 12 CYS H H -2.064 7.715 11.474 1.00 . A A . 12 CYS H 1 1 10 6439 1 1 12 CYS HA H 0.130 9.111 9.790 1.00 . A A . 12 CYS HA 1 1 10 6440 1 1 12 CYS HB2 H -0.284 7.640 7.863 1.00 . A A . 12 CYS HB2 1 1 10 6441 1 1 12 CYS HB3 H 0.062 6.618 9.245 1.00 . A A . 12 CYS HB3 1 1 10 6442 1 1 12 CYS N N -1.160 8.060 11.141 1.00 . A A . 12 CYS N 1 1 10 6443 1 1 12 CYS O O -2.855 9.922 10.037 1.00 . A A . 12 CYS O 1 1 10 6444 1 1 12 CYS SG S -2.105 6.336 8.551 1.00 . A A . 12 CYS SG 1 1 10 6445 1 1 13 THR C C -2.887 10.626 5.891 1.00 . A A . 13 THR C 1 1 10 6446 1 1 13 THR CA C -2.737 10.919 7.415 1.00 . A A . 13 THR CA 1 1 10 6447 1 1 13 THR CB C -2.197 12.399 7.601 1.00 . A A . 13 THR CB 1 1 10 6448 1 1 13 THR CG2 C -2.958 13.197 8.652 1.00 . A A . 13 THR CG2 1 1 10 6449 1 1 13 THR H H -0.922 9.606 7.606 1.00 . A A . 13 THR H 1 1 10 6450 1 1 13 THR HA H -3.742 10.799 7.894 1.00 . A A . 13 THR HA 1 1 10 6451 1 1 13 THR HB H -2.325 12.928 6.638 1.00 . A A . 13 THR HB 1 1 10 6452 1 1 13 THR HG1 H -0.825 12.014 8.904 1.00 . A A . 13 THR HG1 1 1 10 6453 1 1 13 THR HG21 H -4.025 13.280 8.389 1.00 . A A . 13 THR HG21 1 1 10 6454 1 1 13 THR HG22 H -2.853 12.750 9.655 1.00 . A A . 13 THR HG22 1 1 10 6455 1 1 13 THR HG23 H -2.549 14.226 8.697 1.00 . A A . 13 THR HG23 1 1 10 6456 1 1 13 THR N N -1.811 9.928 8.031 1.00 . A A . 13 THR N 1 1 10 6457 1 1 13 THR O O -1.960 10.198 5.192 1.00 . A A . 13 THR O 1 1 10 6458 1 1 13 THR OG1 O -0.838 12.445 8.046 1.00 . A A . 13 THR OG1 1 1 10 6459 1 1 14 TRP C C -4.109 12.482 3.559 1.00 . A A . 14 TRP C 1 1 10 6460 1 1 14 TRP CA C -4.419 11.006 3.944 1.00 . A A . 14 TRP CA 1 1 10 6461 1 1 14 TRP CB C -5.894 10.621 3.651 1.00 . A A . 14 TRP CB 1 1 10 6462 1 1 14 TRP CD1 C -5.475 7.995 3.609 1.00 . A A . 14 TRP CD1 1 1 10 6463 1 1 14 TRP CD2 C -7.543 8.636 4.132 1.00 . A A . 14 TRP CD2 1 1 10 6464 1 1 14 TRP CE2 C -7.473 7.219 4.104 1.00 . A A . 14 TRP CE2 1 1 10 6465 1 1 14 TRP CE3 C -8.767 9.286 4.445 1.00 . A A . 14 TRP CE3 1 1 10 6466 1 1 14 TRP CG C -6.288 9.139 3.820 1.00 . A A . 14 TRP CG 1 1 10 6467 1 1 14 TRP CH2 C -9.817 7.102 4.689 1.00 . A A . 14 TRP CH2 1 1 10 6468 1 1 14 TRP CZ2 C -8.626 6.445 4.379 1.00 . A A . 14 TRP CZ2 1 1 10 6469 1 1 14 TRP CZ3 C -9.886 8.500 4.723 1.00 . A A . 14 TRP CZ3 1 1 10 6470 1 1 14 TRP H H -4.666 11.435 6.108 1.00 . A A . 14 TRP H 1 1 10 6471 1 1 14 TRP HA H -3.770 10.305 3.380 1.00 . A A . 14 TRP HA 1 1 10 6472 1 1 14 TRP HB2 H -6.569 11.254 4.261 1.00 . A A . 14 TRP HB2 1 1 10 6473 1 1 14 TRP HB3 H -6.129 10.896 2.605 1.00 . A A . 14 TRP HB3 1 1 10 6474 1 1 14 TRP HD1 H -4.430 8.022 3.336 1.00 . A A . 14 TRP HD1 1 1 10 6475 1 1 14 TRP HE1 H -5.848 5.837 3.694 1.00 . A A . 14 TRP HE1 1 1 10 6476 1 1 14 TRP HE3 H -8.837 10.364 4.472 1.00 . A A . 14 TRP HE3 1 1 10 6477 1 1 14 TRP HH2 H -10.701 6.522 4.910 1.00 . A A . 14 TRP HH2 1 1 10 6478 1 1 14 TRP HZ2 H -8.588 5.366 4.359 1.00 . A A . 14 TRP HZ2 1 1 10 6479 1 1 14 TRP HZ3 H -10.823 8.980 4.969 1.00 . A A . 14 TRP HZ3 1 1 10 6480 1 1 14 TRP N N -4.101 10.949 5.403 1.00 . A A . 14 TRP N 1 1 10 6481 1 1 14 TRP NE1 N -6.191 6.800 3.790 1.00 . A A . 14 TRP NE1 1 1 10 6482 1 1 14 TRP O O -4.858 13.413 3.879 1.00 . A A . 14 TRP O 1 1 10 6483 1 1 15 GLY C C -1.440 14.175 4.004 1.00 . A A . 15 GLY C 1 1 10 6484 1 1 15 GLY CA C -2.312 13.996 2.733 1.00 . A A . 15 GLY CA 1 1 10 6485 1 1 15 GLY H H -2.414 11.798 2.748 1.00 . A A . 15 GLY H 1 1 10 6486 1 1 15 GLY HA2 H -1.702 14.008 1.809 1.00 . A A . 15 GLY HA2 1 1 10 6487 1 1 15 GLY HA3 H -3.058 14.807 2.637 1.00 . A A . 15 GLY HA3 1 1 10 6488 1 1 15 GLY N N -2.939 12.662 2.925 1.00 . A A . 15 GLY N 1 1 10 6489 1 1 15 GLY O O -1.808 14.911 4.924 1.00 . A A . 15 GLY O 1 1 10 6490 1 1 16 GLY C C 1.719 12.364 5.014 1.00 . A A . 16 GLY C 1 1 10 6491 1 1 16 GLY CA C 0.479 13.235 5.258 1.00 . A A . 16 GLY CA 1 1 10 6492 1 1 16 GLY H H -0.186 12.854 3.202 1.00 . A A . 16 GLY H 1 1 10 6493 1 1 16 GLY HA2 H 0.599 14.088 5.952 1.00 . A A . 16 GLY HA2 1 1 10 6494 1 1 16 GLY HA3 H -0.186 12.581 5.836 1.00 . A A . 16 GLY HA3 1 1 10 6495 1 1 16 GLY N N -0.325 13.430 4.039 1.00 . A A . 16 GLY N 1 1 10 6496 1 1 16 GLY O O 2.231 12.237 3.895 1.00 . A A . 16 GLY O 1 1 10 6497 1 1 17 THR C C 2.294 9.321 5.859 1.00 . A A . 17 THR C 1 1 10 6498 1 1 17 THR CA C 3.160 10.618 6.024 1.00 . A A . 17 THR CA 1 1 10 6499 1 1 17 THR CB C 4.094 10.456 7.283 1.00 . A A . 17 THR CB 1 1 10 6500 1 1 17 THR CG2 C 5.405 9.724 6.929 1.00 . A A . 17 THR CG2 1 1 10 6501 1 1 17 THR H H 1.669 12.028 6.961 1.00 . A A . 17 THR H 1 1 10 6502 1 1 17 THR HA H 3.812 10.801 5.144 1.00 . A A . 17 THR HA 1 1 10 6503 1 1 17 THR HB H 3.604 9.824 8.050 1.00 . A A . 17 THR HB 1 1 10 6504 1 1 17 THR HG1 H 3.628 12.156 8.055 1.00 . A A . 17 THR HG1 1 1 10 6505 1 1 17 THR HG21 H 5.223 8.731 6.484 1.00 . A A . 17 THR HG21 1 1 10 6506 1 1 17 THR HG22 H 6.049 10.266 6.217 1.00 . A A . 17 THR HG22 1 1 10 6507 1 1 17 THR HG23 H 6.009 9.522 7.834 1.00 . A A . 17 THR HG23 1 1 10 6508 1 1 17 THR N N 2.153 11.719 6.109 1.00 . A A . 17 THR N 1 1 10 6509 1 1 17 THR O O 1.263 9.103 6.517 1.00 . A A . 17 THR O 1 1 10 6510 1 1 17 THR OG1 O 4.451 11.733 7.802 1.00 . A A . 17 THR OG1 1 1 10 6511 1 1 18 LYS C C 3.304 6.174 5.530 1.00 . A A . 18 LYS C 1 1 10 6512 1 1 18 LYS CA C 2.310 7.083 4.768 1.00 . A A . 18 LYS CA 1 1 10 6513 1 1 18 LYS CB C 2.202 6.719 3.252 1.00 . A A . 18 LYS CB 1 1 10 6514 1 1 18 LYS CD C 2.215 8.826 1.694 1.00 . A A . 18 LYS CD 1 1 10 6515 1 1 18 LYS CE C 1.349 9.731 0.799 1.00 . A A . 18 LYS CE 1 1 10 6516 1 1 18 LYS CG C 1.411 7.656 2.303 1.00 . A A . 18 LYS CG 1 1 10 6517 1 1 18 LYS H H 3.723 8.766 4.638 1.00 . A A . 18 LYS H 1 1 10 6518 1 1 18 LYS HA H 1.309 6.895 5.188 1.00 . A A . 18 LYS HA 1 1 10 6519 1 1 18 LYS HB2 H 3.191 6.440 2.857 1.00 . A A . 18 LYS HB2 1 1 10 6520 1 1 18 LYS HB3 H 1.664 5.753 3.211 1.00 . A A . 18 LYS HB3 1 1 10 6521 1 1 18 LYS HD2 H 2.666 9.440 2.495 1.00 . A A . 18 LYS HD2 1 1 10 6522 1 1 18 LYS HD3 H 3.065 8.421 1.112 1.00 . A A . 18 LYS HD3 1 1 10 6523 1 1 18 LYS HE2 H 0.911 9.149 -0.033 1.00 . A A . 18 LYS HE2 1 1 10 6524 1 1 18 LYS HE3 H 0.498 10.141 1.374 1.00 . A A . 18 LYS HE3 1 1 10 6525 1 1 18 LYS HG2 H 1.012 7.046 1.470 1.00 . A A . 18 LYS HG2 1 1 10 6526 1 1 18 LYS HG3 H 0.517 8.039 2.831 1.00 . A A . 18 LYS HG3 1 1 10 6527 1 1 18 LYS HZ1 H 1.526 11.459 -0.318 1.00 . A A . 18 LYS HZ1 1 1 10 6528 1 1 18 LYS HZ2 H 2.488 11.441 1.004 1.00 . A A . 18 LYS HZ2 1 1 10 6529 1 1 18 LYS N N 2.792 8.477 4.951 1.00 . A A . 18 LYS N 1 1 10 6530 1 1 18 LYS NZ N 2.132 10.850 0.244 1.00 . A A . 18 LYS NZ 1 1 10 6531 1 1 18 LYS O O 4.268 6.586 6.193 1.00 . A A . 18 LYS O 1 1 10 6532 1 1 19 CYS C C 5.214 3.670 5.480 1.00 . A A . 19 CYS C 1 1 10 6533 1 1 19 CYS CA C 3.848 3.885 6.182 1.00 . A A . 19 CYS CA 1 1 10 6534 1 1 19 CYS CB C 3.078 2.562 6.251 1.00 . A A . 19 CYS CB 1 1 10 6535 1 1 19 CYS H H 2.313 4.721 4.713 1.00 . A A . 19 CYS H 1 1 10 6536 1 1 19 CYS HA H 4.005 4.307 7.201 1.00 . A A . 19 CYS HA 1 1 10 6537 1 1 19 CYS HB2 H 2.825 2.242 5.248 1.00 . A A . 19 CYS HB2 1 1 10 6538 1 1 19 CYS HB3 H 3.694 1.781 6.753 1.00 . A A . 19 CYS HB3 1 1 10 6539 1 1 19 CYS N N 3.038 4.878 5.433 1.00 . A A . 19 CYS N 1 1 10 6540 1 1 19 CYS O O 5.358 3.893 4.266 1.00 . A A . 19 CYS O 1 1 10 6541 1 1 19 CYS SG S 1.549 2.771 7.136 1.00 . A A . 19 CYS SG 1 1 10 6542 1 1 20 CYS C C 7.849 2.220 4.669 1.00 . A A . 20 CYS C 1 1 10 6543 1 1 20 CYS CA C 7.637 3.288 5.804 1.00 . A A . 20 CYS CA 1 1 10 6544 1 1 20 CYS CB C 8.614 3.041 6.980 1.00 . A A . 20 CYS CB 1 1 10 6545 1 1 20 CYS H H 5.990 3.128 7.263 1.00 . A A . 20 CYS H 1 1 10 6546 1 1 20 CYS HA H 7.752 4.336 5.497 1.00 . A A . 20 CYS HA 1 1 10 6547 1 1 20 CYS HB2 H 8.265 3.491 7.913 1.00 . A A . 20 CYS HB2 1 1 10 6548 1 1 20 CYS HB3 H 8.790 1.963 7.115 1.00 . A A . 20 CYS HB3 1 1 10 6549 1 1 20 CYS N N 6.233 3.265 6.276 1.00 . A A . 20 CYS N 1 1 10 6550 1 1 20 CYS O O 6.904 1.598 4.190 1.00 . A A . 20 CYS O 1 1 10 6551 1 1 20 CYS SG S 10.221 3.789 6.635 1.00 . A A . 20 CYS SG 1 1 10 6552 1 1 21 ARG C C 8.605 0.758 2.014 1.00 . A A . 21 ARG C 1 1 10 6553 1 1 21 ARG CA C 9.646 1.320 3.046 1.00 . A A . 21 ARG CA 1 1 10 6554 1 1 21 ARG CB C 10.509 0.148 3.628 1.00 . A A . 21 ARG CB 1 1 10 6555 1 1 21 ARG CD C 10.733 -2.097 4.890 1.00 . A A . 21 ARG CD 1 1 10 6556 1 1 21 ARG CG C 9.803 -0.940 4.488 1.00 . A A . 21 ARG CG 1 1 10 6557 1 1 21 ARG CZ C 10.348 -4.240 6.167 1.00 . A A . 21 ARG CZ 1 1 10 6558 1 1 21 ARG H H 9.634 2.788 4.691 1.00 . A A . 21 ARG H 1 1 10 6559 1 1 21 ARG HA H 10.296 2.005 2.469 1.00 . A A . 21 ARG HA 1 1 10 6560 1 1 21 ARG HB2 H 11.018 -0.351 2.781 1.00 . A A . 21 ARG HB2 1 1 10 6561 1 1 21 ARG HB3 H 11.344 0.575 4.218 1.00 . A A . 21 ARG HB3 1 1 10 6562 1 1 21 ARG HD2 H 11.150 -2.583 3.987 1.00 . A A . 21 ARG HD2 1 1 10 6563 1 1 21 ARG HD3 H 11.595 -1.714 5.469 1.00 . A A . 21 ARG HD3 1 1 10 6564 1 1 21 ARG HG2 H 9.385 -0.472 5.400 1.00 . A A . 21 ARG HG2 1 1 10 6565 1 1 21 ARG HG3 H 8.933 -1.346 3.940 1.00 . A A . 21 ARG HG3 1 1 10 6566 1 1 21 ARG HH11 H 12.214 -4.184 5.418 1.00 . A A . 21 ARG HH11 1 1 10 6567 1 1 21 ARG HH12 H 11.743 -5.672 6.384 1.00 . A A . 21 ARG HH12 1 1 10 6568 1 1 21 ARG HH21 H 8.552 -4.518 7.007 1.00 . A A . 21 ARG HH21 1 1 10 6569 1 1 21 ARG HH22 H 9.799 -5.846 7.229 1.00 . A A . 21 ARG HH22 1 1 10 6570 1 1 21 ARG N N 9.115 2.038 4.262 1.00 . A A . 21 ARG N 1 1 10 6571 1 1 21 ARG NE N 9.988 -3.107 5.708 1.00 . A A . 21 ARG NE 1 1 10 6572 1 1 21 ARG NH1 N 11.560 -4.751 5.970 1.00 . A A . 21 ARG NH1 1 1 10 6573 1 1 21 ARG NH2 N 9.478 -4.939 6.872 1.00 . A A . 21 ARG NH2 1 1 10 6574 1 1 21 ARG O O 8.556 -0.398 1.582 1.00 . A A . 21 ARG O 1 1 10 6575 1 1 22 GLY C C 5.478 0.819 1.101 1.00 . A A . 22 GLY C 1 1 10 6576 1 1 22 GLY CA C 6.698 1.626 0.649 1.00 . A A . 22 GLY CA 1 1 10 6577 1 1 22 GLY H H 7.974 2.564 2.254 1.00 . A A . 22 GLY H 1 1 10 6578 1 1 22 GLY HA2 H 6.373 2.641 0.351 1.00 . A A . 22 GLY HA2 1 1 10 6579 1 1 22 GLY HA3 H 7.072 1.182 -0.272 1.00 . A A . 22 GLY HA3 1 1 10 6580 1 1 22 GLY N N 7.806 1.758 1.615 1.00 . A A . 22 GLY N 1 1 10 6581 1 1 22 GLY O O 5.169 -0.223 0.515 1.00 . A A . 22 GLY O 1 1 10 6582 1 1 23 ARG C C 2.388 1.650 2.729 1.00 . A A . 23 ARG C 1 1 10 6583 1 1 23 ARG CA C 3.619 0.660 2.728 1.00 . A A . 23 ARG CA 1 1 10 6584 1 1 23 ARG CB C 3.942 0.208 4.179 1.00 . A A . 23 ARG CB 1 1 10 6585 1 1 23 ARG CD C 4.413 -2.332 3.924 1.00 . A A . 23 ARG CD 1 1 10 6586 1 1 23 ARG CG C 4.885 -0.967 4.453 1.00 . A A . 23 ARG CG 1 1 10 6587 1 1 23 ARG CZ C 5.296 -4.588 4.666 1.00 . A A . 23 ARG CZ 1 1 10 6588 1 1 23 ARG H H 5.329 2.112 2.572 1.00 . A A . 23 ARG H 1 1 10 6589 1 1 23 ARG HA H 3.356 -0.243 2.153 1.00 . A A . 23 ARG HA 1 1 10 6590 1 1 23 ARG HB2 H 4.423 1.048 4.699 1.00 . A A . 23 ARG HB2 1 1 10 6591 1 1 23 ARG HB3 H 3.000 0.001 4.724 1.00 . A A . 23 ARG HB3 1 1 10 6592 1 1 23 ARG HD2 H 3.426 -2.582 4.359 1.00 . A A . 23 ARG HD2 1 1 10 6593 1 1 23 ARG HD3 H 4.270 -2.298 2.828 1.00 . A A . 23 ARG HD3 1 1 10 6594 1 1 23 ARG HG2 H 5.885 -0.707 4.069 1.00 . A A . 23 ARG HG2 1 1 10 6595 1 1 23 ARG HG3 H 4.997 -1.011 5.557 1.00 . A A . 23 ARG HG3 1 1 10 6596 1 1 23 ARG HH11 H 3.288 -4.578 4.733 1.00 . A A . 23 ARG HH11 1 1 10 6597 1 1 23 ARG HH12 H 4.134 -6.127 5.234 1.00 . A A . 23 ARG HH12 1 1 10 6598 1 1 23 ARG HH21 H 7.283 -4.833 4.682 1.00 . A A . 23 ARG HH21 1 1 10 6599 1 1 23 ARG HH22 H 6.255 -6.261 5.206 1.00 . A A . 23 ARG HH22 1 1 10 6600 1 1 23 ARG N N 4.808 1.332 2.136 1.00 . A A . 23 ARG N 1 1 10 6601 1 1 23 ARG NE N 5.422 -3.389 4.252 1.00 . A A . 23 ARG NE 1 1 10 6602 1 1 23 ARG NH1 N 4.118 -5.156 4.902 1.00 . A A . 23 ARG NH1 1 1 10 6603 1 1 23 ARG NH2 N 6.389 -5.300 4.871 1.00 . A A . 23 ARG NH2 1 1 10 6604 1 1 23 ARG O O 2.559 2.854 2.997 1.00 . A A . 23 ARG O 1 1 10 6605 1 1 24 PRO C C -0.661 2.329 3.940 1.00 . A A . 24 PRO C 1 1 10 6606 1 1 24 PRO CA C -0.087 2.046 2.513 1.00 . A A . 24 PRO CA 1 1 10 6607 1 1 24 PRO CB C -1.062 1.250 1.620 1.00 . A A . 24 PRO CB 1 1 10 6608 1 1 24 PRO CD C 0.815 -0.197 2.055 1.00 . A A . 24 PRO CD 1 1 10 6609 1 1 24 PRO CG C -0.699 -0.218 1.846 1.00 . A A . 24 PRO CG 1 1 10 6610 1 1 24 PRO HA H 0.130 3.030 2.048 1.00 . A A . 24 PRO HA 1 1 10 6611 1 1 24 PRO HB2 H -2.129 1.454 1.828 1.00 . A A . 24 PRO HB2 1 1 10 6612 1 1 24 PRO HB3 H -0.898 1.513 0.557 1.00 . A A . 24 PRO HB3 1 1 10 6613 1 1 24 PRO HD2 H 1.129 -0.953 2.799 1.00 . A A . 24 PRO HD2 1 1 10 6614 1 1 24 PRO HD3 H 1.333 -0.420 1.103 1.00 . A A . 24 PRO HD3 1 1 10 6615 1 1 24 PRO HG2 H -1.204 -0.605 2.751 1.00 . A A . 24 PRO HG2 1 1 10 6616 1 1 24 PRO HG3 H -1.003 -0.865 1.003 1.00 . A A . 24 PRO HG3 1 1 10 6617 1 1 24 PRO N N 1.121 1.181 2.501 1.00 . A A . 24 PRO N 1 1 10 6618 1 1 24 PRO O O -0.326 1.669 4.932 1.00 . A A . 24 PRO O 1 1 10 6619 1 1 25 CYS C C -3.899 3.609 4.813 1.00 . A A . 25 CYS C 1 1 10 6620 1 1 25 CYS CA C -2.382 3.626 5.198 1.00 . A A . 25 CYS CA 1 1 10 6621 1 1 25 CYS CB C -1.971 5.014 5.768 1.00 . A A . 25 CYS CB 1 1 10 6622 1 1 25 CYS H H -1.757 3.770 3.089 1.00 . A A . 25 CYS H 1 1 10 6623 1 1 25 CYS HA H -2.205 2.867 5.986 1.00 . A A . 25 CYS HA 1 1 10 6624 1 1 25 CYS HB2 H -1.178 5.478 5.156 1.00 . A A . 25 CYS HB2 1 1 10 6625 1 1 25 CYS HB3 H -2.823 5.695 5.809 1.00 . A A . 25 CYS HB3 1 1 10 6626 1 1 25 CYS N N -1.575 3.313 3.989 1.00 . A A . 25 CYS N 1 1 10 6627 1 1 25 CYS O O -4.305 3.875 3.675 1.00 . A A . 25 CYS O 1 1 10 6628 1 1 25 CYS SG S -1.395 4.845 7.436 1.00 . A A . 25 CYS SG 1 1 10 6629 1 1 26 ARG C C -6.660 3.841 7.159 1.00 . A A . 26 ARG C 1 1 10 6630 1 1 26 ARG CA C -6.215 3.404 5.741 1.00 . A A . 26 ARG CA 1 1 10 6631 1 1 26 ARG CB C -6.881 2.058 5.338 1.00 . A A . 26 ARG CB 1 1 10 6632 1 1 26 ARG CD C -9.089 0.894 4.572 1.00 . A A . 26 ARG CD 1 1 10 6633 1 1 26 ARG CG C -8.343 2.212 4.853 1.00 . A A . 26 ARG CG 1 1 10 6634 1 1 26 ARG CZ C -10.556 -0.670 5.880 1.00 . A A . 26 ARG CZ 1 1 10 6635 1 1 26 ARG H H -4.288 3.263 6.748 1.00 . A A . 26 ARG H 1 1 10 6636 1 1 26 ARG HA H -6.483 4.178 4.994 1.00 . A A . 26 ARG HA 1 1 10 6637 1 1 26 ARG HB2 H -6.305 1.586 4.518 1.00 . A A . 26 ARG HB2 1 1 10 6638 1 1 26 ARG HB3 H -6.836 1.339 6.178 1.00 . A A . 26 ARG HB3 1 1 10 6639 1 1 26 ARG HD2 H -9.960 1.131 3.931 1.00 . A A . 26 ARG HD2 1 1 10 6640 1 1 26 ARG HD3 H -8.458 0.207 3.976 1.00 . A A . 26 ARG HD3 1 1 10 6641 1 1 26 ARG HG2 H -8.930 2.819 5.567 1.00 . A A . 26 ARG HG2 1 1 10 6642 1 1 26 ARG HG3 H -8.333 2.809 3.921 1.00 . A A . 26 ARG HG3 1 1 10 6643 1 1 26 ARG HH11 H -11.025 -0.643 3.923 1.00 . A A . 26 ARG HH11 1 1 10 6644 1 1 26 ARG HH12 H -12.023 -1.737 5.008 1.00 . A A . 26 ARG HH12 1 1 10 6645 1 1 26 ARG HH21 H -10.294 -0.877 7.853 1.00 . A A . 26 ARG HH21 1 1 10 6646 1 1 26 ARG HH22 H -11.635 -1.857 7.076 1.00 . A A . 26 ARG HH22 1 1 10 6647 1 1 26 ARG N N -4.733 3.302 5.819 1.00 . A A . 26 ARG N 1 1 10 6648 1 1 26 ARG NE N -9.541 0.216 5.815 1.00 . A A . 26 ARG NE 1 1 10 6649 1 1 26 ARG NH1 N -11.275 -1.057 4.828 1.00 . A A . 26 ARG NH1 1 1 10 6650 1 1 26 ARG NH2 N -10.859 -1.186 7.055 1.00 . A A . 26 ARG NH2 1 1 10 6651 1 1 26 ARG O O -6.090 3.409 8.176 1.00 . A A . 26 ARG O 1 1 10 6652 1 1 27 CYS C C -8.654 4.401 9.592 1.00 . A A . 27 CYS C 1 1 10 6653 1 1 27 CYS CA C -7.963 5.355 8.563 1.00 . A A . 27 CYS CA 1 1 10 6654 1 1 27 CYS CB C -8.903 6.591 8.375 1.00 . A A . 27 CYS CB 1 1 10 6655 1 1 27 CYS H H -8.076 5.052 6.372 1.00 . A A . 27 CYS H 1 1 10 6656 1 1 27 CYS HA H -6.960 5.664 8.869 1.00 . A A . 27 CYS HA 1 1 10 6657 1 1 27 CYS HB2 H -9.667 6.371 7.642 1.00 . A A . 27 CYS HB2 1 1 10 6658 1 1 27 CYS HB3 H -9.479 6.835 9.288 1.00 . A A . 27 CYS HB3 1 1 10 6659 1 1 27 CYS N N -7.676 4.723 7.258 1.00 . A A . 27 CYS N 1 1 10 6660 1 1 27 CYS O O -9.143 3.305 9.302 1.00 . A A . 27 CYS O 1 1 10 6661 1 1 27 CYS SG S -8.131 8.156 7.929 1.00 . A A . 27 CYS SG 1 1 10 6662 1 1 28 SER C C -10.892 4.244 11.838 1.00 . A A . 28 SER C 1 1 10 6663 1 1 28 SER CA C -9.341 4.383 12.025 1.00 . A A . 28 SER CA 1 1 10 6664 1 1 28 SER CB C -8.924 5.366 13.169 1.00 . A A . 28 SER CB 1 1 10 6665 1 1 28 SER H H -8.254 5.877 10.849 1.00 . A A . 28 SER H 1 1 10 6666 1 1 28 SER HA H -8.984 3.373 12.284 1.00 . A A . 28 SER HA 1 1 10 6667 1 1 28 SER HB2 H -7.877 5.717 13.083 1.00 . A A . 28 SER HB2 1 1 10 6668 1 1 28 SER HB3 H -9.548 6.279 13.168 1.00 . A A . 28 SER HB3 1 1 10 6669 1 1 28 SER HG H -9.967 4.497 14.528 1.00 . A A . 28 SER HG 1 1 10 6670 1 1 28 SER N N -8.646 4.929 10.834 1.00 . A A . 28 SER N 1 1 10 6671 1 1 28 SER O O -11.459 4.298 10.741 1.00 . A A . 28 SER O 1 1 10 6672 1 1 28 SER OG O -9.042 4.740 14.439 1.00 . A A . 28 SER OG 1 1 10 6673 1 1 29 MET C C -13.954 4.858 12.661 1.00 . A A . 29 MET C 1 1 10 6674 1 1 29 MET CA C -13.008 3.684 13.060 1.00 . A A . 29 MET CA 1 1 10 6675 1 1 29 MET CB C -13.288 3.275 14.534 1.00 . A A . 29 MET CB 1 1 10 6676 1 1 29 MET CE C -15.603 -0.192 14.288 1.00 . A A . 29 MET CE 1 1 10 6677 1 1 29 MET CG C -14.468 2.310 14.719 1.00 . A A . 29 MET CG 1 1 10 6678 1 1 29 MET H H -10.926 4.153 13.769 1.00 . A A . 29 MET H 1 1 10 6679 1 1 29 MET HA H -13.217 2.838 12.376 1.00 . A A . 29 MET HA 1 1 10 6680 1 1 29 MET HB2 H -12.396 2.809 14.975 1.00 . A A . 29 MET HB2 1 1 10 6681 1 1 29 MET HB3 H -13.446 4.168 15.170 1.00 . A A . 29 MET HB3 1 1 10 6682 1 1 29 MET HE1 H -16.490 0.317 13.870 1.00 . A A . 29 MET HE1 1 1 10 6683 1 1 29 MET HE2 H -15.551 -1.205 13.850 1.00 . A A . 29 MET HE2 1 1 10 6684 1 1 29 MET HE3 H -15.745 -0.297 15.379 1.00 . A A . 29 MET HE3 1 1 10 6685 1 1 29 MET HG2 H -14.651 2.137 15.796 1.00 . A A . 29 MET HG2 1 1 10 6686 1 1 29 MET HG3 H -15.400 2.736 14.303 1.00 . A A . 29 MET HG3 1 1 10 6687 1 1 29 MET N N -11.554 4.017 12.971 1.00 . A A . 29 MET N 1 1 10 6688 1 1 29 MET O O -14.988 4.625 12.029 1.00 . A A . 29 MET O 1 1 10 6689 1 1 29 MET SD S -14.098 0.732 13.922 1.00 . A A . 29 MET SD 1 1 10 6690 1 1 30 ILE C C -14.331 7.771 11.288 1.00 . A A . 30 ILE C 1 1 10 6691 1 1 30 ILE CA C -14.424 7.317 12.788 1.00 . A A . 30 ILE CA 1 1 10 6692 1 1 30 ILE CB C -13.983 8.509 13.740 1.00 . A A . 30 ILE CB 1 1 10 6693 1 1 30 ILE CD1 C -12.013 10.092 14.445 1.00 . A A . 30 ILE CD1 1 1 10 6694 1 1 30 ILE CG1 C -12.435 8.749 13.825 1.00 . A A . 30 ILE CG1 1 1 10 6695 1 1 30 ILE CG2 C -14.524 8.201 15.163 1.00 . A A . 30 ILE CG2 1 1 10 6696 1 1 30 ILE H H -12.647 6.092 13.453 1.00 . A A . 30 ILE H 1 1 10 6697 1 1 30 ILE HA H -15.486 7.078 12.973 1.00 . A A . 30 ILE HA 1 1 10 6698 1 1 30 ILE HB H -14.438 9.453 13.384 1.00 . A A . 30 ILE HB 1 1 10 6699 1 1 30 ILE HD11 H -12.430 10.948 13.883 1.00 . A A . 30 ILE HD11 1 1 10 6700 1 1 30 ILE HD12 H -12.340 10.187 15.496 1.00 . A A . 30 ILE HD12 1 1 10 6701 1 1 30 ILE HD13 H -10.913 10.203 14.438 1.00 . A A . 30 ILE HD13 1 1 10 6702 1 1 30 ILE HG12 H -11.937 7.926 14.372 1.00 . A A . 30 ILE HG12 1 1 10 6703 1 1 30 ILE HG13 H -11.995 8.719 12.815 1.00 . A A . 30 ILE HG13 1 1 10 6704 1 1 30 ILE HG21 H -15.619 8.046 15.157 1.00 . A A . 30 ILE HG21 1 1 10 6705 1 1 30 ILE HG22 H -14.068 7.296 15.606 1.00 . A A . 30 ILE HG22 1 1 10 6706 1 1 30 ILE HG23 H -14.338 9.034 15.865 1.00 . A A . 30 ILE HG23 1 1 10 6707 1 1 30 ILE N N -13.598 6.094 13.054 1.00 . A A . 30 ILE N 1 1 10 6708 1 1 30 ILE O O -15.367 8.153 10.736 1.00 . A A . 30 ILE O 1 1 10 6709 1 1 31 GLY C C -11.725 9.158 9.061 1.00 . A A . 31 GLY C 1 1 10 6710 1 1 31 GLY CA C -12.958 8.249 9.263 1.00 . A A . 31 GLY CA 1 1 10 6711 1 1 31 GLY H H -12.380 7.487 11.280 1.00 . A A . 31 GLY H 1 1 10 6712 1 1 31 GLY HA2 H -12.869 7.378 8.589 1.00 . A A . 31 GLY HA2 1 1 10 6713 1 1 31 GLY HA3 H -13.846 8.799 8.899 1.00 . A A . 31 GLY HA3 1 1 10 6714 1 1 31 GLY N N -13.149 7.734 10.646 1.00 . A A . 31 GLY N 1 1 10 6715 1 1 31 GLY O O -11.018 9.011 8.062 1.00 . A A . 31 GLY O 1 1 10 6716 1 1 32 THR C C -9.318 10.495 11.121 1.00 . A A . 32 THR C 1 1 10 6717 1 1 32 THR CA C -10.299 10.988 10.007 1.00 . A A . 32 THR CA 1 1 10 6718 1 1 32 THR CB C -10.710 12.476 10.279 1.00 . A A . 32 THR CB 1 1 10 6719 1 1 32 THR CG2 C -11.550 13.076 9.135 1.00 . A A . 32 THR CG2 1 1 10 6720 1 1 32 THR H H -12.114 9.993 10.808 1.00 . A A . 32 THR H 1 1 10 6721 1 1 32 THR HA H -9.774 10.948 9.031 1.00 . A A . 32 THR HA 1 1 10 6722 1 1 32 THR HB H -9.781 13.067 10.389 1.00 . A A . 32 THR HB 1 1 10 6723 1 1 32 THR HG1 H -12.280 12.053 11.316 1.00 . A A . 32 THR HG1 1 1 10 6724 1 1 32 THR HG21 H -11.013 13.029 8.169 1.00 . A A . 32 THR HG21 1 1 10 6725 1 1 32 THR HG22 H -12.516 12.554 9.003 1.00 . A A . 32 THR HG22 1 1 10 6726 1 1 32 THR HG23 H -11.780 14.141 9.326 1.00 . A A . 32 THR HG23 1 1 10 6727 1 1 32 THR N N -11.508 10.107 9.987 1.00 . A A . 32 THR N 1 1 10 6728 1 1 32 THR O O -9.681 9.709 12.003 1.00 . A A . 32 THR O 1 1 10 6729 1 1 32 THR OG1 O -11.489 12.574 11.473 1.00 . A A . 32 THR OG1 1 1 10 6730 1 1 33 ASN C C -6.557 9.113 11.620 1.00 . A A . 33 ASN C 1 1 10 6731 1 1 33 ASN CA C -6.917 10.583 11.963 1.00 . A A . 33 ASN CA 1 1 10 6732 1 1 33 ASN CB C -7.265 10.739 13.485 1.00 . A A . 33 ASN CB 1 1 10 6733 1 1 33 ASN CG C -7.350 12.195 13.981 1.00 . A A . 33 ASN CG 1 1 10 6734 1 1 33 ASN H H -7.828 11.485 10.198 1.00 . A A . 33 ASN H 1 1 10 6735 1 1 33 ASN HA H -6.045 11.227 11.733 1.00 . A A . 33 ASN HA 1 1 10 6736 1 1 33 ASN HB2 H -8.175 10.180 13.770 1.00 . A A . 33 ASN HB2 1 1 10 6737 1 1 33 ASN HB3 H -6.489 10.224 14.080 1.00 . A A . 33 ASN HB3 1 1 10 6738 1 1 33 ASN HD21 H -9.355 12.132 13.918 1.00 . A A . 33 ASN HD21 1 1 10 6739 1 1 33 ASN HD22 H -8.581 13.701 14.473 1.00 . A A . 33 ASN HD22 1 1 10 6740 1 1 33 ASN N N -8.050 10.977 11.060 1.00 . A A . 33 ASN N 1 1 10 6741 1 1 33 ASN ND2 N -8.552 12.731 14.140 1.00 . A A . 33 ASN ND2 1 1 10 6742 1 1 33 ASN O O -6.899 8.178 12.356 1.00 . A A . 33 ASN O 1 1 10 6743 1 1 33 ASN OD1 O -6.335 12.846 14.226 1.00 . A A . 33 ASN OD1 1 1 10 6744 1 1 34 CYS C C -4.669 6.708 10.777 1.00 . A A . 34 CYS C 1 1 10 6745 1 1 34 CYS CA C -5.669 7.557 9.923 1.00 . A A . 34 CYS CA 1 1 10 6746 1 1 34 CYS CB C -5.106 7.606 8.468 1.00 . A A . 34 CYS CB 1 1 10 6747 1 1 34 CYS H H -5.822 9.788 9.910 1.00 . A A . 34 CYS H 1 1 10 6748 1 1 34 CYS HA H -6.660 7.121 9.922 1.00 . A A . 34 CYS HA 1 1 10 6749 1 1 34 CYS HB2 H -4.302 8.323 8.442 1.00 . A A . 34 CYS HB2 1 1 10 6750 1 1 34 CYS HB3 H -4.676 6.630 8.175 1.00 . A A . 34 CYS HB3 1 1 10 6751 1 1 34 CYS N N -5.868 8.926 10.472 1.00 . A A . 34 CYS N 1 1 10 6752 1 1 34 CYS O O -3.979 7.224 11.662 1.00 . A A . 34 CYS O 1 1 10 6753 1 1 34 CYS SG S -6.322 7.918 7.184 1.00 . A A . 34 CYS SG 1 1 10 6754 1 1 35 GLU C C -2.912 3.608 9.935 1.00 . A A . 35 GLU C 1 1 10 6755 1 1 35 GLU CA C -3.543 4.498 11.065 1.00 . A A . 35 GLU CA 1 1 10 6756 1 1 35 GLU CB C -4.089 3.552 12.180 1.00 . A A . 35 GLU CB 1 1 10 6757 1 1 35 GLU CD C -5.709 2.995 14.085 1.00 . A A . 35 GLU CD 1 1 10 6758 1 1 35 GLU CG C -5.196 4.064 13.126 1.00 . A A . 35 GLU CG 1 1 10 6759 1 1 35 GLU H H -5.239 5.129 9.702 1.00 . A A . 35 GLU H 1 1 10 6760 1 1 35 GLU HA H -2.750 5.130 11.502 1.00 . A A . 35 GLU HA 1 1 10 6761 1 1 35 GLU HB2 H -4.329 2.567 11.746 1.00 . A A . 35 GLU HB2 1 1 10 6762 1 1 35 GLU HB3 H -3.224 3.306 12.825 1.00 . A A . 35 GLU HB3 1 1 10 6763 1 1 35 GLU HE2 H -5.216 2.155 15.770 1.00 . A A . 35 GLU HE2 1 1 10 6764 1 1 35 GLU HG2 H -4.827 4.939 13.692 1.00 . A A . 35 GLU HG2 1 1 10 6765 1 1 35 GLU HG3 H -6.052 4.433 12.534 1.00 . A A . 35 GLU HG3 1 1 10 6766 1 1 35 GLU N N -4.611 5.386 10.487 1.00 . A A . 35 GLU N 1 1 10 6767 1 1 35 GLU O O -3.386 3.553 8.796 1.00 . A A . 35 GLU O 1 1 10 6768 1 1 35 GLU OE1 O -6.746 2.361 13.890 1.00 . A A . 35 GLU OE1 1 1 10 6769 1 1 35 GLU OE2 O -4.888 2.830 15.172 1.00 . A A . 35 GLU OE2 1 1 10 6770 1 1 36 CYS C C -1.642 0.789 9.003 1.00 . A A . 36 CYS C 1 1 10 6771 1 1 36 CYS CA C -0.967 2.166 9.285 1.00 . A A . 36 CYS CA 1 1 10 6772 1 1 36 CYS CB C 0.515 1.896 9.771 1.00 . A A . 36 CYS CB 1 1 10 6773 1 1 36 CYS H H -1.663 2.927 11.293 1.00 . A A . 36 CYS H 1 1 10 6774 1 1 36 CYS HA H -0.919 2.774 8.345 1.00 . A A . 36 CYS HA 1 1 10 6775 1 1 36 CYS HB2 H 1.119 2.768 10.093 1.00 . A A . 36 CYS HB2 1 1 10 6776 1 1 36 CYS HB3 H 0.523 1.206 10.628 1.00 . A A . 36 CYS HB3 1 1 10 6777 1 1 36 CYS N N -1.811 2.900 10.277 1.00 . A A . 36 CYS N 1 1 10 6778 1 1 36 CYS O O -2.023 0.067 9.933 1.00 . A A . 36 CYS O 1 1 10 6779 1 1 36 CYS SG S 1.286 1.204 8.318 1.00 . A A . 36 CYS SG 1 1 10 6780 1 1 37 THR C C -0.921 -1.813 7.039 1.00 . A A . 37 THR C 1 1 10 6781 1 1 37 THR CA C -2.205 -0.953 7.325 1.00 . A A . 37 THR CA 1 1 10 6782 1 1 37 THR CB C -3.117 -0.951 6.061 1.00 . A A . 37 THR CB 1 1 10 6783 1 1 37 THR CG2 C -4.485 -0.318 6.352 1.00 . A A . 37 THR CG2 1 1 10 6784 1 1 37 THR H H -1.350 1.066 7.023 1.00 . A A . 37 THR H 1 1 10 6785 1 1 37 THR HA H -2.807 -1.403 8.136 1.00 . A A . 37 THR HA 1 1 10 6786 1 1 37 THR HB H -3.266 -2.005 5.759 1.00 . A A . 37 THR HB 1 1 10 6787 1 1 37 THR HG1 H -2.433 0.687 5.315 1.00 . A A . 37 THR HG1 1 1 10 6788 1 1 37 THR HG21 H -5.010 -0.832 7.175 1.00 . A A . 37 THR HG21 1 1 10 6789 1 1 37 THR HG22 H -4.394 0.741 6.645 1.00 . A A . 37 THR HG22 1 1 10 6790 1 1 37 THR HG23 H -5.142 -0.367 5.465 1.00 . A A . 37 THR HG23 1 1 10 6791 1 1 37 THR N N -1.749 0.414 7.712 1.00 . A A . 37 THR N 1 1 10 6792 1 1 37 THR O O -0.148 -1.446 6.145 1.00 . A A . 37 THR O 1 1 10 6793 1 1 37 THR OG1 O -2.533 -0.212 4.992 1.00 . A A . 37 THR OG1 1 1 10 6794 1 1 38 PRO C C 0.530 -4.832 6.377 1.00 . A A . 38 PRO C 1 1 10 6795 1 1 38 PRO CA C 0.571 -3.778 7.542 1.00 . A A . 38 PRO CA 1 1 10 6796 1 1 38 PRO CB C 0.694 -4.411 8.947 1.00 . A A . 38 PRO CB 1 1 10 6797 1 1 38 PRO CD C -1.470 -3.405 8.895 1.00 . A A . 38 PRO CD 1 1 10 6798 1 1 38 PRO CG C -0.738 -4.627 9.434 1.00 . A A . 38 PRO CG 1 1 10 6799 1 1 38 PRO HA H 1.458 -3.147 7.337 1.00 . A A . 38 PRO HA 1 1 10 6800 1 1 38 PRO HB2 H 1.280 -5.346 8.984 1.00 . A A . 38 PRO HB2 1 1 10 6801 1 1 38 PRO HB3 H 1.205 -3.701 9.620 1.00 . A A . 38 PRO HB3 1 1 10 6802 1 1 38 PRO HD2 H -2.499 -3.656 8.592 1.00 . A A . 38 PRO HD2 1 1 10 6803 1 1 38 PRO HD3 H -1.533 -2.607 9.657 1.00 . A A . 38 PRO HD3 1 1 10 6804 1 1 38 PRO HG2 H -1.160 -5.551 8.998 1.00 . A A . 38 PRO HG2 1 1 10 6805 1 1 38 PRO HG3 H -0.811 -4.719 10.533 1.00 . A A . 38 PRO HG3 1 1 10 6806 1 1 38 PRO N N -0.661 -2.957 7.743 1.00 . A A . 38 PRO N 1 1 10 6807 1 1 38 PRO O O 1.222 -5.851 6.465 1.00 . A A . 38 PRO O 1 1 10 6808 1 1 39 ARG C C -1.054 -7.004 4.755 1.00 . A A . 39 ARG C 1 1 10 6809 1 1 39 ARG CA C -0.577 -5.598 4.209 1.00 . A A . 39 ARG CA 1 1 10 6810 1 1 39 ARG CB C 0.698 -5.755 3.309 1.00 . A A . 39 ARG CB 1 1 10 6811 1 1 39 ARG CD C 0.232 -3.871 1.525 1.00 . A A . 39 ARG CD 1 1 10 6812 1 1 39 ARG CG C 1.203 -4.503 2.543 1.00 . A A . 39 ARG CG 1 1 10 6813 1 1 39 ARG CZ C -0.998 -4.491 -0.571 1.00 . A A . 39 ARG CZ 1 1 10 6814 1 1 39 ARG H H -0.763 -3.711 5.343 1.00 . A A . 39 ARG H 1 1 10 6815 1 1 39 ARG HA H -1.416 -5.209 3.604 1.00 . A A . 39 ARG HA 1 1 10 6816 1 1 39 ARG HB2 H 1.537 -6.161 3.905 1.00 . A A . 39 ARG HB2 1 1 10 6817 1 1 39 ARG HB3 H 0.508 -6.539 2.552 1.00 . A A . 39 ARG HB3 1 1 10 6818 1 1 39 ARG HD2 H -0.688 -3.535 2.042 1.00 . A A . 39 ARG HD2 1 1 10 6819 1 1 39 ARG HD3 H 0.697 -2.955 1.116 1.00 . A A . 39 ARG HD3 1 1 10 6820 1 1 39 ARG HG2 H 1.494 -3.727 3.275 1.00 . A A . 39 ARG HG2 1 1 10 6821 1 1 39 ARG HG3 H 2.147 -4.761 2.028 1.00 . A A . 39 ARG HG3 1 1 10 6822 1 1 39 ARG HH11 H -1.503 -2.660 0.097 1.00 . A A . 39 ARG HH11 1 1 10 6823 1 1 39 ARG HH12 H -2.330 -3.251 -1.431 1.00 . A A . 39 ARG HH12 1 1 10 6824 1 1 39 ARG HH21 H -0.671 -6.269 -1.430 1.00 . A A . 39 ARG HH21 1 1 10 6825 1 1 39 ARG HH22 H -1.888 -5.158 -2.235 1.00 . A A . 39 ARG HH22 1 1 10 6826 1 1 39 ARG N N -0.262 -4.605 5.299 1.00 . A A . 39 ARG N 1 1 10 6827 1 1 39 ARG NE N -0.109 -4.777 0.399 1.00 . A A . 39 ARG NE 1 1 10 6828 1 1 39 ARG NH1 N -1.681 -3.349 -0.642 1.00 . A A . 39 ARG NH1 1 1 10 6829 1 1 39 ARG NH2 N -1.206 -5.398 -1.507 1.00 . A A . 39 ARG NH2 1 1 10 6830 1 1 39 ARG O O -0.681 -8.053 4.217 1.00 . A A . 39 ARG O 1 1 10 6831 1 1 40 LEU C C -3.767 -8.009 7.098 1.00 . A A . 40 LEU C 1 1 10 6832 1 1 40 LEU CA C -2.348 -8.261 6.503 1.00 . A A . 40 LEU CA 1 1 10 6833 1 1 40 LEU CB C -1.333 -8.664 7.632 1.00 . A A . 40 LEU CB 1 1 10 6834 1 1 40 LEU CD1 C 0.980 -9.341 8.449 1.00 . A A . 40 LEU CD1 1 1 10 6835 1 1 40 LEU CD2 C -0.043 -10.601 6.513 1.00 . A A . 40 LEU CD2 1 1 10 6836 1 1 40 LEU CG C 0.054 -9.234 7.221 1.00 . A A . 40 LEU CG 1 1 10 6837 1 1 40 LEU H H -2.154 -6.091 6.160 1.00 . A A . 40 LEU H 1 1 10 6838 1 1 40 LEU HA H -2.429 -9.090 5.782 1.00 . A A . 40 LEU HA 1 1 10 6839 1 1 40 LEU HB2 H -1.174 -7.788 8.291 1.00 . A A . 40 LEU HB2 1 1 10 6840 1 1 40 LEU HB3 H -1.817 -9.411 8.292 1.00 . A A . 40 LEU HB3 1 1 10 6841 1 1 40 LEU HD11 H 1.123 -8.358 8.937 1.00 . A A . 40 LEU HD11 1 1 10 6842 1 1 40 LEU HD12 H 0.580 -10.032 9.215 1.00 . A A . 40 LEU HD12 1 1 10 6843 1 1 40 LEU HD13 H 1.987 -9.704 8.172 1.00 . A A . 40 LEU HD13 1 1 10 6844 1 1 40 LEU HD21 H -0.520 -11.368 7.152 1.00 . A A . 40 LEU HD21 1 1 10 6845 1 1 40 LEU HD22 H -0.631 -10.540 5.579 1.00 . A A . 40 LEU HD22 1 1 10 6846 1 1 40 LEU HD23 H 0.955 -10.985 6.228 1.00 . A A . 40 LEU HD23 1 1 10 6847 1 1 40 LEU HG H 0.538 -8.525 6.527 1.00 . A A . 40 LEU HG 1 1 10 6848 1 1 40 LEU N N -1.902 -7.020 5.807 1.00 . A A . 40 LEU N 1 1 10 6849 1 1 40 LEU O O -4.725 -8.656 6.664 1.00 . A A . 40 LEU O 1 1 10 6850 1 1 41 ILE C C -5.315 -5.327 8.962 1.00 . A A . 41 ILE C 1 1 10 6851 1 1 41 ILE CA C -5.145 -6.875 8.866 1.00 . A A . 41 ILE CA 1 1 10 6852 1 1 41 ILE CB C -5.103 -7.546 10.304 1.00 . A A . 41 ILE CB 1 1 10 6853 1 1 41 ILE CD1 C -3.735 -7.811 12.536 1.00 . A A . 41 ILE CD1 1 1 10 6854 1 1 41 ILE CG1 C -3.733 -7.395 11.056 1.00 . A A . 41 ILE CG1 1 1 10 6855 1 1 41 ILE CG2 C -5.420 -9.056 10.130 1.00 . A A . 41 ILE CG2 1 1 10 6856 1 1 41 ILE H H -2.995 -6.676 8.347 1.00 . A A . 41 ILE H 1 1 10 6857 1 1 41 ILE HA H -6.012 -7.296 8.315 1.00 . A A . 41 ILE HA 1 1 10 6858 1 1 41 ILE HB H -5.881 -7.091 10.947 1.00 . A A . 41 ILE HB 1 1 10 6859 1 1 41 ILE HD11 H -4.514 -7.279 13.113 1.00 . A A . 41 ILE HD11 1 1 10 6860 1 1 41 ILE HD12 H -3.909 -8.895 12.662 1.00 . A A . 41 ILE HD12 1 1 10 6861 1 1 41 ILE HD13 H -2.764 -7.582 13.012 1.00 . A A . 41 ILE HD13 1 1 10 6862 1 1 41 ILE HG12 H -2.937 -7.960 10.534 1.00 . A A . 41 ILE HG12 1 1 10 6863 1 1 41 ILE HG13 H -3.398 -6.344 11.016 1.00 . A A . 41 ILE HG13 1 1 10 6864 1 1 41 ILE HG21 H -6.384 -9.214 9.610 1.00 . A A . 41 ILE HG21 1 1 10 6865 1 1 41 ILE HG22 H -4.644 -9.588 9.548 1.00 . A A . 41 ILE HG22 1 1 10 6866 1 1 41 ILE HG23 H -5.510 -9.574 11.102 1.00 . A A . 41 ILE HG23 1 1 10 6867 1 1 41 ILE N N -3.890 -7.105 8.092 1.00 . A A . 41 ILE N 1 1 10 6868 1 1 41 ILE O O -4.559 -4.630 9.645 1.00 . A A . 41 ILE O 1 1 10 6869 1 1 42 MET C C -7.543 -2.773 9.062 1.00 . A A . 42 MET C 1 1 10 6870 1 1 42 MET CA C -6.505 -3.335 8.040 1.00 . A A . 42 MET CA 1 1 10 6871 1 1 42 MET CB C -6.973 -3.082 6.575 1.00 . A A . 42 MET CB 1 1 10 6872 1 1 42 MET CE C -9.893 -4.386 3.900 1.00 . A A . 42 MET CE 1 1 10 6873 1 1 42 MET CG C -8.237 -3.793 6.046 1.00 . A A . 42 MET CG 1 1 10 6874 1 1 42 MET H H -6.868 -5.487 7.707 1.00 . A A . 42 MET H 1 1 10 6875 1 1 42 MET HA H -5.541 -2.806 8.187 1.00 . A A . 42 MET HA 1 1 10 6876 1 1 42 MET HB2 H -7.112 -1.994 6.431 1.00 . A A . 42 MET HB2 1 1 10 6877 1 1 42 MET HB3 H -6.136 -3.336 5.897 1.00 . A A . 42 MET HB3 1 1 10 6878 1 1 42 MET HE1 H -10.758 -4.168 4.553 1.00 . A A . 42 MET HE1 1 1 10 6879 1 1 42 MET HE2 H -10.203 -4.217 2.853 1.00 . A A . 42 MET HE2 1 1 10 6880 1 1 42 MET HE3 H -9.635 -5.455 4.012 1.00 . A A . 42 MET HE3 1 1 10 6881 1 1 42 MET HG2 H -8.133 -4.891 6.119 1.00 . A A . 42 MET HG2 1 1 10 6882 1 1 42 MET HG3 H -9.128 -3.514 6.635 1.00 . A A . 42 MET HG3 1 1 10 6883 1 1 42 MET N N -6.314 -4.800 8.232 1.00 . A A . 42 MET N 1 1 10 6884 1 1 42 MET O O -8.593 -3.377 9.306 1.00 . A A . 42 MET O 1 1 10 6885 1 1 42 MET SD S -8.489 -3.336 4.319 1.00 . A A . 42 MET SD 1 1 10 6886 1 1 43 GLU C C -8.002 -1.669 12.040 1.00 . A A . 43 GLU C 1 1 10 6887 1 1 43 GLU CA C -7.981 -0.857 10.701 1.00 . A A . 43 GLU CA 1 1 10 6888 1 1 43 GLU CB C -9.436 -0.569 10.226 1.00 . A A . 43 GLU CB 1 1 10 6889 1 1 43 GLU CD C -11.624 0.734 10.532 1.00 . A A . 43 GLU CD 1 1 10 6890 1 1 43 GLU CG C -10.230 0.437 11.089 1.00 . A A . 43 GLU CG 1 1 10 6891 1 1 43 GLU H H -6.306 -1.229 9.320 1.00 . A A . 43 GLU H 1 1 10 6892 1 1 43 GLU HA H -7.450 0.102 10.873 1.00 . A A . 43 GLU HA 1 1 10 6893 1 1 43 GLU HB2 H -9.362 -0.131 9.218 1.00 . A A . 43 GLU HB2 1 1 10 6894 1 1 43 GLU HB3 H -10.020 -1.502 10.116 1.00 . A A . 43 GLU HB3 1 1 10 6895 1 1 43 GLU HE2 H -12.460 1.733 9.085 1.00 . A A . 43 GLU HE2 1 1 10 6896 1 1 43 GLU HG2 H -10.335 0.055 12.121 1.00 . A A . 43 GLU HG2 1 1 10 6897 1 1 43 GLU HG3 H -9.666 1.383 11.181 1.00 . A A . 43 GLU HG3 1 1 10 6898 1 1 43 GLU N N -7.207 -1.596 9.646 1.00 . A A . 43 GLU N 1 1 10 6899 1 1 43 GLU O O -8.227 -2.884 12.089 1.00 . A A . 43 GLU O 1 1 10 6900 1 1 43 GLU OE1 O -12.659 0.289 11.026 1.00 . A A . 43 GLU OE1 1 1 10 6901 1 1 43 GLU OE2 O -11.583 1.551 9.430 1.00 . A A . 43 GLU OE2 1 1 10 6902 1 1 44 GLY C C -7.018 -0.477 15.439 1.00 . A A . 44 GLY C 1 1 10 6903 1 1 44 GLY CA C -7.618 -1.518 14.481 1.00 . A A . 44 GLY CA 1 1 10 6904 1 1 44 GLY H H -7.680 0.071 12.931 1.00 . A A . 44 GLY H 1 1 10 6905 1 1 44 GLY HA2 H -8.602 -1.891 14.828 1.00 . A A . 44 GLY HA2 1 1 10 6906 1 1 44 GLY HA3 H -6.951 -2.401 14.455 1.00 . A A . 44 GLY HA3 1 1 10 6907 1 1 44 GLY N N -7.751 -0.934 13.130 1.00 . A A . 44 GLY N 1 1 10 6908 1 1 44 GLY O O -5.846 -0.120 15.298 1.00 . A A . 44 GLY O 1 1 10 6909 1 1 45 LEU C C -7.457 0.748 18.777 1.00 . A A . 45 LEU C 1 1 10 6910 1 1 45 LEU CA C -7.475 1.160 17.269 1.00 . A A . 45 LEU CA 1 1 10 6911 1 1 45 LEU CB C -8.509 2.304 16.987 1.00 . A A . 45 LEU CB 1 1 10 6912 1 1 45 LEU CD1 C -10.672 3.595 17.383 1.00 . A A . 45 LEU CD1 1 1 10 6913 1 1 45 LEU CD2 C -10.833 1.132 16.858 1.00 . A A . 45 LEU CD2 1 1 10 6914 1 1 45 LEU CG C -9.975 2.226 17.524 1.00 . A A . 45 LEU CG 1 1 10 6915 1 1 45 LEU H H -8.781 -0.385 16.381 1.00 . A A . 45 LEU H 1 1 10 6916 1 1 45 LEU HA H -6.462 1.539 17.024 1.00 . A A . 45 LEU HA 1 1 10 6917 1 1 45 LEU HB2 H -8.054 3.223 17.405 1.00 . A A . 45 LEU HB2 1 1 10 6918 1 1 45 LEU HB3 H -8.535 2.513 15.900 1.00 . A A . 45 LEU HB3 1 1 10 6919 1 1 45 LEU HD11 H -10.123 4.390 17.921 1.00 . A A . 45 LEU HD11 1 1 10 6920 1 1 45 LEU HD12 H -10.756 3.914 16.328 1.00 . A A . 45 LEU HD12 1 1 10 6921 1 1 45 LEU HD13 H -11.695 3.580 17.803 1.00 . A A . 45 LEU HD13 1 1 10 6922 1 1 45 LEU HD21 H -10.835 1.219 15.755 1.00 . A A . 45 LEU HD21 1 1 10 6923 1 1 45 LEU HD22 H -10.468 0.119 17.107 1.00 . A A . 45 LEU HD22 1 1 10 6924 1 1 45 LEU HD23 H -11.887 1.170 17.194 1.00 . A A . 45 LEU HD23 1 1 10 6925 1 1 45 LEU HG H -9.939 2.005 18.606 1.00 . A A . 45 LEU HG 1 1 10 6926 1 1 45 LEU N N -7.834 0.011 16.388 1.00 . A A . 45 LEU N 1 1 10 6927 1 1 45 LEU O O -7.926 -0.327 19.167 1.00 . A A . 45 LEU O 1 1 10 6928 1 1 46 SER C C -5.958 0.489 21.606 1.00 . A A . 46 SER C 1 1 10 6929 1 1 46 SER CA C -6.919 1.616 21.120 1.00 . A A . 46 SER CA 1 1 10 6930 1 1 46 SER CB C -8.342 1.368 21.699 1.00 . A A . 46 SER CB 1 1 10 6931 1 1 46 SER H H -6.565 2.498 19.134 1.00 . A A . 46 SER H 1 1 10 6932 1 1 46 SER HA H -6.556 2.593 21.496 1.00 . A A . 46 SER HA 1 1 10 6933 1 1 46 SER HB2 H -8.764 0.392 21.397 1.00 . A A . 46 SER HB2 1 1 10 6934 1 1 46 SER HB3 H -8.300 1.340 22.804 1.00 . A A . 46 SER HB3 1 1 10 6935 1 1 46 SER HG H -10.080 2.193 21.719 1.00 . A A . 46 SER HG 1 1 10 6936 1 1 46 SER N N -6.919 1.666 19.619 1.00 . A A . 46 SER N 1 1 10 6937 1 1 46 SER O O -6.239 -0.706 21.457 1.00 . A A . 46 SER O 1 1 10 6938 1 1 46 SER OG O -9.236 2.406 21.313 1.00 . A A . 46 SER OG 1 1 10 6939 1 1 47 PHE C C -3.117 0.473 23.903 1.00 . A A . 47 PHE C 1 1 10 6940 1 1 47 PHE CA C -3.714 -0.036 22.564 1.00 . A A . 47 PHE CA 1 1 10 6941 1 1 47 PHE CB C -2.601 -0.097 21.470 1.00 . A A . 47 PHE CB 1 1 10 6942 1 1 47 PHE CD1 C -3.309 -2.009 19.929 1.00 . A A . 47 PHE CD1 1 1 10 6943 1 1 47 PHE CD2 C -3.281 0.237 19.036 1.00 . A A . 47 PHE CD2 1 1 10 6944 1 1 47 PHE CE1 C -3.816 -2.480 18.720 1.00 . A A . 47 PHE CE1 1 1 10 6945 1 1 47 PHE CE2 C -3.784 -0.238 17.829 1.00 . A A . 47 PHE CE2 1 1 10 6946 1 1 47 PHE CG C -3.048 -0.644 20.100 1.00 . A A . 47 PHE CG 1 1 10 6947 1 1 47 PHE CZ C -4.060 -1.594 17.676 1.00 . A A . 47 PHE CZ 1 1 10 6948 1 1 47 PHE H H -4.693 1.919 22.229 1.00 . A A . 47 PHE H 1 1 10 6949 1 1 47 PHE HA H -4.115 -1.063 22.698 1.00 . A A . 47 PHE HA 1 1 10 6950 1 1 47 PHE HB2 H -2.138 0.903 21.346 1.00 . A A . 47 PHE HB2 1 1 10 6951 1 1 47 PHE HB3 H -1.770 -0.729 21.838 1.00 . A A . 47 PHE HB3 1 1 10 6952 1 1 47 PHE HD1 H -3.147 -2.704 20.741 1.00 . A A . 47 PHE HD1 1 1 10 6953 1 1 47 PHE HD2 H -3.101 1.297 19.150 1.00 . A A . 47 PHE HD2 1 1 10 6954 1 1 47 PHE HE1 H -4.031 -3.532 18.597 1.00 . A A . 47 PHE HE1 1 1 10 6955 1 1 47 PHE HE2 H -3.972 0.452 17.021 1.00 . A A . 47 PHE HE2 1 1 10 6956 1 1 47 PHE HZ H -4.471 -1.960 16.747 1.00 . A A . 47 PHE HZ 1 1 10 6957 1 1 47 PHE N N -4.804 0.900 22.168 1.00 . A A . 47 PHE N 1 1 10 6958 1 1 47 PHE O O -2.528 1.560 23.965 1.00 . A A . 47 PHE O 1 1 10 6959 1 1 48 ALA C C -1.343 -0.590 26.500 1.00 . A A . 48 ALA C 1 1 10 6960 1 1 48 ALA CA C -2.757 0.003 26.320 1.00 . A A . 48 ALA CA 1 1 10 6961 1 1 48 ALA CB C -3.727 -0.565 27.374 1.00 . A A . 48 ALA CB 1 1 10 6962 1 1 48 ALA H H -3.777 -1.207 24.784 1.00 . A A . 48 ALA H 1 1 10 6963 1 1 48 ALA HXT H 0.504 0.016 26.613 1.00 . A A . 48 ALA HXT 1 1 10 6964 1 1 48 ALA HA H -2.711 1.101 26.465 1.00 . A A . 48 ALA HA 1 1 10 6965 1 1 48 ALA HB1 H -3.838 -1.664 27.303 1.00 . A A . 48 ALA HB1 1 1 10 6966 1 1 48 ALA HB2 H -3.383 -0.340 28.401 1.00 . A A . 48 ALA HB2 1 1 10 6967 1 1 48 ALA HB3 H -4.737 -0.126 27.277 1.00 . A A . 48 ALA HB3 1 1 10 6968 1 1 48 ALA N N -3.270 -0.334 24.970 1.00 . A A . 48 ALA N 1 1 10 6969 1 1 48 ALA O O -1.105 -1.794 26.611 1.00 . A A . 48 ALA O 1 1 10 6970 1 1 48 ALA OXT O -0.376 0.384 26.508 1.00 . A A . 48 ALA OXT 1 1 11 6971 1 1 1 GLU C C 13.459 6.304 10.960 1.00 . A A . 1 GLU C 1 1 11 6972 1 1 1 GLU CA C 12.618 5.014 11.178 1.00 . A A . 1 GLU CA 1 1 11 6973 1 1 1 GLU CB C 11.496 5.229 12.232 1.00 . A A . 1 GLU CB 1 1 11 6974 1 1 1 GLU CD C 9.286 6.381 12.833 1.00 . A A . 1 GLU CD 1 1 11 6975 1 1 1 GLU CG C 10.329 6.114 11.745 1.00 . A A . 1 GLU CG 1 1 11 6976 1 1 1 GLU H1 H 14.274 3.760 10.970 1.00 . A A . 1 GLU H1 1 1 11 6977 1 1 1 GLU H2 H 13.028 3.066 11.803 1.00 . A A . 1 GLU H2 1 1 11 6978 1 1 1 GLU HA H 12.169 4.688 10.219 1.00 . A A . 1 GLU HA 1 1 11 6979 1 1 1 GLU HB2 H 11.073 4.249 12.527 1.00 . A A . 1 GLU HB2 1 1 11 6980 1 1 1 GLU HB3 H 11.923 5.648 13.165 1.00 . A A . 1 GLU HB3 1 1 11 6981 1 1 1 GLU HE2 H 7.760 5.510 13.671 1.00 . A A . 1 GLU HE2 1 1 11 6982 1 1 1 GLU HG2 H 10.711 7.085 11.377 1.00 . A A . 1 GLU HG2 1 1 11 6983 1 1 1 GLU HG3 H 9.836 5.644 10.873 1.00 . A A . 1 GLU HG3 1 1 11 6984 1 1 1 GLU N N 13.528 3.948 11.649 1.00 . A A . 1 GLU N 1 1 11 6985 1 1 1 GLU O O 13.971 6.896 11.918 1.00 . A A . 1 GLU O 1 1 11 6986 1 1 1 GLU OE1 O 9.244 7.423 13.487 1.00 . A A . 1 GLU OE1 1 1 11 6987 1 1 1 GLU OE2 O 8.412 5.337 12.987 1.00 . A A . 1 GLU OE2 1 1 11 6988 1 1 2 ASP C C 13.278 9.193 9.376 1.00 . A A . 2 ASP C 1 1 11 6989 1 1 2 ASP CA C 14.287 8.000 9.329 1.00 . A A . 2 ASP CA 1 1 11 6990 1 1 2 ASP CB C 14.952 7.767 7.938 1.00 . A A . 2 ASP CB 1 1 11 6991 1 1 2 ASP CG C 15.846 8.920 7.459 1.00 . A A . 2 ASP CG 1 1 11 6992 1 1 2 ASP H H 13.097 6.167 8.989 1.00 . A A . 2 ASP H 1 1 11 6993 1 1 2 ASP HA H 15.084 8.222 10.059 1.00 . A A . 2 ASP HA 1 1 11 6994 1 1 2 ASP HB2 H 15.573 6.850 7.965 1.00 . A A . 2 ASP HB2 1 1 11 6995 1 1 2 ASP HB3 H 14.188 7.563 7.162 1.00 . A A . 2 ASP HB3 1 1 11 6996 1 1 2 ASP HD2 H 17.206 8.113 8.594 1.00 . A A . 2 ASP HD2 1 1 11 6997 1 1 2 ASP N N 13.573 6.743 9.691 1.00 . A A . 2 ASP N 1 1 11 6998 1 1 2 ASP O O 13.346 9.998 10.310 1.00 . A A . 2 ASP O 1 1 11 6999 1 1 2 ASP OD1 O 15.466 9.791 6.677 1.00 . A A . 2 ASP OD1 1 1 11 7000 1 1 2 ASP OD2 O 17.103 8.865 8.006 1.00 . A A . 2 ASP OD2 1 1 11 7001 1 1 3 ASN C C 10.089 9.604 7.584 1.00 . A A . 3 ASN C 1 1 11 7002 1 1 3 ASN CA C 11.210 10.245 8.436 1.00 . A A . 3 ASN CA 1 1 11 7003 1 1 3 ASN CB C 11.640 11.625 7.930 1.00 . A A . 3 ASN CB 1 1 11 7004 1 1 3 ASN CG C 10.571 12.737 7.925 1.00 . A A . 3 ASN CG 1 1 11 7005 1 1 3 ASN H H 12.333 8.468 7.798 1.00 . A A . 3 ASN H 1 1 11 7006 1 1 3 ASN HA H 10.855 10.377 9.483 1.00 . A A . 3 ASN HA 1 1 11 7007 1 1 3 ASN HB2 H 12.348 11.868 8.723 1.00 . A A . 3 ASN HB2 1 1 11 7008 1 1 3 ASN HB3 H 12.207 11.575 6.978 1.00 . A A . 3 ASN HB3 1 1 11 7009 1 1 3 ASN HD21 H 10.640 12.829 5.923 1.00 . A A . 3 ASN HD21 1 1 11 7010 1 1 3 ASN HD22 H 9.480 13.966 6.776 1.00 . A A . 3 ASN HD22 1 1 11 7011 1 1 3 ASN N N 12.363 9.298 8.395 1.00 . A A . 3 ASN N 1 1 11 7012 1 1 3 ASN ND2 N 10.192 13.228 6.755 1.00 . A A . 3 ASN ND2 1 1 11 7013 1 1 3 ASN O O 9.825 9.872 6.408 1.00 . A A . 3 ASN O 1 1 11 7014 1 1 3 ASN OD1 O 10.081 13.162 8.972 1.00 . A A . 3 ASN OD1 1 1 11 7015 1 1 4 CYS C C 7.618 7.183 9.016 1.00 . A A . 4 CYS C 1 1 11 7016 1 1 4 CYS CA C 8.511 7.700 7.834 1.00 . A A . 4 CYS CA 1 1 11 7017 1 1 4 CYS CB C 9.249 6.556 7.143 1.00 . A A . 4 CYS CB 1 1 11 7018 1 1 4 CYS H H 10.119 8.674 9.153 1.00 . A A . 4 CYS H 1 1 11 7019 1 1 4 CYS HA H 7.845 8.124 7.065 1.00 . A A . 4 CYS HA 1 1 11 7020 1 1 4 CYS HB2 H 8.411 5.910 6.968 1.00 . A A . 4 CYS HB2 1 1 11 7021 1 1 4 CYS HB3 H 9.589 6.791 6.123 1.00 . A A . 4 CYS HB3 1 1 11 7022 1 1 4 CYS N N 9.493 8.693 8.331 1.00 . A A . 4 CYS N 1 1 11 7023 1 1 4 CYS O O 7.803 7.560 10.181 1.00 . A A . 4 CYS O 1 1 11 7024 1 1 4 CYS SG S 10.405 5.532 8.070 1.00 . A A . 4 CYS SG 1 1 11 7025 1 1 5 ILE C C 6.211 4.162 9.709 1.00 . A A . 5 ILE C 1 1 11 7026 1 1 5 ILE CA C 5.790 5.645 9.767 1.00 . A A . 5 ILE CA 1 1 11 7027 1 1 5 ILE CB C 4.230 5.816 9.560 1.00 . A A . 5 ILE CB 1 1 11 7028 1 1 5 ILE CD1 C 2.436 7.582 9.060 1.00 . A A . 5 ILE CD1 1 1 11 7029 1 1 5 ILE CG1 C 3.874 7.302 9.423 1.00 . A A . 5 ILE CG1 1 1 11 7030 1 1 5 ILE CG2 C 3.440 5.165 10.743 1.00 . A A . 5 ILE CG2 1 1 11 7031 1 1 5 ILE H H 6.628 6.037 7.680 1.00 . A A . 5 ILE H 1 1 11 7032 1 1 5 ILE HA H 6.027 6.065 10.759 1.00 . A A . 5 ILE HA 1 1 11 7033 1 1 5 ILE HB H 3.864 5.337 8.661 1.00 . A A . 5 ILE HB 1 1 11 7034 1 1 5 ILE HD11 H 1.775 7.168 9.830 1.00 . A A . 5 ILE HD11 1 1 11 7035 1 1 5 ILE HD12 H 2.227 8.663 9.008 1.00 . A A . 5 ILE HD12 1 1 11 7036 1 1 5 ILE HD13 H 2.165 7.125 8.092 1.00 . A A . 5 ILE HD13 1 1 11 7037 1 1 5 ILE HG12 H 4.116 7.827 10.338 1.00 . A A . 5 ILE HG12 1 1 11 7038 1 1 5 ILE HG13 H 4.488 7.740 8.622 1.00 . A A . 5 ILE HG13 1 1 11 7039 1 1 5 ILE HG21 H 3.662 4.087 10.843 1.00 . A A . 5 ILE HG21 1 1 11 7040 1 1 5 ILE HG22 H 3.615 5.637 11.725 1.00 . A A . 5 ILE HG22 1 1 11 7041 1 1 5 ILE HG23 H 2.343 5.181 10.572 1.00 . A A . 5 ILE HG23 1 1 11 7042 1 1 5 ILE N N 6.623 6.311 8.694 1.00 . A A . 5 ILE N 1 1 11 7043 1 1 5 ILE O O 5.707 3.382 8.906 1.00 . A A . 5 ILE O 1 1 11 7044 1 1 6 ALA C C 6.640 1.229 11.096 1.00 . A A . 6 ALA C 1 1 11 7045 1 1 6 ALA CA C 7.632 2.304 10.486 1.00 . A A . 6 ALA CA 1 1 11 7046 1 1 6 ALA CB C 8.975 2.284 11.239 1.00 . A A . 6 ALA CB 1 1 11 7047 1 1 6 ALA H H 7.363 4.388 11.299 1.00 . A A . 6 ALA H 1 1 11 7048 1 1 6 ALA HA H 7.769 2.063 9.401 1.00 . A A . 6 ALA HA 1 1 11 7049 1 1 6 ALA HB1 H 9.700 2.998 10.804 1.00 . A A . 6 ALA HB1 1 1 11 7050 1 1 6 ALA HB2 H 8.860 2.536 12.311 1.00 . A A . 6 ALA HB2 1 1 11 7051 1 1 6 ALA HB3 H 9.450 1.288 11.188 1.00 . A A . 6 ALA HB3 1 1 11 7052 1 1 6 ALA N N 7.136 3.717 10.565 1.00 . A A . 6 ALA N 1 1 11 7053 1 1 6 ALA O O 7.028 0.094 11.391 1.00 . A A . 6 ALA O 1 1 11 7054 1 1 7 GLU C C 3.232 0.301 11.038 1.00 . A A . 7 GLU C 1 1 11 7055 1 1 7 GLU CA C 4.313 0.861 11.979 1.00 . A A . 7 GLU CA 1 1 11 7056 1 1 7 GLU CB C 3.715 1.820 13.043 1.00 . A A . 7 GLU CB 1 1 11 7057 1 1 7 GLU CD C 5.175 1.236 15.098 1.00 . A A . 7 GLU CD 1 1 11 7058 1 1 7 GLU CG C 4.641 2.333 14.172 1.00 . A A . 7 GLU CG 1 1 11 7059 1 1 7 GLU H H 5.340 2.635 11.092 1.00 . A A . 7 GLU H 1 1 11 7060 1 1 7 GLU HA H 4.697 0.004 12.491 1.00 . A A . 7 GLU HA 1 1 11 7061 1 1 7 GLU HB2 H 3.280 2.694 12.534 1.00 . A A . 7 GLU HB2 1 1 11 7062 1 1 7 GLU HB3 H 2.858 1.318 13.531 1.00 . A A . 7 GLU HB3 1 1 11 7063 1 1 7 GLU HE2 H 6.741 0.094 15.289 1.00 . A A . 7 GLU HE2 1 1 11 7064 1 1 7 GLU HG2 H 5.482 2.912 13.746 1.00 . A A . 7 GLU HG2 1 1 11 7065 1 1 7 GLU HG3 H 4.081 3.063 14.786 1.00 . A A . 7 GLU HG3 1 1 11 7066 1 1 7 GLU N N 5.364 1.616 11.257 1.00 . A A . 7 GLU N 1 1 11 7067 1 1 7 GLU O O 2.932 0.845 9.978 1.00 . A A . 7 GLU O 1 1 11 7068 1 1 7 GLU OE1 O 4.558 0.815 16.076 1.00 . A A . 7 GLU OE1 1 1 11 7069 1 1 7 GLU OE2 O 6.409 0.782 14.707 1.00 . A A . 7 GLU OE2 1 1 11 7070 1 1 8 ASP C C 0.036 -1.143 11.452 1.00 . A A . 8 ASP C 1 1 11 7071 1 1 8 ASP CA C 1.429 -1.452 10.885 1.00 . A A . 8 ASP CA 1 1 11 7072 1 1 8 ASP CB C 1.660 -2.974 10.973 1.00 . A A . 8 ASP CB 1 1 11 7073 1 1 8 ASP CG C 1.656 -3.647 12.370 1.00 . A A . 8 ASP CG 1 1 11 7074 1 1 8 ASP H H 3.033 -1.159 12.389 1.00 . A A . 8 ASP H 1 1 11 7075 1 1 8 ASP HA H 1.342 -1.031 9.900 1.00 . A A . 8 ASP HA 1 1 11 7076 1 1 8 ASP HB2 H 0.904 -3.418 10.329 1.00 . A A . 8 ASP HB2 1 1 11 7077 1 1 8 ASP HB3 H 2.637 -3.180 10.570 1.00 . A A . 8 ASP HB3 1 1 11 7078 1 1 8 ASP HD2 H 0.888 -5.163 11.423 1.00 . A A . 8 ASP HD2 1 1 11 7079 1 1 8 ASP N N 2.658 -0.828 11.494 1.00 . A A . 8 ASP N 1 1 11 7080 1 1 8 ASP O O -0.999 -1.528 10.917 1.00 . A A . 8 ASP O 1 1 11 7081 1 1 8 ASP OD1 O 2.062 -3.115 13.403 1.00 . A A . 8 ASP OD1 1 1 11 7082 1 1 8 ASP OD2 O 1.150 -4.920 12.314 1.00 . A A . 8 ASP OD2 1 1 11 7083 1 1 9 TYR C C -0.419 1.601 13.840 1.00 . A A . 9 TYR C 1 1 11 7084 1 1 9 TYR CA C -0.976 0.274 13.209 1.00 . A A . 9 TYR CA 1 1 11 7085 1 1 9 TYR CB C -1.607 -0.713 14.250 1.00 . A A . 9 TYR CB 1 1 11 7086 1 1 9 TYR CD1 C -3.372 -1.864 12.792 1.00 . A A . 9 TYR CD1 1 1 11 7087 1 1 9 TYR CD2 C -1.614 -3.224 13.738 1.00 . A A . 9 TYR CD2 1 1 11 7088 1 1 9 TYR CE1 C -3.854 -2.971 12.100 1.00 . A A . 9 TYR CE1 1 1 11 7089 1 1 9 TYR CE2 C -2.103 -4.331 13.049 1.00 . A A . 9 TYR CE2 1 1 11 7090 1 1 9 TYR CG C -2.260 -1.983 13.639 1.00 . A A . 9 TYR CG 1 1 11 7091 1 1 9 TYR CZ C -3.224 -4.205 12.234 1.00 . A A . 9 TYR CZ 1 1 11 7092 1 1 9 TYR H H 1.144 -0.289 12.359 1.00 . A A . 9 TYR H 1 1 11 7093 1 1 9 TYR HA H -1.758 0.584 12.487 1.00 . A A . 9 TYR HA 1 1 11 7094 1 1 9 TYR HB2 H -0.852 -0.991 15.012 1.00 . A A . 9 TYR HB2 1 1 11 7095 1 1 9 TYR HB3 H -2.385 -0.176 14.825 1.00 . A A . 9 TYR HB3 1 1 11 7096 1 1 9 TYR HD1 H -3.766 -0.891 12.543 1.00 . A A . 9 TYR HD1 1 1 11 7097 1 1 9 TYR HD2 H -0.655 -3.317 14.233 1.00 . A A . 9 TYR HD2 1 1 11 7098 1 1 9 TYR HE1 H -4.681 -2.853 11.414 1.00 . A A . 9 TYR HE1 1 1 11 7099 1 1 9 TYR HE2 H -1.577 -5.274 13.106 1.00 . A A . 9 TYR HE2 1 1 11 7100 1 1 9 TYR HH H -3.109 -6.040 11.709 1.00 . A A . 9 TYR HH 1 1 11 7101 1 1 9 TYR N N 0.132 -0.428 12.515 1.00 . A A . 9 TYR N 1 1 11 7102 1 1 9 TYR O O -0.763 1.968 14.968 1.00 . A A . 9 TYR O 1 1 11 7103 1 1 9 TYR OH O -3.666 -5.284 11.513 1.00 . A A . 9 TYR OH 1 1 11 7104 1 1 10 GLY C C -0.284 4.785 13.175 1.00 . A A . 10 GLY C 1 1 11 7105 1 1 10 GLY CA C 0.813 3.743 13.391 1.00 . A A . 10 GLY CA 1 1 11 7106 1 1 10 GLY H H 0.660 1.868 12.177 1.00 . A A . 10 GLY H 1 1 11 7107 1 1 10 GLY HA2 H 1.287 3.805 14.382 1.00 . A A . 10 GLY HA2 1 1 11 7108 1 1 10 GLY HA3 H 1.622 4.073 12.722 1.00 . A A . 10 GLY HA3 1 1 11 7109 1 1 10 GLY N N 0.384 2.359 13.051 1.00 . A A . 10 GLY N 1 1 11 7110 1 1 10 GLY O O -1.352 4.479 12.655 1.00 . A A . 10 GLY O 1 1 11 7111 1 1 11 LYS C C -0.310 7.795 11.900 1.00 . A A . 11 LYS C 1 1 11 7112 1 1 11 LYS CA C -0.898 7.171 13.199 1.00 . A A . 11 LYS CA 1 1 11 7113 1 1 11 LYS CB C -0.977 8.278 14.276 1.00 . A A . 11 LYS CB 1 1 11 7114 1 1 11 LYS CD C -2.647 7.438 16.137 1.00 . A A . 11 LYS CD 1 1 11 7115 1 1 11 LYS CE C -2.990 5.973 15.801 1.00 . A A . 11 LYS CE 1 1 11 7116 1 1 11 LYS CG C -1.220 7.894 15.757 1.00 . A A . 11 LYS CG 1 1 11 7117 1 1 11 LYS H H 0.983 6.111 13.819 1.00 . A A . 11 LYS H 1 1 11 7118 1 1 11 LYS HA H -1.940 6.806 13.034 1.00 . A A . 11 LYS HA 1 1 11 7119 1 1 11 LYS HB2 H -0.064 8.880 14.191 1.00 . A A . 11 LYS HB2 1 1 11 7120 1 1 11 LYS HB3 H -1.768 8.993 13.978 1.00 . A A . 11 LYS HB3 1 1 11 7121 1 1 11 LYS HD2 H -2.756 7.581 17.229 1.00 . A A . 11 LYS HD2 1 1 11 7122 1 1 11 LYS HD3 H -3.390 8.121 15.683 1.00 . A A . 11 LYS HD3 1 1 11 7123 1 1 11 LYS HE2 H -2.986 5.804 14.710 1.00 . A A . 11 LYS HE2 1 1 11 7124 1 1 11 LYS HE3 H -2.229 5.290 16.222 1.00 . A A . 11 LYS HE3 1 1 11 7125 1 1 11 LYS HG2 H -0.473 7.153 16.097 1.00 . A A . 11 LYS HG2 1 1 11 7126 1 1 11 LYS HG3 H -0.998 8.795 16.358 1.00 . A A . 11 LYS HG3 1 1 11 7127 1 1 11 LYS HZ1 H -4.538 4.633 16.067 1.00 . A A . 11 LYS HZ1 1 1 11 7128 1 1 11 LYS HZ2 H -5.041 6.178 15.893 1.00 . A A . 11 LYS HZ2 1 1 11 7129 1 1 11 LYS N N -0.010 6.027 13.572 1.00 . A A . 11 LYS N 1 1 11 7130 1 1 11 LYS NZ N -4.314 5.600 16.328 1.00 . A A . 11 LYS NZ 1 1 11 7131 1 1 11 LYS O O 0.879 8.120 11.815 1.00 . A A . 11 LYS O 1 1 11 7132 1 1 12 CYS C C -1.981 9.461 9.082 1.00 . A A . 12 CYS C 1 1 11 7133 1 1 12 CYS CA C -0.871 8.494 9.571 1.00 . A A . 12 CYS CA 1 1 11 7134 1 1 12 CYS CB C -0.745 7.318 8.572 1.00 . A A . 12 CYS CB 1 1 11 7135 1 1 12 CYS H H -2.133 7.777 11.287 1.00 . A A . 12 CYS H 1 1 11 7136 1 1 12 CYS HA H 0.096 9.046 9.598 1.00 . A A . 12 CYS HA 1 1 11 7137 1 1 12 CYS HB2 H -0.441 7.664 7.568 1.00 . A A . 12 CYS HB2 1 1 11 7138 1 1 12 CYS HB3 H 0.026 6.605 8.878 1.00 . A A . 12 CYS HB3 1 1 11 7139 1 1 12 CYS N N -1.194 7.957 10.922 1.00 . A A . 12 CYS N 1 1 11 7140 1 1 12 CYS O O -3.018 9.662 9.728 1.00 . A A . 12 CYS O 1 1 11 7141 1 1 12 CYS SG S -2.220 6.346 8.406 1.00 . A A . 12 CYS SG 1 1 11 7142 1 1 13 THR C C -2.583 10.645 5.659 1.00 . A A . 13 THR C 1 1 11 7143 1 1 13 THR CA C -2.826 10.828 7.192 1.00 . A A . 13 THR CA 1 1 11 7144 1 1 13 THR CB C -2.886 12.372 7.606 1.00 . A A . 13 THR CB 1 1 11 7145 1 1 13 THR CG2 C -1.935 12.849 8.730 1.00 . A A . 13 THR CG2 1 1 11 7146 1 1 13 THR H H -0.854 9.760 7.468 1.00 . A A . 13 THR H 1 1 11 7147 1 1 13 THR HA H -3.812 10.372 7.431 1.00 . A A . 13 THR HA 1 1 11 7148 1 1 13 THR HB H -3.947 12.541 7.868 1.00 . A A . 13 THR HB 1 1 11 7149 1 1 13 THR HG1 H -3.147 13.019 5.813 1.00 . A A . 13 THR HG1 1 1 11 7150 1 1 13 THR HG21 H -0.872 12.673 8.479 1.00 . A A . 13 THR HG21 1 1 11 7151 1 1 13 THR HG22 H -2.043 13.934 8.917 1.00 . A A . 13 THR HG22 1 1 11 7152 1 1 13 THR HG23 H -2.139 12.338 9.687 1.00 . A A . 13 THR HG23 1 1 11 7153 1 1 13 THR N N -1.749 10.059 7.898 1.00 . A A . 13 THR N 1 1 11 7154 1 1 13 THR O O -1.468 10.452 5.154 1.00 . A A . 13 THR O 1 1 11 7155 1 1 13 THR OG1 O -2.550 13.243 6.530 1.00 . A A . 13 THR OG1 1 1 11 7156 1 1 14 TRP C C -3.354 12.373 3.086 1.00 . A A . 14 TRP C 1 1 11 7157 1 1 14 TRP CA C -3.708 10.896 3.441 1.00 . A A . 14 TRP CA 1 1 11 7158 1 1 14 TRP CB C -5.094 10.499 2.859 1.00 . A A . 14 TRP CB 1 1 11 7159 1 1 14 TRP CD1 C -4.754 7.877 2.829 1.00 . A A . 14 TRP CD1 1 1 11 7160 1 1 14 TRP CD2 C -6.769 8.565 3.477 1.00 . A A . 14 TRP CD2 1 1 11 7161 1 1 14 TRP CE2 C -6.717 7.147 3.506 1.00 . A A . 14 TRP CE2 1 1 11 7162 1 1 14 TRP CE3 C -7.958 9.245 3.853 1.00 . A A . 14 TRP CE3 1 1 11 7163 1 1 14 TRP CG C -5.534 9.035 3.058 1.00 . A A . 14 TRP CG 1 1 11 7164 1 1 14 TRP CH2 C -9.004 7.091 4.290 1.00 . A A . 14 TRP CH2 1 1 11 7165 1 1 14 TRP CZ2 C -7.848 6.401 3.918 1.00 . A A . 14 TRP CZ2 1 1 11 7166 1 1 14 TRP CZ3 C -9.060 8.489 4.252 1.00 . A A . 14 TRP CZ3 1 1 11 7167 1 1 14 TRP H H -4.504 11.055 5.528 1.00 . A A . 14 TRP H 1 1 11 7168 1 1 14 TRP HA H -2.951 10.205 3.015 1.00 . A A . 14 TRP HA 1 1 11 7169 1 1 14 TRP HB2 H -5.872 11.179 3.257 1.00 . A A . 14 TRP HB2 1 1 11 7170 1 1 14 TRP HB3 H -5.091 10.693 1.770 1.00 . A A . 14 TRP HB3 1 1 11 7171 1 1 14 TRP HD1 H -3.730 7.886 2.488 1.00 . A A . 14 TRP HD1 1 1 11 7172 1 1 14 TRP HE1 H -5.139 5.729 3.036 1.00 . A A . 14 TRP HE1 1 1 11 7173 1 1 14 TRP HE3 H -8.015 10.324 3.839 1.00 . A A . 14 TRP HE3 1 1 11 7174 1 1 14 TRP HH2 H -9.866 6.542 4.632 1.00 . A A . 14 TRP HH2 1 1 11 7175 1 1 14 TRP HZ2 H -7.820 5.322 3.956 1.00 . A A . 14 TRP HZ2 1 1 11 7176 1 1 14 TRP HZ3 H -9.968 8.991 4.553 1.00 . A A . 14 TRP HZ3 1 1 11 7177 1 1 14 TRP N N -3.705 10.799 4.932 1.00 . A A . 14 TRP N 1 1 11 7178 1 1 14 TRP NE1 N -5.467 6.698 3.111 1.00 . A A . 14 TRP NE1 1 1 11 7179 1 1 14 TRP O O -4.165 13.291 3.252 1.00 . A A . 14 TRP O 1 1 11 7180 1 1 15 GLY C C -0.210 14.015 3.373 1.00 . A A . 15 GLY C 1 1 11 7181 1 1 15 GLY CA C -1.487 13.910 2.492 1.00 . A A . 15 GLY CA 1 1 11 7182 1 1 15 GLY H H -1.512 11.731 2.708 1.00 . A A . 15 GLY H 1 1 11 7183 1 1 15 GLY HA2 H -1.223 14.070 1.431 1.00 . A A . 15 GLY HA2 1 1 11 7184 1 1 15 GLY HA3 H -2.183 14.731 2.754 1.00 . A A . 15 GLY HA3 1 1 11 7185 1 1 15 GLY N N -2.105 12.564 2.635 1.00 . A A . 15 GLY N 1 1 11 7186 1 1 15 GLY O O 0.848 14.436 2.899 1.00 . A A . 15 GLY O 1 1 11 7187 1 1 16 GLY C C 1.703 12.214 5.235 1.00 . A A . 16 GLY C 1 1 11 7188 1 1 16 GLY CA C 0.782 13.396 5.593 1.00 . A A . 16 GLY CA 1 1 11 7189 1 1 16 GLY H H -1.247 13.160 4.815 1.00 . A A . 16 GLY H 1 1 11 7190 1 1 16 GLY HA2 H 1.383 14.298 5.782 1.00 . A A . 16 GLY HA2 1 1 11 7191 1 1 16 GLY HA3 H 0.297 13.181 6.566 1.00 . A A . 16 GLY HA3 1 1 11 7192 1 1 16 GLY N N -0.336 13.603 4.651 1.00 . A A . 16 GLY N 1 1 11 7193 1 1 16 GLY O O 1.760 11.733 4.096 1.00 . A A . 16 GLY O 1 1 11 7194 1 1 17 THR C C 2.472 9.277 5.980 1.00 . A A . 17 THR C 1 1 11 7195 1 1 17 THR CA C 3.342 10.579 6.124 1.00 . A A . 17 THR CA 1 1 11 7196 1 1 17 THR CB C 4.308 10.441 7.369 1.00 . A A . 17 THR CB 1 1 11 7197 1 1 17 THR CG2 C 5.626 9.719 7.011 1.00 . A A . 17 THR CG2 1 1 11 7198 1 1 17 THR H H 2.358 12.362 7.083 1.00 . A A . 17 THR H 1 1 11 7199 1 1 17 THR HA H 3.950 10.735 5.208 1.00 . A A . 17 THR HA 1 1 11 7200 1 1 17 THR HB H 3.806 9.851 8.166 1.00 . A A . 17 THR HB 1 1 11 7201 1 1 17 THR HG1 H 5.265 11.553 8.617 1.00 . A A . 17 THR HG1 1 1 11 7202 1 1 17 THR HG21 H 6.216 10.228 6.228 1.00 . A A . 17 THR HG21 1 1 11 7203 1 1 17 THR HG22 H 6.281 9.624 7.898 1.00 . A A . 17 THR HG22 1 1 11 7204 1 1 17 THR HG23 H 5.464 8.688 6.660 1.00 . A A . 17 THR HG23 1 1 11 7205 1 1 17 THR N N 2.419 11.747 6.263 1.00 . A A . 17 THR N 1 1 11 7206 1 1 17 THR O O 1.385 9.125 6.562 1.00 . A A . 17 THR O 1 1 11 7207 1 1 17 THR OG1 O 4.688 11.722 7.869 1.00 . A A . 17 THR OG1 1 1 11 7208 1 1 18 LYS C C 3.699 6.063 5.599 1.00 . A A . 18 LYS C 1 1 11 7209 1 1 18 LYS CA C 2.553 6.953 5.050 1.00 . A A . 18 LYS CA 1 1 11 7210 1 1 18 LYS CB C 2.179 6.593 3.579 1.00 . A A . 18 LYS CB 1 1 11 7211 1 1 18 LYS CD C 0.855 7.095 1.411 1.00 . A A . 18 LYS CD 1 1 11 7212 1 1 18 LYS CE C 0.117 8.138 0.547 1.00 . A A . 18 LYS CE 1 1 11 7213 1 1 18 LYS CG C 1.366 7.630 2.766 1.00 . A A . 18 LYS CG 1 1 11 7214 1 1 18 LYS H H 3.960 8.634 4.849 1.00 . A A . 18 LYS H 1 1 11 7215 1 1 18 LYS HA H 1.652 6.735 5.648 1.00 . A A . 18 LYS HA 1 1 11 7216 1 1 18 LYS HB2 H 3.082 6.255 3.043 1.00 . A A . 18 LYS HB2 1 1 11 7217 1 1 18 LYS HB3 H 1.571 5.668 3.625 1.00 . A A . 18 LYS HB3 1 1 11 7218 1 1 18 LYS HD2 H 1.717 6.717 0.830 1.00 . A A . 18 LYS HD2 1 1 11 7219 1 1 18 LYS HD3 H 0.205 6.213 1.572 1.00 . A A . 18 LYS HD3 1 1 11 7220 1 1 18 LYS HE2 H 0.753 9.029 0.392 1.00 . A A . 18 LYS HE2 1 1 11 7221 1 1 18 LYS HE3 H -0.056 7.718 -0.461 1.00 . A A . 18 LYS HE3 1 1 11 7222 1 1 18 LYS HG2 H 0.508 7.973 3.374 1.00 . A A . 18 LYS HG2 1 1 11 7223 1 1 18 LYS HG3 H 1.988 8.528 2.593 1.00 . A A . 18 LYS HG3 1 1 11 7224 1 1 18 LYS HZ1 H -1.049 8.963 2.040 1.00 . A A . 18 LYS HZ1 1 1 11 7225 1 1 18 LYS HZ2 H -1.787 7.740 1.245 1.00 . A A . 18 LYS HZ2 1 1 11 7226 1 1 18 LYS N N 3.030 8.359 5.181 1.00 . A A . 18 LYS N 1 1 11 7227 1 1 18 LYS NZ N -1.183 8.558 1.107 1.00 . A A . 18 LYS NZ 1 1 11 7228 1 1 18 LYS O O 4.771 6.499 6.060 1.00 . A A . 18 LYS O 1 1 11 7229 1 1 19 CYS C C 5.573 3.503 5.413 1.00 . A A . 19 CYS C 1 1 11 7230 1 1 19 CYS CA C 4.342 3.827 6.313 1.00 . A A . 19 CYS CA 1 1 11 7231 1 1 19 CYS CB C 3.552 2.607 6.814 1.00 . A A . 19 CYS CB 1 1 11 7232 1 1 19 CYS H H 2.563 4.563 5.064 1.00 . A A . 19 CYS H 1 1 11 7233 1 1 19 CYS HA H 4.646 4.384 7.225 1.00 . A A . 19 CYS HA 1 1 11 7234 1 1 19 CYS HB2 H 2.791 2.266 6.091 1.00 . A A . 19 CYS HB2 1 1 11 7235 1 1 19 CYS HB3 H 4.204 1.718 6.938 1.00 . A A . 19 CYS HB3 1 1 11 7236 1 1 19 CYS N N 3.430 4.754 5.595 1.00 . A A . 19 CYS N 1 1 11 7237 1 1 19 CYS O O 5.582 3.427 4.181 1.00 . A A . 19 CYS O 1 1 11 7238 1 1 19 CYS SG S 2.866 3.121 8.394 1.00 . A A . 19 CYS SG 1 1 11 7239 1 1 20 CYS C C 8.519 2.604 4.687 1.00 . A A . 20 CYS C 1 1 11 7240 1 1 20 CYS CA C 8.068 3.498 5.879 1.00 . A A . 20 CYS CA 1 1 11 7241 1 1 20 CYS CB C 8.860 3.079 7.141 1.00 . A A . 20 CYS CB 1 1 11 7242 1 1 20 CYS H H 6.370 3.527 7.217 1.00 . A A . 20 CYS H 1 1 11 7243 1 1 20 CYS HA H 8.191 4.570 5.738 1.00 . A A . 20 CYS HA 1 1 11 7244 1 1 20 CYS HB2 H 8.398 3.502 8.036 1.00 . A A . 20 CYS HB2 1 1 11 7245 1 1 20 CYS HB3 H 8.912 1.984 7.298 1.00 . A A . 20 CYS HB3 1 1 11 7246 1 1 20 CYS N N 6.638 3.451 6.229 1.00 . A A . 20 CYS N 1 1 11 7247 1 1 20 CYS O O 9.140 3.130 3.760 1.00 . A A . 20 CYS O 1 1 11 7248 1 1 20 CYS SG S 10.515 3.789 7.060 1.00 . A A . 20 CYS SG 1 1 11 7249 1 1 21 ARG C C 7.660 0.088 2.522 1.00 . A A . 21 ARG C 1 1 11 7250 1 1 21 ARG CA C 8.692 0.318 3.674 1.00 . A A . 21 ARG CA 1 1 11 7251 1 1 21 ARG CB C 9.025 -1.013 4.419 1.00 . A A . 21 ARG CB 1 1 11 7252 1 1 21 ARG CD C 11.609 -0.644 4.822 1.00 . A A . 21 ARG CD 1 1 11 7253 1 1 21 ARG CG C 10.223 -1.002 5.407 1.00 . A A . 21 ARG CG 1 1 11 7254 1 1 21 ARG CZ C 12.225 -1.705 2.599 1.00 . A A . 21 ARG CZ 1 1 11 7255 1 1 21 ARG H H 7.597 1.076 5.485 1.00 . A A . 21 ARG H 1 1 11 7256 1 1 21 ARG HA H 9.574 0.730 3.165 1.00 . A A . 21 ARG HA 1 1 11 7257 1 1 21 ARG HB2 H 8.128 -1.379 4.956 1.00 . A A . 21 ARG HB2 1 1 11 7258 1 1 21 ARG HB3 H 9.234 -1.804 3.675 1.00 . A A . 21 ARG HB3 1 1 11 7259 1 1 21 ARG HD2 H 11.589 0.353 4.342 1.00 . A A . 21 ARG HD2 1 1 11 7260 1 1 21 ARG HD3 H 12.331 -0.546 5.653 1.00 . A A . 21 ARG HD3 1 1 11 7261 1 1 21 ARG HG2 H 10.001 -0.296 6.229 1.00 . A A . 21 ARG HG2 1 1 11 7262 1 1 21 ARG HG3 H 10.283 -1.989 5.903 1.00 . A A . 21 ARG HG3 1 1 11 7263 1 1 21 ARG HH11 H 11.487 0.141 2.302 1.00 . A A . 21 ARG HH11 1 1 11 7264 1 1 21 ARG HH12 H 11.997 -0.806 0.815 1.00 . A A . 21 ARG HH12 1 1 11 7265 1 1 21 ARG HH21 H 12.983 -3.557 2.647 1.00 . A A . 21 ARG HH21 1 1 11 7266 1 1 21 ARG HH22 H 12.791 -2.769 1.001 1.00 . A A . 21 ARG HH22 1 1 11 7267 1 1 21 ARG N N 8.242 1.288 4.727 1.00 . A A . 21 ARG N 1 1 11 7268 1 1 21 ARG NE N 12.116 -1.690 3.870 1.00 . A A . 21 ARG NE 1 1 11 7269 1 1 21 ARG NH1 N 11.867 -0.685 1.826 1.00 . A A . 21 ARG NH1 1 1 11 7270 1 1 21 ARG NH2 N 12.716 -2.787 2.024 1.00 . A A . 21 ARG NH2 1 1 11 7271 1 1 21 ARG O O 7.548 -0.995 1.938 1.00 . A A . 21 ARG O 1 1 11 7272 1 1 22 GLY C C 4.604 0.484 1.521 1.00 . A A . 22 GLY C 1 1 11 7273 1 1 22 GLY CA C 5.909 1.193 1.137 1.00 . A A . 22 GLY CA 1 1 11 7274 1 1 22 GLY H H 7.146 1.875 2.910 1.00 . A A . 22 GLY H 1 1 11 7275 1 1 22 GLY HA2 H 5.700 2.247 0.870 1.00 . A A . 22 GLY HA2 1 1 11 7276 1 1 22 GLY HA3 H 6.291 0.746 0.216 1.00 . A A . 22 GLY HA3 1 1 11 7277 1 1 22 GLY N N 6.957 1.166 2.184 1.00 . A A . 22 GLY N 1 1 11 7278 1 1 22 GLY O O 4.212 -0.521 0.922 1.00 . A A . 22 GLY O 1 1 11 7279 1 1 23 ARG C C 1.628 1.462 3.193 1.00 . A A . 23 ARG C 1 1 11 7280 1 1 23 ARG CA C 2.827 0.450 3.248 1.00 . A A . 23 ARG CA 1 1 11 7281 1 1 23 ARG CB C 3.247 0.152 4.706 1.00 . A A . 23 ARG CB 1 1 11 7282 1 1 23 ARG CD C 2.612 -0.902 7.038 1.00 . A A . 23 ARG CD 1 1 11 7283 1 1 23 ARG CG C 2.148 -0.342 5.680 1.00 . A A . 23 ARG CG 1 1 11 7284 1 1 23 ARG CZ C 4.169 -2.807 7.612 1.00 . A A . 23 ARG CZ 1 1 11 7285 1 1 23 ARG H H 4.573 1.771 2.981 1.00 . A A . 23 ARG H 1 1 11 7286 1 1 23 ARG HA H 2.546 -0.515 2.787 1.00 . A A . 23 ARG HA 1 1 11 7287 1 1 23 ARG HB2 H 4.120 -0.458 4.836 1.00 . A A . 23 ARG HB2 1 1 11 7288 1 1 23 ARG HB3 H 3.779 1.033 5.027 1.00 . A A . 23 ARG HB3 1 1 11 7289 1 1 23 ARG HD2 H 3.279 -0.187 7.549 1.00 . A A . 23 ARG HD2 1 1 11 7290 1 1 23 ARG HD3 H 1.729 -1.010 7.692 1.00 . A A . 23 ARG HD3 1 1 11 7291 1 1 23 ARG HG2 H 1.465 0.502 5.887 1.00 . A A . 23 ARG HG2 1 1 11 7292 1 1 23 ARG HG3 H 1.533 -1.100 5.171 1.00 . A A . 23 ARG HG3 1 1 11 7293 1 1 23 ARG HH11 H 4.383 -1.304 8.930 1.00 . A A . 23 ARG HH11 1 1 11 7294 1 1 23 ARG HH12 H 5.425 -2.793 9.182 1.00 . A A . 23 ARG HH12 1 1 11 7295 1 1 23 ARG HH21 H 4.131 -4.423 6.431 1.00 . A A . 23 ARG HH21 1 1 11 7296 1 1 23 ARG HH22 H 5.290 -4.448 7.853 1.00 . A A . 23 ARG HH22 1 1 11 7297 1 1 23 ARG N N 3.978 1.055 2.546 1.00 . A A . 23 ARG N 1 1 11 7298 1 1 23 ARG NE N 3.276 -2.238 6.902 1.00 . A A . 23 ARG NE 1 1 11 7299 1 1 23 ARG NH1 N 4.716 -2.243 8.685 1.00 . A A . 23 ARG NH1 1 1 11 7300 1 1 23 ARG NH2 N 4.570 -4.015 7.264 1.00 . A A . 23 ARG NH2 1 1 11 7301 1 1 23 ARG O O 1.789 2.598 3.678 1.00 . A A . 23 ARG O 1 1 11 7302 1 1 24 PRO C C -1.479 2.149 4.004 1.00 . A A . 24 PRO C 1 1 11 7303 1 1 24 PRO CA C -0.759 1.989 2.628 1.00 . A A . 24 PRO CA 1 1 11 7304 1 1 24 PRO CB C -1.644 1.323 1.554 1.00 . A A . 24 PRO CB 1 1 11 7305 1 1 24 PRO CD C 0.148 -0.217 2.032 1.00 . A A . 24 PRO CD 1 1 11 7306 1 1 24 PRO CG C -1.333 -0.170 1.655 1.00 . A A . 24 PRO CG 1 1 11 7307 1 1 24 PRO HA H -0.458 3.003 2.293 1.00 . A A . 24 PRO HA 1 1 11 7308 1 1 24 PRO HB2 H -2.723 1.536 1.667 1.00 . A A . 24 PRO HB2 1 1 11 7309 1 1 24 PRO HB3 H -1.359 1.695 0.550 1.00 . A A . 24 PRO HB3 1 1 11 7310 1 1 24 PRO HD2 H 0.352 -1.065 2.714 1.00 . A A . 24 PRO HD2 1 1 11 7311 1 1 24 PRO HD3 H 0.780 -0.343 1.131 1.00 . A A . 24 PRO HD3 1 1 11 7312 1 1 24 PRO HG2 H -1.945 -0.632 2.454 1.00 . A A . 24 PRO HG2 1 1 11 7313 1 1 24 PRO HG3 H -1.552 -0.716 0.719 1.00 . A A . 24 PRO HG3 1 1 11 7314 1 1 24 PRO N N 0.418 1.089 2.673 1.00 . A A . 24 PRO N 1 1 11 7315 1 1 24 PRO O O -1.277 1.377 4.952 1.00 . A A . 24 PRO O 1 1 11 7316 1 1 25 CYS C C -4.641 3.356 4.962 1.00 . A A . 25 CYS C 1 1 11 7317 1 1 25 CYS CA C -3.122 3.519 5.272 1.00 . A A . 25 CYS CA 1 1 11 7318 1 1 25 CYS CB C -2.785 4.967 5.714 1.00 . A A . 25 CYS CB 1 1 11 7319 1 1 25 CYS H H -2.403 3.732 3.200 1.00 . A A . 25 CYS H 1 1 11 7320 1 1 25 CYS HA H -2.848 2.842 6.107 1.00 . A A . 25 CYS HA 1 1 11 7321 1 1 25 CYS HB2 H -2.258 5.518 4.925 1.00 . A A . 25 CYS HB2 1 1 11 7322 1 1 25 CYS HB3 H -3.699 5.520 5.989 1.00 . A A . 25 CYS HB3 1 1 11 7323 1 1 25 CYS N N -2.334 3.181 4.063 1.00 . A A . 25 CYS N 1 1 11 7324 1 1 25 CYS O O -5.141 3.579 3.854 1.00 . A A . 25 CYS O 1 1 11 7325 1 1 25 CYS SG S -1.731 4.890 7.145 1.00 . A A . 25 CYS SG 1 1 11 7326 1 1 26 ARG C C -7.240 3.538 7.382 1.00 . A A . 26 ARG C 1 1 11 7327 1 1 26 ARG CA C -6.826 2.828 6.070 1.00 . A A . 26 ARG CA 1 1 11 7328 1 1 26 ARG CB C -7.222 1.327 6.031 1.00 . A A . 26 ARG CB 1 1 11 7329 1 1 26 ARG CD C -9.512 1.314 4.746 1.00 . A A . 26 ARG CD 1 1 11 7330 1 1 26 ARG CG C -8.723 0.966 6.025 1.00 . A A . 26 ARG CG 1 1 11 7331 1 1 26 ARG CZ C -10.965 3.162 3.880 1.00 . A A . 26 ARG CZ 1 1 11 7332 1 1 26 ARG H H -4.821 2.977 6.908 1.00 . A A . 26 ARG H 1 1 11 7333 1 1 26 ARG HA H -7.280 3.338 5.197 1.00 . A A . 26 ARG HA 1 1 11 7334 1 1 26 ARG HB2 H -6.762 0.857 5.141 1.00 . A A . 26 ARG HB2 1 1 11 7335 1 1 26 ARG HB3 H -6.758 0.808 6.892 1.00 . A A . 26 ARG HB3 1 1 11 7336 1 1 26 ARG HD2 H -8.890 1.155 3.845 1.00 . A A . 26 ARG HD2 1 1 11 7337 1 1 26 ARG HD3 H -10.350 0.596 4.658 1.00 . A A . 26 ARG HD3 1 1 11 7338 1 1 26 ARG HG2 H -8.789 -0.129 6.164 1.00 . A A . 26 ARG HG2 1 1 11 7339 1 1 26 ARG HG3 H -9.213 1.381 6.923 1.00 . A A . 26 ARG HG3 1 1 11 7340 1 1 26 ARG HH11 H -11.079 1.504 2.746 1.00 . A A . 26 ARG HH11 1 1 11 7341 1 1 26 ARG HH12 H -12.131 2.926 2.257 1.00 . A A . 26 ARG HH12 1 1 11 7342 1 1 26 ARG HH21 H -11.042 4.913 4.845 1.00 . A A . 26 ARG HH21 1 1 11 7343 1 1 26 ARG HH22 H -12.109 4.720 3.365 1.00 . A A . 26 ARG HH22 1 1 11 7344 1 1 26 ARG N N -5.350 2.961 6.027 1.00 . A A . 26 ARG N 1 1 11 7345 1 1 26 ARG NE N -10.060 2.693 4.761 1.00 . A A . 26 ARG NE 1 1 11 7346 1 1 26 ARG NH1 N -11.441 2.458 2.855 1.00 . A A . 26 ARG NH1 1 1 11 7347 1 1 26 ARG NH2 N -11.417 4.389 4.046 1.00 . A A . 26 ARG NH2 1 1 11 7348 1 1 26 ARG O O -6.678 3.248 8.453 1.00 . A A . 26 ARG O 1 1 11 7349 1 1 27 CYS C C -9.173 4.639 9.689 1.00 . A A . 27 CYS C 1 1 11 7350 1 1 27 CYS CA C -8.429 5.359 8.511 1.00 . A A . 27 CYS CA 1 1 11 7351 1 1 27 CYS CB C -9.289 6.617 8.151 1.00 . A A . 27 CYS CB 1 1 11 7352 1 1 27 CYS H H -8.589 4.690 6.401 1.00 . A A . 27 CYS H 1 1 11 7353 1 1 27 CYS HA H -7.398 5.656 8.739 1.00 . A A . 27 CYS HA 1 1 11 7354 1 1 27 CYS HB2 H -10.037 6.339 7.426 1.00 . A A . 27 CYS HB2 1 1 11 7355 1 1 27 CYS HB3 H -9.882 7.006 8.999 1.00 . A A . 27 CYS HB3 1 1 11 7356 1 1 27 CYS N N -8.198 4.492 7.329 1.00 . A A . 27 CYS N 1 1 11 7357 1 1 27 CYS O O -9.740 3.549 9.590 1.00 . A A . 27 CYS O 1 1 11 7358 1 1 27 CYS SG S -8.450 8.074 7.516 1.00 . A A . 27 CYS SG 1 1 11 7359 1 1 28 SER C C -11.454 4.962 11.864 1.00 . A A . 28 SER C 1 1 11 7360 1 1 28 SER CA C -9.908 5.120 12.069 1.00 . A A . 28 SER CA 1 1 11 7361 1 1 28 SER CB C -9.538 6.347 12.963 1.00 . A A . 28 SER CB 1 1 11 7362 1 1 28 SER H H -8.661 6.268 10.681 1.00 . A A . 28 SER H 1 1 11 7363 1 1 28 SER HA H -9.573 4.184 12.554 1.00 . A A . 28 SER HA 1 1 11 7364 1 1 28 SER HB2 H -9.664 7.307 12.424 1.00 . A A . 28 SER HB2 1 1 11 7365 1 1 28 SER HB3 H -10.183 6.458 13.849 1.00 . A A . 28 SER HB3 1 1 11 7366 1 1 28 SER HG H -8.170 5.426 13.953 1.00 . A A . 28 SER HG 1 1 11 7367 1 1 28 SER N N -9.136 5.370 10.822 1.00 . A A . 28 SER N 1 1 11 7368 1 1 28 SER O O -12.005 5.045 10.761 1.00 . A A . 28 SER O 1 1 11 7369 1 1 28 SER OG O -8.203 6.240 13.444 1.00 . A A . 28 SER OG 1 1 11 7370 1 1 29 MET C C -14.565 5.459 12.533 1.00 . A A . 29 MET C 1 1 11 7371 1 1 29 MET CA C -13.591 4.363 13.053 1.00 . A A . 29 MET CA 1 1 11 7372 1 1 29 MET CB C -13.890 4.062 14.548 1.00 . A A . 29 MET CB 1 1 11 7373 1 1 29 MET CE C -11.215 4.880 16.549 1.00 . A A . 29 MET CE 1 1 11 7374 1 1 29 MET CG C -13.875 5.142 15.656 1.00 . A A . 29 MET CG 1 1 11 7375 1 1 29 MET H H -11.578 4.810 13.838 1.00 . A A . 29 MET H 1 1 11 7376 1 1 29 MET HA H -13.780 3.459 12.443 1.00 . A A . 29 MET HA 1 1 11 7377 1 1 29 MET HB2 H -14.890 3.609 14.577 1.00 . A A . 29 MET HB2 1 1 11 7378 1 1 29 MET HB3 H -13.193 3.284 14.866 1.00 . A A . 29 MET HB3 1 1 11 7379 1 1 29 MET HE1 H -11.611 4.582 17.536 1.00 . A A . 29 MET HE1 1 1 11 7380 1 1 29 MET HE2 H -11.090 3.970 15.935 1.00 . A A . 29 MET HE2 1 1 11 7381 1 1 29 MET HE3 H -10.216 5.327 16.700 1.00 . A A . 29 MET HE3 1 1 11 7382 1 1 29 MET HG2 H -14.707 5.850 15.503 1.00 . A A . 29 MET HG2 1 1 11 7383 1 1 29 MET HG3 H -14.072 4.677 16.639 1.00 . A A . 29 MET HG3 1 1 11 7384 1 1 29 MET N N -12.136 4.702 12.988 1.00 . A A . 29 MET N 1 1 11 7385 1 1 29 MET O O -15.563 5.150 11.879 1.00 . A A . 29 MET O 1 1 11 7386 1 1 29 MET SD S -12.316 6.060 15.739 1.00 . A A . 29 MET SD 1 1 11 7387 1 1 30 ILE C C -14.810 8.164 10.881 1.00 . A A . 30 ILE C 1 1 11 7388 1 1 30 ILE CA C -15.024 7.921 12.418 1.00 . A A . 30 ILE CA 1 1 11 7389 1 1 30 ILE CB C -14.582 9.181 13.273 1.00 . A A . 30 ILE CB 1 1 11 7390 1 1 30 ILE CD1 C -14.232 10.021 15.741 1.00 . A A . 30 ILE CD1 1 1 11 7391 1 1 30 ILE CG1 C -14.850 8.973 14.799 1.00 . A A . 30 ILE CG1 1 1 11 7392 1 1 30 ILE CG2 C -15.374 10.445 12.822 1.00 . A A . 30 ILE CG2 1 1 11 7393 1 1 30 ILE H H -13.357 6.676 13.373 1.00 . A A . 30 ILE H 1 1 11 7394 1 1 30 ILE HA H -16.097 7.725 12.587 1.00 . A A . 30 ILE HA 1 1 11 7395 1 1 30 ILE HB H -13.500 9.367 13.126 1.00 . A A . 30 ILE HB 1 1 11 7396 1 1 30 ILE HD11 H -13.141 10.116 15.586 1.00 . A A . 30 ILE HD11 1 1 11 7397 1 1 30 ILE HD12 H -14.678 11.023 15.606 1.00 . A A . 30 ILE HD12 1 1 11 7398 1 1 30 ILE HD13 H -14.387 9.741 16.799 1.00 . A A . 30 ILE HD13 1 1 11 7399 1 1 30 ILE HG12 H -15.936 8.890 14.998 1.00 . A A . 30 ILE HG12 1 1 11 7400 1 1 30 ILE HG13 H -14.429 8.007 15.120 1.00 . A A . 30 ILE HG13 1 1 11 7401 1 1 30 ILE HG21 H -16.467 10.316 12.937 1.00 . A A . 30 ILE HG21 1 1 11 7402 1 1 30 ILE HG22 H -15.088 11.346 13.392 1.00 . A A . 30 ILE HG22 1 1 11 7403 1 1 30 ILE HG23 H -15.187 10.698 11.763 1.00 . A A . 30 ILE HG23 1 1 11 7404 1 1 30 ILE N N -14.233 6.718 12.831 1.00 . A A . 30 ILE N 1 1 11 7405 1 1 30 ILE O O -15.801 8.305 10.158 1.00 . A A . 30 ILE O 1 1 11 7406 1 1 31 GLY C C -11.989 9.382 8.729 1.00 . A A . 31 GLY C 1 1 11 7407 1 1 31 GLY CA C -13.240 8.522 8.992 1.00 . A A . 31 GLY CA 1 1 11 7408 1 1 31 GLY H H -12.862 8.062 11.158 1.00 . A A . 31 GLY H 1 1 11 7409 1 1 31 GLY HA2 H -13.111 7.556 8.473 1.00 . A A . 31 GLY HA2 1 1 11 7410 1 1 31 GLY HA3 H -14.093 9.011 8.483 1.00 . A A . 31 GLY HA3 1 1 11 7411 1 1 31 GLY N N -13.553 8.231 10.414 1.00 . A A . 31 GLY N 1 1 11 7412 1 1 31 GLY O O -11.249 9.101 7.784 1.00 . A A . 31 GLY O 1 1 11 7413 1 1 32 THR C C -9.563 10.738 10.638 1.00 . A A . 32 THR C 1 1 11 7414 1 1 32 THR CA C -10.531 11.253 9.521 1.00 . A A . 32 THR CA 1 1 11 7415 1 1 32 THR CB C -10.867 12.767 9.754 1.00 . A A . 32 THR CB 1 1 11 7416 1 1 32 THR CG2 C -11.680 13.376 8.594 1.00 . A A . 32 THR CG2 1 1 11 7417 1 1 32 THR H H -12.424 10.445 10.339 1.00 . A A . 32 THR H 1 1 11 7418 1 1 32 THR HA H -10.021 11.159 8.541 1.00 . A A . 32 THR HA 1 1 11 7419 1 1 32 THR HB H -9.910 13.316 9.846 1.00 . A A . 32 THR HB 1 1 11 7420 1 1 32 THR HG1 H -11.106 12.568 11.656 1.00 . A A . 32 THR HG1 1 1 11 7421 1 1 32 THR HG21 H -11.145 13.281 7.631 1.00 . A A . 32 THR HG21 1 1 11 7422 1 1 32 THR HG22 H -12.668 12.894 8.474 1.00 . A A . 32 THR HG22 1 1 11 7423 1 1 32 THR HG23 H -11.861 14.454 8.758 1.00 . A A . 32 THR HG23 1 1 11 7424 1 1 32 THR N N -11.782 10.435 9.537 1.00 . A A . 32 THR N 1 1 11 7425 1 1 32 THR O O -9.958 9.985 11.536 1.00 . A A . 32 THR O 1 1 11 7426 1 1 32 THR OG1 O -11.636 12.936 10.945 1.00 . A A . 32 THR OG1 1 1 11 7427 1 1 33 ASN C C -6.829 9.279 11.210 1.00 . A A . 33 ASN C 1 1 11 7428 1 1 33 ASN CA C -7.160 10.772 11.480 1.00 . A A . 33 ASN CA 1 1 11 7429 1 1 33 ASN CB C -7.518 11.015 12.993 1.00 . A A . 33 ASN CB 1 1 11 7430 1 1 33 ASN CG C -7.409 12.486 13.432 1.00 . A A . 33 ASN CG 1 1 11 7431 1 1 33 ASN H H -8.040 11.646 9.685 1.00 . A A . 33 ASN H 1 1 11 7432 1 1 33 ASN HA H -6.265 11.372 11.225 1.00 . A A . 33 ASN HA 1 1 11 7433 1 1 33 ASN HB2 H -8.530 10.664 13.254 1.00 . A A . 33 ASN HB2 1 1 11 7434 1 1 33 ASN HB3 H -6.896 10.369 13.646 1.00 . A A . 33 ASN HB3 1 1 11 7435 1 1 33 ASN HD21 H -5.534 12.185 14.078 1.00 . A A . 33 ASN HD21 1 1 11 7436 1 1 33 ASN HD22 H -6.223 13.875 14.262 1.00 . A A . 33 ASN HD22 1 1 11 7437 1 1 33 ASN N N -8.277 11.165 10.559 1.00 . A A . 33 ASN N 1 1 11 7438 1 1 33 ASN ND2 N -6.273 12.890 13.980 1.00 . A A . 33 ASN ND2 1 1 11 7439 1 1 33 ASN O O -7.144 8.400 12.018 1.00 . A A . 33 ASN O 1 1 11 7440 1 1 33 ASN OD1 O -8.346 13.269 13.277 1.00 . A A . 33 ASN OD1 1 1 11 7441 1 1 34 CYS C C -4.948 6.820 10.479 1.00 . A A . 34 CYS C 1 1 11 7442 1 1 34 CYS CA C -5.993 7.590 9.614 1.00 . A A . 34 CYS CA 1 1 11 7443 1 1 34 CYS CB C -5.449 7.506 8.146 1.00 . A A . 34 CYS CB 1 1 11 7444 1 1 34 CYS H H -6.153 9.817 9.424 1.00 . A A . 34 CYS H 1 1 11 7445 1 1 34 CYS HA H -6.979 7.137 9.705 1.00 . A A . 34 CYS HA 1 1 11 7446 1 1 34 CYS HB2 H -4.653 8.227 8.056 1.00 . A A . 34 CYS HB2 1 1 11 7447 1 1 34 CYS HB3 H -5.010 6.513 7.933 1.00 . A A . 34 CYS HB3 1 1 11 7448 1 1 34 CYS N N -6.188 9.000 10.051 1.00 . A A . 34 CYS N 1 1 11 7449 1 1 34 CYS O O -4.177 7.404 11.248 1.00 . A A . 34 CYS O 1 1 11 7450 1 1 34 CYS SG S -6.656 7.670 6.832 1.00 . A A . 34 CYS SG 1 1 11 7451 1 1 35 GLU C C -3.246 3.749 9.718 1.00 . A A . 35 GLU C 1 1 11 7452 1 1 35 GLU CA C -3.858 4.617 10.868 1.00 . A A . 35 GLU CA 1 1 11 7453 1 1 35 GLU CB C -4.365 3.663 11.994 1.00 . A A . 35 GLU CB 1 1 11 7454 1 1 35 GLU CD C -6.789 3.336 12.853 1.00 . A A . 35 GLU CD 1 1 11 7455 1 1 35 GLU CG C -5.485 4.136 12.951 1.00 . A A . 35 GLU CG 1 1 11 7456 1 1 35 GLU H H -5.651 5.148 9.626 1.00 . A A . 35 GLU H 1 1 11 7457 1 1 35 GLU HA H -3.065 5.272 11.283 1.00 . A A . 35 GLU HA 1 1 11 7458 1 1 35 GLU HB2 H -4.529 2.650 11.586 1.00 . A A . 35 GLU HB2 1 1 11 7459 1 1 35 GLU HB3 H -3.500 3.448 12.644 1.00 . A A . 35 GLU HB3 1 1 11 7460 1 1 35 GLU HE2 H -8.265 2.792 13.998 1.00 . A A . 35 GLU HE2 1 1 11 7461 1 1 35 GLU HG2 H -5.100 4.090 13.984 1.00 . A A . 35 GLU HG2 1 1 11 7462 1 1 35 GLU HG3 H -5.708 5.210 12.802 1.00 . A A . 35 GLU HG3 1 1 11 7463 1 1 35 GLU N N -4.944 5.477 10.307 1.00 . A A . 35 GLU N 1 1 11 7464 1 1 35 GLU O O -3.779 3.635 8.609 1.00 . A A . 35 GLU O 1 1 11 7465 1 1 35 GLU OE1 O -7.208 2.820 11.816 1.00 . A A . 35 GLU OE1 1 1 11 7466 1 1 35 GLU OE2 O -7.443 3.285 14.056 1.00 . A A . 35 GLU OE2 1 1 11 7467 1 1 36 CYS C C -1.930 0.838 9.098 1.00 . A A . 36 CYS C 1 1 11 7468 1 1 36 CYS CA C -1.330 2.272 9.064 1.00 . A A . 36 CYS CA 1 1 11 7469 1 1 36 CYS CB C 0.197 2.300 9.441 1.00 . A A . 36 CYS CB 1 1 11 7470 1 1 36 CYS H H -1.909 3.203 11.032 1.00 . A A . 36 CYS H 1 1 11 7471 1 1 36 CYS HA H -1.436 2.692 8.031 1.00 . A A . 36 CYS HA 1 1 11 7472 1 1 36 CYS HB2 H 0.399 2.396 10.525 1.00 . A A . 36 CYS HB2 1 1 11 7473 1 1 36 CYS HB3 H 0.739 1.358 9.243 1.00 . A A . 36 CYS HB3 1 1 11 7474 1 1 36 CYS N N -2.092 3.130 10.024 1.00 . A A . 36 CYS N 1 1 11 7475 1 1 36 CYS O O -2.596 0.429 10.058 1.00 . A A . 36 CYS O 1 1 11 7476 1 1 36 CYS SG S 0.945 3.568 8.424 1.00 . A A . 36 CYS SG 1 1 11 7477 1 1 37 THR C C -1.305 -2.104 6.916 1.00 . A A . 37 THR C 1 1 11 7478 1 1 37 THR CA C -2.252 -1.307 7.884 1.00 . A A . 37 THR CA 1 1 11 7479 1 1 37 THR CB C -3.735 -1.328 7.393 1.00 . A A . 37 THR CB 1 1 11 7480 1 1 37 THR CG2 C -4.008 -0.615 6.056 1.00 . A A . 37 THR CG2 1 1 11 7481 1 1 37 THR H H -1.274 0.565 7.209 1.00 . A A . 37 THR H 1 1 11 7482 1 1 37 THR HA H -2.240 -1.785 8.875 1.00 . A A . 37 THR HA 1 1 11 7483 1 1 37 THR HB H -4.331 -0.892 8.211 1.00 . A A . 37 THR HB 1 1 11 7484 1 1 37 THR HG1 H -5.084 -2.632 6.964 1.00 . A A . 37 THR HG1 1 1 11 7485 1 1 37 THR HG21 H -3.420 -1.044 5.226 1.00 . A A . 37 THR HG21 1 1 11 7486 1 1 37 THR HG22 H -5.073 -0.698 5.784 1.00 . A A . 37 THR HG22 1 1 11 7487 1 1 37 THR HG23 H -3.768 0.462 6.120 1.00 . A A . 37 THR HG23 1 1 11 7488 1 1 37 THR N N -1.745 0.092 7.992 1.00 . A A . 37 THR N 1 1 11 7489 1 1 37 THR O O -0.951 -1.591 5.847 1.00 . A A . 37 THR O 1 1 11 7490 1 1 37 THR OG1 O -4.157 -2.676 7.208 1.00 . A A . 37 THR OG1 1 1 11 7491 1 1 38 PRO C C -0.875 -4.836 5.173 1.00 . A A . 38 PRO C 1 1 11 7492 1 1 38 PRO CA C -0.064 -4.213 6.350 1.00 . A A . 38 PRO CA 1 1 11 7493 1 1 38 PRO CB C 0.507 -5.255 7.330 1.00 . A A . 38 PRO CB 1 1 11 7494 1 1 38 PRO CD C -1.286 -4.074 8.475 1.00 . A A . 38 PRO CD 1 1 11 7495 1 1 38 PRO CG C -0.561 -5.422 8.418 1.00 . A A . 38 PRO CG 1 1 11 7496 1 1 38 PRO HA H 0.771 -3.620 5.922 1.00 . A A . 38 PRO HA 1 1 11 7497 1 1 38 PRO HB2 H 0.773 -6.216 6.850 1.00 . A A . 38 PRO HB2 1 1 11 7498 1 1 38 PRO HB3 H 1.438 -4.866 7.786 1.00 . A A . 38 PRO HB3 1 1 11 7499 1 1 38 PRO HD2 H -2.377 -4.198 8.551 1.00 . A A . 38 PRO HD2 1 1 11 7500 1 1 38 PRO HD3 H -1.002 -3.479 9.355 1.00 . A A . 38 PRO HD3 1 1 11 7501 1 1 38 PRO HG2 H -1.272 -6.220 8.132 1.00 . A A . 38 PRO HG2 1 1 11 7502 1 1 38 PRO HG3 H -0.127 -5.709 9.394 1.00 . A A . 38 PRO HG3 1 1 11 7503 1 1 38 PRO N N -0.910 -3.375 7.230 1.00 . A A . 38 PRO N 1 1 11 7504 1 1 38 PRO O O -1.922 -5.453 5.402 1.00 . A A . 38 PRO O 1 1 11 7505 1 1 39 ARG C C -0.883 -6.551 2.388 1.00 . A A . 39 ARG C 1 1 11 7506 1 1 39 ARG CA C -1.171 -5.053 2.716 1.00 . A A . 39 ARG CA 1 1 11 7507 1 1 39 ARG CB C -0.764 -4.108 1.549 1.00 . A A . 39 ARG CB 1 1 11 7508 1 1 39 ARG CD C -3.003 -3.899 0.151 1.00 . A A . 39 ARG CD 1 1 11 7509 1 1 39 ARG CG C -1.505 -4.286 0.198 1.00 . A A . 39 ARG CG 1 1 11 7510 1 1 39 ARG CZ C -4.373 -6.010 0.294 1.00 . A A . 39 ARG CZ 1 1 11 7511 1 1 39 ARG H H 0.475 -4.121 3.864 1.00 . A A . 39 ARG H 1 1 11 7512 1 1 39 ARG HA H -2.255 -4.925 2.903 1.00 . A A . 39 ARG HA 1 1 11 7513 1 1 39 ARG HB2 H -0.900 -3.058 1.867 1.00 . A A . 39 ARG HB2 1 1 11 7514 1 1 39 ARG HB3 H 0.322 -4.201 1.356 1.00 . A A . 39 ARG HB3 1 1 11 7515 1 1 39 ARG HD2 H -3.138 -2.900 0.605 1.00 . A A . 39 ARG HD2 1 1 11 7516 1 1 39 ARG HD3 H -3.310 -3.764 -0.904 1.00 . A A . 39 ARG HD3 1 1 11 7517 1 1 39 ARG HG2 H -0.983 -3.651 -0.541 1.00 . A A . 39 ARG HG2 1 1 11 7518 1 1 39 ARG HG3 H -1.363 -5.315 -0.182 1.00 . A A . 39 ARG HG3 1 1 11 7519 1 1 39 ARG HH11 H -3.371 -5.884 -1.446 1.00 . A A . 39 ARG HH11 1 1 11 7520 1 1 39 ARG HH12 H -4.421 -7.367 -1.191 1.00 . A A . 39 ARG HH12 1 1 11 7521 1 1 39 ARG HH21 H -5.462 -6.368 1.935 1.00 . A A . 39 ARG HH21 1 1 11 7522 1 1 39 ARG HH22 H -5.524 -7.619 0.594 1.00 . A A . 39 ARG HH22 1 1 11 7523 1 1 39 ARG N N -0.401 -4.653 3.925 1.00 . A A . 39 ARG N 1 1 11 7524 1 1 39 ARG NE N -3.934 -4.848 0.818 1.00 . A A . 39 ARG NE 1 1 11 7525 1 1 39 ARG NH1 N -4.018 -6.468 -0.905 1.00 . A A . 39 ARG NH1 1 1 11 7526 1 1 39 ARG NH2 N -5.204 -6.740 1.014 1.00 . A A . 39 ARG NH2 1 1 11 7527 1 1 39 ARG O O 0.123 -6.900 1.760 1.00 . A A . 39 ARG O 1 1 11 7528 1 1 40 LEU C C -3.214 -9.410 2.732 1.00 . A A . 40 LEU C 1 1 11 7529 1 1 40 LEU CA C -1.750 -8.888 2.603 1.00 . A A . 40 LEU CA 1 1 11 7530 1 1 40 LEU CB C -0.744 -9.559 3.602 1.00 . A A . 40 LEU CB 1 1 11 7531 1 1 40 LEU CD1 C 0.982 -11.370 4.086 1.00 . A A . 40 LEU CD1 1 1 11 7532 1 1 40 LEU CD2 C -1.362 -12.089 3.531 1.00 . A A . 40 LEU CD2 1 1 11 7533 1 1 40 LEU CG C -0.285 -11.013 3.280 1.00 . A A . 40 LEU CG 1 1 11 7534 1 1 40 LEU H H -2.579 -6.988 3.355 1.00 . A A . 40 LEU H 1 1 11 7535 1 1 40 LEU HA H -1.415 -9.077 1.570 1.00 . A A . 40 LEU HA 1 1 11 7536 1 1 40 LEU HB2 H 0.171 -8.935 3.618 1.00 . A A . 40 LEU HB2 1 1 11 7537 1 1 40 LEU HB3 H -1.119 -9.500 4.643 1.00 . A A . 40 LEU HB3 1 1 11 7538 1 1 40 LEU HD11 H 1.809 -10.666 3.879 1.00 . A A . 40 LEU HD11 1 1 11 7539 1 1 40 LEU HD12 H 0.801 -11.352 5.177 1.00 . A A . 40 LEU HD12 1 1 11 7540 1 1 40 LEU HD13 H 1.359 -12.379 3.832 1.00 . A A . 40 LEU HD13 1 1 11 7541 1 1 40 LEU HD21 H -1.742 -12.063 4.570 1.00 . A A . 40 LEU HD21 1 1 11 7542 1 1 40 LEU HD22 H -2.231 -11.969 2.860 1.00 . A A . 40 LEU HD22 1 1 11 7543 1 1 40 LEU HD23 H -0.975 -13.109 3.348 1.00 . A A . 40 LEU HD23 1 1 11 7544 1 1 40 LEU HG H -0.007 -11.056 2.210 1.00 . A A . 40 LEU HG 1 1 11 7545 1 1 40 LEU N N -1.800 -7.421 2.846 1.00 . A A . 40 LEU N 1 1 11 7546 1 1 40 LEU O O -3.810 -9.789 1.720 1.00 . A A . 40 LEU O 1 1 11 7547 1 1 41 ILE C C -6.051 -8.528 4.330 1.00 . A A . 41 ILE C 1 1 11 7548 1 1 41 ILE CA C -5.185 -9.835 4.227 1.00 . A A . 41 ILE CA 1 1 11 7549 1 1 41 ILE CB C -5.140 -10.769 5.511 1.00 . A A . 41 ILE CB 1 1 11 7550 1 1 41 ILE CD1 C -7.814 -11.064 5.827 1.00 . A A . 41 ILE CD1 1 1 11 7551 1 1 41 ILE CG1 C -6.415 -11.668 5.611 1.00 . A A . 41 ILE CG1 1 1 11 7552 1 1 41 ILE CG2 C -4.994 -9.958 6.833 1.00 . A A . 41 ILE CG2 1 1 11 7553 1 1 41 ILE H H -3.154 -9.067 4.687 1.00 . A A . 41 ILE H 1 1 11 7554 1 1 41 ILE HA H -5.572 -10.432 3.375 1.00 . A A . 41 ILE HA 1 1 11 7555 1 1 41 ILE HB H -4.277 -11.461 5.433 1.00 . A A . 41 ILE HB 1 1 11 7556 1 1 41 ILE HD11 H -7.848 -10.359 6.676 1.00 . A A . 41 ILE HD11 1 1 11 7557 1 1 41 ILE HD12 H -8.178 -10.537 4.930 1.00 . A A . 41 ILE HD12 1 1 11 7558 1 1 41 ILE HD13 H -8.553 -11.859 6.038 1.00 . A A . 41 ILE HD13 1 1 11 7559 1 1 41 ILE HG12 H -6.461 -12.307 4.709 1.00 . A A . 41 ILE HG12 1 1 11 7560 1 1 41 ILE HG13 H -6.247 -12.391 6.431 1.00 . A A . 41 ILE HG13 1 1 11 7561 1 1 41 ILE HG21 H -4.084 -9.329 6.824 1.00 . A A . 41 ILE HG21 1 1 11 7562 1 1 41 ILE HG22 H -5.848 -9.288 7.038 1.00 . A A . 41 ILE HG22 1 1 11 7563 1 1 41 ILE HG23 H -4.898 -10.630 7.707 1.00 . A A . 41 ILE HG23 1 1 11 7564 1 1 41 ILE N N -3.783 -9.411 3.955 1.00 . A A . 41 ILE N 1 1 11 7565 1 1 41 ILE O O -5.716 -7.589 5.064 1.00 . A A . 41 ILE O 1 1 11 7566 1 1 42 MET C C -8.921 -7.265 4.872 1.00 . A A . 42 MET C 1 1 11 7567 1 1 42 MET CA C -8.084 -7.304 3.550 1.00 . A A . 42 MET CA 1 1 11 7568 1 1 42 MET CB C -9.009 -7.396 2.297 1.00 . A A . 42 MET CB 1 1 11 7569 1 1 42 MET CE C -10.443 -11.315 1.849 1.00 . A A . 42 MET CE 1 1 11 7570 1 1 42 MET CG C -9.980 -8.586 2.114 1.00 . A A . 42 MET CG 1 1 11 7571 1 1 42 MET H H -7.335 -9.309 2.998 1.00 . A A . 42 MET H 1 1 11 7572 1 1 42 MET HA H -7.491 -6.369 3.468 1.00 . A A . 42 MET HA 1 1 11 7573 1 1 42 MET HB2 H -9.615 -6.471 2.262 1.00 . A A . 42 MET HB2 1 1 11 7574 1 1 42 MET HB3 H -8.380 -7.332 1.389 1.00 . A A . 42 MET HB3 1 1 11 7575 1 1 42 MET HE1 H -10.984 -11.291 2.812 1.00 . A A . 42 MET HE1 1 1 11 7576 1 1 42 MET HE2 H -11.162 -11.091 1.040 1.00 . A A . 42 MET HE2 1 1 11 7577 1 1 42 MET HE3 H -10.063 -12.341 1.696 1.00 . A A . 42 MET HE3 1 1 11 7578 1 1 42 MET HG2 H -10.659 -8.686 2.980 1.00 . A A . 42 MET HG2 1 1 11 7579 1 1 42 MET HG3 H -10.629 -8.404 1.238 1.00 . A A . 42 MET HG3 1 1 11 7580 1 1 42 MET N N -7.162 -8.474 3.569 1.00 . A A . 42 MET N 1 1 11 7581 1 1 42 MET O O -9.578 -8.241 5.251 1.00 . A A . 42 MET O 1 1 11 7582 1 1 42 MET SD S -9.083 -10.132 1.847 1.00 . A A . 42 MET SD 1 1 11 7583 1 1 43 GLU C C -10.163 -4.699 7.157 1.00 . A A . 43 GLU C 1 1 11 7584 1 1 43 GLU CA C -9.317 -6.000 6.987 1.00 . A A . 43 GLU CA 1 1 11 7585 1 1 43 GLU CB C -8.081 -6.009 7.941 1.00 . A A . 43 GLU CB 1 1 11 7586 1 1 43 GLU CD C -5.872 -5.027 8.794 1.00 . A A . 43 GLU CD 1 1 11 7587 1 1 43 GLU CG C -7.025 -4.882 7.799 1.00 . A A . 43 GLU CG 1 1 11 7588 1 1 43 GLU H H -8.239 -5.406 5.156 1.00 . A A . 43 GLU H 1 1 11 7589 1 1 43 GLU HA H -9.966 -6.860 7.254 1.00 . A A . 43 GLU HA 1 1 11 7590 1 1 43 GLU HB2 H -8.455 -6.010 8.983 1.00 . A A . 43 GLU HB2 1 1 11 7591 1 1 43 GLU HB3 H -7.571 -6.987 7.838 1.00 . A A . 43 GLU HB3 1 1 11 7592 1 1 43 GLU HE2 H -5.474 -4.634 10.658 1.00 . A A . 43 GLU HE2 1 1 11 7593 1 1 43 GLU HG2 H -6.611 -4.875 6.774 1.00 . A A . 43 GLU HG2 1 1 11 7594 1 1 43 GLU HG3 H -7.499 -3.892 7.933 1.00 . A A . 43 GLU HG3 1 1 11 7595 1 1 43 GLU N N -8.824 -6.130 5.587 1.00 . A A . 43 GLU N 1 1 11 7596 1 1 43 GLU O O -10.003 -3.712 6.427 1.00 . A A . 43 GLU O 1 1 11 7597 1 1 43 GLU OE1 O -4.784 -5.525 8.505 1.00 . A A . 43 GLU OE1 1 1 11 7598 1 1 43 GLU OE2 O -6.197 -4.540 10.034 1.00 . A A . 43 GLU OE2 1 1 11 7599 1 1 44 GLY C C -11.318 -2.395 9.223 1.00 . A A . 44 GLY C 1 1 11 7600 1 1 44 GLY CA C -11.961 -3.576 8.458 1.00 . A A . 44 GLY CA 1 1 11 7601 1 1 44 GLY H H -11.089 -5.585 8.705 1.00 . A A . 44 GLY H 1 1 11 7602 1 1 44 GLY HA2 H -12.406 -3.194 7.518 1.00 . A A . 44 GLY HA2 1 1 11 7603 1 1 44 GLY HA3 H -12.818 -3.981 9.029 1.00 . A A . 44 GLY HA3 1 1 11 7604 1 1 44 GLY N N -11.056 -4.712 8.166 1.00 . A A . 44 GLY N 1 1 11 7605 1 1 44 GLY O O -10.122 -2.121 9.082 1.00 . A A . 44 GLY O 1 1 11 7606 1 1 45 LEU C C -11.416 0.686 9.581 1.00 . A A . 45 LEU C 1 1 11 7607 1 1 45 LEU CA C -11.843 -0.361 10.662 1.00 . A A . 45 LEU CA 1 1 11 7608 1 1 45 LEU CB C -10.730 -0.581 11.743 1.00 . A A . 45 LEU CB 1 1 11 7609 1 1 45 LEU CD1 C -11.583 1.013 13.593 1.00 . A A . 45 LEU CD1 1 1 11 7610 1 1 45 LEU CD2 C -9.164 0.307 13.537 1.00 . A A . 45 LEU CD2 1 1 11 7611 1 1 45 LEU CG C -10.406 0.619 12.678 1.00 . A A . 45 LEU CG 1 1 11 7612 1 1 45 LEU H H -13.125 -2.027 9.991 1.00 . A A . 45 LEU H 1 1 11 7613 1 1 45 LEU HA H -12.765 0.002 11.154 1.00 . A A . 45 LEU HA 1 1 11 7614 1 1 45 LEU HB2 H -11.011 -1.445 12.377 1.00 . A A . 45 LEU HB2 1 1 11 7615 1 1 45 LEU HB3 H -9.792 -0.898 11.247 1.00 . A A . 45 LEU HB3 1 1 11 7616 1 1 45 LEU HD11 H -11.904 0.177 14.242 1.00 . A A . 45 LEU HD11 1 1 11 7617 1 1 45 LEU HD12 H -11.317 1.859 14.254 1.00 . A A . 45 LEU HD12 1 1 11 7618 1 1 45 LEU HD13 H -12.465 1.336 13.012 1.00 . A A . 45 LEU HD13 1 1 11 7619 1 1 45 LEU HD21 H -9.309 -0.589 14.169 1.00 . A A . 45 LEU HD21 1 1 11 7620 1 1 45 LEU HD22 H -8.271 0.128 12.911 1.00 . A A . 45 LEU HD22 1 1 11 7621 1 1 45 LEU HD23 H -8.914 1.144 14.214 1.00 . A A . 45 LEU HD23 1 1 11 7622 1 1 45 LEU HG H -10.156 1.498 12.053 1.00 . A A . 45 LEU HG 1 1 11 7623 1 1 45 LEU N N -12.166 -1.663 9.984 1.00 . A A . 45 LEU N 1 1 11 7624 1 1 45 LEU O O -10.240 0.769 9.210 1.00 . A A . 45 LEU O 1 1 11 7625 1 1 46 SER C C -12.896 3.528 7.784 1.00 . A A . 46 SER C 1 1 11 7626 1 1 46 SER CA C -12.246 2.116 7.728 1.00 . A A . 46 SER CA 1 1 11 7627 1 1 46 SER CB C -12.841 1.186 6.624 1.00 . A A . 46 SER CB 1 1 11 7628 1 1 46 SER H H -13.335 1.241 9.433 1.00 . A A . 46 SER H 1 1 11 7629 1 1 46 SER HA H -11.186 2.288 7.490 1.00 . A A . 46 SER HA 1 1 11 7630 1 1 46 SER HB2 H -12.793 1.687 5.641 1.00 . A A . 46 SER HB2 1 1 11 7631 1 1 46 SER HB3 H -12.212 0.282 6.517 1.00 . A A . 46 SER HB3 1 1 11 7632 1 1 46 SER HG H -14.704 1.587 6.908 1.00 . A A . 46 SER HG 1 1 11 7633 1 1 46 SER N N -12.407 1.416 9.031 1.00 . A A . 46 SER N 1 1 11 7634 1 1 46 SER O O -12.154 4.511 7.877 1.00 . A A . 46 SER O 1 1 11 7635 1 1 46 SER OG O -14.186 0.780 6.866 1.00 . A A . 46 SER OG 1 1 11 7636 1 1 47 PHE C C -16.407 4.794 7.923 1.00 . A A . 47 PHE C 1 1 11 7637 1 1 47 PHE CA C -14.914 4.967 7.522 1.00 . A A . 47 PHE CA 1 1 11 7638 1 1 47 PHE CB C -14.798 5.457 6.039 1.00 . A A . 47 PHE CB 1 1 11 7639 1 1 47 PHE CD1 C -16.267 7.539 5.826 1.00 . A A . 47 PHE CD1 1 1 11 7640 1 1 47 PHE CD2 C -13.874 7.797 5.624 1.00 . A A . 47 PHE CD2 1 1 11 7641 1 1 47 PHE CE1 C -16.428 8.912 5.655 1.00 . A A . 47 PHE CE1 1 1 11 7642 1 1 47 PHE CE2 C -14.038 9.168 5.445 1.00 . A A . 47 PHE CE2 1 1 11 7643 1 1 47 PHE CG C -14.987 6.972 5.828 1.00 . A A . 47 PHE CG 1 1 11 7644 1 1 47 PHE CZ C -15.314 9.725 5.465 1.00 . A A . 47 PHE CZ 1 1 11 7645 1 1 47 PHE H H -14.716 2.759 7.557 1.00 . A A . 47 PHE H 1 1 11 7646 1 1 47 PHE HA H -14.427 5.701 8.195 1.00 . A A . 47 PHE HA 1 1 11 7647 1 1 47 PHE HB2 H -13.807 5.177 5.631 1.00 . A A . 47 PHE HB2 1 1 11 7648 1 1 47 PHE HB3 H -15.498 4.899 5.387 1.00 . A A . 47 PHE HB3 1 1 11 7649 1 1 47 PHE HD1 H -17.142 6.921 5.967 1.00 . A A . 47 PHE HD1 1 1 11 7650 1 1 47 PHE HD2 H -12.875 7.383 5.619 1.00 . A A . 47 PHE HD2 1 1 11 7651 1 1 47 PHE HE1 H -17.418 9.344 5.669 1.00 . A A . 47 PHE HE1 1 1 11 7652 1 1 47 PHE HE2 H -13.174 9.801 5.300 1.00 . A A . 47 PHE HE2 1 1 11 7653 1 1 47 PHE HZ H -15.440 10.789 5.332 1.00 . A A . 47 PHE HZ 1 1 11 7654 1 1 47 PHE N N -14.234 3.655 7.682 1.00 . A A . 47 PHE N 1 1 11 7655 1 1 47 PHE O O -17.126 3.971 7.343 1.00 . A A . 47 PHE O 1 1 11 7656 1 1 48 ALA C C -18.854 7.048 8.566 1.00 . A A . 48 ALA C 1 1 11 7657 1 1 48 ALA CA C -18.314 5.750 9.203 1.00 . A A . 48 ALA CA 1 1 11 7658 1 1 48 ALA CB C -18.493 5.776 10.732 1.00 . A A . 48 ALA CB 1 1 11 7659 1 1 48 ALA H H -16.173 6.265 9.264 1.00 . A A . 48 ALA H 1 1 11 7660 1 1 48 ALA HXT H -20.024 7.597 7.110 1.00 . A A . 48 ALA HXT 1 1 11 7661 1 1 48 ALA HA H -18.894 4.887 8.821 1.00 . A A . 48 ALA HA 1 1 11 7662 1 1 48 ALA HB1 H -17.935 6.602 11.213 1.00 . A A . 48 ALA HB1 1 1 11 7663 1 1 48 ALA HB2 H -19.556 5.894 11.013 1.00 . A A . 48 ALA HB2 1 1 11 7664 1 1 48 ALA HB3 H -18.149 4.833 11.196 1.00 . A A . 48 ALA HB3 1 1 11 7665 1 1 48 ALA N N -16.873 5.624 8.874 1.00 . A A . 48 ALA N 1 1 11 7666 1 1 48 ALA O O -18.559 8.182 8.947 1.00 . A A . 48 ALA O 1 1 11 7667 1 1 48 ALA OXT O -19.690 6.790 7.509 1.00 . A A . 48 ALA OXT 1 1 12 7668 1 1 1 GLU C C 7.259 15.080 10.457 1.00 . A A . 1 GLU C 1 1 12 7669 1 1 1 GLU CA C 8.035 16.392 10.757 1.00 . A A . 1 GLU CA 1 1 12 7670 1 1 1 GLU CB C 9.136 16.111 11.815 1.00 . A A . 1 GLU CB 1 1 12 7671 1 1 1 GLU CD C 11.228 16.891 13.059 1.00 . A A . 1 GLU CD 1 1 12 7672 1 1 1 GLU CG C 10.138 17.262 12.050 1.00 . A A . 1 GLU CG 1 1 12 7673 1 1 1 GLU H1 H 6.346 17.609 10.565 1.00 . A A . 1 GLU H1 1 1 12 7674 1 1 1 GLU H2 H 7.548 18.299 11.463 1.00 . A A . 1 GLU H2 1 1 12 7675 1 1 1 GLU HA H 8.503 16.779 9.830 1.00 . A A . 1 GLU HA 1 1 12 7676 1 1 1 GLU HB2 H 8.678 15.808 12.778 1.00 . A A . 1 GLU HB2 1 1 12 7677 1 1 1 GLU HB3 H 9.720 15.230 11.484 1.00 . A A . 1 GLU HB3 1 1 12 7678 1 1 1 GLU HE2 H 12.933 15.952 13.118 1.00 . A A . 1 GLU HE2 1 1 12 7679 1 1 1 GLU HG2 H 10.609 17.558 11.093 1.00 . A A . 1 GLU HG2 1 1 12 7680 1 1 1 GLU HG3 H 9.607 18.162 12.411 1.00 . A A . 1 GLU HG3 1 1 12 7681 1 1 1 GLU N N 7.079 17.410 11.254 1.00 . A A . 1 GLU N 1 1 12 7682 1 1 1 GLU O O 6.471 14.592 11.276 1.00 . A A . 1 GLU O 1 1 12 7683 1 1 1 GLU OE1 O 11.179 17.193 14.251 1.00 . A A . 1 GLU OE1 1 1 12 7684 1 1 1 GLU OE2 O 12.253 16.184 12.481 1.00 . A A . 1 GLU OE2 1 1 12 7685 1 1 2 ASP C C 7.627 11.991 9.558 1.00 . A A . 2 ASP C 1 1 12 7686 1 1 2 ASP CA C 6.930 13.197 8.850 1.00 . A A . 2 ASP CA 1 1 12 7687 1 1 2 ASP CB C 7.045 13.092 7.298 1.00 . A A . 2 ASP CB 1 1 12 7688 1 1 2 ASP CG C 6.054 13.962 6.509 1.00 . A A . 2 ASP CG 1 1 12 7689 1 1 2 ASP H H 8.221 14.988 8.699 1.00 . A A . 2 ASP H 1 1 12 7690 1 1 2 ASP HA H 5.863 13.165 9.128 1.00 . A A . 2 ASP HA 1 1 12 7691 1 1 2 ASP HB2 H 8.078 13.300 6.956 1.00 . A A . 2 ASP HB2 1 1 12 7692 1 1 2 ASP HB3 H 6.866 12.046 6.989 1.00 . A A . 2 ASP HB3 1 1 12 7693 1 1 2 ASP HD2 H 7.411 15.349 6.661 1.00 . A A . 2 ASP HD2 1 1 12 7694 1 1 2 ASP N N 7.540 14.489 9.281 1.00 . A A . 2 ASP N 1 1 12 7695 1 1 2 ASP O O 6.954 11.271 10.300 1.00 . A A . 2 ASP O 1 1 12 7696 1 1 2 ASP OD1 O 4.956 13.560 6.122 1.00 . A A . 2 ASP OD1 1 1 12 7697 1 1 2 ASP OD2 O 6.537 15.225 6.284 1.00 . A A . 2 ASP OD2 1 1 12 7698 1 1 3 ASN C C 9.328 9.188 9.528 1.00 . A A . 3 ASN C 1 1 12 7699 1 1 3 ASN CA C 9.789 10.652 9.895 1.00 . A A . 3 ASN CA 1 1 12 7700 1 1 3 ASN CB C 9.807 10.775 11.453 1.00 . A A . 3 ASN CB 1 1 12 7701 1 1 3 ASN CG C 10.263 12.108 12.086 1.00 . A A . 3 ASN CG 1 1 12 7702 1 1 3 ASN H H 9.292 12.367 8.565 1.00 . A A . 3 ASN H 1 1 12 7703 1 1 3 ASN HA H 10.791 10.758 9.461 1.00 . A A . 3 ASN HA 1 1 12 7704 1 1 3 ASN HB2 H 8.786 10.535 11.801 1.00 . A A . 3 ASN HB2 1 1 12 7705 1 1 3 ASN HB3 H 10.436 9.972 11.885 1.00 . A A . 3 ASN HB3 1 1 12 7706 1 1 3 ASN HD21 H 12.169 11.744 11.576 1.00 . A A . 3 ASN HD21 1 1 12 7707 1 1 3 ASN HD22 H 11.824 13.309 12.470 1.00 . A A . 3 ASN HD22 1 1 12 7708 1 1 3 ASN N N 8.946 11.777 9.326 1.00 . A A . 3 ASN N 1 1 12 7709 1 1 3 ASN ND2 N 11.550 12.419 12.039 1.00 . A A . 3 ASN ND2 1 1 12 7710 1 1 3 ASN O O 9.741 8.209 10.157 1.00 . A A . 3 ASN O 1 1 12 7711 1 1 3 ASN OD1 O 9.454 12.862 12.626 1.00 . A A . 3 ASN OD1 1 1 12 7712 1 1 4 CYS C C 6.881 7.193 9.104 1.00 . A A . 4 CYS C 1 1 12 7713 1 1 4 CYS CA C 7.780 7.863 7.992 1.00 . A A . 4 CYS CA 1 1 12 7714 1 1 4 CYS CB C 8.775 6.845 7.422 1.00 . A A . 4 CYS CB 1 1 12 7715 1 1 4 CYS H H 8.292 10.047 8.218 1.00 . A A . 4 CYS H 1 1 12 7716 1 1 4 CYS HA H 7.144 8.152 7.140 1.00 . A A . 4 CYS HA 1 1 12 7717 1 1 4 CYS HB2 H 8.047 6.114 7.137 1.00 . A A . 4 CYS HB2 1 1 12 7718 1 1 4 CYS HB3 H 9.205 7.114 6.446 1.00 . A A . 4 CYS HB3 1 1 12 7719 1 1 4 CYS N N 8.505 9.078 8.480 1.00 . A A . 4 CYS N 1 1 12 7720 1 1 4 CYS O O 6.964 7.525 10.293 1.00 . A A . 4 CYS O 1 1 12 7721 1 1 4 CYS SG S 9.883 5.875 8.462 1.00 . A A . 4 CYS SG 1 1 12 7722 1 1 5 ILE C C 5.744 4.016 9.619 1.00 . A A . 5 ILE C 1 1 12 7723 1 1 5 ILE CA C 5.177 5.447 9.687 1.00 . A A . 5 ILE CA 1 1 12 7724 1 1 5 ILE CB C 3.619 5.352 9.417 1.00 . A A . 5 ILE CB 1 1 12 7725 1 1 5 ILE CD1 C 3.171 7.854 9.864 1.00 . A A . 5 ILE CD1 1 1 12 7726 1 1 5 ILE CG1 C 3.007 6.676 8.932 1.00 . A A . 5 ILE CG1 1 1 12 7727 1 1 5 ILE CG2 C 2.887 4.898 10.717 1.00 . A A . 5 ILE CG2 1 1 12 7728 1 1 5 ILE H H 6.129 5.988 7.678 1.00 . A A . 5 ILE H 1 1 12 7729 1 1 5 ILE HA H 5.299 5.889 10.690 1.00 . A A . 5 ILE HA 1 1 12 7730 1 1 5 ILE HB H 3.324 4.594 8.694 1.00 . A A . 5 ILE HB 1 1 12 7731 1 1 5 ILE HD11 H 3.113 7.548 10.914 1.00 . A A . 5 ILE HD11 1 1 12 7732 1 1 5 ILE HD12 H 4.155 8.312 9.681 1.00 . A A . 5 ILE HD12 1 1 12 7733 1 1 5 ILE HD13 H 2.372 8.576 9.661 1.00 . A A . 5 ILE HD13 1 1 12 7734 1 1 5 ILE HG12 H 3.382 6.989 7.951 1.00 . A A . 5 ILE HG12 1 1 12 7735 1 1 5 ILE HG13 H 1.960 6.482 8.708 1.00 . A A . 5 ILE HG13 1 1 12 7736 1 1 5 ILE HG21 H 3.107 5.511 11.611 1.00 . A A . 5 ILE HG21 1 1 12 7737 1 1 5 ILE HG22 H 1.789 4.921 10.582 1.00 . A A . 5 ILE HG22 1 1 12 7738 1 1 5 ILE HG23 H 3.128 3.854 10.977 1.00 . A A . 5 ILE HG23 1 1 12 7739 1 1 5 ILE N N 5.990 6.244 8.684 1.00 . A A . 5 ILE N 1 1 12 7740 1 1 5 ILE O O 5.327 3.186 8.805 1.00 . A A . 5 ILE O 1 1 12 7741 1 1 6 ALA C C 6.484 1.221 11.179 1.00 . A A . 6 ALA C 1 1 12 7742 1 1 6 ALA CA C 7.338 2.344 10.465 1.00 . A A . 6 ALA CA 1 1 12 7743 1 1 6 ALA CB C 8.702 2.501 11.163 1.00 . A A . 6 ALA CB 1 1 12 7744 1 1 6 ALA H H 6.839 4.400 11.221 1.00 . A A . 6 ALA H 1 1 12 7745 1 1 6 ALA HA H 7.471 2.060 9.392 1.00 . A A . 6 ALA HA 1 1 12 7746 1 1 6 ALA HB1 H 9.330 3.266 10.669 1.00 . A A . 6 ALA HB1 1 1 12 7747 1 1 6 ALA HB2 H 8.595 2.789 12.226 1.00 . A A . 6 ALA HB2 1 1 12 7748 1 1 6 ALA HB3 H 9.275 1.556 11.135 1.00 . A A . 6 ALA HB3 1 1 12 7749 1 1 6 ALA N N 6.703 3.697 10.493 1.00 . A A . 6 ALA N 1 1 12 7750 1 1 6 ALA O O 7.007 0.173 11.570 1.00 . A A . 6 ALA O 1 1 12 7751 1 1 7 GLU C C 3.061 0.060 11.392 1.00 . A A . 7 GLU C 1 1 12 7752 1 1 7 GLU CA C 4.241 0.673 12.171 1.00 . A A . 7 GLU CA 1 1 12 7753 1 1 7 GLU CB C 3.737 1.635 13.289 1.00 . A A . 7 GLU CB 1 1 12 7754 1 1 7 GLU CD C 4.166 2.938 15.436 1.00 . A A . 7 GLU CD 1 1 12 7755 1 1 7 GLU CG C 4.748 1.962 14.409 1.00 . A A . 7 GLU CG 1 1 12 7756 1 1 7 GLU H H 5.025 2.463 11.094 1.00 . A A . 7 GLU H 1 1 12 7757 1 1 7 GLU HA H 4.732 -0.166 12.619 1.00 . A A . 7 GLU HA 1 1 12 7758 1 1 7 GLU HB2 H 3.388 2.574 12.829 1.00 . A A . 7 GLU HB2 1 1 12 7759 1 1 7 GLU HB3 H 2.838 1.206 13.775 1.00 . A A . 7 GLU HB3 1 1 12 7760 1 1 7 GLU HE2 H 3.138 2.909 17.089 1.00 . A A . 7 GLU HE2 1 1 12 7761 1 1 7 GLU HG2 H 5.072 1.033 14.914 1.00 . A A . 7 GLU HG2 1 1 12 7762 1 1 7 GLU HG3 H 5.667 2.404 13.980 1.00 . A A . 7 GLU HG3 1 1 12 7763 1 1 7 GLU N N 5.173 1.473 11.340 1.00 . A A . 7 GLU N 1 1 12 7764 1 1 7 GLU O O 2.718 0.468 10.285 1.00 . A A . 7 GLU O 1 1 12 7765 1 1 7 GLU OE1 O 4.276 4.161 15.346 1.00 . A A . 7 GLU OE1 1 1 12 7766 1 1 7 GLU OE2 O 3.505 2.293 16.450 1.00 . A A . 7 GLU OE2 1 1 12 7767 1 1 8 ASP C C 0.213 -0.983 12.776 1.00 . A A . 8 ASP C 1 1 12 7768 1 1 8 ASP CA C 1.153 -1.551 11.690 1.00 . A A . 8 ASP CA 1 1 12 7769 1 1 8 ASP CB C 1.075 -3.109 11.694 1.00 . A A . 8 ASP CB 1 1 12 7770 1 1 8 ASP CG C 2.074 -3.845 12.608 1.00 . A A . 8 ASP CG 1 1 12 7771 1 1 8 ASP H H 2.892 -1.153 12.969 1.00 . A A . 8 ASP H 1 1 12 7772 1 1 8 ASP HA H 0.866 -1.230 10.664 1.00 . A A . 8 ASP HA 1 1 12 7773 1 1 8 ASP HB2 H 0.032 -3.423 11.897 1.00 . A A . 8 ASP HB2 1 1 12 7774 1 1 8 ASP HB3 H 1.266 -3.396 10.653 1.00 . A A . 8 ASP HB3 1 1 12 7775 1 1 8 ASP HD2 H 3.253 -3.819 11.058 1.00 . A A . 8 ASP HD2 1 1 12 7776 1 1 8 ASP N N 2.455 -0.940 12.066 1.00 . A A . 8 ASP N 1 1 12 7777 1 1 8 ASP O O 0.373 -1.148 13.992 1.00 . A A . 8 ASP O 1 1 12 7778 1 1 8 ASP OD1 O 1.831 -4.137 13.778 1.00 . A A . 8 ASP OD1 1 1 12 7779 1 1 8 ASP OD2 O 3.254 -4.128 11.966 1.00 . A A . 8 ASP OD2 1 1 12 7780 1 1 9 TYR C C -0.959 1.805 13.694 1.00 . A A . 9 TYR C 1 1 12 7781 1 1 9 TYR CA C -1.723 0.631 12.951 1.00 . A A . 9 TYR CA 1 1 12 7782 1 1 9 TYR CB C -2.608 -0.248 13.909 1.00 . A A . 9 TYR CB 1 1 12 7783 1 1 9 TYR CD1 C -4.309 -1.212 12.246 1.00 . A A . 9 TYR CD1 1 1 12 7784 1 1 9 TYR CD2 C -2.847 -2.744 13.407 1.00 . A A . 9 TYR CD2 1 1 12 7785 1 1 9 TYR CE1 C -4.794 -2.266 11.474 1.00 . A A . 9 TYR CE1 1 1 12 7786 1 1 9 TYR CE2 C -3.335 -3.795 12.636 1.00 . A A . 9 TYR CE2 1 1 12 7787 1 1 9 TYR CG C -3.326 -1.440 13.217 1.00 . A A . 9 TYR CG 1 1 12 7788 1 1 9 TYR CZ C -4.306 -3.555 11.668 1.00 . A A . 9 TYR CZ 1 1 12 7789 1 1 9 TYR H H -0.760 -0.397 11.207 1.00 . A A . 9 TYR H 1 1 12 7790 1 1 9 TYR HA H -2.381 1.128 12.218 1.00 . A A . 9 TYR HA 1 1 12 7791 1 1 9 TYR HB2 H -2.012 -0.601 14.772 1.00 . A A . 9 TYR HB2 1 1 12 7792 1 1 9 TYR HB3 H -3.379 0.400 14.368 1.00 . A A . 9 TYR HB3 1 1 12 7793 1 1 9 TYR HD1 H -4.648 -0.208 12.033 1.00 . A A . 9 TYR HD1 1 1 12 7794 1 1 9 TYR HD2 H -2.042 -2.938 14.100 1.00 . A A . 9 TYR HD2 1 1 12 7795 1 1 9 TYR HE1 H -5.527 -2.077 10.703 1.00 . A A . 9 TYR HE1 1 1 12 7796 1 1 9 TYR HE2 H -2.934 -4.789 12.767 1.00 . A A . 9 TYR HE2 1 1 12 7797 1 1 9 TYR HH H -5.407 -4.243 10.263 1.00 . A A . 9 TYR HH 1 1 12 7798 1 1 9 TYR N N -0.763 -0.265 12.227 1.00 . A A . 9 TYR N 1 1 12 7799 1 1 9 TYR O O -1.332 2.192 14.805 1.00 . A A . 9 TYR O 1 1 12 7800 1 1 9 TYR OH O -4.757 -4.584 10.882 1.00 . A A . 9 TYR OH 1 1 12 7801 1 1 10 GLY C C 0.055 4.921 12.906 1.00 . A A . 10 GLY C 1 1 12 7802 1 1 10 GLY CA C 0.705 3.681 13.488 1.00 . A A . 10 GLY CA 1 1 12 7803 1 1 10 GLY H H 0.321 1.960 12.148 1.00 . A A . 10 GLY H 1 1 12 7804 1 1 10 GLY HA2 H 0.811 3.715 14.574 1.00 . A A . 10 GLY HA2 1 1 12 7805 1 1 10 GLY HA3 H 1.745 3.800 13.194 1.00 . A A . 10 GLY HA3 1 1 12 7806 1 1 10 GLY N N 0.055 2.425 13.027 1.00 . A A . 10 GLY N 1 1 12 7807 1 1 10 GLY O O -0.449 4.931 11.786 1.00 . A A . 10 GLY O 1 1 12 7808 1 1 11 LYS C C -0.063 7.971 12.214 1.00 . A A . 11 LYS C 1 1 12 7809 1 1 11 LYS CA C -0.675 7.223 13.433 1.00 . A A . 11 LYS CA 1 1 12 7810 1 1 11 LYS CB C -0.684 8.185 14.646 1.00 . A A . 11 LYS CB 1 1 12 7811 1 1 11 LYS CD C 0.451 9.390 16.665 1.00 . A A . 11 LYS CD 1 1 12 7812 1 1 11 LYS CE C 0.212 10.877 16.324 1.00 . A A . 11 LYS CE 1 1 12 7813 1 1 11 LYS CG C 0.607 8.413 15.477 1.00 . A A . 11 LYS CG 1 1 12 7814 1 1 11 LYS H H 0.718 5.747 14.495 1.00 . A A . 11 LYS H 1 1 12 7815 1 1 11 LYS HA H -1.729 6.936 13.218 1.00 . A A . 11 LYS HA 1 1 12 7816 1 1 11 LYS HB2 H -1.071 9.169 14.316 1.00 . A A . 11 LYS HB2 1 1 12 7817 1 1 11 LYS HB3 H -1.501 7.813 15.278 1.00 . A A . 11 LYS HB3 1 1 12 7818 1 1 11 LYS HD2 H -0.378 9.038 17.307 1.00 . A A . 11 LYS HD2 1 1 12 7819 1 1 11 LYS HD3 H 1.349 9.311 17.308 1.00 . A A . 11 LYS HD3 1 1 12 7820 1 1 11 LYS HE2 H -0.687 10.995 15.692 1.00 . A A . 11 LYS HE2 1 1 12 7821 1 1 11 LYS HE3 H -0.009 11.431 17.254 1.00 . A A . 11 LYS HE3 1 1 12 7822 1 1 11 LYS HG2 H 0.950 7.442 15.880 1.00 . A A . 11 LYS HG2 1 1 12 7823 1 1 11 LYS HG3 H 1.425 8.756 14.817 1.00 . A A . 11 LYS HG3 1 1 12 7824 1 1 11 LYS HZ1 H 2.184 11.491 16.278 1.00 . A A . 11 LYS HZ1 1 1 12 7825 1 1 11 LYS HZ2 H 1.170 12.514 15.505 1.00 . A A . 11 LYS HZ2 1 1 12 7826 1 1 11 LYS N N 0.095 5.973 13.710 1.00 . A A . 11 LYS N 1 1 12 7827 1 1 11 LYS NZ N 1.364 11.519 15.662 1.00 . A A . 11 LYS NZ 1 1 12 7828 1 1 11 LYS O O 1.114 8.333 12.159 1.00 . A A . 11 LYS O 1 1 12 7829 1 1 12 CYS C C -1.784 9.530 9.355 1.00 . A A . 12 CYS C 1 1 12 7830 1 1 12 CYS CA C -0.644 8.615 9.876 1.00 . A A . 12 CYS CA 1 1 12 7831 1 1 12 CYS CB C -0.428 7.369 8.989 1.00 . A A . 12 CYS CB 1 1 12 7832 1 1 12 CYS H H -1.900 7.891 11.597 1.00 . A A . 12 CYS H 1 1 12 7833 1 1 12 CYS HA H 0.291 9.205 9.843 1.00 . A A . 12 CYS HA 1 1 12 7834 1 1 12 CYS HB2 H 0.227 7.636 8.142 1.00 . A A . 12 CYS HB2 1 1 12 7835 1 1 12 CYS HB3 H 0.119 6.593 9.538 1.00 . A A . 12 CYS HB3 1 1 12 7836 1 1 12 CYS N N -0.965 8.143 11.248 1.00 . A A . 12 CYS N 1 1 12 7837 1 1 12 CYS O O -2.667 9.985 10.094 1.00 . A A . 12 CYS O 1 1 12 7838 1 1 12 CYS SG S -1.910 6.570 8.383 1.00 . A A . 12 CYS SG 1 1 12 7839 1 1 13 THR C C -2.815 10.368 5.878 1.00 . A A . 13 THR C 1 1 12 7840 1 1 13 THR CA C -2.671 10.759 7.383 1.00 . A A . 13 THR CA 1 1 12 7841 1 1 13 THR CB C -2.194 12.266 7.478 1.00 . A A . 13 THR CB 1 1 12 7842 1 1 13 THR CG2 C -2.922 13.069 8.550 1.00 . A A . 13 THR CG2 1 1 12 7843 1 1 13 THR H H -0.842 9.454 7.622 1.00 . A A . 13 THR H 1 1 12 7844 1 1 13 THR HA H -3.669 10.640 7.873 1.00 . A A . 13 THR HA 1 1 12 7845 1 1 13 THR HB H -2.414 12.751 6.507 1.00 . A A . 13 THR HB 1 1 12 7846 1 1 13 THR HG1 H -0.325 11.926 7.137 1.00 . A A . 13 THR HG1 1 1 12 7847 1 1 13 THR HG21 H -4.009 13.087 8.364 1.00 . A A . 13 THR HG21 1 1 12 7848 1 1 13 THR HG22 H -2.725 12.674 9.561 1.00 . A A . 13 THR HG22 1 1 12 7849 1 1 13 THR HG23 H -2.568 14.119 8.526 1.00 . A A . 13 THR HG23 1 1 12 7850 1 1 13 THR N N -1.703 9.839 8.051 1.00 . A A . 13 THR N 1 1 12 7851 1 1 13 THR O O -1.868 9.957 5.197 1.00 . A A . 13 THR O 1 1 12 7852 1 1 13 THR OG1 O -0.811 12.387 7.824 1.00 . A A . 13 THR OG1 1 1 12 7853 1 1 14 TRP C C -4.164 11.990 3.427 1.00 . A A . 14 TRP C 1 1 12 7854 1 1 14 TRP CA C -4.380 10.533 3.920 1.00 . A A . 14 TRP CA 1 1 12 7855 1 1 14 TRP CB C -5.832 10.041 3.673 1.00 . A A . 14 TRP CB 1 1 12 7856 1 1 14 TRP CD1 C -5.178 7.477 3.997 1.00 . A A . 14 TRP CD1 1 1 12 7857 1 1 14 TRP CD2 C -7.355 7.921 3.870 1.00 . A A . 14 TRP CD2 1 1 12 7858 1 1 14 TRP CE2 C -7.158 6.523 4.018 1.00 . A A . 14 TRP CE2 1 1 12 7859 1 1 14 TRP CE3 C -8.668 8.453 3.784 1.00 . A A . 14 TRP CE3 1 1 12 7860 1 1 14 TRP CG C -6.112 8.535 3.858 1.00 . A A . 14 TRP CG 1 1 12 7861 1 1 14 TRP CH2 C -9.554 6.195 4.008 1.00 . A A . 14 TRP CH2 1 1 12 7862 1 1 14 TRP CZ2 C -8.271 5.651 4.089 1.00 . A A . 14 TRP CZ2 1 1 12 7863 1 1 14 TRP CZ3 C -9.749 7.573 3.856 1.00 . A A . 14 TRP CZ3 1 1 12 7864 1 1 14 TRP H H -4.643 11.079 6.056 1.00 . A A . 14 TRP H 1 1 12 7865 1 1 14 TRP HA H -3.695 9.835 3.396 1.00 . A A . 14 TRP HA 1 1 12 7866 1 1 14 TRP HB2 H -6.539 10.623 4.297 1.00 . A A . 14 TRP HB2 1 1 12 7867 1 1 14 TRP HB3 H -6.115 10.288 2.632 1.00 . A A . 14 TRP HB3 1 1 12 7868 1 1 14 TRP HD1 H -4.105 7.599 4.020 1.00 . A A . 14 TRP HD1 1 1 12 7869 1 1 14 TRP HE1 H -5.371 5.307 4.210 1.00 . A A . 14 TRP HE1 1 1 12 7870 1 1 14 TRP HE3 H -8.834 9.515 3.674 1.00 . A A . 14 TRP HE3 1 1 12 7871 1 1 14 TRP HH2 H -10.411 5.540 4.065 1.00 . A A . 14 TRP HH2 1 1 12 7872 1 1 14 TRP HZ2 H -8.136 4.586 4.210 1.00 . A A . 14 TRP HZ2 1 1 12 7873 1 1 14 TRP HZ3 H -10.755 7.963 3.798 1.00 . A A . 14 TRP HZ3 1 1 12 7874 1 1 14 TRP N N -4.050 10.587 5.378 1.00 . A A . 14 TRP N 1 1 12 7875 1 1 14 TRP NE1 N -5.809 6.228 4.097 1.00 . A A . 14 TRP NE1 1 1 12 7876 1 1 14 TRP O O -4.918 12.913 3.760 1.00 . A A . 14 TRP O 1 1 12 7877 1 1 15 GLY C C -1.629 13.825 3.619 1.00 . A A . 15 GLY C 1 1 12 7878 1 1 15 GLY CA C -2.499 13.514 2.371 1.00 . A A . 15 GLY CA 1 1 12 7879 1 1 15 GLY H H -2.517 11.316 2.513 1.00 . A A . 15 GLY H 1 1 12 7880 1 1 15 GLY HA2 H -1.896 13.479 1.444 1.00 . A A . 15 GLY HA2 1 1 12 7881 1 1 15 GLY HA3 H -3.285 14.276 2.222 1.00 . A A . 15 GLY HA3 1 1 12 7882 1 1 15 GLY N N -3.058 12.171 2.686 1.00 . A A . 15 GLY N 1 1 12 7883 1 1 15 GLY O O -2.023 14.616 4.481 1.00 . A A . 15 GLY O 1 1 12 7884 1 1 16 GLY C C 1.573 12.209 4.811 1.00 . A A . 16 GLY C 1 1 12 7885 1 1 16 GLY CA C 0.298 13.047 4.949 1.00 . A A . 16 GLY CA 1 1 12 7886 1 1 16 GLY H H -0.335 12.477 2.927 1.00 . A A . 16 GLY H 1 1 12 7887 1 1 16 GLY HA2 H 0.385 13.948 5.583 1.00 . A A . 16 GLY HA2 1 1 12 7888 1 1 16 GLY HA3 H -0.379 12.434 5.558 1.00 . A A . 16 GLY HA3 1 1 12 7889 1 1 16 GLY N N -0.491 13.117 3.713 1.00 . A A . 16 GLY N 1 1 12 7890 1 1 16 GLY O O 2.222 12.141 3.761 1.00 . A A . 16 GLY O 1 1 12 7891 1 1 17 THR C C 2.168 9.120 5.646 1.00 . A A . 17 THR C 1 1 12 7892 1 1 17 THR CA C 2.902 10.463 5.972 1.00 . A A . 17 THR CA 1 1 12 7893 1 1 17 THR CB C 3.601 10.306 7.369 1.00 . A A . 17 THR CB 1 1 12 7894 1 1 17 THR CG2 C 4.999 9.680 7.234 1.00 . A A . 17 THR CG2 1 1 12 7895 1 1 17 THR H H 1.278 11.836 6.714 1.00 . A A . 17 THR H 1 1 12 7896 1 1 17 THR HA H 3.682 10.701 5.217 1.00 . A A . 17 THR HA 1 1 12 7897 1 1 17 THR HB H 3.009 9.612 8.002 1.00 . A A . 17 THR HB 1 1 12 7898 1 1 17 THR HG1 H 2.892 11.934 8.113 1.00 . A A . 17 THR HG1 1 1 12 7899 1 1 17 THR HG21 H 5.650 10.185 6.498 1.00 . A A . 17 THR HG21 1 1 12 7900 1 1 17 THR HG22 H 5.537 9.673 8.200 1.00 . A A . 17 THR HG22 1 1 12 7901 1 1 17 THR HG23 H 4.937 8.624 6.924 1.00 . A A . 17 THR HG23 1 1 12 7902 1 1 17 THR N N 1.868 11.533 5.929 1.00 . A A . 17 THR N 1 1 12 7903 1 1 17 THR O O 1.075 8.818 6.154 1.00 . A A . 17 THR O 1 1 12 7904 1 1 17 THR OG1 O 3.773 11.570 8.003 1.00 . A A . 17 THR OG1 1 1 12 7905 1 1 18 LYS C C 3.579 6.065 5.236 1.00 . A A . 18 LYS C 1 1 12 7906 1 1 18 LYS CA C 2.510 6.924 4.511 1.00 . A A . 18 LYS CA 1 1 12 7907 1 1 18 LYS CB C 2.473 6.614 2.981 1.00 . A A . 18 LYS CB 1 1 12 7908 1 1 18 LYS CD C 2.729 8.744 1.488 1.00 . A A . 18 LYS CD 1 1 12 7909 1 1 18 LYS CE C 1.983 9.744 0.585 1.00 . A A . 18 LYS CE 1 1 12 7910 1 1 18 LYS CG C 1.809 7.616 2.003 1.00 . A A . 18 LYS CG 1 1 12 7911 1 1 18 LYS H H 3.794 8.708 4.632 1.00 . A A . 18 LYS H 1 1 12 7912 1 1 18 LYS HA H 1.518 6.636 4.905 1.00 . A A . 18 LYS HA 1 1 12 7913 1 1 18 LYS HB2 H 3.464 6.273 2.640 1.00 . A A . 18 LYS HB2 1 1 12 7914 1 1 18 LYS HB3 H 1.884 5.681 2.886 1.00 . A A . 18 LYS HB3 1 1 12 7915 1 1 18 LYS HD2 H 3.178 9.291 2.337 1.00 . A A . 18 LYS HD2 1 1 12 7916 1 1 18 LYS HD3 H 3.578 8.297 0.937 1.00 . A A . 18 LYS HD3 1 1 12 7917 1 1 18 LYS HE2 H 1.550 9.227 -0.291 1.00 . A A . 18 LYS HE2 1 1 12 7918 1 1 18 LYS HE3 H 1.134 10.197 1.131 1.00 . A A . 18 LYS HE3 1 1 12 7919 1 1 18 LYS HG2 H 1.434 7.051 1.128 1.00 . A A . 18 LYS HG2 1 1 12 7920 1 1 18 LYS HG3 H 0.905 8.042 2.478 1.00 . A A . 18 LYS HG3 1 1 12 7921 1 1 18 LYS HZ1 H 3.670 10.418 -0.394 1.00 . A A . 18 LYS HZ1 1 1 12 7922 1 1 18 LYS HZ2 H 3.284 11.311 0.920 1.00 . A A . 18 LYS HZ2 1 1 12 7923 1 1 18 LYS N N 2.852 8.343 4.799 1.00 . A A . 18 LYS N 1 1 12 7924 1 1 18 LYS NZ N 2.876 10.819 0.118 1.00 . A A . 18 LYS NZ 1 1 12 7925 1 1 18 LYS O O 4.574 6.518 5.830 1.00 . A A . 18 LYS O 1 1 12 7926 1 1 19 CYS C C 5.520 3.595 5.340 1.00 . A A . 19 CYS C 1 1 12 7927 1 1 19 CYS CA C 4.124 3.815 6.026 1.00 . A A . 19 CYS CA 1 1 12 7928 1 1 19 CYS CB C 3.278 2.547 6.231 1.00 . A A . 19 CYS CB 1 1 12 7929 1 1 19 CYS H H 2.576 4.543 4.520 1.00 . A A . 19 CYS H 1 1 12 7930 1 1 19 CYS HA H 4.222 4.326 7.023 1.00 . A A . 19 CYS HA 1 1 12 7931 1 1 19 CYS HB2 H 2.779 2.252 5.306 1.00 . A A . 19 CYS HB2 1 1 12 7932 1 1 19 CYS HB3 H 3.917 1.702 6.602 1.00 . A A . 19 CYS HB3 1 1 12 7933 1 1 19 CYS N N 3.338 4.755 5.186 1.00 . A A . 19 CYS N 1 1 12 7934 1 1 19 CYS O O 5.704 3.578 4.117 1.00 . A A . 19 CYS O 1 1 12 7935 1 1 19 CYS SG S 1.983 2.956 7.396 1.00 . A A . 19 CYS SG 1 1 12 7936 1 1 20 CYS C C 8.583 2.869 4.883 1.00 . A A . 20 CYS C 1 1 12 7937 1 1 20 CYS CA C 7.946 3.703 6.032 1.00 . A A . 20 CYS CA 1 1 12 7938 1 1 20 CYS CB C 8.658 3.323 7.349 1.00 . A A . 20 CYS CB 1 1 12 7939 1 1 20 CYS H H 6.126 3.575 7.221 1.00 . A A . 20 CYS H 1 1 12 7940 1 1 20 CYS HA H 8.024 4.770 5.896 1.00 . A A . 20 CYS HA 1 1 12 7941 1 1 20 CYS HB2 H 8.088 3.685 8.203 1.00 . A A . 20 CYS HB2 1 1 12 7942 1 1 20 CYS HB3 H 8.794 2.235 7.493 1.00 . A A . 20 CYS HB3 1 1 12 7943 1 1 20 CYS N N 6.490 3.554 6.262 1.00 . A A . 20 CYS N 1 1 12 7944 1 1 20 CYS O O 9.235 3.475 4.028 1.00 . A A . 20 CYS O 1 1 12 7945 1 1 20 CYS SG S 10.246 4.172 7.435 1.00 . A A . 20 CYS SG 1 1 12 7946 1 1 21 ARG C C 8.405 0.327 2.594 1.00 . A A . 21 ARG C 1 1 12 7947 1 1 21 ARG CA C 9.185 0.644 3.909 1.00 . A A . 21 ARG CA 1 1 12 7948 1 1 21 ARG CB C 9.537 -0.651 4.706 1.00 . A A . 21 ARG CB 1 1 12 7949 1 1 21 ARG CD C 12.108 -0.212 5.126 1.00 . A A . 21 ARG CD 1 1 12 7950 1 1 21 ARG CG C 10.713 -0.530 5.710 1.00 . A A . 21 ARG CG 1 1 12 7951 1 1 21 ARG CZ C 12.702 -1.376 2.951 1.00 . A A . 21 ARG CZ 1 1 12 7952 1 1 21 ARG H H 7.771 1.231 5.564 1.00 . A A . 21 ARG H 1 1 12 7953 1 1 21 ARG HA H 10.089 1.161 3.559 1.00 . A A . 21 ARG HA 1 1 12 7954 1 1 21 ARG HB2 H 8.644 -1.039 5.234 1.00 . A A . 21 ARG HB2 1 1 12 7955 1 1 21 ARG HB3 H 9.801 -1.468 4.008 1.00 . A A . 21 ARG HB3 1 1 12 7956 1 1 21 ARG HD2 H 12.104 0.764 4.606 1.00 . A A . 21 ARG HD2 1 1 12 7957 1 1 21 ARG HD3 H 12.820 -0.084 5.961 1.00 . A A . 21 ARG HD3 1 1 12 7958 1 1 21 ARG HG2 H 10.464 0.242 6.461 1.00 . A A . 21 ARG HG2 1 1 12 7959 1 1 21 ARG HG3 H 10.782 -1.466 6.291 1.00 . A A . 21 ARG HG3 1 1 12 7960 1 1 21 ARG HH11 H 11.910 0.433 2.577 1.00 . A A . 21 ARG HH11 1 1 12 7961 1 1 21 ARG HH12 H 12.410 -0.577 1.130 1.00 . A A . 21 ARG HH12 1 1 12 7962 1 1 21 ARG HH21 H 13.510 -3.203 3.070 1.00 . A A . 21 ARG HH21 1 1 12 7963 1 1 21 ARG HH22 H 13.257 -2.503 1.393 1.00 . A A . 21 ARG HH22 1 1 12 7964 1 1 21 ARG N N 8.450 1.533 4.874 1.00 . A A . 21 ARG N 1 1 12 7965 1 1 21 ARG NE N 12.622 -1.297 4.223 1.00 . A A . 21 ARG NE 1 1 12 7966 1 1 21 ARG NH1 N 12.299 -0.407 2.135 1.00 . A A . 21 ARG NH1 1 1 12 7967 1 1 21 ARG NH2 N 13.208 -2.472 2.417 1.00 . A A . 21 ARG NH2 1 1 12 7968 1 1 21 ARG O O 8.506 -0.752 2.001 1.00 . A A . 21 ARG O 1 1 12 7969 1 1 22 GLY C C 5.476 0.408 1.334 1.00 . A A . 22 GLY C 1 1 12 7970 1 1 22 GLY CA C 6.724 1.229 0.995 1.00 . A A . 22 GLY CA 1 1 12 7971 1 1 22 GLY H H 7.645 2.028 2.908 1.00 . A A . 22 GLY H 1 1 12 7972 1 1 22 GLY HA2 H 6.445 2.247 0.662 1.00 . A A . 22 GLY HA2 1 1 12 7973 1 1 22 GLY HA3 H 7.224 0.779 0.133 1.00 . A A . 22 GLY HA3 1 1 12 7974 1 1 22 GLY N N 7.656 1.332 2.144 1.00 . A A . 22 GLY N 1 1 12 7975 1 1 22 GLY O O 5.287 -0.717 0.864 1.00 . A A . 22 GLY O 1 1 12 7976 1 1 23 ARG C C 2.263 1.296 2.779 1.00 . A A . 23 ARG C 1 1 12 7977 1 1 23 ARG CA C 3.534 0.374 2.864 1.00 . A A . 23 ARG CA 1 1 12 7978 1 1 23 ARG CB C 3.917 0.140 4.347 1.00 . A A . 23 ARG CB 1 1 12 7979 1 1 23 ARG CD C 5.268 -0.985 6.273 1.00 . A A . 23 ARG CD 1 1 12 7980 1 1 23 ARG CG C 4.985 -0.868 4.764 1.00 . A A . 23 ARG CG 1 1 12 7981 1 1 23 ARG CZ C 3.992 -1.902 8.239 1.00 . A A . 23 ARG CZ 1 1 12 7982 1 1 23 ARG H H 5.110 1.878 2.568 1.00 . A A . 23 ARG H 1 1 12 7983 1 1 23 ARG HA H 3.323 -0.608 2.401 1.00 . A A . 23 ARG HA 1 1 12 7984 1 1 23 ARG HB2 H 4.377 1.077 4.672 1.00 . A A . 23 ARG HB2 1 1 12 7985 1 1 23 ARG HB3 H 3.006 -0.036 4.951 1.00 . A A . 23 ARG HB3 1 1 12 7986 1 1 23 ARG HD2 H 6.171 -1.608 6.420 1.00 . A A . 23 ARG HD2 1 1 12 7987 1 1 23 ARG HD3 H 5.510 0.005 6.703 1.00 . A A . 23 ARG HD3 1 1 12 7988 1 1 23 ARG HG2 H 4.704 -1.846 4.372 1.00 . A A . 23 ARG HG2 1 1 12 7989 1 1 23 ARG HG3 H 5.926 -0.529 4.304 1.00 . A A . 23 ARG HG3 1 1 12 7990 1 1 23 ARG HH11 H 5.814 -1.277 8.807 1.00 . A A . 23 ARG HH11 1 1 12 7991 1 1 23 ARG HH12 H 4.726 -1.981 10.106 1.00 . A A . 23 ARG HH12 1 1 12 7992 1 1 23 ARG HH21 H 2.144 -2.585 7.909 1.00 . A A . 23 ARG HH21 1 1 12 7993 1 1 23 ARG HH22 H 2.782 -2.674 9.627 1.00 . A A . 23 ARG HH22 1 1 12 7994 1 1 23 ARG N N 4.671 1.030 2.190 1.00 . A A . 23 ARG N 1 1 12 7995 1 1 23 ARG NE N 4.121 -1.600 7.010 1.00 . A A . 23 ARG NE 1 1 12 7996 1 1 23 ARG NH1 N 4.941 -1.699 9.144 1.00 . A A . 23 ARG NH1 1 1 12 7997 1 1 23 ARG NH2 N 2.859 -2.441 8.631 1.00 . A A . 23 ARG NH2 1 1 12 7998 1 1 23 ARG O O 2.384 2.518 2.987 1.00 . A A . 23 ARG O 1 1 12 7999 1 1 24 PRO C C -0.707 1.924 4.016 1.00 . A A . 24 PRO C 1 1 12 8000 1 1 24 PRO CA C -0.221 1.566 2.579 1.00 . A A . 24 PRO CA 1 1 12 8001 1 1 24 PRO CB C -1.227 0.674 1.830 1.00 . A A . 24 PRO CB 1 1 12 8002 1 1 24 PRO CD C 0.772 -0.648 2.204 1.00 . A A . 24 PRO CD 1 1 12 8003 1 1 24 PRO CG C -0.748 -0.760 2.070 1.00 . A A . 24 PRO CG 1 1 12 8004 1 1 24 PRO HA H -0.074 2.514 2.021 1.00 . A A . 24 PRO HA 1 1 12 8005 1 1 24 PRO HB2 H -2.278 0.822 2.144 1.00 . A A . 24 PRO HB2 1 1 12 8006 1 1 24 PRO HB3 H -1.193 0.919 0.753 1.00 . A A . 24 PRO HB3 1 1 12 8007 1 1 24 PRO HD2 H 1.151 -1.335 2.984 1.00 . A A . 24 PRO HD2 1 1 12 8008 1 1 24 PRO HD3 H 1.270 -0.903 1.249 1.00 . A A . 24 PRO HD3 1 1 12 8009 1 1 24 PRO HG2 H -1.180 -1.151 3.011 1.00 . A A . 24 PRO HG2 1 1 12 8010 1 1 24 PRO HG3 H -1.053 -1.451 1.263 1.00 . A A . 24 PRO HG3 1 1 12 8011 1 1 24 PRO N N 1.023 0.763 2.559 1.00 . A A . 24 PRO N 1 1 12 8012 1 1 24 PRO O O -0.471 1.198 4.993 1.00 . A A . 24 PRO O 1 1 12 8013 1 1 25 CYS C C -3.683 3.345 5.076 1.00 . A A . 25 CYS C 1 1 12 8014 1 1 25 CYS CA C -2.144 3.472 5.318 1.00 . A A . 25 CYS CA 1 1 12 8015 1 1 25 CYS CB C -1.734 4.928 5.695 1.00 . A A . 25 CYS CB 1 1 12 8016 1 1 25 CYS H H -1.612 3.479 3.171 1.00 . A A . 25 CYS H 1 1 12 8017 1 1 25 CYS HA H -1.857 2.818 6.162 1.00 . A A . 25 CYS HA 1 1 12 8018 1 1 25 CYS HB2 H -0.875 5.288 5.098 1.00 . A A . 25 CYS HB2 1 1 12 8019 1 1 25 CYS HB3 H -2.574 5.619 5.545 1.00 . A A . 25 CYS HB3 1 1 12 8020 1 1 25 CYS N N -1.436 3.047 4.086 1.00 . A A . 25 CYS N 1 1 12 8021 1 1 25 CYS O O -4.195 3.481 3.958 1.00 . A A . 25 CYS O 1 1 12 8022 1 1 25 CYS SG S -1.274 4.940 7.424 1.00 . A A . 25 CYS SG 1 1 12 8023 1 1 26 ARG C C -6.273 4.364 7.128 1.00 . A A . 26 ARG C 1 1 12 8024 1 1 26 ARG CA C -5.896 3.139 6.227 1.00 . A A . 26 ARG CA 1 1 12 8025 1 1 26 ARG CB C -6.417 1.762 6.766 1.00 . A A . 26 ARG CB 1 1 12 8026 1 1 26 ARG CD C -7.047 0.364 8.862 1.00 . A A . 26 ARG CD 1 1 12 8027 1 1 26 ARG CG C -6.094 1.407 8.249 1.00 . A A . 26 ARG CG 1 1 12 8028 1 1 26 ARG CZ C -7.904 -0.151 11.163 1.00 . A A . 26 ARG CZ 1 1 12 8029 1 1 26 ARG H H -3.904 3.157 7.070 1.00 . A A . 26 ARG H 1 1 12 8030 1 1 26 ARG HA H -6.328 3.304 5.221 1.00 . A A . 26 ARG HA 1 1 12 8031 1 1 26 ARG HB2 H -7.515 1.765 6.631 1.00 . A A . 26 ARG HB2 1 1 12 8032 1 1 26 ARG HB3 H -6.072 0.940 6.110 1.00 . A A . 26 ARG HB3 1 1 12 8033 1 1 26 ARG HD2 H -8.082 0.559 8.521 1.00 . A A . 26 ARG HD2 1 1 12 8034 1 1 26 ARG HD3 H -6.786 -0.651 8.507 1.00 . A A . 26 ARG HD3 1 1 12 8035 1 1 26 ARG HG2 H -5.045 1.075 8.340 1.00 . A A . 26 ARG HG2 1 1 12 8036 1 1 26 ARG HG3 H -6.135 2.324 8.864 1.00 . A A . 26 ARG HG3 1 1 12 8037 1 1 26 ARG HH11 H -9.034 -0.989 9.725 1.00 . A A . 26 ARG HH11 1 1 12 8038 1 1 26 ARG HH12 H -9.558 -1.257 11.463 1.00 . A A . 26 ARG HH12 1 1 12 8039 1 1 26 ARG HH21 H -6.952 0.576 12.767 1.00 . A A . 26 ARG HH21 1 1 12 8040 1 1 26 ARG HH22 H -8.457 -0.430 13.067 1.00 . A A . 26 ARG HH22 1 1 12 8041 1 1 26 ARG N N -4.411 3.082 6.174 1.00 . A A . 26 ARG N 1 1 12 8042 1 1 26 ARG NE N -7.001 0.421 10.344 1.00 . A A . 26 ARG NE 1 1 12 8043 1 1 26 ARG NH1 N -8.939 -0.874 10.740 1.00 . A A . 26 ARG NH1 1 1 12 8044 1 1 26 ARG NH2 N -7.756 0.015 12.464 1.00 . A A . 26 ARG NH2 1 1 12 8045 1 1 26 ARG O O -5.466 5.290 7.280 1.00 . A A . 26 ARG O 1 1 12 8046 1 1 27 CYS C C -8.439 4.617 10.024 1.00 . A A . 27 CYS C 1 1 12 8047 1 1 27 CYS CA C -7.757 5.368 8.827 1.00 . A A . 27 CYS CA 1 1 12 8048 1 1 27 CYS CB C -8.656 6.521 8.332 1.00 . A A . 27 CYS CB 1 1 12 8049 1 1 27 CYS H H -8.064 3.566 7.586 1.00 . A A . 27 CYS H 1 1 12 8050 1 1 27 CYS HA H -6.800 5.815 9.131 1.00 . A A . 27 CYS HA 1 1 12 8051 1 1 27 CYS HB2 H -9.613 6.162 7.976 1.00 . A A . 27 CYS HB2 1 1 12 8052 1 1 27 CYS HB3 H -8.904 7.200 9.168 1.00 . A A . 27 CYS HB3 1 1 12 8053 1 1 27 CYS N N -7.464 4.380 7.760 1.00 . A A . 27 CYS N 1 1 12 8054 1 1 27 CYS O O -8.854 3.452 9.949 1.00 . A A . 27 CYS O 1 1 12 8055 1 1 27 CYS SG S -7.819 7.520 7.101 1.00 . A A . 27 CYS SG 1 1 12 8056 1 1 28 SER C C -10.909 4.711 12.003 1.00 . A A . 28 SER C 1 1 12 8057 1 1 28 SER CA C -9.389 4.917 12.333 1.00 . A A . 28 SER CA 1 1 12 8058 1 1 28 SER CB C -9.169 6.021 13.408 1.00 . A A . 28 SER CB 1 1 12 8059 1 1 28 SER H H -8.164 6.281 11.085 1.00 . A A . 28 SER H 1 1 12 8060 1 1 28 SER HA H -9.020 3.948 12.720 1.00 . A A . 28 SER HA 1 1 12 8061 1 1 28 SER HB2 H -9.250 7.042 12.987 1.00 . A A . 28 SER HB2 1 1 12 8062 1 1 28 SER HB3 H -9.927 5.996 14.209 1.00 . A A . 28 SER HB3 1 1 12 8063 1 1 28 SER HG H -7.838 6.546 14.692 1.00 . A A . 28 SER HG 1 1 12 8064 1 1 28 SER N N -8.583 5.346 11.149 1.00 . A A . 28 SER N 1 1 12 8065 1 1 28 SER O O -11.394 4.939 10.889 1.00 . A A . 28 SER O 1 1 12 8066 1 1 28 SER OG O -7.907 5.846 14.039 1.00 . A A . 28 SER OG 1 1 12 8067 1 1 29 MET C C -14.050 5.061 12.619 1.00 . A A . 29 MET C 1 1 12 8068 1 1 29 MET CA C -13.090 3.868 12.925 1.00 . A A . 29 MET CA 1 1 12 8069 1 1 29 MET CB C -13.495 3.237 14.287 1.00 . A A . 29 MET CB 1 1 12 8070 1 1 29 MET CE C -12.079 0.264 12.386 1.00 . A A . 29 MET CE 1 1 12 8071 1 1 29 MET CG C -12.967 1.815 14.554 1.00 . A A . 29 MET CG 1 1 12 8072 1 1 29 MET H H -11.152 4.249 13.919 1.00 . A A . 29 MET H 1 1 12 8073 1 1 29 MET HA H -13.223 3.128 12.113 1.00 . A A . 29 MET HA 1 1 12 8074 1 1 29 MET HB2 H -13.194 3.896 15.126 1.00 . A A . 29 MET HB2 1 1 12 8075 1 1 29 MET HB3 H -14.595 3.211 14.357 1.00 . A A . 29 MET HB3 1 1 12 8076 1 1 29 MET HE1 H -11.626 1.174 11.952 1.00 . A A . 29 MET HE1 1 1 12 8077 1 1 29 MET HE2 H -11.331 -0.213 13.045 1.00 . A A . 29 MET HE2 1 1 12 8078 1 1 29 MET HE3 H -12.302 -0.434 11.560 1.00 . A A . 29 MET HE3 1 1 12 8079 1 1 29 MET HG2 H -11.862 1.801 14.594 1.00 . A A . 29 MET HG2 1 1 12 8080 1 1 29 MET HG3 H -13.311 1.469 15.546 1.00 . A A . 29 MET HG3 1 1 12 8081 1 1 29 MET N N -11.646 4.244 13.024 1.00 . A A . 29 MET N 1 1 12 8082 1 1 29 MET O O -15.039 4.870 11.905 1.00 . A A . 29 MET O 1 1 12 8083 1 1 29 MET SD S -13.584 0.662 13.302 1.00 . A A . 29 MET SD 1 1 12 8084 1 1 30 ILE C C -14.205 8.025 11.393 1.00 . A A . 30 ILE C 1 1 12 8085 1 1 30 ILE CA C -14.530 7.506 12.847 1.00 . A A . 30 ILE CA 1 1 12 8086 1 1 30 ILE CB C -14.223 8.503 14.048 1.00 . A A . 30 ILE CB 1 1 12 8087 1 1 30 ILE CD1 C -15.120 10.839 12.990 1.00 . A A . 30 ILE CD1 1 1 12 8088 1 1 30 ILE CG1 C -15.218 9.712 14.038 1.00 . A A . 30 ILE CG1 1 1 12 8089 1 1 30 ILE CG2 C -12.765 9.056 14.032 1.00 . A A . 30 ILE CG2 1 1 12 8090 1 1 30 ILE H H -12.838 6.247 13.614 1.00 . A A . 30 ILE H 1 1 12 8091 1 1 30 ILE HA H -15.607 7.270 12.835 1.00 . A A . 30 ILE HA 1 1 12 8092 1 1 30 ILE HB H -14.380 7.969 15.006 1.00 . A A . 30 ILE HB 1 1 12 8093 1 1 30 ILE HD11 H -14.131 11.332 12.994 1.00 . A A . 30 ILE HD11 1 1 12 8094 1 1 30 ILE HD12 H -15.314 10.486 11.964 1.00 . A A . 30 ILE HD12 1 1 12 8095 1 1 30 ILE HD13 H -15.867 11.627 13.196 1.00 . A A . 30 ILE HD13 1 1 12 8096 1 1 30 ILE HG12 H -16.251 9.317 14.017 1.00 . A A . 30 ILE HG12 1 1 12 8097 1 1 30 ILE HG13 H -15.148 10.199 15.029 1.00 . A A . 30 ILE HG13 1 1 12 8098 1 1 30 ILE HG21 H -12.015 8.244 14.051 1.00 . A A . 30 ILE HG21 1 1 12 8099 1 1 30 ILE HG22 H -12.538 9.683 13.153 1.00 . A A . 30 ILE HG22 1 1 12 8100 1 1 30 ILE HG23 H -12.566 9.681 14.922 1.00 . A A . 30 ILE HG23 1 1 12 8101 1 1 30 ILE N N -13.753 6.263 13.143 1.00 . A A . 30 ILE N 1 1 12 8102 1 1 30 ILE O O -15.149 8.309 10.650 1.00 . A A . 30 ILE O 1 1 12 8103 1 1 31 GLY C C -11.280 9.592 9.768 1.00 . A A . 31 GLY C 1 1 12 8104 1 1 31 GLY CA C -12.525 8.688 9.679 1.00 . A A . 31 GLY CA 1 1 12 8105 1 1 31 GLY H H -12.272 7.946 11.758 1.00 . A A . 31 GLY H 1 1 12 8106 1 1 31 GLY HA2 H -12.321 7.858 8.979 1.00 . A A . 31 GLY HA2 1 1 12 8107 1 1 31 GLY HA3 H -13.343 9.267 9.210 1.00 . A A . 31 GLY HA3 1 1 12 8108 1 1 31 GLY N N -12.928 8.107 10.985 1.00 . A A . 31 GLY N 1 1 12 8109 1 1 31 GLY O O -10.314 9.397 9.025 1.00 . A A . 31 GLY O 1 1 12 8110 1 1 32 THR C C -9.234 10.666 12.056 1.00 . A A . 32 THR C 1 1 12 8111 1 1 32 THR CA C -10.142 11.422 11.030 1.00 . A A . 32 THR CA 1 1 12 8112 1 1 32 THR CB C -10.600 12.784 11.651 1.00 . A A . 32 THR CB 1 1 12 8113 1 1 32 THR CG2 C -11.363 13.668 10.644 1.00 . A A . 32 THR CG2 1 1 12 8114 1 1 32 THR H H -12.128 10.479 11.311 1.00 . A A . 32 THR H 1 1 12 8115 1 1 32 THR HA H -9.552 11.632 10.114 1.00 . A A . 32 THR HA 1 1 12 8116 1 1 32 THR HB H -9.690 13.322 11.982 1.00 . A A . 32 THR HB 1 1 12 8117 1 1 32 THR HG1 H -11.688 13.438 13.102 1.00 . A A . 32 THR HG1 1 1 12 8118 1 1 32 THR HG21 H -10.754 13.880 9.746 1.00 . A A . 32 THR HG21 1 1 12 8119 1 1 32 THR HG22 H -12.306 13.201 10.304 1.00 . A A . 32 THR HG22 1 1 12 8120 1 1 32 THR HG23 H -11.627 14.644 11.092 1.00 . A A . 32 THR HG23 1 1 12 8121 1 1 32 THR N N -11.322 10.576 10.682 1.00 . A A . 32 THR N 1 1 12 8122 1 1 32 THR O O -9.655 9.715 12.724 1.00 . A A . 32 THR O 1 1 12 8123 1 1 32 THR OG1 O -11.469 12.567 12.764 1.00 . A A . 32 THR OG1 1 1 12 8124 1 1 33 ASN C C -6.529 9.092 12.305 1.00 . A A . 33 ASN C 1 1 12 8125 1 1 33 ASN CA C -6.855 10.482 12.934 1.00 . A A . 33 ASN CA 1 1 12 8126 1 1 33 ASN CB C -7.232 10.347 14.453 1.00 . A A . 33 ASN CB 1 1 12 8127 1 1 33 ASN CG C -7.309 11.680 15.221 1.00 . A A . 33 ASN CG 1 1 12 8128 1 1 33 ASN H H -7.727 11.809 11.421 1.00 . A A . 33 ASN H 1 1 12 8129 1 1 33 ASN HA H -5.949 11.113 12.847 1.00 . A A . 33 ASN HA 1 1 12 8130 1 1 33 ASN HB2 H -8.187 9.812 14.596 1.00 . A A . 33 ASN HB2 1 1 12 8131 1 1 33 ASN HB3 H -6.515 9.668 14.956 1.00 . A A . 33 ASN HB3 1 1 12 8132 1 1 33 ASN HD21 H -5.380 11.525 15.750 1.00 . A A . 33 ASN HD21 1 1 12 8133 1 1 33 ASN HD22 H -6.294 13.006 16.333 1.00 . A A . 33 ASN HD22 1 1 12 8134 1 1 33 ASN N N -7.961 11.117 12.141 1.00 . A A . 33 ASN N 1 1 12 8135 1 1 33 ASN ND2 N -6.216 12.115 15.830 1.00 . A A . 33 ASN ND2 1 1 12 8136 1 1 33 ASN O O -6.764 8.040 12.905 1.00 . A A . 33 ASN O 1 1 12 8137 1 1 33 ASN OD1 O -8.354 12.328 15.268 1.00 . A A . 33 ASN OD1 1 1 12 8138 1 1 34 CYS C C -4.613 6.971 10.891 1.00 . A A . 34 CYS C 1 1 12 8139 1 1 34 CYS CA C -5.760 7.854 10.291 1.00 . A A . 34 CYS CA 1 1 12 8140 1 1 34 CYS CB C -5.432 8.243 8.842 1.00 . A A . 34 CYS CB 1 1 12 8141 1 1 34 CYS H H -5.987 10.039 10.650 1.00 . A A . 34 CYS H 1 1 12 8142 1 1 34 CYS HA H -6.705 7.300 10.280 1.00 . A A . 34 CYS HA 1 1 12 8143 1 1 34 CYS HB2 H -4.561 8.874 8.821 1.00 . A A . 34 CYS HB2 1 1 12 8144 1 1 34 CYS HB3 H -5.149 7.360 8.257 1.00 . A A . 34 CYS HB3 1 1 12 8145 1 1 34 CYS N N -5.972 9.103 11.077 1.00 . A A . 34 CYS N 1 1 12 8146 1 1 34 CYS O O -3.842 7.431 11.741 1.00 . A A . 34 CYS O 1 1 12 8147 1 1 34 CYS SG S -6.868 8.986 8.059 1.00 . A A . 34 CYS SG 1 1 12 8148 1 1 35 GLU C C -2.924 3.826 9.866 1.00 . A A . 35 GLU C 1 1 12 8149 1 1 35 GLU CA C -3.484 4.745 11.010 1.00 . A A . 35 GLU CA 1 1 12 8150 1 1 35 GLU CB C -4.031 3.807 12.134 1.00 . A A . 35 GLU CB 1 1 12 8151 1 1 35 GLU CD C -5.490 3.286 14.167 1.00 . A A . 35 GLU CD 1 1 12 8152 1 1 35 GLU CG C -5.048 4.349 13.160 1.00 . A A . 35 GLU CG 1 1 12 8153 1 1 35 GLU H H -5.158 5.473 9.675 1.00 . A A . 35 GLU H 1 1 12 8154 1 1 35 GLU HA H -2.661 5.349 11.421 1.00 . A A . 35 GLU HA 1 1 12 8155 1 1 35 GLU HB2 H -4.371 2.853 11.692 1.00 . A A . 35 GLU HB2 1 1 12 8156 1 1 35 GLU HB3 H -3.147 3.485 12.716 1.00 . A A . 35 GLU HB3 1 1 12 8157 1 1 35 GLU HE2 H -4.823 2.391 15.762 1.00 . A A . 35 GLU HE2 1 1 12 8158 1 1 35 GLU HG2 H -4.620 5.219 13.693 1.00 . A A . 35 GLU HG2 1 1 12 8159 1 1 35 GLU HG3 H -5.942 4.731 12.635 1.00 . A A . 35 GLU HG3 1 1 12 8160 1 1 35 GLU N N -4.537 5.682 10.477 1.00 . A A . 35 GLU N 1 1 12 8161 1 1 35 GLU O O -3.413 3.845 8.739 1.00 . A A . 35 GLU O 1 1 12 8162 1 1 35 GLU OE1 O -6.574 2.708 14.107 1.00 . A A . 35 GLU OE1 1 1 12 8163 1 1 35 GLU OE2 O -4.542 3.059 15.132 1.00 . A A . 35 GLU OE2 1 1 12 8164 1 1 36 CYS C C -2.001 0.795 9.009 1.00 . A A . 36 CYS C 1 1 12 8165 1 1 36 CYS CA C -1.202 2.132 9.164 1.00 . A A . 36 CYS CA 1 1 12 8166 1 1 36 CYS CB C 0.281 1.780 9.567 1.00 . A A . 36 CYS CB 1 1 12 8167 1 1 36 CYS H H -1.719 2.991 11.183 1.00 . A A . 36 CYS H 1 1 12 8168 1 1 36 CYS HA H -1.170 2.659 8.189 1.00 . A A . 36 CYS HA 1 1 12 8169 1 1 36 CYS HB2 H 0.872 2.586 10.051 1.00 . A A . 36 CYS HB2 1 1 12 8170 1 1 36 CYS HB3 H 0.298 0.954 10.290 1.00 . A A . 36 CYS HB3 1 1 12 8171 1 1 36 CYS N N -1.885 3.010 10.170 1.00 . A A . 36 CYS N 1 1 12 8172 1 1 36 CYS O O -2.803 0.407 9.867 1.00 . A A . 36 CYS O 1 1 12 8173 1 1 36 CYS SG S 1.080 1.314 8.031 1.00 . A A . 36 CYS SG 1 1 12 8174 1 1 37 THR C C -1.124 -2.208 7.119 1.00 . A A . 37 THR C 1 1 12 8175 1 1 37 THR CA C -2.274 -1.320 7.734 1.00 . A A . 37 THR CA 1 1 12 8176 1 1 37 THR CB C -3.562 -1.339 6.852 1.00 . A A . 37 THR CB 1 1 12 8177 1 1 37 THR CG2 C -3.439 -0.684 5.460 1.00 . A A . 37 THR CG2 1 1 12 8178 1 1 37 THR H H -1.146 0.522 7.204 1.00 . A A . 37 THR H 1 1 12 8179 1 1 37 THR HA H -2.548 -1.727 8.723 1.00 . A A . 37 THR HA 1 1 12 8180 1 1 37 THR HB H -4.344 -0.864 7.461 1.00 . A A . 37 THR HB 1 1 12 8181 1 1 37 THR HG1 H -4.064 -3.088 7.478 1.00 . A A . 37 THR HG1 1 1 12 8182 1 1 37 THR HG21 H -3.160 0.382 5.535 1.00 . A A . 37 THR HG21 1 1 12 8183 1 1 37 THR HG22 H -2.682 -1.185 4.832 1.00 . A A . 37 THR HG22 1 1 12 8184 1 1 37 THR HG23 H -4.401 -0.725 4.919 1.00 . A A . 37 THR HG23 1 1 12 8185 1 1 37 THR N N -1.761 0.072 7.897 1.00 . A A . 37 THR N 1 1 12 8186 1 1 37 THR O O -0.442 -1.767 6.185 1.00 . A A . 37 THR O 1 1 12 8187 1 1 37 THR OG1 O -3.956 -2.687 6.613 1.00 . A A . 37 THR OG1 1 1 12 8188 1 1 38 PRO C C -0.124 -5.027 5.735 1.00 . A A . 38 PRO C 1 1 12 8189 1 1 38 PRO CA C 0.186 -4.355 7.109 1.00 . A A . 38 PRO CA 1 1 12 8190 1 1 38 PRO CB C 0.340 -5.376 8.254 1.00 . A A . 38 PRO CB 1 1 12 8191 1 1 38 PRO CD C -1.626 -4.047 8.750 1.00 . A A . 38 PRO CD 1 1 12 8192 1 1 38 PRO CG C -1.020 -5.432 8.952 1.00 . A A . 38 PRO CG 1 1 12 8193 1 1 38 PRO HA H 1.127 -3.780 7.000 1.00 . A A . 38 PRO HA 1 1 12 8194 1 1 38 PRO HB2 H 0.680 -6.373 7.915 1.00 . A A . 38 PRO HB2 1 1 12 8195 1 1 38 PRO HB3 H 1.105 -5.022 8.970 1.00 . A A . 38 PRO HB3 1 1 12 8196 1 1 38 PRO HD2 H -2.711 -4.111 8.564 1.00 . A A . 38 PRO HD2 1 1 12 8197 1 1 38 PRO HD3 H -1.506 -3.397 9.637 1.00 . A A . 38 PRO HD3 1 1 12 8198 1 1 38 PRO HG2 H -1.659 -6.198 8.472 1.00 . A A . 38 PRO HG2 1 1 12 8199 1 1 38 PRO HG3 H -0.939 -5.699 10.021 1.00 . A A . 38 PRO HG3 1 1 12 8200 1 1 38 PRO N N -0.905 -3.474 7.594 1.00 . A A . 38 PRO N 1 1 12 8201 1 1 38 PRO O O -1.213 -5.573 5.524 1.00 . A A . 38 PRO O 1 1 12 8202 1 1 39 ARG C C 1.378 -6.917 3.186 1.00 . A A . 39 ARG C 1 1 12 8203 1 1 39 ARG CA C 0.722 -5.510 3.430 1.00 . A A . 39 ARG CA 1 1 12 8204 1 1 39 ARG CB C 1.357 -4.441 2.480 1.00 . A A . 39 ARG CB 1 1 12 8205 1 1 39 ARG CD C 3.966 -4.781 2.619 1.00 . A A . 39 ARG CD 1 1 12 8206 1 1 39 ARG CG C 2.763 -3.827 2.734 1.00 . A A . 39 ARG CG 1 1 12 8207 1 1 39 ARG CZ C 6.466 -4.562 2.655 1.00 . A A . 39 ARG CZ 1 1 12 8208 1 1 39 ARG H H 1.712 -4.499 5.133 1.00 . A A . 39 ARG H 1 1 12 8209 1 1 39 ARG HA H -0.344 -5.629 3.153 1.00 . A A . 39 ARG HA 1 1 12 8210 1 1 39 ARG HB2 H 1.330 -4.818 1.439 1.00 . A A . 39 ARG HB2 1 1 12 8211 1 1 39 ARG HB3 H 0.648 -3.593 2.448 1.00 . A A . 39 ARG HB3 1 1 12 8212 1 1 39 ARG HD2 H 3.903 -5.567 3.393 1.00 . A A . 39 ARG HD2 1 1 12 8213 1 1 39 ARG HD3 H 3.950 -5.295 1.639 1.00 . A A . 39 ARG HD3 1 1 12 8214 1 1 39 ARG HG2 H 2.896 -3.004 2.006 1.00 . A A . 39 ARG HG2 1 1 12 8215 1 1 39 ARG HG3 H 2.773 -3.331 3.723 1.00 . A A . 39 ARG HG3 1 1 12 8216 1 1 39 ARG HH11 H 5.877 -6.428 2.185 1.00 . A A . 39 ARG HH11 1 1 12 8217 1 1 39 ARG HH12 H 7.683 -6.117 2.266 1.00 . A A . 39 ARG HH12 1 1 12 8218 1 1 39 ARG HH21 H 7.297 -2.797 3.101 1.00 . A A . 39 ARG HH21 1 1 12 8219 1 1 39 ARG HH22 H 8.431 -4.195 2.751 1.00 . A A . 39 ARG HH22 1 1 12 8220 1 1 39 ARG N N 0.860 -4.978 4.821 1.00 . A A . 39 ARG N 1 1 12 8221 1 1 39 ARG NE N 5.236 -4.034 2.786 1.00 . A A . 39 ARG NE 1 1 12 8222 1 1 39 ARG NH1 N 6.699 -5.834 2.336 1.00 . A A . 39 ARG NH1 1 1 12 8223 1 1 39 ARG NH2 N 7.503 -3.771 2.856 1.00 . A A . 39 ARG NH2 1 1 12 8224 1 1 39 ARG O O 1.309 -7.379 2.042 1.00 . A A . 39 ARG O 1 1 12 8225 1 1 40 LEU C C 2.296 -9.847 5.209 1.00 . A A . 40 LEU C 1 1 12 8226 1 1 40 LEU CA C 2.599 -8.955 3.968 1.00 . A A . 40 LEU CA 1 1 12 8227 1 1 40 LEU CB C 4.121 -8.733 3.678 1.00 . A A . 40 LEU CB 1 1 12 8228 1 1 40 LEU CD1 C 4.500 -10.600 1.926 1.00 . A A . 40 LEU CD1 1 1 12 8229 1 1 40 LEU CD2 C 6.453 -9.630 3.194 1.00 . A A . 40 LEU CD2 1 1 12 8230 1 1 40 LEU CG C 4.952 -9.980 3.265 1.00 . A A . 40 LEU CG 1 1 12 8231 1 1 40 LEU H H 1.973 -7.158 5.097 1.00 . A A . 40 LEU H 1 1 12 8232 1 1 40 LEU HA H 2.141 -9.459 3.103 1.00 . A A . 40 LEU HA 1 1 12 8233 1 1 40 LEU HB2 H 4.233 -7.976 2.875 1.00 . A A . 40 LEU HB2 1 1 12 8234 1 1 40 LEU HB3 H 4.591 -8.263 4.563 1.00 . A A . 40 LEU HB3 1 1 12 8235 1 1 40 LEU HD11 H 4.563 -9.877 1.091 1.00 . A A . 40 LEU HD11 1 1 12 8236 1 1 40 LEU HD12 H 5.119 -11.475 1.651 1.00 . A A . 40 LEU HD12 1 1 12 8237 1 1 40 LEU HD13 H 3.457 -10.960 1.971 1.00 . A A . 40 LEU HD13 1 1 12 8238 1 1 40 LEU HD21 H 6.823 -9.205 4.146 1.00 . A A . 40 LEU HD21 1 1 12 8239 1 1 40 LEU HD22 H 7.072 -10.522 2.985 1.00 . A A . 40 LEU HD22 1 1 12 8240 1 1 40 LEU HD23 H 6.670 -8.888 2.403 1.00 . A A . 40 LEU HD23 1 1 12 8241 1 1 40 LEU HG H 4.833 -10.752 4.047 1.00 . A A . 40 LEU HG 1 1 12 8242 1 1 40 LEU N N 1.974 -7.619 4.180 1.00 . A A . 40 LEU N 1 1 12 8243 1 1 40 LEU O O 1.429 -10.720 5.104 1.00 . A A . 40 LEU O 1 1 12 8244 1 1 41 ILE C C 1.842 -9.495 8.517 1.00 . A A . 41 ILE C 1 1 12 8245 1 1 41 ILE CA C 2.722 -10.414 7.610 1.00 . A A . 41 ILE CA 1 1 12 8246 1 1 41 ILE CB C 4.070 -10.807 8.331 1.00 . A A . 41 ILE CB 1 1 12 8247 1 1 41 ILE CD1 C 6.142 -10.806 6.768 1.00 . A A . 41 ILE CD1 1 1 12 8248 1 1 41 ILE CG1 C 5.026 -11.641 7.412 1.00 . A A . 41 ILE CG1 1 1 12 8249 1 1 41 ILE CG2 C 3.764 -11.671 9.586 1.00 . A A . 41 ILE CG2 1 1 12 8250 1 1 41 ILE H H 3.665 -8.889 6.286 1.00 . A A . 41 ILE H 1 1 12 8251 1 1 41 ILE HA H 2.182 -11.355 7.374 1.00 . A A . 41 ILE HA 1 1 12 8252 1 1 41 ILE HB H 4.602 -9.896 8.663 1.00 . A A . 41 ILE HB 1 1 12 8253 1 1 41 ILE HD11 H 5.745 -9.952 6.191 1.00 . A A . 41 ILE HD11 1 1 12 8254 1 1 41 ILE HD12 H 6.820 -10.392 7.535 1.00 . A A . 41 ILE HD12 1 1 12 8255 1 1 41 ILE HD13 H 6.756 -11.415 6.081 1.00 . A A . 41 ILE HD13 1 1 12 8256 1 1 41 ILE HG12 H 5.533 -12.451 7.970 1.00 . A A . 41 ILE HG12 1 1 12 8257 1 1 41 ILE HG13 H 4.456 -12.169 6.624 1.00 . A A . 41 ILE HG13 1 1 12 8258 1 1 41 ILE HG21 H 3.226 -12.604 9.333 1.00 . A A . 41 ILE HG21 1 1 12 8259 1 1 41 ILE HG22 H 4.689 -11.958 10.119 1.00 . A A . 41 ILE HG22 1 1 12 8260 1 1 41 ILE HG23 H 3.147 -11.127 10.325 1.00 . A A . 41 ILE HG23 1 1 12 8261 1 1 41 ILE N N 2.968 -9.636 6.359 1.00 . A A . 41 ILE N 1 1 12 8262 1 1 41 ILE O O 2.250 -8.391 8.900 1.00 . A A . 41 ILE O 1 1 12 8263 1 1 42 MET C C 0.081 -9.058 11.145 1.00 . A A . 42 MET C 1 1 12 8264 1 1 42 MET CA C -0.360 -9.210 9.653 1.00 . A A . 42 MET CA 1 1 12 8265 1 1 42 MET CB C -1.739 -9.929 9.557 1.00 . A A . 42 MET CB 1 1 12 8266 1 1 42 MET CE C -3.449 -12.638 8.166 1.00 . A A . 42 MET CE 1 1 12 8267 1 1 42 MET CG C -1.890 -11.360 10.119 1.00 . A A . 42 MET CG 1 1 12 8268 1 1 42 MET H H 0.429 -10.921 8.498 1.00 . A A . 42 MET H 1 1 12 8269 1 1 42 MET HA H -0.458 -8.202 9.205 1.00 . A A . 42 MET HA 1 1 12 8270 1 1 42 MET HB2 H -2.497 -9.291 10.050 1.00 . A A . 42 MET HB2 1 1 12 8271 1 1 42 MET HB3 H -2.053 -9.940 8.496 1.00 . A A . 42 MET HB3 1 1 12 8272 1 1 42 MET HE1 H -2.688 -13.438 8.118 1.00 . A A . 42 MET HE1 1 1 12 8273 1 1 42 MET HE2 H -4.417 -13.068 7.852 1.00 . A A . 42 MET HE2 1 1 12 8274 1 1 42 MET HE3 H -3.173 -11.853 7.440 1.00 . A A . 42 MET HE3 1 1 12 8275 1 1 42 MET HG2 H -1.160 -12.055 9.664 1.00 . A A . 42 MET HG2 1 1 12 8276 1 1 42 MET HG3 H -1.696 -11.372 11.207 1.00 . A A . 42 MET HG3 1 1 12 8277 1 1 42 MET N N 0.641 -9.990 8.874 1.00 . A A . 42 MET N 1 1 12 8278 1 1 42 MET O O 0.545 -10.010 11.782 1.00 . A A . 42 MET O 1 1 12 8279 1 1 42 MET SD S -3.570 -11.963 9.837 1.00 . A A . 42 MET SD 1 1 12 8280 1 1 43 GLU C C 1.817 -7.737 13.430 1.00 . A A . 43 GLU C 1 1 12 8281 1 1 43 GLU CA C 0.323 -7.397 13.064 1.00 . A A . 43 GLU CA 1 1 12 8282 1 1 43 GLU CB C -0.645 -8.081 14.071 1.00 . A A . 43 GLU CB 1 1 12 8283 1 1 43 GLU CD C -3.016 -8.438 14.965 1.00 . A A . 43 GLU CD 1 1 12 8284 1 1 43 GLU CG C -2.135 -7.684 13.968 1.00 . A A . 43 GLU CG 1 1 12 8285 1 1 43 GLU H H -0.465 -7.141 11.011 1.00 . A A . 43 GLU H 1 1 12 8286 1 1 43 GLU HA H 0.227 -6.298 13.136 1.00 . A A . 43 GLU HA 1 1 12 8287 1 1 43 GLU HB2 H -0.510 -9.168 13.956 1.00 . A A . 43 GLU HB2 1 1 12 8288 1 1 43 GLU HB3 H -0.314 -7.854 15.104 1.00 . A A . 43 GLU HB3 1 1 12 8289 1 1 43 GLU HE2 H -3.655 -8.271 16.797 1.00 . A A . 43 GLU HE2 1 1 12 8290 1 1 43 GLU HG2 H -2.244 -6.595 14.125 1.00 . A A . 43 GLU HG2 1 1 12 8291 1 1 43 GLU HG3 H -2.517 -7.876 12.948 1.00 . A A . 43 GLU HG3 1 1 12 8292 1 1 43 GLU N N -0.067 -7.820 11.669 1.00 . A A . 43 GLU N 1 1 12 8293 1 1 43 GLU O O 2.136 -8.295 14.487 1.00 . A A . 43 GLU O 1 1 12 8294 1 1 43 GLU OE1 O -3.579 -9.501 14.703 1.00 . A A . 43 GLU OE1 1 1 12 8295 1 1 43 GLU OE2 O -3.101 -7.794 16.174 1.00 . A A . 43 GLU OE2 1 1 12 8296 1 1 44 GLY C C 4.857 -7.762 11.351 1.00 . A A . 44 GLY C 1 1 12 8297 1 1 44 GLY CA C 4.180 -7.491 12.703 1.00 . A A . 44 GLY CA 1 1 12 8298 1 1 44 GLY H H 2.250 -7.030 11.678 1.00 . A A . 44 GLY H 1 1 12 8299 1 1 44 GLY HA2 H 4.597 -6.586 13.187 1.00 . A A . 44 GLY HA2 1 1 12 8300 1 1 44 GLY HA3 H 4.419 -8.327 13.389 1.00 . A A . 44 GLY HA3 1 1 12 8301 1 1 44 GLY N N 2.720 -7.328 12.536 1.00 . A A . 44 GLY N 1 1 12 8302 1 1 44 GLY O O 4.993 -8.924 10.963 1.00 . A A . 44 GLY O 1 1 12 8303 1 1 45 LEU C C 7.457 -7.123 9.466 1.00 . A A . 45 LEU C 1 1 12 8304 1 1 45 LEU CA C 5.935 -6.798 9.317 1.00 . A A . 45 LEU CA 1 1 12 8305 1 1 45 LEU CB C 5.745 -5.438 8.557 1.00 . A A . 45 LEU CB 1 1 12 8306 1 1 45 LEU CD1 C 6.143 -6.314 6.130 1.00 . A A . 45 LEU CD1 1 1 12 8307 1 1 45 LEU CD2 C 3.793 -5.905 6.955 1.00 . A A . 45 LEU CD2 1 1 12 8308 1 1 45 LEU CG C 5.264 -5.480 7.079 1.00 . A A . 45 LEU CG 1 1 12 8309 1 1 45 LEU H H 5.118 -5.787 11.107 1.00 . A A . 45 LEU H 1 1 12 8310 1 1 45 LEU HA H 5.443 -7.613 8.749 1.00 . A A . 45 LEU HA 1 1 12 8311 1 1 45 LEU HB2 H 5.039 -4.774 9.096 1.00 . A A . 45 LEU HB2 1 1 12 8312 1 1 45 LEU HB3 H 6.682 -4.850 8.588 1.00 . A A . 45 LEU HB3 1 1 12 8313 1 1 45 LEU HD11 H 7.195 -5.983 6.151 1.00 . A A . 45 LEU HD11 1 1 12 8314 1 1 45 LEU HD12 H 6.129 -7.391 6.380 1.00 . A A . 45 LEU HD12 1 1 12 8315 1 1 45 LEU HD13 H 5.805 -6.223 5.082 1.00 . A A . 45 LEU HD13 1 1 12 8316 1 1 45 LEU HD21 H 3.139 -5.285 7.592 1.00 . A A . 45 LEU HD21 1 1 12 8317 1 1 45 LEU HD22 H 3.427 -5.793 5.918 1.00 . A A . 45 LEU HD22 1 1 12 8318 1 1 45 LEU HD23 H 3.637 -6.958 7.246 1.00 . A A . 45 LEU HD23 1 1 12 8319 1 1 45 LEU HG H 5.315 -4.438 6.710 1.00 . A A . 45 LEU HG 1 1 12 8320 1 1 45 LEU N N 5.292 -6.693 10.659 1.00 . A A . 45 LEU N 1 1 12 8321 1 1 45 LEU O O 8.132 -6.630 10.378 1.00 . A A . 45 LEU O 1 1 12 8322 1 1 46 SER C C 10.261 -6.866 7.973 1.00 . A A . 46 SER C 1 1 12 8323 1 1 46 SER CA C 9.471 -8.150 8.399 1.00 . A A . 46 SER CA 1 1 12 8324 1 1 46 SER CB C 9.681 -9.301 7.377 1.00 . A A . 46 SER CB 1 1 12 8325 1 1 46 SER H H 7.340 -8.240 7.804 1.00 . A A . 46 SER H 1 1 12 8326 1 1 46 SER HA H 9.873 -8.463 9.376 1.00 . A A . 46 SER HA 1 1 12 8327 1 1 46 SER HB2 H 10.760 -9.520 7.272 1.00 . A A . 46 SER HB2 1 1 12 8328 1 1 46 SER HB3 H 9.237 -10.238 7.763 1.00 . A A . 46 SER HB3 1 1 12 8329 1 1 46 SER HG H 8.198 -8.891 6.218 1.00 . A A . 46 SER HG 1 1 12 8330 1 1 46 SER N N 8.000 -7.906 8.514 1.00 . A A . 46 SER N 1 1 12 8331 1 1 46 SER O O 11.212 -6.497 8.668 1.00 . A A . 46 SER O 1 1 12 8332 1 1 46 SER OG O 9.138 -9.030 6.086 1.00 . A A . 46 SER OG 1 1 12 8333 1 1 47 PHE C C 9.258 -3.807 6.994 1.00 . A A . 47 PHE C 1 1 12 8334 1 1 47 PHE CA C 10.344 -4.822 6.540 1.00 . A A . 47 PHE CA 1 1 12 8335 1 1 47 PHE CB C 10.609 -4.722 5.009 1.00 . A A . 47 PHE CB 1 1 12 8336 1 1 47 PHE CD1 C 13.103 -5.164 4.694 1.00 . A A . 47 PHE CD1 1 1 12 8337 1 1 47 PHE CD2 C 11.534 -6.774 3.809 1.00 . A A . 47 PHE CD2 1 1 12 8338 1 1 47 PHE CE1 C 14.161 -5.941 4.229 1.00 . A A . 47 PHE CE1 1 1 12 8339 1 1 47 PHE CE2 C 12.594 -7.550 3.347 1.00 . A A . 47 PHE CE2 1 1 12 8340 1 1 47 PHE CG C 11.781 -5.574 4.486 1.00 . A A . 47 PHE CG 1 1 12 8341 1 1 47 PHE CZ C 13.906 -7.133 3.556 1.00 . A A . 47 PHE CZ 1 1 12 8342 1 1 47 PHE H H 9.026 -6.601 6.448 1.00 . A A . 47 PHE H 1 1 12 8343 1 1 47 PHE HA H 11.302 -4.599 7.054 1.00 . A A . 47 PHE HA 1 1 12 8344 1 1 47 PHE HB2 H 9.684 -4.960 4.448 1.00 . A A . 47 PHE HB2 1 1 12 8345 1 1 47 PHE HB3 H 10.810 -3.666 4.747 1.00 . A A . 47 PHE HB3 1 1 12 8346 1 1 47 PHE HD1 H 13.315 -4.242 5.217 1.00 . A A . 47 PHE HD1 1 1 12 8347 1 1 47 PHE HD2 H 10.521 -7.113 3.644 1.00 . A A . 47 PHE HD2 1 1 12 8348 1 1 47 PHE HE1 H 15.179 -5.619 4.391 1.00 . A A . 47 PHE HE1 1 1 12 8349 1 1 47 PHE HE2 H 12.398 -8.477 2.827 1.00 . A A . 47 PHE HE2 1 1 12 8350 1 1 47 PHE HZ H 14.727 -7.736 3.197 1.00 . A A . 47 PHE HZ 1 1 12 8351 1 1 47 PHE N N 9.849 -6.180 6.890 1.00 . A A . 47 PHE N 1 1 12 8352 1 1 47 PHE O O 8.270 -3.564 6.291 1.00 . A A . 47 PHE O 1 1 12 8353 1 1 48 ALA C C 8.701 -0.923 8.683 1.00 . A A . 48 ALA C 1 1 12 8354 1 1 48 ALA CA C 8.413 -2.426 8.879 1.00 . A A . 48 ALA CA 1 1 12 8355 1 1 48 ALA CB C 8.401 -2.812 10.371 1.00 . A A . 48 ALA CB 1 1 12 8356 1 1 48 ALA H H 10.303 -3.543 8.687 1.00 . A A . 48 ALA H 1 1 12 8357 1 1 48 ALA HXT H 10.039 0.427 9.119 1.00 . A A . 48 ALA HXT 1 1 12 8358 1 1 48 ALA HA H 7.410 -2.633 8.462 1.00 . A A . 48 ALA HA 1 1 12 8359 1 1 48 ALA HB1 H 8.176 -3.885 10.513 1.00 . A A . 48 ALA HB1 1 1 12 8360 1 1 48 ALA HB2 H 9.365 -2.609 10.876 1.00 . A A . 48 ALA HB2 1 1 12 8361 1 1 48 ALA HB3 H 7.619 -2.259 10.923 1.00 . A A . 48 ALA HB3 1 1 12 8362 1 1 48 ALA N N 9.445 -3.250 8.206 1.00 . A A . 48 ALA N 1 1 12 8363 1 1 48 ALA O O 7.941 -0.180 8.064 1.00 . A A . 48 ALA O 1 1 12 8364 1 1 48 ALA OXT O 9.881 -0.510 9.256 1.00 . A A . 48 ALA OXT 1 1 13 8365 1 1 1 GLU C C 7.366 11.799 4.349 1.00 . A A . 1 GLU C 1 1 13 8366 1 1 1 GLU CA C 6.555 11.001 3.279 1.00 . A A . 1 GLU CA 1 1 13 8367 1 1 1 GLU CB C 7.091 9.575 2.944 1.00 . A A . 1 GLU CB 1 1 13 8368 1 1 1 GLU CD C 7.341 7.127 3.716 1.00 . A A . 1 GLU CD 1 1 13 8369 1 1 1 GLU CG C 6.981 8.565 4.105 1.00 . A A . 1 GLU CG 1 1 13 8370 1 1 1 GLU H1 H 6.188 12.728 2.161 1.00 . A A . 1 GLU H1 1 1 13 8371 1 1 1 GLU H2 H 6.008 11.336 1.290 1.00 . A A . 1 GLU H2 1 1 13 8372 1 1 1 GLU HA H 5.519 10.930 3.645 1.00 . A A . 1 GLU HA 1 1 13 8373 1 1 1 GLU HB2 H 6.515 9.167 2.090 1.00 . A A . 1 GLU HB2 1 1 13 8374 1 1 1 GLU HB3 H 8.140 9.621 2.590 1.00 . A A . 1 GLU HB3 1 1 13 8375 1 1 1 GLU HE2 H 8.906 6.064 3.258 1.00 . A A . 1 GLU HE2 1 1 13 8376 1 1 1 GLU HG2 H 7.623 8.885 4.945 1.00 . A A . 1 GLU HG2 1 1 13 8377 1 1 1 GLU HG3 H 5.949 8.570 4.499 1.00 . A A . 1 GLU HG3 1 1 13 8378 1 1 1 GLU N N 6.569 11.785 2.022 1.00 . A A . 1 GLU N 1 1 13 8379 1 1 1 GLU O O 6.738 12.479 5.165 1.00 . A A . 1 GLU O 1 1 13 8380 1 1 1 GLU OE1 O 6.513 6.222 3.624 1.00 . A A . 1 GLU OE1 1 1 13 8381 1 1 1 GLU OE2 O 8.685 6.967 3.496 1.00 . A A . 1 GLU OE2 1 1 13 8382 1 1 2 ASP C C 9.501 12.281 6.665 1.00 . A A . 2 ASP C 1 1 13 8383 1 1 2 ASP CA C 9.662 12.599 5.141 1.00 . A A . 2 ASP CA 1 1 13 8384 1 1 2 ASP CB C 9.417 14.124 4.899 1.00 . A A . 2 ASP CB 1 1 13 8385 1 1 2 ASP CG C 9.730 14.612 3.476 1.00 . A A . 2 ASP CG 1 1 13 8386 1 1 2 ASP H H 9.069 11.128 3.591 1.00 . A A . 2 ASP H 1 1 13 8387 1 1 2 ASP HA H 10.700 12.356 4.837 1.00 . A A . 2 ASP HA 1 1 13 8388 1 1 2 ASP HB2 H 8.382 14.416 5.156 1.00 . A A . 2 ASP HB2 1 1 13 8389 1 1 2 ASP HB3 H 10.045 14.711 5.597 1.00 . A A . 2 ASP HB3 1 1 13 8390 1 1 2 ASP HD2 H 11.580 14.661 4.080 1.00 . A A . 2 ASP HD2 1 1 13 8391 1 1 2 ASP N N 8.721 11.752 4.326 1.00 . A A . 2 ASP N 1 1 13 8392 1 1 2 ASP O O 8.568 12.752 7.324 1.00 . A A . 2 ASP O 1 1 13 8393 1 1 2 ASP OD1 O 8.869 14.769 2.611 1.00 . A A . 2 ASP OD1 1 1 13 8394 1 1 2 ASP OD2 O 11.069 14.843 3.288 1.00 . A A . 2 ASP OD2 1 1 13 8395 1 1 3 ASN C C 9.084 9.987 8.668 1.00 . A A . 3 ASN C 1 1 13 8396 1 1 3 ASN CA C 10.384 10.829 8.573 1.00 . A A . 3 ASN CA 1 1 13 8397 1 1 3 ASN CB C 10.490 11.906 9.663 1.00 . A A . 3 ASN CB 1 1 13 8398 1 1 3 ASN CG C 10.471 11.425 11.129 1.00 . A A . 3 ASN CG 1 1 13 8399 1 1 3 ASN H H 11.044 11.014 6.506 1.00 . A A . 3 ASN H 1 1 13 8400 1 1 3 ASN HA H 11.263 10.159 8.696 1.00 . A A . 3 ASN HA 1 1 13 8401 1 1 3 ASN HB2 H 11.510 12.234 9.453 1.00 . A A . 3 ASN HB2 1 1 13 8402 1 1 3 ASN HB3 H 9.822 12.774 9.503 1.00 . A A . 3 ASN HB3 1 1 13 8403 1 1 3 ASN HD21 H 8.698 12.314 11.422 1.00 . A A . 3 ASN HD21 1 1 13 8404 1 1 3 ASN HD22 H 9.436 11.424 12.846 1.00 . A A . 3 ASN HD22 1 1 13 8405 1 1 3 ASN N N 10.432 11.451 7.202 1.00 . A A . 3 ASN N 1 1 13 8406 1 1 3 ASN ND2 N 9.429 11.755 11.875 1.00 . A A . 3 ASN ND2 1 1 13 8407 1 1 3 ASN O O 8.004 10.390 9.107 1.00 . A A . 3 ASN O 1 1 13 8408 1 1 3 ASN OD1 O 11.391 10.754 11.597 1.00 . A A . 3 ASN OD1 1 1 13 8409 1 1 4 CYS C C 7.589 7.129 9.056 1.00 . A A . 4 CYS C 1 1 13 8410 1 1 4 CYS CA C 8.332 7.767 7.831 1.00 . A A . 4 CYS CA 1 1 13 8411 1 1 4 CYS CB C 9.087 6.701 7.056 1.00 . A A . 4 CYS CB 1 1 13 8412 1 1 4 CYS H H 10.317 8.906 7.827 1.00 . A A . 4 CYS H 1 1 13 8413 1 1 4 CYS HA H 7.577 8.194 7.152 1.00 . A A . 4 CYS HA 1 1 13 8414 1 1 4 CYS HB2 H 8.256 6.053 6.876 1.00 . A A . 4 CYS HB2 1 1 13 8415 1 1 4 CYS HB3 H 9.378 6.977 6.033 1.00 . A A . 4 CYS HB3 1 1 13 8416 1 1 4 CYS N N 9.345 8.795 8.164 1.00 . A A . 4 CYS N 1 1 13 8417 1 1 4 CYS O O 7.942 7.362 10.218 1.00 . A A . 4 CYS O 1 1 13 8418 1 1 4 CYS SG S 10.278 5.651 7.906 1.00 . A A . 4 CYS SG 1 1 13 8419 1 1 5 ILE C C 6.081 4.140 9.680 1.00 . A A . 5 ILE C 1 1 13 8420 1 1 5 ILE CA C 5.722 5.630 9.824 1.00 . A A . 5 ILE CA 1 1 13 8421 1 1 5 ILE CB C 4.158 5.809 9.714 1.00 . A A . 5 ILE CB 1 1 13 8422 1 1 5 ILE CD1 C 2.406 7.561 9.139 1.00 . A A . 5 ILE CD1 1 1 13 8423 1 1 5 ILE CG1 C 3.824 7.299 9.567 1.00 . A A . 5 ILE CG1 1 1 13 8424 1 1 5 ILE CG2 C 3.437 5.206 10.967 1.00 . A A . 5 ILE CG2 1 1 13 8425 1 1 5 ILE H H 6.477 6.097 7.724 1.00 . A A . 5 ILE H 1 1 13 8426 1 1 5 ILE HA H 5.998 6.023 10.805 1.00 . A A . 5 ILE HA 1 1 13 8427 1 1 5 ILE HB H 3.716 5.289 8.872 1.00 . A A . 5 ILE HB 1 1 13 8428 1 1 5 ILE HD11 H 1.712 7.087 9.846 1.00 . A A . 5 ILE HD11 1 1 13 8429 1 1 5 ILE HD12 H 2.174 8.634 9.142 1.00 . A A . 5 ILE HD12 1 1 13 8430 1 1 5 ILE HD13 H 2.207 7.165 8.125 1.00 . A A . 5 ILE HD13 1 1 13 8431 1 1 5 ILE HG12 H 4.039 7.821 10.493 1.00 . A A . 5 ILE HG12 1 1 13 8432 1 1 5 ILE HG13 H 4.454 7.758 8.792 1.00 . A A . 5 ILE HG13 1 1 13 8433 1 1 5 ILE HG21 H 3.770 5.614 11.936 1.00 . A A . 5 ILE HG21 1 1 13 8434 1 1 5 ILE HG22 H 2.339 5.351 10.938 1.00 . A A . 5 ILE HG22 1 1 13 8435 1 1 5 ILE HG23 H 3.543 4.105 11.011 1.00 . A A . 5 ILE HG23 1 1 13 8436 1 1 5 ILE N N 6.535 6.314 8.747 1.00 . A A . 5 ILE N 1 1 13 8437 1 1 5 ILE O O 5.491 3.406 8.885 1.00 . A A . 5 ILE O 1 1 13 8438 1 1 6 ALA C C 6.702 1.140 10.881 1.00 . A A . 6 ALA C 1 1 13 8439 1 1 6 ALA CA C 7.599 2.285 10.270 1.00 . A A . 6 ALA CA 1 1 13 8440 1 1 6 ALA CB C 8.993 2.288 10.928 1.00 . A A . 6 ALA CB 1 1 13 8441 1 1 6 ALA H H 7.344 4.317 11.190 1.00 . A A . 6 ALA H 1 1 13 8442 1 1 6 ALA HA H 7.674 2.101 9.173 1.00 . A A . 6 ALA HA 1 1 13 8443 1 1 6 ALA HB1 H 9.652 3.063 10.493 1.00 . A A . 6 ALA HB1 1 1 13 8444 1 1 6 ALA HB2 H 8.941 2.468 12.019 1.00 . A A . 6 ALA HB2 1 1 13 8445 1 1 6 ALA HB3 H 9.507 1.321 10.780 1.00 . A A . 6 ALA HB3 1 1 13 8446 1 1 6 ALA N N 7.057 3.666 10.462 1.00 . A A . 6 ALA N 1 1 13 8447 1 1 6 ALA O O 7.164 0.021 11.124 1.00 . A A . 6 ALA O 1 1 13 8448 1 1 7 GLU C C 3.295 0.099 11.009 1.00 . A A . 7 GLU C 1 1 13 8449 1 1 7 GLU CA C 4.456 0.638 11.866 1.00 . A A . 7 GLU CA 1 1 13 8450 1 1 7 GLU CB C 3.930 1.547 13.023 1.00 . A A . 7 GLU CB 1 1 13 8451 1 1 7 GLU CD C 4.323 2.838 15.188 1.00 . A A . 7 GLU CD 1 1 13 8452 1 1 7 GLU CG C 4.940 1.915 14.133 1.00 . A A . 7 GLU CG 1 1 13 8453 1 1 7 GLU H H 5.344 2.484 10.988 1.00 . A A . 7 GLU H 1 1 13 8454 1 1 7 GLU HA H 4.924 -0.244 12.270 1.00 . A A . 7 GLU HA 1 1 13 8455 1 1 7 GLU HB2 H 3.500 2.470 12.594 1.00 . A A . 7 GLU HB2 1 1 13 8456 1 1 7 GLU HB3 H 3.073 1.052 13.521 1.00 . A A . 7 GLU HB3 1 1 13 8457 1 1 7 GLU HE2 H 3.963 4.732 15.466 1.00 . A A . 7 GLU HE2 1 1 13 8458 1 1 7 GLU HG2 H 5.313 0.996 14.623 1.00 . A A . 7 GLU HG2 1 1 13 8459 1 1 7 GLU HG3 H 5.833 2.405 13.702 1.00 . A A . 7 GLU HG3 1 1 13 8460 1 1 7 GLU N N 5.422 1.460 11.112 1.00 . A A . 7 GLU N 1 1 13 8461 1 1 7 GLU O O 3.018 0.526 9.888 1.00 . A A . 7 GLU O 1 1 13 8462 1 1 7 GLU OE1 O 3.850 2.434 16.249 1.00 . A A . 7 GLU OE1 1 1 13 8463 1 1 7 GLU OE2 O 4.353 4.156 14.805 1.00 . A A . 7 GLU OE2 1 1 13 8464 1 1 8 ASP C C 0.430 -0.967 12.436 1.00 . A A . 8 ASP C 1 1 13 8465 1 1 8 ASP CA C 1.316 -1.413 11.250 1.00 . A A . 8 ASP CA 1 1 13 8466 1 1 8 ASP CB C 1.224 -2.952 11.061 1.00 . A A . 8 ASP CB 1 1 13 8467 1 1 8 ASP CG C 2.164 -3.814 11.928 1.00 . A A . 8 ASP CG 1 1 13 8468 1 1 8 ASP H H 3.020 -1.091 12.578 1.00 . A A . 8 ASP H 1 1 13 8469 1 1 8 ASP HA H 1.001 -0.963 10.281 1.00 . A A . 8 ASP HA 1 1 13 8470 1 1 8 ASP HB2 H 0.172 -3.269 11.188 1.00 . A A . 8 ASP HB2 1 1 13 8471 1 1 8 ASP HB3 H 1.465 -3.106 10.001 1.00 . A A . 8 ASP HB3 1 1 13 8472 1 1 8 ASP HD2 H 3.392 -3.698 10.422 1.00 . A A . 8 ASP HD2 1 1 13 8473 1 1 8 ASP N N 2.624 -0.863 11.660 1.00 . A A . 8 ASP N 1 1 13 8474 1 1 8 ASP O O 0.636 -1.267 13.619 1.00 . A A . 8 ASP O 1 1 13 8475 1 1 8 ASP OD1 O 1.869 -4.204 13.057 1.00 . A A . 8 ASP OD1 1 1 13 8476 1 1 8 ASP OD2 O 3.350 -4.090 11.297 1.00 . A A . 8 ASP OD2 1 1 13 8477 1 1 9 TYR C C -0.743 1.796 13.627 1.00 . A A . 9 TYR C 1 1 13 8478 1 1 9 TYR CA C -1.495 0.626 12.858 1.00 . A A . 9 TYR CA 1 1 13 8479 1 1 9 TYR CB C -2.278 -0.346 13.821 1.00 . A A . 9 TYR CB 1 1 13 8480 1 1 9 TYR CD1 C -3.960 -1.335 12.154 1.00 . A A . 9 TYR CD1 1 1 13 8481 1 1 9 TYR CD2 C -2.405 -2.833 13.238 1.00 . A A . 9 TYR CD2 1 1 13 8482 1 1 9 TYR CE1 C -4.364 -2.369 11.311 1.00 . A A . 9 TYR CE1 1 1 13 8483 1 1 9 TYR CE2 C -2.811 -3.865 12.396 1.00 . A A . 9 TYR CE2 1 1 13 8484 1 1 9 TYR CG C -2.961 -1.552 13.113 1.00 . A A . 9 TYR CG 1 1 13 8485 1 1 9 TYR CZ C -3.788 -3.631 11.431 1.00 . A A . 9 TYR CZ 1 1 13 8486 1 1 9 TYR H H -0.580 -0.208 10.983 1.00 . A A . 9 TYR H 1 1 13 8487 1 1 9 TYR HA H -2.218 1.135 12.196 1.00 . A A . 9 TYR HA 1 1 13 8488 1 1 9 TYR HB2 H -1.619 -0.695 14.639 1.00 . A A . 9 TYR HB2 1 1 13 8489 1 1 9 TYR HB3 H -3.061 0.235 14.344 1.00 . A A . 9 TYR HB3 1 1 13 8490 1 1 9 TYR HD1 H -4.360 -0.344 11.997 1.00 . A A . 9 TYR HD1 1 1 13 8491 1 1 9 TYR HD2 H -1.592 -3.016 13.927 1.00 . A A . 9 TYR HD2 1 1 13 8492 1 1 9 TYR HE1 H -5.088 -2.181 10.533 1.00 . A A . 9 TYR HE1 1 1 13 8493 1 1 9 TYR HE2 H -2.332 -4.833 12.460 1.00 . A A . 9 TYR HE2 1 1 13 8494 1 1 9 TYR HH H -4.819 -4.300 9.965 1.00 . A A . 9 TYR HH 1 1 13 8495 1 1 9 TYR N N -0.554 -0.184 12.011 1.00 . A A . 9 TYR N 1 1 13 8496 1 1 9 TYR O O -1.086 2.129 14.764 1.00 . A A . 9 TYR O 1 1 13 8497 1 1 9 TYR OH O -4.152 -4.634 10.570 1.00 . A A . 9 TYR OH 1 1 13 8498 1 1 10 GLY C C 0.128 4.927 12.757 1.00 . A A . 10 GLY C 1 1 13 8499 1 1 10 GLY CA C 0.849 3.744 13.396 1.00 . A A . 10 GLY CA 1 1 13 8500 1 1 10 GLY H H 0.443 2.061 12.032 1.00 . A A . 10 GLY H 1 1 13 8501 1 1 10 GLY HA2 H 0.941 3.823 14.483 1.00 . A A . 10 GLY HA2 1 1 13 8502 1 1 10 GLY HA3 H 1.888 3.883 13.091 1.00 . A A . 10 GLY HA3 1 1 13 8503 1 1 10 GLY N N 0.223 2.471 12.949 1.00 . A A . 10 GLY N 1 1 13 8504 1 1 10 GLY O O -0.434 4.852 11.665 1.00 . A A . 10 GLY O 1 1 13 8505 1 1 11 LYS C C -0.116 7.946 11.864 1.00 . A A . 11 LYS C 1 1 13 8506 1 1 11 LYS CA C -0.680 7.223 13.123 1.00 . A A . 11 LYS CA 1 1 13 8507 1 1 11 LYS CB C -0.752 8.245 14.285 1.00 . A A . 11 LYS CB 1 1 13 8508 1 1 11 LYS CD C 0.301 9.652 16.214 1.00 . A A . 11 LYS CD 1 1 13 8509 1 1 11 LYS CE C -0.633 9.287 17.389 1.00 . A A . 11 LYS CE 1 1 13 8510 1 1 11 LYS CG C 0.510 8.574 15.126 1.00 . A A . 11 LYS CG 1 1 13 8511 1 1 11 LYS H H 0.824 5.902 14.245 1.00 . A A . 11 LYS H 1 1 13 8512 1 1 11 LYS HA H -1.719 6.868 12.923 1.00 . A A . 11 LYS HA 1 1 13 8513 1 1 11 LYS HB2 H -1.179 9.195 13.908 1.00 . A A . 11 LYS HB2 1 1 13 8514 1 1 11 LYS HB3 H -1.562 7.859 14.917 1.00 . A A . 11 LYS HB3 1 1 13 8515 1 1 11 LYS HD2 H 1.289 9.945 16.618 1.00 . A A . 11 LYS HD2 1 1 13 8516 1 1 11 LYS HD3 H -0.083 10.571 15.732 1.00 . A A . 11 LYS HD3 1 1 13 8517 1 1 11 LYS HE2 H -0.802 10.186 18.009 1.00 . A A . 11 LYS HE2 1 1 13 8518 1 1 11 LYS HE3 H -1.632 8.993 17.018 1.00 . A A . 11 LYS HE3 1 1 13 8519 1 1 11 LYS HG2 H 0.909 7.654 15.592 1.00 . A A . 11 LYS HG2 1 1 13 8520 1 1 11 LYS HG3 H 1.310 8.921 14.446 1.00 . A A . 11 LYS HG3 1 1 13 8521 1 1 11 LYS HZ1 H -0.001 7.348 17.719 1.00 . A A . 11 LYS HZ1 1 1 13 8522 1 1 11 LYS HZ2 H -0.760 8.008 19.007 1.00 . A A . 11 LYS HZ2 1 1 13 8523 1 1 11 LYS N N 0.161 6.037 13.473 1.00 . A A . 11 LYS N 1 1 13 8524 1 1 11 LYS NZ N -0.096 8.218 18.254 1.00 . A A . 11 LYS NZ 1 1 13 8525 1 1 11 LYS O O 1.015 8.438 11.814 1.00 . A A . 11 LYS O 1 1 13 8526 1 1 12 CYS C C -1.927 9.510 9.149 1.00 . A A . 12 CYS C 1 1 13 8527 1 1 12 CYS CA C -0.785 8.543 9.524 1.00 . A A . 12 CYS CA 1 1 13 8528 1 1 12 CYS CB C -0.721 7.406 8.466 1.00 . A A . 12 CYS CB 1 1 13 8529 1 1 12 CYS H H -1.917 7.632 11.234 1.00 . A A . 12 CYS H 1 1 13 8530 1 1 12 CYS HA H 0.162 9.114 9.506 1.00 . A A . 12 CYS HA 1 1 13 8531 1 1 12 CYS HB2 H -0.486 7.797 7.461 1.00 . A A . 12 CYS HB2 1 1 13 8532 1 1 12 CYS HB3 H 0.073 6.687 8.677 1.00 . A A . 12 CYS HB3 1 1 13 8533 1 1 12 CYS N N -1.010 7.955 10.871 1.00 . A A . 12 CYS N 1 1 13 8534 1 1 12 CYS O O -2.919 9.675 9.871 1.00 . A A . 12 CYS O 1 1 13 8535 1 1 12 CYS SG S -2.169 6.385 8.345 1.00 . A A . 12 CYS SG 1 1 13 8536 1 1 13 THR C C -2.828 10.740 5.842 1.00 . A A . 13 THR C 1 1 13 8537 1 1 13 THR CA C -2.903 10.937 7.385 1.00 . A A . 13 THR CA 1 1 13 8538 1 1 13 THR CB C -2.878 12.486 7.759 1.00 . A A . 13 THR CB 1 1 13 8539 1 1 13 THR CG2 C -2.079 12.895 9.017 1.00 . A A . 13 THR CG2 1 1 13 8540 1 1 13 THR H H -0.900 9.885 7.472 1.00 . A A . 13 THR H 1 1 13 8541 1 1 13 THR HA H -3.872 10.515 7.742 1.00 . A A . 13 THR HA 1 1 13 8542 1 1 13 THR HB H -3.942 12.773 7.854 1.00 . A A . 13 THR HB 1 1 13 8543 1 1 13 THR HG1 H -1.364 12.993 6.690 1.00 . A A . 13 THR HG1 1 1 13 8544 1 1 13 THR HG21 H -2.441 12.383 9.924 1.00 . A A . 13 THR HG21 1 1 13 8545 1 1 13 THR HG22 H -0.999 12.671 8.907 1.00 . A A . 13 THR HG22 1 1 13 8546 1 1 13 THR HG23 H -2.154 13.983 9.198 1.00 . A A . 13 THR HG23 1 1 13 8547 1 1 13 THR N N -1.771 10.156 7.977 1.00 . A A . 13 THR N 1 1 13 8548 1 1 13 THR O O -1.761 10.583 5.233 1.00 . A A . 13 THR O 1 1 13 8549 1 1 13 THR OG1 O -2.279 13.278 6.743 1.00 . A A . 13 THR OG1 1 1 13 8550 1 1 14 TRP C C -3.904 12.435 3.382 1.00 . A A . 14 TRP C 1 1 13 8551 1 1 14 TRP CA C -4.146 10.933 3.738 1.00 . A A . 14 TRP CA 1 1 13 8552 1 1 14 TRP CB C -5.537 10.400 3.290 1.00 . A A . 14 TRP CB 1 1 13 8553 1 1 14 TRP CD1 C -4.773 7.855 3.498 1.00 . A A . 14 TRP CD1 1 1 13 8554 1 1 14 TRP CD2 C -6.971 8.197 3.496 1.00 . A A . 14 TRP CD2 1 1 13 8555 1 1 14 TRP CE2 C -6.699 6.806 3.602 1.00 . A A . 14 TRP CE2 1 1 13 8556 1 1 14 TRP CE3 C -8.312 8.661 3.459 1.00 . A A . 14 TRP CE3 1 1 13 8557 1 1 14 TRP CG C -5.761 8.873 3.434 1.00 . A A . 14 TRP CG 1 1 13 8558 1 1 14 TRP CH2 C -9.074 6.352 3.630 1.00 . A A . 14 TRP CH2 1 1 13 8559 1 1 14 TRP CZ2 C -7.763 5.875 3.666 1.00 . A A . 14 TRP CZ2 1 1 13 8560 1 1 14 TRP CZ3 C -9.344 7.723 3.528 1.00 . A A . 14 TRP CZ3 1 1 13 8561 1 1 14 TRP H H -4.790 11.019 5.876 1.00 . A A . 14 TRP H 1 1 13 8562 1 1 14 TRP HA H -3.380 10.306 3.242 1.00 . A A . 14 TRP HA 1 1 13 8563 1 1 14 TRP HB2 H -6.341 10.946 3.822 1.00 . A A . 14 TRP HB2 1 1 13 8564 1 1 14 TRP HB3 H -5.687 10.653 2.224 1.00 . A A . 14 TRP HB3 1 1 13 8565 1 1 14 TRP HD1 H -3.707 8.027 3.467 1.00 . A A . 14 TRP HD1 1 1 13 8566 1 1 14 TRP HE1 H -4.849 5.674 3.674 1.00 . A A . 14 TRP HE1 1 1 13 8567 1 1 14 TRP HE3 H -8.536 9.715 3.377 1.00 . A A . 14 TRP HE3 1 1 13 8568 1 1 14 TRP HH2 H -9.894 5.652 3.681 1.00 . A A . 14 TRP HH2 1 1 13 8569 1 1 14 TRP HZ2 H -7.569 4.815 3.740 1.00 . A A . 14 TRP HZ2 1 1 13 8570 1 1 14 TRP HZ3 H -10.369 8.061 3.502 1.00 . A A . 14 TRP HZ3 1 1 13 8571 1 1 14 TRP N N -4.016 10.849 5.222 1.00 . A A . 14 TRP N 1 1 13 8572 1 1 14 TRP NE1 N -5.336 6.574 3.613 1.00 . A A . 14 TRP NE1 1 1 13 8573 1 1 14 TRP O O -4.765 13.306 3.543 1.00 . A A . 14 TRP O 1 1 13 8574 1 1 15 GLY C C -1.169 14.307 4.057 1.00 . A A . 15 GLY C 1 1 13 8575 1 1 15 GLY CA C -2.064 14.038 2.813 1.00 . A A . 15 GLY CA 1 1 13 8576 1 1 15 GLY H H -2.067 11.846 2.885 1.00 . A A . 15 GLY H 1 1 13 8577 1 1 15 GLY HA2 H -1.462 14.085 1.886 1.00 . A A . 15 GLY HA2 1 1 13 8578 1 1 15 GLY HA3 H -2.837 14.821 2.715 1.00 . A A . 15 GLY HA3 1 1 13 8579 1 1 15 GLY N N -2.654 12.684 2.959 1.00 . A A . 15 GLY N 1 1 13 8580 1 1 15 GLY O O -1.449 15.210 4.849 1.00 . A A . 15 GLY O 1 1 13 8581 1 1 16 GLY C C 1.909 12.472 5.200 1.00 . A A . 16 GLY C 1 1 13 8582 1 1 16 GLY CA C 0.707 13.393 5.435 1.00 . A A . 16 GLY CA 1 1 13 8583 1 1 16 GLY H H -0.038 12.792 3.456 1.00 . A A . 16 GLY H 1 1 13 8584 1 1 16 GLY HA2 H 1.031 14.339 5.890 1.00 . A A . 16 GLY HA2 1 1 13 8585 1 1 16 GLY HA3 H 0.065 12.947 6.218 1.00 . A A . 16 GLY HA3 1 1 13 8586 1 1 16 GLY N N -0.121 13.481 4.211 1.00 . A A . 16 GLY N 1 1 13 8587 1 1 16 GLY O O 2.432 12.319 4.088 1.00 . A A . 16 GLY O 1 1 13 8588 1 1 17 THR C C 2.490 9.425 5.921 1.00 . A A . 17 THR C 1 1 13 8589 1 1 17 THR CA C 3.314 10.724 6.244 1.00 . A A . 17 THR CA 1 1 13 8590 1 1 17 THR CB C 4.124 10.511 7.579 1.00 . A A . 17 THR CB 1 1 13 8591 1 1 17 THR CG2 C 5.471 9.818 7.309 1.00 . A A . 17 THR CG2 1 1 13 8592 1 1 17 THR H H 1.858 12.219 7.138 1.00 . A A . 17 THR H 1 1 13 8593 1 1 17 THR HA H 4.040 10.952 5.435 1.00 . A A . 17 THR HA 1 1 13 8594 1 1 17 THR HB H 3.576 9.837 8.268 1.00 . A A . 17 THR HB 1 1 13 8595 1 1 17 THR HG1 H 3.567 12.167 8.386 1.00 . A A . 17 THR HG1 1 1 13 8596 1 1 17 THR HG21 H 5.365 8.895 6.717 1.00 . A A . 17 THR HG21 1 1 13 8597 1 1 17 THR HG22 H 6.208 10.448 6.781 1.00 . A A . 17 THR HG22 1 1 13 8598 1 1 17 THR HG23 H 5.931 9.490 8.256 1.00 . A A . 17 THR HG23 1 1 13 8599 1 1 17 THR N N 2.321 11.839 6.305 1.00 . A A . 17 THR N 1 1 13 8600 1 1 17 THR O O 1.383 9.173 6.436 1.00 . A A . 17 THR O 1 1 13 8601 1 1 17 THR OG1 O 4.416 11.760 8.199 1.00 . A A . 17 THR OG1 1 1 13 8602 1 1 18 LYS C C 3.662 6.299 5.517 1.00 . A A . 18 LYS C 1 1 13 8603 1 1 18 LYS CA C 2.747 7.245 4.696 1.00 . A A . 18 LYS CA 1 1 13 8604 1 1 18 LYS CB C 2.899 6.956 3.162 1.00 . A A . 18 LYS CB 1 1 13 8605 1 1 18 LYS CD C 1.228 8.399 1.725 1.00 . A A . 18 LYS CD 1 1 13 8606 1 1 18 LYS CE C 0.448 9.202 2.781 1.00 . A A . 18 LYS CE 1 1 13 8607 1 1 18 LYS CG C 2.688 8.058 2.091 1.00 . A A . 18 LYS CG 1 1 13 8608 1 1 18 LYS H H 4.077 8.988 4.845 1.00 . A A . 18 LYS H 1 1 13 8609 1 1 18 LYS HA H 1.697 7.014 4.951 1.00 . A A . 18 LYS HA 1 1 13 8610 1 1 18 LYS HB2 H 3.884 6.488 2.996 1.00 . A A . 18 LYS HB2 1 1 13 8611 1 1 18 LYS HB3 H 2.220 6.118 2.914 1.00 . A A . 18 LYS HB3 1 1 13 8612 1 1 18 LYS HD2 H 1.251 8.978 0.781 1.00 . A A . 18 LYS HD2 1 1 13 8613 1 1 18 LYS HD3 H 0.685 7.467 1.477 1.00 . A A . 18 LYS HD3 1 1 13 8614 1 1 18 LYS HE2 H 0.334 8.619 3.712 1.00 . A A . 18 LYS HE2 1 1 13 8615 1 1 18 LYS HE3 H 0.995 10.123 3.053 1.00 . A A . 18 LYS HE3 1 1 13 8616 1 1 18 LYS HG2 H 3.248 8.976 2.350 1.00 . A A . 18 LYS HG2 1 1 13 8617 1 1 18 LYS HG3 H 3.173 7.701 1.163 1.00 . A A . 18 LYS HG3 1 1 13 8618 1 1 18 LYS HZ1 H -0.802 10.172 1.457 1.00 . A A . 18 LYS HZ1 1 1 13 8619 1 1 18 LYS HZ2 H -1.387 10.121 2.983 1.00 . A A . 18 LYS HZ2 1 1 13 8620 1 1 18 LYS N N 3.133 8.640 5.041 1.00 . A A . 18 LYS N 1 1 13 8621 1 1 18 LYS NZ N -0.887 9.565 2.280 1.00 . A A . 18 LYS NZ 1 1 13 8622 1 1 18 LYS O O 4.614 6.674 6.222 1.00 . A A . 18 LYS O 1 1 13 8623 1 1 19 CYS C C 5.224 3.492 5.498 1.00 . A A . 19 CYS C 1 1 13 8624 1 1 19 CYS CA C 3.958 3.996 6.292 1.00 . A A . 19 CYS CA 1 1 13 8625 1 1 19 CYS CB C 2.845 3.000 6.679 1.00 . A A . 19 CYS CB 1 1 13 8626 1 1 19 CYS H H 2.637 4.822 4.667 1.00 . A A . 19 CYS H 1 1 13 8627 1 1 19 CYS HA H 4.250 4.503 7.244 1.00 . A A . 19 CYS HA 1 1 13 8628 1 1 19 CYS HB2 H 2.457 2.494 5.810 1.00 . A A . 19 CYS HB2 1 1 13 8629 1 1 19 CYS HB3 H 3.214 2.251 7.416 1.00 . A A . 19 CYS HB3 1 1 13 8630 1 1 19 CYS N N 3.338 5.009 5.409 1.00 . A A . 19 CYS N 1 1 13 8631 1 1 19 CYS O O 5.201 3.078 4.337 1.00 . A A . 19 CYS O 1 1 13 8632 1 1 19 CYS SG S 1.466 3.972 7.350 1.00 . A A . 19 CYS SG 1 1 13 8633 1 1 20 CYS C C 8.192 2.791 4.613 1.00 . A A . 20 CYS C 1 1 13 8634 1 1 20 CYS CA C 7.761 3.698 5.812 1.00 . A A . 20 CYS CA 1 1 13 8635 1 1 20 CYS CB C 8.595 3.277 7.046 1.00 . A A . 20 CYS CB 1 1 13 8636 1 1 20 CYS H H 6.105 4.030 7.165 1.00 . A A . 20 CYS H 1 1 13 8637 1 1 20 CYS HA H 7.921 4.753 5.640 1.00 . A A . 20 CYS HA 1 1 13 8638 1 1 20 CYS HB2 H 8.199 3.742 7.954 1.00 . A A . 20 CYS HB2 1 1 13 8639 1 1 20 CYS HB3 H 8.623 2.187 7.221 1.00 . A A . 20 CYS HB3 1 1 13 8640 1 1 20 CYS N N 6.333 3.700 6.221 1.00 . A A . 20 CYS N 1 1 13 8641 1 1 20 CYS O O 8.645 3.347 3.609 1.00 . A A . 20 CYS O 1 1 13 8642 1 1 20 CYS SG S 10.270 3.920 6.879 1.00 . A A . 20 CYS SG 1 1 13 8643 1 1 21 ARG C C 7.727 0.064 2.587 1.00 . A A . 21 ARG C 1 1 13 8644 1 1 21 ARG CA C 8.714 0.501 3.717 1.00 . A A . 21 ARG CA 1 1 13 8645 1 1 21 ARG CB C 9.231 -0.712 4.549 1.00 . A A . 21 ARG CB 1 1 13 8646 1 1 21 ARG CD C 10.692 -2.868 4.578 1.00 . A A . 21 ARG CD 1 1 13 8647 1 1 21 ARG CG C 10.341 -1.546 3.864 1.00 . A A . 21 ARG CG 1 1 13 8648 1 1 21 ARG CZ C 10.896 -2.870 7.107 1.00 . A A . 21 ARG CZ 1 1 13 8649 1 1 21 ARG H H 7.594 1.180 5.540 1.00 . A A . 21 ARG H 1 1 13 8650 1 1 21 ARG HA H 9.544 1.007 3.196 1.00 . A A . 21 ARG HA 1 1 13 8651 1 1 21 ARG HB2 H 9.648 -0.374 5.519 1.00 . A A . 21 ARG HB2 1 1 13 8652 1 1 21 ARG HB3 H 8.385 -1.373 4.819 1.00 . A A . 21 ARG HB3 1 1 13 8653 1 1 21 ARG HD2 H 9.793 -3.509 4.660 1.00 . A A . 21 ARG HD2 1 1 13 8654 1 1 21 ARG HD3 H 11.397 -3.441 3.949 1.00 . A A . 21 ARG HD3 1 1 13 8655 1 1 21 ARG HG2 H 10.034 -1.798 2.833 1.00 . A A . 21 ARG HG2 1 1 13 8656 1 1 21 ARG HG3 H 11.251 -0.927 3.745 1.00 . A A . 21 ARG HG3 1 1 13 8657 1 1 21 ARG HH11 H 9.116 -3.624 6.553 1.00 . A A . 21 ARG HH11 1 1 13 8658 1 1 21 ARG HH12 H 9.464 -3.532 8.353 1.00 . A A . 21 ARG HH12 1 1 13 8659 1 1 21 ARG HH21 H 12.593 -2.158 7.894 1.00 . A A . 21 ARG HH21 1 1 13 8660 1 1 21 ARG HH22 H 11.309 -2.753 9.062 1.00 . A A . 21 ARG HH22 1 1 13 8661 1 1 21 ARG N N 8.114 1.452 4.716 1.00 . A A . 21 ARG N 1 1 13 8662 1 1 21 ARG NE N 11.320 -2.647 5.924 1.00 . A A . 21 ARG NE 1 1 13 8663 1 1 21 ARG NH1 N 9.702 -3.396 7.364 1.00 . A A . 21 ARG NH1 1 1 13 8664 1 1 21 ARG NH2 N 11.678 -2.562 8.124 1.00 . A A . 21 ARG NH2 1 1 13 8665 1 1 21 ARG O O 7.701 -1.080 2.122 1.00 . A A . 21 ARG O 1 1 13 8666 1 1 22 GLY C C 4.533 0.109 1.850 1.00 . A A . 22 GLY C 1 1 13 8667 1 1 22 GLY CA C 5.771 0.811 1.257 1.00 . A A . 22 GLY CA 1 1 13 8668 1 1 22 GLY H H 7.059 1.796 2.852 1.00 . A A . 22 GLY H 1 1 13 8669 1 1 22 GLY HA2 H 5.460 1.787 0.841 1.00 . A A . 22 GLY HA2 1 1 13 8670 1 1 22 GLY HA3 H 6.102 0.229 0.394 1.00 . A A . 22 GLY HA3 1 1 13 8671 1 1 22 GLY N N 6.924 1.032 2.165 1.00 . A A . 22 GLY N 1 1 13 8672 1 1 22 GLY O O 3.909 -0.739 1.207 1.00 . A A . 22 GLY O 1 1 13 8673 1 1 23 ARG C C 1.865 1.271 3.376 1.00 . A A . 23 ARG C 1 1 13 8674 1 1 23 ARG CA C 2.939 0.178 3.750 1.00 . A A . 23 ARG CA 1 1 13 8675 1 1 23 ARG CB C 3.163 0.146 5.289 1.00 . A A . 23 ARG CB 1 1 13 8676 1 1 23 ARG CD C 4.930 -1.743 5.716 1.00 . A A . 23 ARG CD 1 1 13 8677 1 1 23 ARG CG C 3.554 -1.130 6.036 1.00 . A A . 23 ARG CG 1 1 13 8678 1 1 23 ARG CZ C 6.584 -1.142 7.531 1.00 . A A . 23 ARG CZ 1 1 13 8679 1 1 23 ARG H H 4.794 1.299 3.375 1.00 . A A . 23 ARG H 1 1 13 8680 1 1 23 ARG HA H 2.606 -0.829 3.453 1.00 . A A . 23 ARG HA 1 1 13 8681 1 1 23 ARG HB2 H 3.902 0.912 5.579 1.00 . A A . 23 ARG HB2 1 1 13 8682 1 1 23 ARG HB3 H 2.210 0.423 5.779 1.00 . A A . 23 ARG HB3 1 1 13 8683 1 1 23 ARG HD2 H 4.940 -2.804 6.029 1.00 . A A . 23 ARG HD2 1 1 13 8684 1 1 23 ARG HD3 H 5.102 -1.760 4.625 1.00 . A A . 23 ARG HD3 1 1 13 8685 1 1 23 ARG HG2 H 3.498 -0.885 7.119 1.00 . A A . 23 ARG HG2 1 1 13 8686 1 1 23 ARG HG3 H 2.756 -1.867 5.871 1.00 . A A . 23 ARG HG3 1 1 13 8687 1 1 23 ARG HH11 H 5.325 -2.570 8.178 1.00 . A A . 23 ARG HH11 1 1 13 8688 1 1 23 ARG HH12 H 6.634 -2.019 9.339 1.00 . A A . 23 ARG HH12 1 1 13 8689 1 1 23 ARG HH21 H 7.951 0.254 7.108 1.00 . A A . 23 ARG HH21 1 1 13 8690 1 1 23 ARG HH22 H 8.026 -0.521 8.769 1.00 . A A . 23 ARG HH22 1 1 13 8691 1 1 23 ARG N N 4.188 0.536 3.063 1.00 . A A . 23 ARG N 1 1 13 8692 1 1 23 ARG NE N 6.061 -1.015 6.375 1.00 . A A . 23 ARG NE 1 1 13 8693 1 1 23 ARG NH1 N 6.135 -1.999 8.443 1.00 . A A . 23 ARG NH1 1 1 13 8694 1 1 23 ARG NH2 N 7.625 -0.394 7.833 1.00 . A A . 23 ARG NH2 1 1 13 8695 1 1 23 ARG O O 2.123 2.480 3.559 1.00 . A A . 23 ARG O 1 1 13 8696 1 1 24 PRO C C -1.150 2.185 4.103 1.00 . A A . 24 PRO C 1 1 13 8697 1 1 24 PRO CA C -0.479 1.856 2.728 1.00 . A A . 24 PRO CA 1 1 13 8698 1 1 24 PRO CB C -1.385 1.129 1.711 1.00 . A A . 24 PRO CB 1 1 13 8699 1 1 24 PRO CD C 0.299 -0.468 2.437 1.00 . A A . 24 PRO CD 1 1 13 8700 1 1 24 PRO CG C -1.140 -0.366 1.924 1.00 . A A . 24 PRO CG 1 1 13 8701 1 1 24 PRO HA H -0.144 2.821 2.300 1.00 . A A . 24 PRO HA 1 1 13 8702 1 1 24 PRO HB2 H -2.455 1.394 1.796 1.00 . A A . 24 PRO HB2 1 1 13 8703 1 1 24 PRO HB3 H -1.082 1.406 0.683 1.00 . A A . 24 PRO HB3 1 1 13 8704 1 1 24 PRO HD2 H 0.369 -1.198 3.265 1.00 . A A . 24 PRO HD2 1 1 13 8705 1 1 24 PRO HD3 H 0.979 -0.802 1.630 1.00 . A A . 24 PRO HD3 1 1 13 8706 1 1 24 PRO HG2 H -1.845 -0.759 2.678 1.00 . A A . 24 PRO HG2 1 1 13 8707 1 1 24 PRO HG3 H -1.302 -0.955 1.002 1.00 . A A . 24 PRO HG3 1 1 13 8708 1 1 24 PRO N N 0.647 0.903 2.873 1.00 . A A . 24 PRO N 1 1 13 8709 1 1 24 PRO O O -0.713 1.709 5.160 1.00 . A A . 24 PRO O 1 1 13 8710 1 1 25 CYS C C -4.472 3.155 5.065 1.00 . A A . 25 CYS C 1 1 13 8711 1 1 25 CYS CA C -2.951 3.387 5.314 1.00 . A A . 25 CYS CA 1 1 13 8712 1 1 25 CYS CB C -2.659 4.861 5.702 1.00 . A A . 25 CYS CB 1 1 13 8713 1 1 25 CYS H H -2.445 3.383 3.156 1.00 . A A . 25 CYS H 1 1 13 8714 1 1 25 CYS HA H -2.632 2.751 6.166 1.00 . A A . 25 CYS HA 1 1 13 8715 1 1 25 CYS HB2 H -2.151 5.395 4.887 1.00 . A A . 25 CYS HB2 1 1 13 8716 1 1 25 CYS HB3 H -3.587 5.394 5.957 1.00 . A A . 25 CYS HB3 1 1 13 8717 1 1 25 CYS N N -2.197 3.024 4.085 1.00 . A A . 25 CYS N 1 1 13 8718 1 1 25 CYS O O -5.013 3.329 3.967 1.00 . A A . 25 CYS O 1 1 13 8719 1 1 25 CYS SG S -1.613 4.894 7.143 1.00 . A A . 25 CYS SG 1 1 13 8720 1 1 26 ARG C C -6.953 3.381 7.580 1.00 . A A . 26 ARG C 1 1 13 8721 1 1 26 ARG CA C -6.615 2.657 6.258 1.00 . A A . 26 ARG CA 1 1 13 8722 1 1 26 ARG CB C -7.112 1.184 6.270 1.00 . A A . 26 ARG CB 1 1 13 8723 1 1 26 ARG CD C -7.726 0.899 3.755 1.00 . A A . 26 ARG CD 1 1 13 8724 1 1 26 ARG CG C -6.914 0.385 4.961 1.00 . A A . 26 ARG CG 1 1 13 8725 1 1 26 ARG CZ C -7.871 0.394 1.305 1.00 . A A . 26 ARG CZ 1 1 13 8726 1 1 26 ARG H H -4.588 2.814 7.028 1.00 . A A . 26 ARG H 1 1 13 8727 1 1 26 ARG HA H -7.087 3.177 5.401 1.00 . A A . 26 ARG HA 1 1 13 8728 1 1 26 ARG HB2 H -6.618 0.632 7.094 1.00 . A A . 26 ARG HB2 1 1 13 8729 1 1 26 ARG HB3 H -8.189 1.164 6.527 1.00 . A A . 26 ARG HB3 1 1 13 8730 1 1 26 ARG HD2 H -8.807 0.875 3.986 1.00 . A A . 26 ARG HD2 1 1 13 8731 1 1 26 ARG HD3 H -7.472 1.957 3.551 1.00 . A A . 26 ARG HD3 1 1 13 8732 1 1 26 ARG HG2 H -5.838 0.372 4.706 1.00 . A A . 26 ARG HG2 1 1 13 8733 1 1 26 ARG HG3 H -7.180 -0.672 5.156 1.00 . A A . 26 ARG HG3 1 1 13 8734 1 1 26 ARG HH11 H -8.826 2.098 1.791 1.00 . A A . 26 ARG HH11 1 1 13 8735 1 1 26 ARG HH12 H -8.845 1.604 0.024 1.00 . A A . 26 ARG HH12 1 1 13 8736 1 1 26 ARG HH21 H -6.996 -1.251 0.572 1.00 . A A . 26 ARG HH21 1 1 13 8737 1 1 26 ARG HH22 H -7.878 -0.166 -0.617 1.00 . A A . 26 ARG HH22 1 1 13 8738 1 1 26 ARG N N -5.138 2.752 6.159 1.00 . A A . 26 ARG N 1 1 13 8739 1 1 26 ARG NE N -7.453 0.084 2.547 1.00 . A A . 26 ARG NE 1 1 13 8740 1 1 26 ARG NH1 N -8.588 1.477 1.010 1.00 . A A . 26 ARG NH1 1 1 13 8741 1 1 26 ARG NH2 N -7.549 -0.424 0.320 1.00 . A A . 26 ARG NH2 1 1 13 8742 1 1 26 ARG O O -6.359 3.113 8.638 1.00 . A A . 26 ARG O 1 1 13 8743 1 1 27 CYS C C -8.885 4.595 9.846 1.00 . A A . 27 CYS C 1 1 13 8744 1 1 27 CYS CA C -8.096 5.254 8.667 1.00 . A A . 27 CYS CA 1 1 13 8745 1 1 27 CYS CB C -8.862 6.501 8.174 1.00 . A A . 27 CYS CB 1 1 13 8746 1 1 27 CYS H H -8.311 4.502 6.598 1.00 . A A . 27 CYS H 1 1 13 8747 1 1 27 CYS HA H -7.076 5.552 8.957 1.00 . A A . 27 CYS HA 1 1 13 8748 1 1 27 CYS HB2 H -9.892 6.269 7.919 1.00 . A A . 27 CYS HB2 1 1 13 8749 1 1 27 CYS HB3 H -8.934 7.247 8.987 1.00 . A A . 27 CYS HB3 1 1 13 8750 1 1 27 CYS N N -7.896 4.339 7.522 1.00 . A A . 27 CYS N 1 1 13 8751 1 1 27 CYS O O -9.474 3.513 9.743 1.00 . A A . 27 CYS O 1 1 13 8752 1 1 27 CYS SG S -8.015 7.294 6.804 1.00 . A A . 27 CYS SG 1 1 13 8753 1 1 28 SER C C -10.995 4.853 12.291 1.00 . A A . 28 SER C 1 1 13 8754 1 1 28 SER CA C -9.426 4.849 12.282 1.00 . A A . 28 SER CA 1 1 13 8755 1 1 28 SER CB C -8.771 5.798 13.336 1.00 . A A . 28 SER CB 1 1 13 8756 1 1 28 SER H H -8.309 6.173 10.924 1.00 . A A . 28 SER H 1 1 13 8757 1 1 28 SER HA H -9.136 3.813 12.526 1.00 . A A . 28 SER HA 1 1 13 8758 1 1 28 SER HB2 H -7.707 6.011 13.115 1.00 . A A . 28 SER HB2 1 1 13 8759 1 1 28 SER HB3 H -9.291 6.773 13.368 1.00 . A A . 28 SER HB3 1 1 13 8760 1 1 28 SER HG H -8.403 5.859 15.223 1.00 . A A . 28 SER HG 1 1 13 8761 1 1 28 SER N N -8.850 5.304 10.990 1.00 . A A . 28 SER N 1 1 13 8762 1 1 28 SER O O -11.686 4.897 11.267 1.00 . A A . 28 SER O 1 1 13 8763 1 1 28 SER OG O -8.811 5.219 14.635 1.00 . A A . 28 SER OG 1 1 13 8764 1 1 29 MET C C -13.907 5.706 13.444 1.00 . A A . 29 MET C 1 1 13 8765 1 1 29 MET CA C -12.963 4.528 13.830 1.00 . A A . 29 MET CA 1 1 13 8766 1 1 29 MET CB C -13.025 4.272 15.361 1.00 . A A . 29 MET CB 1 1 13 8767 1 1 29 MET CE C -12.147 6.094 19.012 1.00 . A A . 29 MET CE 1 1 13 8768 1 1 29 MET CG C -12.637 5.360 16.383 1.00 . A A . 29 MET CG 1 1 13 8769 1 1 29 MET H H -10.779 4.839 14.214 1.00 . A A . 29 MET H 1 1 13 8770 1 1 29 MET HA H -13.334 3.636 13.287 1.00 . A A . 29 MET HA 1 1 13 8771 1 1 29 MET HB2 H -14.048 3.949 15.603 1.00 . A A . 29 MET HB2 1 1 13 8772 1 1 29 MET HB3 H -12.373 3.419 15.562 1.00 . A A . 29 MET HB3 1 1 13 8773 1 1 29 MET HE1 H -12.928 6.869 18.906 1.00 . A A . 29 MET HE1 1 1 13 8774 1 1 29 MET HE2 H -12.068 5.832 20.082 1.00 . A A . 29 MET HE2 1 1 13 8775 1 1 29 MET HE3 H -11.182 6.528 18.694 1.00 . A A . 29 MET HE3 1 1 13 8776 1 1 29 MET HG2 H -11.664 5.822 16.133 1.00 . A A . 29 MET HG2 1 1 13 8777 1 1 29 MET HG3 H -13.393 6.162 16.392 1.00 . A A . 29 MET HG3 1 1 13 8778 1 1 29 MET N N -11.517 4.735 13.512 1.00 . A A . 29 MET N 1 1 13 8779 1 1 29 MET O O -15.015 5.488 12.944 1.00 . A A . 29 MET O 1 1 13 8780 1 1 29 MET SD S -12.549 4.633 18.032 1.00 . A A . 29 MET SD 1 1 13 8781 1 1 30 ILE C C -13.998 8.366 11.723 1.00 . A A . 30 ILE C 1 1 13 8782 1 1 30 ILE CA C -14.124 8.195 13.278 1.00 . A A . 30 ILE CA 1 1 13 8783 1 1 30 ILE CB C -13.501 9.421 14.069 1.00 . A A . 30 ILE CB 1 1 13 8784 1 1 30 ILE CD1 C -12.918 10.243 16.493 1.00 . A A . 30 ILE CD1 1 1 13 8785 1 1 30 ILE CG1 C -13.751 9.299 15.608 1.00 . A A . 30 ILE CG1 1 1 13 8786 1 1 30 ILE CG2 C -14.137 10.762 13.597 1.00 . A A . 30 ILE CG2 1 1 13 8787 1 1 30 ILE H H -12.479 6.820 14.069 1.00 . A A . 30 ILE H 1 1 13 8788 1 1 30 ILE HA H -15.198 8.115 13.526 1.00 . A A . 30 ILE HA 1 1 13 8789 1 1 30 ILE HB H -12.410 9.462 13.885 1.00 . A A . 30 ILE HB 1 1 13 8790 1 1 30 ILE HD11 H -11.835 10.124 16.308 1.00 . A A . 30 ILE HD11 1 1 13 8791 1 1 30 ILE HD12 H -13.171 11.305 16.328 1.00 . A A . 30 ILE HD12 1 1 13 8792 1 1 30 ILE HD13 H -13.091 10.034 17.564 1.00 . A A . 30 ILE HD13 1 1 13 8793 1 1 30 ILE HG12 H -14.826 9.422 15.842 1.00 . A A . 30 ILE HG12 1 1 13 8794 1 1 30 ILE HG13 H -13.509 8.280 15.948 1.00 . A A . 30 ILE HG13 1 1 13 8795 1 1 30 ILE HG21 H -15.234 10.778 13.736 1.00 . A A . 30 ILE HG21 1 1 13 8796 1 1 30 ILE HG22 H -13.725 11.635 14.135 1.00 . A A . 30 ILE HG22 1 1 13 8797 1 1 30 ILE HG23 H -13.942 10.960 12.527 1.00 . A A . 30 ILE HG23 1 1 13 8798 1 1 30 ILE N N -13.426 6.931 13.673 1.00 . A A . 30 ILE N 1 1 13 8799 1 1 30 ILE O O -15.023 8.495 11.047 1.00 . A A . 30 ILE O 1 1 13 8800 1 1 31 GLY C C -11.253 9.641 9.590 1.00 . A A . 31 GLY C 1 1 13 8801 1 1 31 GLY CA C -12.500 8.756 9.779 1.00 . A A . 31 GLY CA 1 1 13 8802 1 1 31 GLY H H -12.041 8.288 11.916 1.00 . A A . 31 GLY H 1 1 13 8803 1 1 31 GLY HA2 H -12.376 7.826 9.196 1.00 . A A . 31 GLY HA2 1 1 13 8804 1 1 31 GLY HA3 H -13.364 9.275 9.320 1.00 . A A . 31 GLY HA3 1 1 13 8805 1 1 31 GLY N N -12.765 8.387 11.192 1.00 . A A . 31 GLY N 1 1 13 8806 1 1 31 GLY O O -10.411 9.344 8.739 1.00 . A A . 31 GLY O 1 1 13 8807 1 1 32 THR C C -8.960 10.984 11.533 1.00 . A A . 32 THR C 1 1 13 8808 1 1 32 THR CA C -9.922 11.567 10.449 1.00 . A A . 32 THR CA 1 1 13 8809 1 1 32 THR CB C -10.259 13.048 10.817 1.00 . A A . 32 THR CB 1 1 13 8810 1 1 32 THR CG2 C -11.071 13.762 9.719 1.00 . A A . 32 THR CG2 1 1 13 8811 1 1 32 THR H H -11.859 10.724 11.125 1.00 . A A . 32 THR H 1 1 13 8812 1 1 32 THR HA H -9.411 11.564 9.464 1.00 . A A . 32 THR HA 1 1 13 8813 1 1 32 THR HB H -9.294 13.576 10.954 1.00 . A A . 32 THR HB 1 1 13 8814 1 1 32 THR HG1 H -11.173 14.046 12.190 1.00 . A A . 32 THR HG1 1 1 13 8815 1 1 32 THR HG21 H -10.539 13.755 8.750 1.00 . A A . 32 THR HG21 1 1 13 8816 1 1 32 THR HG22 H -12.060 13.294 9.557 1.00 . A A . 32 THR HG22 1 1 13 8817 1 1 32 THR HG23 H -11.251 14.820 9.982 1.00 . A A . 32 THR HG23 1 1 13 8818 1 1 32 THR N N -11.153 10.726 10.379 1.00 . A A . 32 THR N 1 1 13 8819 1 1 32 THR O O -9.364 10.275 12.463 1.00 . A A . 32 THR O 1 1 13 8820 1 1 32 THR OG1 O -11.029 13.113 12.018 1.00 . A A . 32 THR OG1 1 1 13 8821 1 1 33 ASN C C -6.404 9.211 11.735 1.00 . A A . 33 ASN C 1 1 13 8822 1 1 33 ASN CA C -6.500 10.722 12.110 1.00 . A A . 33 ASN CA 1 1 13 8823 1 1 33 ASN CB C -6.632 10.914 13.660 1.00 . A A . 33 ASN CB 1 1 13 8824 1 1 33 ASN CG C -6.575 12.377 14.143 1.00 . A A . 33 ASN CG 1 1 13 8825 1 1 33 ASN H H -7.483 11.807 10.481 1.00 . A A . 33 ASN H 1 1 13 8826 1 1 33 ASN HA H -5.573 11.226 11.773 1.00 . A A . 33 ASN HA 1 1 13 8827 1 1 33 ASN HB2 H -7.555 10.452 14.053 1.00 . A A . 33 ASN HB2 1 1 13 8828 1 1 33 ASN HB3 H -5.833 10.333 14.160 1.00 . A A . 33 ASN HB3 1 1 13 8829 1 1 33 ASN HD21 H -4.585 12.263 14.366 1.00 . A A . 33 ASN HD21 1 1 13 8830 1 1 33 ASN HD22 H -5.385 13.860 14.782 1.00 . A A . 33 ASN HD22 1 1 13 8831 1 1 33 ASN N N -7.659 11.305 11.358 1.00 . A A . 33 ASN N 1 1 13 8832 1 1 33 ASN ND2 N -5.394 12.886 14.461 1.00 . A A . 33 ASN ND2 1 1 13 8833 1 1 33 ASN O O -6.744 8.315 12.515 1.00 . A A . 33 ASN O 1 1 13 8834 1 1 33 ASN OD1 O -7.596 13.058 14.232 1.00 . A A . 33 ASN OD1 1 1 13 8835 1 1 34 CYS C C -4.713 6.743 10.639 1.00 . A A . 34 CYS C 1 1 13 8836 1 1 34 CYS CA C -5.819 7.590 9.932 1.00 . A A . 34 CYS CA 1 1 13 8837 1 1 34 CYS CB C -5.490 7.717 8.425 1.00 . A A . 34 CYS CB 1 1 13 8838 1 1 34 CYS H H -5.852 9.823 9.936 1.00 . A A . 34 CYS H 1 1 13 8839 1 1 34 CYS HA H -6.795 7.097 10.047 1.00 . A A . 34 CYS HA 1 1 13 8840 1 1 34 CYS HB2 H -4.508 8.164 8.291 1.00 . A A . 34 CYS HB2 1 1 13 8841 1 1 34 CYS HB3 H -5.427 6.715 7.960 1.00 . A A . 34 CYS HB3 1 1 13 8842 1 1 34 CYS N N -5.925 8.964 10.500 1.00 . A A . 34 CYS N 1 1 13 8843 1 1 34 CYS O O -3.911 7.274 11.416 1.00 . A A . 34 CYS O 1 1 13 8844 1 1 34 CYS SG S -6.782 8.642 7.587 1.00 . A A . 34 CYS SG 1 1 13 8845 1 1 35 GLU C C -2.990 3.671 9.696 1.00 . A A . 35 GLU C 1 1 13 8846 1 1 35 GLU CA C -3.540 4.565 10.860 1.00 . A A . 35 GLU CA 1 1 13 8847 1 1 35 GLU CB C -3.957 3.636 12.042 1.00 . A A . 35 GLU CB 1 1 13 8848 1 1 35 GLU CD C -5.191 3.140 14.227 1.00 . A A . 35 GLU CD 1 1 13 8849 1 1 35 GLU CG C -4.922 4.166 13.125 1.00 . A A . 35 GLU CG 1 1 13 8850 1 1 35 GLU H H -5.410 5.107 9.708 1.00 . A A . 35 GLU H 1 1 13 8851 1 1 35 GLU HA H -2.719 5.217 11.212 1.00 . A A . 35 GLU HA 1 1 13 8852 1 1 35 GLU HB2 H -4.262 2.652 11.649 1.00 . A A . 35 GLU HB2 1 1 13 8853 1 1 35 GLU HB3 H -3.017 3.385 12.569 1.00 . A A . 35 GLU HB3 1 1 13 8854 1 1 35 GLU HE2 H -4.328 2.412 15.814 1.00 . A A . 35 GLU HE2 1 1 13 8855 1 1 35 GLU HG2 H -4.512 5.093 13.570 1.00 . A A . 35 GLU HG2 1 1 13 8856 1 1 35 GLU HG3 H -5.884 4.456 12.665 1.00 . A A . 35 GLU HG3 1 1 13 8857 1 1 35 GLU N N -4.680 5.416 10.375 1.00 . A A . 35 GLU N 1 1 13 8858 1 1 35 GLU O O -3.548 3.571 8.602 1.00 . A A . 35 GLU O 1 1 13 8859 1 1 35 GLU OE1 O -6.220 2.469 14.289 1.00 . A A . 35 GLU OE1 1 1 13 8860 1 1 35 GLU OE2 O -4.156 3.058 15.125 1.00 . A A . 35 GLU OE2 1 1 13 8861 1 1 36 CYS C C -1.669 0.782 8.913 1.00 . A A . 36 CYS C 1 1 13 8862 1 1 36 CYS CA C -1.051 2.209 9.016 1.00 . A A . 36 CYS CA 1 1 13 8863 1 1 36 CYS CB C 0.446 2.168 9.520 1.00 . A A . 36 CYS CB 1 1 13 8864 1 1 36 CYS H H -1.651 3.096 10.990 1.00 . A A . 36 CYS H 1 1 13 8865 1 1 36 CYS HA H -1.089 2.703 8.010 1.00 . A A . 36 CYS HA 1 1 13 8866 1 1 36 CYS HB2 H 0.514 1.766 10.531 1.00 . A A . 36 CYS HB2 1 1 13 8867 1 1 36 CYS HB3 H 1.105 1.477 8.973 1.00 . A A . 36 CYS HB3 1 1 13 8868 1 1 36 CYS N N -1.850 3.018 9.986 1.00 . A A . 36 CYS N 1 1 13 8869 1 1 36 CYS O O -2.464 0.343 9.754 1.00 . A A . 36 CYS O 1 1 13 8870 1 1 36 CYS SG S 1.235 3.747 9.299 1.00 . A A . 36 CYS SG 1 1 13 8871 1 1 37 THR C C -0.631 -2.154 6.953 1.00 . A A . 37 THR C 1 1 13 8872 1 1 37 THR CA C -1.784 -1.345 7.652 1.00 . A A . 37 THR CA 1 1 13 8873 1 1 37 THR CB C -3.121 -1.382 6.833 1.00 . A A . 37 THR CB 1 1 13 8874 1 1 37 THR CG2 C -3.053 -0.809 5.404 1.00 . A A . 37 THR CG2 1 1 13 8875 1 1 37 THR H H -0.697 0.536 7.183 1.00 . A A . 37 THR H 1 1 13 8876 1 1 37 THR HA H -1.989 -1.807 8.635 1.00 . A A . 37 THR HA 1 1 13 8877 1 1 37 THR HB H -3.872 -0.850 7.442 1.00 . A A . 37 THR HB 1 1 13 8878 1 1 37 THR HG1 H -2.866 -3.170 6.173 1.00 . A A . 37 THR HG1 1 1 13 8879 1 1 37 THR HG21 H -2.254 -1.281 4.807 1.00 . A A . 37 THR HG21 1 1 13 8880 1 1 37 THR HG22 H -3.999 -0.973 4.859 1.00 . A A . 37 THR HG22 1 1 13 8881 1 1 37 THR HG23 H -2.876 0.279 5.413 1.00 . A A . 37 THR HG23 1 1 13 8882 1 1 37 THR N N -1.331 0.063 7.836 1.00 . A A . 37 THR N 1 1 13 8883 1 1 37 THR O O 0.062 -1.604 6.087 1.00 . A A . 37 THR O 1 1 13 8884 1 1 37 THR OG1 O -3.548 -2.731 6.687 1.00 . A A . 37 THR OG1 1 1 13 8885 1 1 38 PRO C C 0.433 -4.352 4.985 1.00 . A A . 38 PRO C 1 1 13 8886 1 1 38 PRO CA C 0.513 -4.379 6.548 1.00 . A A . 38 PRO CA 1 1 13 8887 1 1 38 PRO CB C 0.132 -5.762 7.118 1.00 . A A . 38 PRO CB 1 1 13 8888 1 1 38 PRO CD C -1.113 -4.150 8.389 1.00 . A A . 38 PRO CD 1 1 13 8889 1 1 38 PRO CG C -0.406 -5.494 8.521 1.00 . A A . 38 PRO CG 1 1 13 8890 1 1 38 PRO HA H 1.549 -4.102 6.829 1.00 . A A . 38 PRO HA 1 1 13 8891 1 1 38 PRO HB2 H -0.657 -6.250 6.512 1.00 . A A . 38 PRO HB2 1 1 13 8892 1 1 38 PRO HB3 H 0.988 -6.456 7.148 1.00 . A A . 38 PRO HB3 1 1 13 8893 1 1 38 PRO HD2 H -2.189 -4.253 8.177 1.00 . A A . 38 PRO HD2 1 1 13 8894 1 1 38 PRO HD3 H -1.053 -3.567 9.323 1.00 . A A . 38 PRO HD3 1 1 13 8895 1 1 38 PRO HG2 H -1.079 -6.294 8.882 1.00 . A A . 38 PRO HG2 1 1 13 8896 1 1 38 PRO HG3 H 0.429 -5.418 9.243 1.00 . A A . 38 PRO HG3 1 1 13 8897 1 1 38 PRO N N -0.434 -3.475 7.264 1.00 . A A . 38 PRO N 1 1 13 8898 1 1 38 PRO O O -0.598 -3.991 4.405 1.00 . A A . 38 PRO O 1 1 13 8899 1 1 39 ARG C C 0.767 -5.507 2.047 1.00 . A A . 39 ARG C 1 1 13 8900 1 1 39 ARG CA C 1.701 -4.551 2.846 1.00 . A A . 39 ARG CA 1 1 13 8901 1 1 39 ARG CB C 3.165 -4.863 2.420 1.00 . A A . 39 ARG CB 1 1 13 8902 1 1 39 ARG CD C 5.636 -4.040 2.345 1.00 . A A . 39 ARG CD 1 1 13 8903 1 1 39 ARG CG C 4.232 -3.886 2.960 1.00 . A A . 39 ARG CG 1 1 13 8904 1 1 39 ARG CZ C 6.792 -3.582 0.167 1.00 . A A . 39 ARG CZ 1 1 13 8905 1 1 39 ARG H H 2.326 -5.014 4.915 1.00 . A A . 39 ARG H 1 1 13 8906 1 1 39 ARG HA H 1.473 -3.496 2.587 1.00 . A A . 39 ARG HA 1 1 13 8907 1 1 39 ARG HB2 H 3.443 -5.899 2.698 1.00 . A A . 39 ARG HB2 1 1 13 8908 1 1 39 ARG HB3 H 3.218 -4.842 1.314 1.00 . A A . 39 ARG HB3 1 1 13 8909 1 1 39 ARG HD2 H 6.356 -3.465 2.959 1.00 . A A . 39 ARG HD2 1 1 13 8910 1 1 39 ARG HD3 H 5.963 -5.096 2.401 1.00 . A A . 39 ARG HD3 1 1 13 8911 1 1 39 ARG HG2 H 3.885 -2.843 2.842 1.00 . A A . 39 ARG HG2 1 1 13 8912 1 1 39 ARG HG3 H 4.315 -4.040 4.051 1.00 . A A . 39 ARG HG3 1 1 13 8913 1 1 39 ARG HH11 H 8.016 -4.438 1.515 1.00 . A A . 39 ARG HH11 1 1 13 8914 1 1 39 ARG HH12 H 8.730 -4.039 -0.127 1.00 . A A . 39 ARG HH12 1 1 13 8915 1 1 39 ARG HH21 H 5.780 -2.728 -1.335 1.00 . A A . 39 ARG HH21 1 1 13 8916 1 1 39 ARG HH22 H 7.544 -3.134 -1.634 1.00 . A A . 39 ARG HH22 1 1 13 8917 1 1 39 ARG N N 1.540 -4.733 4.317 1.00 . A A . 39 ARG N 1 1 13 8918 1 1 39 ARG NE N 5.694 -3.549 0.945 1.00 . A A . 39 ARG NE 1 1 13 8919 1 1 39 ARG NH1 N 7.968 -4.070 0.559 1.00 . A A . 39 ARG NH1 1 1 13 8920 1 1 39 ARG NH2 N 6.696 -3.099 -1.058 1.00 . A A . 39 ARG NH2 1 1 13 8921 1 1 39 ARG O O 0.760 -6.725 2.257 1.00 . A A . 39 ARG O 1 1 13 8922 1 1 40 LEU C C -0.005 -5.544 -1.260 1.00 . A A . 40 LEU C 1 1 13 8923 1 1 40 LEU CA C -0.765 -5.676 0.091 1.00 . A A . 40 LEU CA 1 1 13 8924 1 1 40 LEU CB C -2.217 -5.114 0.007 1.00 . A A . 40 LEU CB 1 1 13 8925 1 1 40 LEU CD1 C -4.428 -4.475 1.105 1.00 . A A . 40 LEU CD1 1 1 13 8926 1 1 40 LEU CD2 C -3.419 -6.730 1.634 1.00 . A A . 40 LEU CD2 1 1 13 8927 1 1 40 LEU CG C -3.113 -5.262 1.273 1.00 . A A . 40 LEU CG 1 1 13 8928 1 1 40 LEU H H 0.135 -3.898 1.034 1.00 . A A . 40 LEU H 1 1 13 8929 1 1 40 LEU HA H -0.841 -6.749 0.361 1.00 . A A . 40 LEU HA 1 1 13 8930 1 1 40 LEU HB2 H -2.167 -4.042 -0.270 1.00 . A A . 40 LEU HB2 1 1 13 8931 1 1 40 LEU HB3 H -2.735 -5.594 -0.846 1.00 . A A . 40 LEU HB3 1 1 13 8932 1 1 40 LEU HD11 H -4.238 -3.403 0.910 1.00 . A A . 40 LEU HD11 1 1 13 8933 1 1 40 LEU HD12 H -5.039 -4.858 0.266 1.00 . A A . 40 LEU HD12 1 1 13 8934 1 1 40 LEU HD13 H -5.053 -4.524 2.016 1.00 . A A . 40 LEU HD13 1 1 13 8935 1 1 40 LEU HD21 H -3.935 -7.262 0.812 1.00 . A A . 40 LEU HD21 1 1 13 8936 1 1 40 LEU HD22 H -2.498 -7.297 1.866 1.00 . A A . 40 LEU HD22 1 1 13 8937 1 1 40 LEU HD23 H -4.064 -6.805 2.530 1.00 . A A . 40 LEU HD23 1 1 13 8938 1 1 40 LEU HG H -2.580 -4.812 2.131 1.00 . A A . 40 LEU HG 1 1 13 8939 1 1 40 LEU N N 0.018 -4.915 1.099 1.00 . A A . 40 LEU N 1 1 13 8940 1 1 40 LEU O O -0.221 -4.603 -2.033 1.00 . A A . 40 LEU O 1 1 13 8941 1 1 41 ILE C C 1.439 -7.065 -3.857 1.00 . A A . 41 ILE C 1 1 13 8942 1 1 41 ILE CA C 1.963 -6.334 -2.572 1.00 . A A . 41 ILE CA 1 1 13 8943 1 1 41 ILE CB C 3.339 -6.883 -2.011 1.00 . A A . 41 ILE CB 1 1 13 8944 1 1 41 ILE CD1 C 5.908 -6.686 -2.476 1.00 . A A . 41 ILE CD1 1 1 13 8945 1 1 41 ILE CG1 C 4.478 -6.525 -3.017 1.00 . A A . 41 ILE CG1 1 1 13 8946 1 1 41 ILE CG2 C 3.333 -8.425 -1.782 1.00 . A A . 41 ILE CG2 1 1 13 8947 1 1 41 ILE H H 1.020 -7.197 -0.772 1.00 . A A . 41 ILE H 1 1 13 8948 1 1 41 ILE HA H 2.098 -5.258 -2.817 1.00 . A A . 41 ILE HA 1 1 13 8949 1 1 41 ILE HB H 3.553 -6.380 -1.047 1.00 . A A . 41 ILE HB 1 1 13 8950 1 1 41 ILE HD11 H 6.060 -6.109 -1.545 1.00 . A A . 41 ILE HD11 1 1 13 8951 1 1 41 ILE HD12 H 6.153 -7.742 -2.259 1.00 . A A . 41 ILE HD12 1 1 13 8952 1 1 41 ILE HD13 H 6.652 -6.326 -3.209 1.00 . A A . 41 ILE HD13 1 1 13 8953 1 1 41 ILE HG12 H 4.375 -7.107 -3.953 1.00 . A A . 41 ILE HG12 1 1 13 8954 1 1 41 ILE HG13 H 4.373 -5.468 -3.327 1.00 . A A . 41 ILE HG13 1 1 13 8955 1 1 41 ILE HG21 H 2.492 -8.745 -1.139 1.00 . A A . 41 ILE HG21 1 1 13 8956 1 1 41 ILE HG22 H 3.263 -9.000 -2.724 1.00 . A A . 41 ILE HG22 1 1 13 8957 1 1 41 ILE HG23 H 4.253 -8.762 -1.270 1.00 . A A . 41 ILE HG23 1 1 13 8958 1 1 41 ILE N N 0.941 -6.475 -1.497 1.00 . A A . 41 ILE N 1 1 13 8959 1 1 41 ILE O O 1.039 -8.235 -3.826 1.00 . A A . 41 ILE O 1 1 13 8960 1 1 42 MET C C 2.088 -6.466 -7.367 1.00 . A A . 42 MET C 1 1 13 8961 1 1 42 MET CA C 1.005 -6.838 -6.311 1.00 . A A . 42 MET CA 1 1 13 8962 1 1 42 MET CB C -0.392 -6.247 -6.674 1.00 . A A . 42 MET CB 1 1 13 8963 1 1 42 MET CE C -2.956 -8.847 -4.647 1.00 . A A . 42 MET CE 1 1 13 8964 1 1 42 MET CG C -1.570 -6.738 -5.811 1.00 . A A . 42 MET CG 1 1 13 8965 1 1 42 MET H H 1.793 -5.369 -4.860 1.00 . A A . 42 MET H 1 1 13 8966 1 1 42 MET HA H 0.923 -7.938 -6.300 1.00 . A A . 42 MET HA 1 1 13 8967 1 1 42 MET HB2 H -0.367 -5.141 -6.644 1.00 . A A . 42 MET HB2 1 1 13 8968 1 1 42 MET HB3 H -0.627 -6.498 -7.726 1.00 . A A . 42 MET HB3 1 1 13 8969 1 1 42 MET HE1 H -3.898 -8.308 -4.856 1.00 . A A . 42 MET HE1 1 1 13 8970 1 1 42 MET HE2 H -3.185 -9.926 -4.587 1.00 . A A . 42 MET HE2 1 1 13 8971 1 1 42 MET HE3 H -2.580 -8.521 -3.660 1.00 . A A . 42 MET HE3 1 1 13 8972 1 1 42 MET HG2 H -1.429 -6.446 -4.754 1.00 . A A . 42 MET HG2 1 1 13 8973 1 1 42 MET HG3 H -2.512 -6.263 -6.143 1.00 . A A . 42 MET HG3 1 1 13 8974 1 1 42 MET N N 1.440 -6.325 -4.979 1.00 . A A . 42 MET N 1 1 13 8975 1 1 42 MET O O 2.692 -7.378 -7.937 1.00 . A A . 42 MET O 1 1 13 8976 1 1 42 MET SD S -1.734 -8.532 -5.935 1.00 . A A . 42 MET SD 1 1 13 8977 1 1 43 GLU C C 3.141 -4.817 -9.957 1.00 . A A . 43 GLU C 1 1 13 8978 1 1 43 GLU CA C 3.441 -4.579 -8.443 1.00 . A A . 43 GLU CA 1 1 13 8979 1 1 43 GLU CB C 4.838 -5.202 -8.130 1.00 . A A . 43 GLU CB 1 1 13 8980 1 1 43 GLU CD C 6.710 -5.663 -6.450 1.00 . A A . 43 GLU CD 1 1 13 8981 1 1 43 GLU CG C 5.344 -5.013 -6.682 1.00 . A A . 43 GLU CG 1 1 13 8982 1 1 43 GLU H H 1.733 -4.549 -7.036 1.00 . A A . 43 GLU H 1 1 13 8983 1 1 43 GLU HA H 3.479 -3.491 -8.236 1.00 . A A . 43 GLU HA 1 1 13 8984 1 1 43 GLU HB2 H 4.863 -6.272 -8.404 1.00 . A A . 43 GLU HB2 1 1 13 8985 1 1 43 GLU HB3 H 5.580 -4.729 -8.803 1.00 . A A . 43 GLU HB3 1 1 13 8986 1 1 43 GLU HE2 H 8.601 -5.219 -6.572 1.00 . A A . 43 GLU HE2 1 1 13 8987 1 1 43 GLU HG2 H 5.392 -3.936 -6.434 1.00 . A A . 43 GLU HG2 1 1 13 8988 1 1 43 GLU HG3 H 4.623 -5.449 -5.967 1.00 . A A . 43 GLU HG3 1 1 13 8989 1 1 43 GLU N N 2.336 -5.152 -7.603 1.00 . A A . 43 GLU N 1 1 13 8990 1 1 43 GLU O O 2.817 -5.925 -10.401 1.00 . A A . 43 GLU O 1 1 13 8991 1 1 43 GLU OE1 O 6.849 -6.826 -6.072 1.00 . A A . 43 GLU OE1 1 1 13 8992 1 1 43 GLU OE2 O 7.746 -4.806 -6.717 1.00 . A A . 43 GLU OE2 1 1 13 8993 1 1 44 GLY C C 3.313 -2.423 -12.859 1.00 . A A . 44 GLY C 1 1 13 8994 1 1 44 GLY CA C 3.149 -3.807 -12.212 1.00 . A A . 44 GLY CA 1 1 13 8995 1 1 44 GLY H H 3.648 -2.908 -10.260 1.00 . A A . 44 GLY H 1 1 13 8996 1 1 44 GLY HA2 H 3.877 -4.525 -12.639 1.00 . A A . 44 GLY HA2 1 1 13 8997 1 1 44 GLY HA3 H 2.151 -4.211 -12.469 1.00 . A A . 44 GLY HA3 1 1 13 8998 1 1 44 GLY N N 3.301 -3.743 -10.744 1.00 . A A . 44 GLY N 1 1 13 8999 1 1 44 GLY O O 2.317 -1.758 -13.160 1.00 . A A . 44 GLY O 1 1 13 9000 1 1 45 LEU C C 6.215 -1.087 -14.613 1.00 . A A . 45 LEU C 1 1 13 9001 1 1 45 LEU CA C 4.908 -0.776 -13.833 1.00 . A A . 45 LEU CA 1 1 13 9002 1 1 45 LEU CB C 5.062 0.420 -12.842 1.00 . A A . 45 LEU CB 1 1 13 9003 1 1 45 LEU CD1 C 4.148 2.346 -14.306 1.00 . A A . 45 LEU CD1 1 1 13 9004 1 1 45 LEU CD2 C 5.683 2.843 -12.365 1.00 . A A . 45 LEU CD2 1 1 13 9005 1 1 45 LEU CG C 5.329 1.821 -13.464 1.00 . A A . 45 LEU CG 1 1 13 9006 1 1 45 LEU H H 5.299 -2.675 -12.782 1.00 . A A . 45 LEU H 1 1 13 9007 1 1 45 LEU HA H 4.097 -0.538 -14.551 1.00 . A A . 45 LEU HA 1 1 13 9008 1 1 45 LEU HB2 H 4.151 0.488 -12.214 1.00 . A A . 45 LEU HB2 1 1 13 9009 1 1 45 LEU HB3 H 5.873 0.184 -12.124 1.00 . A A . 45 LEU HB3 1 1 13 9010 1 1 45 LEU HD11 H 3.218 2.427 -13.713 1.00 . A A . 45 LEU HD11 1 1 13 9011 1 1 45 LEU HD12 H 4.358 3.347 -14.726 1.00 . A A . 45 LEU HD12 1 1 13 9012 1 1 45 LEU HD13 H 3.932 1.687 -15.167 1.00 . A A . 45 LEU HD13 1 1 13 9013 1 1 45 LEU HD21 H 6.568 2.525 -11.783 1.00 . A A . 45 LEU HD21 1 1 13 9014 1 1 45 LEU HD22 H 5.925 3.835 -12.791 1.00 . A A . 45 LEU HD22 1 1 13 9015 1 1 45 LEU HD23 H 4.853 2.987 -11.647 1.00 . A A . 45 LEU HD23 1 1 13 9016 1 1 45 LEU HG H 6.210 1.746 -14.128 1.00 . A A . 45 LEU HG 1 1 13 9017 1 1 45 LEU N N 4.574 -2.015 -13.084 1.00 . A A . 45 LEU N 1 1 13 9018 1 1 45 LEU O O 7.316 -0.983 -14.061 1.00 . A A . 45 LEU O 1 1 13 9019 1 1 46 SER C C 7.502 -3.562 -16.085 1.00 . A A . 46 SER C 1 1 13 9020 1 1 46 SER CA C 7.099 -2.192 -16.737 1.00 . A A . 46 SER CA 1 1 13 9021 1 1 46 SER CB C 8.298 -1.218 -16.955 1.00 . A A . 46 SER CB 1 1 13 9022 1 1 46 SER H H 5.070 -1.545 -16.182 1.00 . A A . 46 SER H 1 1 13 9023 1 1 46 SER HA H 6.654 -2.433 -17.716 1.00 . A A . 46 SER HA 1 1 13 9024 1 1 46 SER HB2 H 7.941 -0.249 -17.352 1.00 . A A . 46 SER HB2 1 1 13 9025 1 1 46 SER HB3 H 8.838 -0.983 -16.020 1.00 . A A . 46 SER HB3 1 1 13 9026 1 1 46 SER HG H 8.717 -1.934 -18.690 1.00 . A A . 46 SER HG 1 1 13 9027 1 1 46 SER N N 6.052 -1.535 -15.884 1.00 . A A . 46 SER N 1 1 13 9028 1 1 46 SER O O 6.935 -4.590 -16.468 1.00 . A A . 46 SER O 1 1 13 9029 1 1 46 SER OG O 9.218 -1.772 -17.887 1.00 . A A . 46 SER OG 1 1 13 9030 1 1 47 PHE C C 7.649 -4.919 -13.120 1.00 . A A . 47 PHE C 1 1 13 9031 1 1 47 PHE CA C 8.711 -4.772 -14.259 1.00 . A A . 47 PHE CA 1 1 13 9032 1 1 47 PHE CB C 10.150 -4.618 -13.664 1.00 . A A . 47 PHE CB 1 1 13 9033 1 1 47 PHE CD1 C 10.694 -2.191 -13.043 1.00 . A A . 47 PHE CD1 1 1 13 9034 1 1 47 PHE CD2 C 10.360 -3.783 -11.257 1.00 . A A . 47 PHE CD2 1 1 13 9035 1 1 47 PHE CE1 C 10.887 -1.180 -12.103 1.00 . A A . 47 PHE CE1 1 1 13 9036 1 1 47 PHE CE2 C 10.555 -2.772 -10.320 1.00 . A A . 47 PHE CE2 1 1 13 9037 1 1 47 PHE CG C 10.421 -3.500 -12.627 1.00 . A A . 47 PHE CG 1 1 13 9038 1 1 47 PHE CZ C 10.817 -1.472 -10.743 1.00 . A A . 47 PHE CZ 1 1 13 9039 1 1 47 PHE H H 8.803 -2.652 -14.892 1.00 . A A . 47 PHE H 1 1 13 9040 1 1 47 PHE HA H 8.690 -5.684 -14.891 1.00 . A A . 47 PHE HA 1 1 13 9041 1 1 47 PHE HB2 H 10.432 -5.592 -13.220 1.00 . A A . 47 PHE HB2 1 1 13 9042 1 1 47 PHE HB3 H 10.872 -4.515 -14.498 1.00 . A A . 47 PHE HB3 1 1 13 9043 1 1 47 PHE HD1 H 10.740 -1.948 -14.095 1.00 . A A . 47 PHE HD1 1 1 13 9044 1 1 47 PHE HD2 H 10.145 -4.785 -10.913 1.00 . A A . 47 PHE HD2 1 1 13 9045 1 1 47 PHE HE1 H 11.087 -0.171 -12.430 1.00 . A A . 47 PHE HE1 1 1 13 9046 1 1 47 PHE HE2 H 10.500 -2.996 -9.264 1.00 . A A . 47 PHE HE2 1 1 13 9047 1 1 47 PHE HZ H 10.966 -0.687 -10.016 1.00 . A A . 47 PHE HZ 1 1 13 9048 1 1 47 PHE N N 8.414 -3.579 -15.096 1.00 . A A . 47 PHE N 1 1 13 9049 1 1 47 PHE O O 7.205 -3.928 -12.525 1.00 . A A . 47 PHE O 1 1 13 9050 1 1 48 ALA C C 7.351 -6.947 -10.458 1.00 . A A . 48 ALA C 1 1 13 9051 1 1 48 ALA CA C 6.444 -6.494 -11.623 1.00 . A A . 48 ALA CA 1 1 13 9052 1 1 48 ALA CB C 5.438 -7.589 -12.028 1.00 . A A . 48 ALA CB 1 1 13 9053 1 1 48 ALA H H 7.747 -6.910 -13.353 1.00 . A A . 48 ALA H 1 1 13 9054 1 1 48 ALA HXT H 8.340 -6.159 -8.977 1.00 . A A . 48 ALA HXT 1 1 13 9055 1 1 48 ALA HA H 5.858 -5.614 -11.294 1.00 . A A . 48 ALA HA 1 1 13 9056 1 1 48 ALA HB1 H 5.932 -8.518 -12.371 1.00 . A A . 48 ALA HB1 1 1 13 9057 1 1 48 ALA HB2 H 4.781 -7.863 -11.182 1.00 . A A . 48 ALA HB2 1 1 13 9058 1 1 48 ALA HB3 H 4.773 -7.248 -12.845 1.00 . A A . 48 ALA HB3 1 1 13 9059 1 1 48 ALA N N 7.298 -6.176 -12.793 1.00 . A A . 48 ALA N 1 1 13 9060 1 1 48 ALA O O 7.676 -8.115 -10.238 1.00 . A A . 48 ALA O 1 1 13 9061 1 1 48 ALA OXT O 7.774 -5.883 -9.701 1.00 . A A . 48 ALA OXT 1 1 14 9062 1 1 1 GLU C C 12.472 6.904 10.650 1.00 . A A . 1 GLU C 1 1 14 9063 1 1 1 GLU CA C 11.773 5.866 11.572 1.00 . A A . 1 GLU CA 1 1 14 9064 1 1 1 GLU CB C 12.460 4.464 11.545 1.00 . A A . 1 GLU CB 1 1 14 9065 1 1 1 GLU CD C 13.091 2.241 10.429 1.00 . A A . 1 GLU CD 1 1 14 9066 1 1 1 GLU CG C 12.510 3.642 10.229 1.00 . A A . 1 GLU CG 1 1 14 9067 1 1 1 GLU H1 H 9.880 6.648 11.161 1.00 . A A . 1 GLU H1 1 1 14 9068 1 1 1 GLU H2 H 10.306 5.408 10.157 1.00 . A A . 1 GLU H2 1 1 14 9069 1 1 1 GLU HA H 11.787 6.241 12.615 1.00 . A A . 1 GLU HA 1 1 14 9070 1 1 1 GLU HB2 H 13.494 4.585 11.919 1.00 . A A . 1 GLU HB2 1 1 14 9071 1 1 1 GLU HB3 H 11.967 3.845 12.320 1.00 . A A . 1 GLU HB3 1 1 14 9072 1 1 1 GLU HE2 H 12.494 0.438 10.858 1.00 . A A . 1 GLU HE2 1 1 14 9073 1 1 1 GLU HG2 H 11.502 3.560 9.782 1.00 . A A . 1 GLU HG2 1 1 14 9074 1 1 1 GLU HG3 H 13.123 4.161 9.471 1.00 . A A . 1 GLU HG3 1 1 14 9075 1 1 1 GLU N N 10.367 5.746 11.123 1.00 . A A . 1 GLU N 1 1 14 9076 1 1 1 GLU O O 12.870 6.605 9.520 1.00 . A A . 1 GLU O 1 1 14 9077 1 1 1 GLU OE1 O 14.291 1.984 10.328 1.00 . A A . 1 GLU OE1 1 1 14 9078 1 1 1 GLU OE2 O 12.125 1.315 10.733 1.00 . A A . 1 GLU OE2 1 1 14 9079 1 1 2 ASP C C 12.350 9.624 9.120 1.00 . A A . 2 ASP C 1 1 14 9080 1 1 2 ASP CA C 13.151 9.346 10.440 1.00 . A A . 2 ASP CA 1 1 14 9081 1 1 2 ASP CB C 14.669 9.109 10.157 1.00 . A A . 2 ASP CB 1 1 14 9082 1 1 2 ASP CG C 15.425 10.365 9.697 1.00 . A A . 2 ASP CG 1 1 14 9083 1 1 2 ASP H H 12.202 8.252 12.101 1.00 . A A . 2 ASP H 1 1 14 9084 1 1 2 ASP HA H 13.040 10.228 11.103 1.00 . A A . 2 ASP HA 1 1 14 9085 1 1 2 ASP HB2 H 15.168 8.752 11.079 1.00 . A A . 2 ASP HB2 1 1 14 9086 1 1 2 ASP HB3 H 14.824 8.296 9.423 1.00 . A A . 2 ASP HB3 1 1 14 9087 1 1 2 ASP HD2 H 15.081 9.707 7.897 1.00 . A A . 2 ASP HD2 1 1 14 9088 1 1 2 ASP N N 12.583 8.156 11.153 1.00 . A A . 2 ASP N 1 1 14 9089 1 1 2 ASP O O 12.646 9.064 8.060 1.00 . A A . 2 ASP O 1 1 14 9090 1 1 2 ASP OD1 O 15.891 11.197 10.474 1.00 . A A . 2 ASP OD1 1 1 14 9091 1 1 2 ASP OD2 O 15.509 10.449 8.330 1.00 . A A . 2 ASP OD2 1 1 14 9092 1 1 3 ASN C C 9.541 9.883 7.420 1.00 . A A . 3 ASN C 1 1 14 9093 1 1 3 ASN CA C 10.435 10.984 8.103 1.00 . A A . 3 ASN CA 1 1 14 9094 1 1 3 ASN CB C 11.314 11.644 6.996 1.00 . A A . 3 ASN CB 1 1 14 9095 1 1 3 ASN CG C 12.213 12.832 7.405 1.00 . A A . 3 ASN CG 1 1 14 9096 1 1 3 ASN H H 11.111 10.754 10.197 1.00 . A A . 3 ASN H 1 1 14 9097 1 1 3 ASN HA H 9.727 11.695 8.547 1.00 . A A . 3 ASN HA 1 1 14 9098 1 1 3 ASN HB2 H 11.928 10.835 6.565 1.00 . A A . 3 ASN HB2 1 1 14 9099 1 1 3 ASN HB3 H 10.677 11.977 6.153 1.00 . A A . 3 ASN HB3 1 1 14 9100 1 1 3 ASN HD21 H 10.668 14.100 7.228 1.00 . A A . 3 ASN HD21 1 1 14 9101 1 1 3 ASN HD22 H 12.281 14.809 7.740 1.00 . A A . 3 ASN HD22 1 1 14 9102 1 1 3 ASN N N 11.330 10.505 9.228 1.00 . A A . 3 ASN N 1 1 14 9103 1 1 3 ASN ND2 N 11.665 14.036 7.465 1.00 . A A . 3 ASN ND2 1 1 14 9104 1 1 3 ASN O O 8.976 10.103 6.343 1.00 . A A . 3 ASN O 1 1 14 9105 1 1 3 ASN OD1 O 13.403 12.670 7.672 1.00 . A A . 3 ASN OD1 1 1 14 9106 1 1 4 CYS C C 7.540 7.251 8.955 1.00 . A A . 4 CYS C 1 1 14 9107 1 1 4 CYS CA C 8.373 7.707 7.719 1.00 . A A . 4 CYS CA 1 1 14 9108 1 1 4 CYS CB C 9.076 6.506 7.083 1.00 . A A . 4 CYS CB 1 1 14 9109 1 1 4 CYS H H 9.926 8.844 8.948 1.00 . A A . 4 CYS H 1 1 14 9110 1 1 4 CYS HA H 7.661 8.064 6.953 1.00 . A A . 4 CYS HA 1 1 14 9111 1 1 4 CYS HB2 H 8.338 5.725 7.169 1.00 . A A . 4 CYS HB2 1 1 14 9112 1 1 4 CYS HB3 H 9.074 6.608 6.002 1.00 . A A . 4 CYS HB3 1 1 14 9113 1 1 4 CYS N N 9.354 8.755 8.101 1.00 . A A . 4 CYS N 1 1 14 9114 1 1 4 CYS O O 7.744 7.665 10.103 1.00 . A A . 4 CYS O 1 1 14 9115 1 1 4 CYS SG S 10.471 5.650 7.833 1.00 . A A . 4 CYS SG 1 1 14 9116 1 1 5 ILE C C 6.329 4.165 9.677 1.00 . A A . 5 ILE C 1 1 14 9117 1 1 5 ILE CA C 5.809 5.623 9.713 1.00 . A A . 5 ILE CA 1 1 14 9118 1 1 5 ILE CB C 4.237 5.629 9.532 1.00 . A A . 5 ILE CB 1 1 14 9119 1 1 5 ILE CD1 C 2.260 7.040 8.703 1.00 . A A . 5 ILE CD1 1 1 14 9120 1 1 5 ILE CG1 C 3.710 7.026 9.154 1.00 . A A . 5 ILE CG1 1 1 14 9121 1 1 5 ILE CG2 C 3.541 5.171 10.848 1.00 . A A . 5 ILE CG2 1 1 14 9122 1 1 5 ILE H H 6.754 6.057 7.631 1.00 . A A . 5 ILE H 1 1 14 9123 1 1 5 ILE HA H 6.010 6.077 10.686 1.00 . A A . 5 ILE HA 1 1 14 9124 1 1 5 ILE HB H 3.891 4.931 8.774 1.00 . A A . 5 ILE HB 1 1 14 9125 1 1 5 ILE HD11 H 1.601 6.604 9.466 1.00 . A A . 5 ILE HD11 1 1 14 9126 1 1 5 ILE HD12 H 1.928 8.073 8.525 1.00 . A A . 5 ILE HD12 1 1 14 9127 1 1 5 ILE HD13 H 2.104 6.465 7.775 1.00 . A A . 5 ILE HD13 1 1 14 9128 1 1 5 ILE HG12 H 3.877 7.715 9.984 1.00 . A A . 5 ILE HG12 1 1 14 9129 1 1 5 ILE HG13 H 4.283 7.447 8.317 1.00 . A A . 5 ILE HG13 1 1 14 9130 1 1 5 ILE HG21 H 3.942 4.217 11.229 1.00 . A A . 5 ILE HG21 1 1 14 9131 1 1 5 ILE HG22 H 3.611 5.912 11.663 1.00 . A A . 5 ILE HG22 1 1 14 9132 1 1 5 ILE HG23 H 2.461 4.976 10.683 1.00 . A A . 5 ILE HG23 1 1 14 9133 1 1 5 ILE N N 6.577 6.350 8.636 1.00 . A A . 5 ILE N 1 1 14 9134 1 1 5 ILE O O 5.842 3.344 8.900 1.00 . A A . 5 ILE O 1 1 14 9135 1 1 6 ALA C C 6.716 1.265 11.065 1.00 . A A . 6 ALA C 1 1 14 9136 1 1 6 ALA CA C 7.771 2.367 10.609 1.00 . A A . 6 ALA CA 1 1 14 9137 1 1 6 ALA CB C 8.958 2.344 11.588 1.00 . A A . 6 ALA CB 1 1 14 9138 1 1 6 ALA H H 7.481 4.516 11.260 1.00 . A A . 6 ALA H 1 1 14 9139 1 1 6 ALA HA H 8.049 2.137 9.555 1.00 . A A . 6 ALA HA 1 1 14 9140 1 1 6 ALA HB1 H 9.762 3.031 11.274 1.00 . A A . 6 ALA HB1 1 1 14 9141 1 1 6 ALA HB2 H 8.666 2.625 12.618 1.00 . A A . 6 ALA HB2 1 1 14 9142 1 1 6 ALA HB3 H 9.418 1.340 11.642 1.00 . A A . 6 ALA HB3 1 1 14 9143 1 1 6 ALA N N 7.273 3.793 10.562 1.00 . A A . 6 ALA N 1 1 14 9144 1 1 6 ALA O O 6.965 0.065 10.946 1.00 . A A . 6 ALA O 1 1 14 9145 1 1 7 GLU C C 4.100 -0.365 12.287 1.00 . A A . 7 GLU C 1 1 14 9146 1 1 7 GLU CA C 4.245 1.136 11.821 1.00 . A A . 7 GLU CA 1 1 14 9147 1 1 7 GLU CB C 3.448 1.292 10.464 1.00 . A A . 7 GLU CB 1 1 14 9148 1 1 7 GLU CD C 4.853 -0.187 8.733 1.00 . A A . 7 GLU CD 1 1 14 9149 1 1 7 GLU CG C 3.501 0.200 9.344 1.00 . A A . 7 GLU CG 1 1 14 9150 1 1 7 GLU H H 5.636 2.776 11.402 1.00 . A A . 7 GLU H 1 1 14 9151 1 1 7 GLU HA H 3.801 1.761 12.626 1.00 . A A . 7 GLU HA 1 1 14 9152 1 1 7 GLU HB2 H 2.381 1.328 10.754 1.00 . A A . 7 GLU HB2 1 1 14 9153 1 1 7 GLU HB3 H 3.564 2.312 10.055 1.00 . A A . 7 GLU HB3 1 1 14 9154 1 1 7 GLU HE2 H 5.997 -1.752 8.553 1.00 . A A . 7 GLU HE2 1 1 14 9155 1 1 7 GLU HG2 H 3.004 -0.713 9.725 1.00 . A A . 7 GLU HG2 1 1 14 9156 1 1 7 GLU HG3 H 2.855 0.501 8.508 1.00 . A A . 7 GLU HG3 1 1 14 9157 1 1 7 GLU N N 5.561 1.759 11.525 1.00 . A A . 7 GLU N 1 1 14 9158 1 1 7 GLU O O 4.899 -1.289 12.129 1.00 . A A . 7 GLU O 1 1 14 9159 1 1 7 GLU OE1 O 5.584 0.595 8.128 1.00 . A A . 7 GLU OE1 1 1 14 9160 1 1 7 GLU OE2 O 5.151 -1.510 8.938 1.00 . A A . 7 GLU OE2 1 1 14 9161 1 1 8 ASP C C 0.964 -0.893 13.924 1.00 . A A . 8 ASP C 1 1 14 9162 1 1 8 ASP CA C 2.035 -1.640 13.119 1.00 . A A . 8 ASP CA 1 1 14 9163 1 1 8 ASP CB C 2.608 -2.765 13.943 1.00 . A A . 8 ASP CB 1 1 14 9164 1 1 8 ASP CG C 1.604 -3.845 14.398 1.00 . A A . 8 ASP CG 1 1 14 9165 1 1 8 ASP H H 2.413 0.460 12.825 1.00 . A A . 8 ASP H 1 1 14 9166 1 1 8 ASP HA H 1.717 -2.040 12.140 1.00 . A A . 8 ASP HA 1 1 14 9167 1 1 8 ASP HB2 H 3.316 -3.255 13.301 1.00 . A A . 8 ASP HB2 1 1 14 9168 1 1 8 ASP HB3 H 3.045 -2.321 14.829 1.00 . A A . 8 ASP HB3 1 1 14 9169 1 1 8 ASP HD2 H 1.470 -4.283 12.506 1.00 . A A . 8 ASP HD2 1 1 14 9170 1 1 8 ASP N N 2.863 -0.461 12.785 1.00 . A A . 8 ASP N 1 1 14 9171 1 1 8 ASP O O 1.065 -0.491 15.090 1.00 . A A . 8 ASP O 1 1 14 9172 1 1 8 ASP OD1 O 1.289 -4.024 15.575 1.00 . A A . 8 ASP OD1 1 1 14 9173 1 1 8 ASP OD2 O 1.106 -4.572 13.346 1.00 . A A . 8 ASP OD2 1 1 14 9174 1 1 9 TYR C C -0.768 1.590 13.798 1.00 . A A . 9 TYR C 1 1 14 9175 1 1 9 TYR CA C -1.245 0.156 13.362 1.00 . A A . 9 TYR CA 1 1 14 9176 1 1 9 TYR CB C -2.159 -0.590 14.396 1.00 . A A . 9 TYR CB 1 1 14 9177 1 1 9 TYR CD1 C -3.101 -2.385 12.832 1.00 . A A . 9 TYR CD1 1 1 14 9178 1 1 9 TYR CD2 C -1.959 -3.115 14.831 1.00 . A A . 9 TYR CD2 1 1 14 9179 1 1 9 TYR CE1 C -3.268 -3.710 12.440 1.00 . A A . 9 TYR CE1 1 1 14 9180 1 1 9 TYR CE2 C -2.132 -4.441 14.440 1.00 . A A . 9 TYR CE2 1 1 14 9181 1 1 9 TYR CG C -2.486 -2.074 14.051 1.00 . A A . 9 TYR CG 1 1 14 9182 1 1 9 TYR CZ C -2.793 -4.738 13.250 1.00 . A A . 9 TYR CZ 1 1 14 9183 1 1 9 TYR H H 0.215 -1.337 12.339 1.00 . A A . 9 TYR H 1 1 14 9184 1 1 9 TYR HA H -1.822 0.332 12.428 1.00 . A A . 9 TYR HA 1 1 14 9185 1 1 9 TYR HB2 H -1.707 -0.527 15.405 1.00 . A A . 9 TYR HB2 1 1 14 9186 1 1 9 TYR HB3 H -3.110 -0.034 14.493 1.00 . A A . 9 TYR HB3 1 1 14 9187 1 1 9 TYR HD1 H -3.326 -1.601 12.127 1.00 . A A . 9 TYR HD1 1 1 14 9188 1 1 9 TYR HD2 H -1.309 -2.910 15.676 1.00 . A A . 9 TYR HD2 1 1 14 9189 1 1 9 TYR HE1 H -3.721 -3.930 11.483 1.00 . A A . 9 TYR HE1 1 1 14 9190 1 1 9 TYR HE2 H -1.704 -5.235 15.033 1.00 . A A . 9 TYR HE2 1 1 14 9191 1 1 9 TYR HH H -3.380 -6.064 12.003 1.00 . A A . 9 TYR HH 1 1 14 9192 1 1 9 TYR N N -0.062 -0.731 13.116 1.00 . A A . 9 TYR N 1 1 14 9193 1 1 9 TYR O O -1.277 2.177 14.757 1.00 . A A . 9 TYR O 1 1 14 9194 1 1 9 TYR OH O -2.923 -6.042 12.847 1.00 . A A . 9 TYR OH 1 1 14 9195 1 1 10 GLY C C -0.256 4.602 13.040 1.00 . A A . 10 GLY C 1 1 14 9196 1 1 10 GLY CA C 0.778 3.491 13.227 1.00 . A A . 10 GLY CA 1 1 14 9197 1 1 10 GLY H H 0.602 1.460 12.342 1.00 . A A . 10 GLY H 1 1 14 9198 1 1 10 GLY HA2 H 1.278 3.561 14.209 1.00 . A A . 10 GLY HA2 1 1 14 9199 1 1 10 GLY HA3 H 1.593 3.681 12.498 1.00 . A A . 10 GLY HA3 1 1 14 9200 1 1 10 GLY N N 0.215 2.133 13.024 1.00 . A A . 10 GLY N 1 1 14 9201 1 1 10 GLY O O -1.377 4.359 12.598 1.00 . A A . 10 GLY O 1 1 14 9202 1 1 11 LYS C C -0.179 7.559 11.682 1.00 . A A . 11 LYS C 1 1 14 9203 1 1 11 LYS CA C -0.703 7.016 13.037 1.00 . A A . 11 LYS CA 1 1 14 9204 1 1 11 LYS CB C -0.625 8.159 14.071 1.00 . A A . 11 LYS CB 1 1 14 9205 1 1 11 LYS CD C -2.467 7.961 15.946 1.00 . A A . 11 LYS CD 1 1 14 9206 1 1 11 LYS CE C -3.414 6.905 15.341 1.00 . A A . 11 LYS CE 1 1 14 9207 1 1 11 LYS CG C -0.977 7.844 15.547 1.00 . A A . 11 LYS CG 1 1 14 9208 1 1 11 LYS H H 1.143 5.829 13.562 1.00 . A A . 11 LYS H 1 1 14 9209 1 1 11 LYS HA H -1.772 6.713 12.964 1.00 . A A . 11 LYS HA 1 1 14 9210 1 1 11 LYS HB2 H 0.378 8.586 13.987 1.00 . A A . 11 LYS HB2 1 1 14 9211 1 1 11 LYS HB3 H -1.274 8.992 13.734 1.00 . A A . 11 LYS HB3 1 1 14 9212 1 1 11 LYS HD2 H -2.518 7.898 17.050 1.00 . A A . 11 LYS HD2 1 1 14 9213 1 1 11 LYS HD3 H -2.832 8.976 15.699 1.00 . A A . 11 LYS HD3 1 1 14 9214 1 1 11 LYS HE2 H -3.486 7.030 14.247 1.00 . A A . 11 LYS HE2 1 1 14 9215 1 1 11 LYS HE3 H -3.022 5.886 15.517 1.00 . A A . 11 LYS HE3 1 1 14 9216 1 1 11 LYS HG2 H -0.578 6.857 15.847 1.00 . A A . 11 LYS HG2 1 1 14 9217 1 1 11 LYS HG3 H -0.420 8.564 16.175 1.00 . A A . 11 LYS HG3 1 1 14 9218 1 1 11 LYS HZ1 H -5.151 7.945 15.744 1.00 . A A . 11 LYS HZ1 1 1 14 9219 1 1 11 LYS HZ2 H -4.740 6.890 16.923 1.00 . A A . 11 LYS HZ2 1 1 14 9220 1 1 11 LYS N N 0.131 5.826 13.383 1.00 . A A . 11 LYS N 1 1 14 9221 1 1 11 LYS NZ N -4.772 7.005 15.904 1.00 . A A . 11 LYS NZ 1 1 14 9222 1 1 11 LYS O O 1.014 7.816 11.487 1.00 . A A . 11 LYS O 1 1 14 9223 1 1 12 CYS C C -1.999 9.347 9.097 1.00 . A A . 12 CYS C 1 1 14 9224 1 1 12 CYS CA C -0.932 8.283 9.429 1.00 . A A . 12 CYS CA 1 1 14 9225 1 1 12 CYS CB C -1.022 7.127 8.398 1.00 . A A . 12 CYS CB 1 1 14 9226 1 1 12 CYS H H -2.040 7.608 11.267 1.00 . A A . 12 CYS H 1 1 14 9227 1 1 12 CYS HA H 0.057 8.770 9.357 1.00 . A A . 12 CYS HA 1 1 14 9228 1 1 12 CYS HB2 H -0.690 7.462 7.399 1.00 . A A . 12 CYS HB2 1 1 14 9229 1 1 12 CYS HB3 H -0.343 6.306 8.646 1.00 . A A . 12 CYS HB3 1 1 14 9230 1 1 12 CYS N N -1.143 7.731 10.791 1.00 . A A . 12 CYS N 1 1 14 9231 1 1 12 CYS O O -2.938 9.610 9.860 1.00 . A A . 12 CYS O 1 1 14 9232 1 1 12 CYS SG S -2.674 6.438 8.277 1.00 . A A . 12 CYS SG 1 1 14 9233 1 1 13 THR C C -2.902 10.596 5.806 1.00 . A A . 13 THR C 1 1 14 9234 1 1 13 THR CA C -2.912 10.828 7.347 1.00 . A A . 13 THR CA 1 1 14 9235 1 1 13 THR CB C -2.740 12.376 7.698 1.00 . A A . 13 THR CB 1 1 14 9236 1 1 13 THR CG2 C -1.749 12.739 8.828 1.00 . A A . 13 THR CG2 1 1 14 9237 1 1 13 THR H H -1.008 9.608 7.381 1.00 . A A . 13 THR H 1 1 14 9238 1 1 13 THR HA H -3.901 10.488 7.745 1.00 . A A . 13 THR HA 1 1 14 9239 1 1 13 THR HB H -3.762 12.725 7.934 1.00 . A A . 13 THR HB 1 1 14 9240 1 1 13 THR HG1 H -2.853 12.974 5.874 1.00 . A A . 13 THR HG1 1 1 14 9241 1 1 13 THR HG21 H -2.018 12.261 9.785 1.00 . A A . 13 THR HG21 1 1 14 9242 1 1 13 THR HG22 H -0.712 12.440 8.579 1.00 . A A . 13 THR HG22 1 1 14 9243 1 1 13 THR HG23 H -1.728 13.831 9.004 1.00 . A A . 13 THR HG23 1 1 14 9244 1 1 13 THR N N -1.836 9.955 7.909 1.00 . A A . 13 THR N 1 1 14 9245 1 1 13 THR O O -1.882 10.320 5.159 1.00 . A A . 13 THR O 1 1 14 9246 1 1 13 THR OG1 O -2.244 13.130 6.599 1.00 . A A . 13 THR OG1 1 1 14 9247 1 1 14 TRP C C -3.932 12.358 3.357 1.00 . A A . 14 TRP C 1 1 14 9248 1 1 14 TRP CA C -4.286 10.892 3.760 1.00 . A A . 14 TRP CA 1 1 14 9249 1 1 14 TRP CB C -5.740 10.511 3.380 1.00 . A A . 14 TRP CB 1 1 14 9250 1 1 14 TRP CD1 C -5.473 7.926 4.062 1.00 . A A . 14 TRP CD1 1 1 14 9251 1 1 14 TRP CD2 C -7.558 8.687 3.800 1.00 . A A . 14 TRP CD2 1 1 14 9252 1 1 14 TRP CE2 C -7.591 7.320 4.171 1.00 . A A . 14 TRP CE2 1 1 14 9253 1 1 14 TRP CE3 C -8.768 9.405 3.605 1.00 . A A . 14 TRP CE3 1 1 14 9254 1 1 14 TRP CG C -6.230 9.086 3.724 1.00 . A A . 14 TRP CG 1 1 14 9255 1 1 14 TRP CH2 C -10.010 7.383 4.153 1.00 . A A . 14 TRP CH2 1 1 14 9256 1 1 14 TRP CZ2 C -8.832 6.661 4.347 1.00 . A A . 14 TRP CZ2 1 1 14 9257 1 1 14 TRP CZ3 C -9.978 8.734 3.788 1.00 . A A . 14 TRP CZ3 1 1 14 9258 1 1 14 TRP H H -4.808 11.107 5.918 1.00 . A A . 14 TRP H 1 1 14 9259 1 1 14 TRP HA H -3.612 10.176 3.246 1.00 . A A . 14 TRP HA 1 1 14 9260 1 1 14 TRP HB2 H -6.438 11.242 3.835 1.00 . A A . 14 TRP HB2 1 1 14 9261 1 1 14 TRP HB3 H -5.866 10.650 2.290 1.00 . A A . 14 TRP HB3 1 1 14 9262 1 1 14 TRP HD1 H -4.391 7.863 4.155 1.00 . A A . 14 TRP HD1 1 1 14 9263 1 1 14 TRP HE1 H -6.029 5.889 4.632 1.00 . A A . 14 TRP HE1 1 1 14 9264 1 1 14 TRP HE3 H -8.761 10.449 3.328 1.00 . A A . 14 TRP HE3 1 1 14 9265 1 1 14 TRP HH2 H -10.962 6.892 4.289 1.00 . A A . 14 TRP HH2 1 1 14 9266 1 1 14 TRP HZ2 H -8.877 5.620 4.631 1.00 . A A . 14 TRP HZ2 1 1 14 9267 1 1 14 TRP HZ3 H -10.907 9.268 3.647 1.00 . A A . 14 TRP HZ3 1 1 14 9268 1 1 14 TRP N N -4.094 10.822 5.235 1.00 . A A . 14 TRP N 1 1 14 9269 1 1 14 TRP NE1 N -6.308 6.833 4.341 1.00 . A A . 14 TRP NE1 1 1 14 9270 1 1 14 TRP O O -4.695 13.303 3.588 1.00 . A A . 14 TRP O 1 1 14 9271 1 1 15 GLY C C -1.151 14.117 3.820 1.00 . A A . 15 GLY C 1 1 14 9272 1 1 15 GLY CA C -2.062 13.825 2.598 1.00 . A A . 15 GLY CA 1 1 14 9273 1 1 15 GLY H H -2.197 11.631 2.689 1.00 . A A . 15 GLY H 1 1 14 9274 1 1 15 GLY HA2 H -1.466 13.796 1.667 1.00 . A A . 15 GLY HA2 1 1 14 9275 1 1 15 GLY HA3 H -2.798 14.636 2.459 1.00 . A A . 15 GLY HA3 1 1 14 9276 1 1 15 GLY N N -2.716 12.508 2.811 1.00 . A A . 15 GLY N 1 1 14 9277 1 1 15 GLY O O -1.426 15.026 4.608 1.00 . A A . 15 GLY O 1 1 14 9278 1 1 16 GLY C C 1.901 12.247 4.973 1.00 . A A . 16 GLY C 1 1 14 9279 1 1 16 GLY CA C 0.755 13.246 5.168 1.00 . A A . 16 GLY CA 1 1 14 9280 1 1 16 GLY H H -0.012 12.608 3.211 1.00 . A A . 16 GLY H 1 1 14 9281 1 1 16 GLY HA2 H 1.161 14.205 5.521 1.00 . A A . 16 GLY HA2 1 1 14 9282 1 1 16 GLY HA3 H 0.114 12.908 6.004 1.00 . A A . 16 GLY HA3 1 1 14 9283 1 1 16 GLY N N -0.093 13.305 3.959 1.00 . A A . 16 GLY N 1 1 14 9284 1 1 16 GLY O O 2.357 11.953 3.860 1.00 . A A . 16 GLY O 1 1 14 9285 1 1 17 THR C C 2.435 9.252 5.884 1.00 . A A . 17 THR C 1 1 14 9286 1 1 17 THR CA C 3.285 10.552 6.129 1.00 . A A . 17 THR CA 1 1 14 9287 1 1 17 THR CB C 4.076 10.407 7.489 1.00 . A A . 17 THR CB 1 1 14 9288 1 1 17 THR CG2 C 5.443 9.717 7.277 1.00 . A A . 17 THR CG2 1 1 14 9289 1 1 17 THR H H 1.936 12.187 6.929 1.00 . A A . 17 THR H 1 1 14 9290 1 1 17 THR HA H 4.020 10.703 5.309 1.00 . A A . 17 THR HA 1 1 14 9291 1 1 17 THR HB H 3.493 9.785 8.202 1.00 . A A . 17 THR HB 1 1 14 9292 1 1 17 THR HG1 H 4.877 12.157 7.413 1.00 . A A . 17 THR HG1 1 1 14 9293 1 1 17 THR HG21 H 5.350 8.722 6.810 1.00 . A A . 17 THR HG21 1 1 14 9294 1 1 17 THR HG22 H 6.135 10.291 6.635 1.00 . A A . 17 THR HG22 1 1 14 9295 1 1 17 THR HG23 H 5.964 9.543 8.238 1.00 . A A . 17 THR HG23 1 1 14 9296 1 1 17 THR N N 2.337 11.706 6.116 1.00 . A A . 17 THR N 1 1 14 9297 1 1 17 THR O O 1.297 9.078 6.362 1.00 . A A . 17 THR O 1 1 14 9298 1 1 17 THR OG1 O 4.350 11.684 8.061 1.00 . A A . 17 THR OG1 1 1 14 9299 1 1 18 LYS C C 3.788 6.064 5.506 1.00 . A A . 18 LYS C 1 1 14 9300 1 1 18 LYS CA C 2.667 6.959 4.901 1.00 . A A . 18 LYS CA 1 1 14 9301 1 1 18 LYS CB C 2.429 6.649 3.389 1.00 . A A . 18 LYS CB 1 1 14 9302 1 1 18 LYS CD C 0.149 7.827 2.983 1.00 . A A . 18 LYS CD 1 1 14 9303 1 1 18 LYS CE C -0.693 8.768 2.100 1.00 . A A . 18 LYS CE 1 1 14 9304 1 1 18 LYS CG C 1.615 7.640 2.524 1.00 . A A . 18 LYS CG 1 1 14 9305 1 1 18 LYS H H 4.043 8.670 4.890 1.00 . A A . 18 LYS H 1 1 14 9306 1 1 18 LYS HA H 1.722 6.708 5.415 1.00 . A A . 18 LYS HA 1 1 14 9307 1 1 18 LYS HB2 H 3.396 6.408 2.922 1.00 . A A . 18 LYS HB2 1 1 14 9308 1 1 18 LYS HB3 H 1.901 5.677 3.330 1.00 . A A . 18 LYS HB3 1 1 14 9309 1 1 18 LYS HD2 H -0.346 6.838 3.000 1.00 . A A . 18 LYS HD2 1 1 14 9310 1 1 18 LYS HD3 H 0.118 8.181 4.030 1.00 . A A . 18 LYS HD3 1 1 14 9311 1 1 18 LYS HE2 H -0.677 8.428 1.048 1.00 . A A . 18 LYS HE2 1 1 14 9312 1 1 18 LYS HE3 H -1.751 8.713 2.416 1.00 . A A . 18 LYS HE3 1 1 14 9313 1 1 18 LYS HG2 H 2.134 8.616 2.495 1.00 . A A . 18 LYS HG2 1 1 14 9314 1 1 18 LYS HG3 H 1.622 7.278 1.479 1.00 . A A . 18 LYS HG3 1 1 14 9315 1 1 18 LYS HZ1 H -0.343 10.523 3.130 1.00 . A A . 18 LYS HZ1 1 1 14 9316 1 1 18 LYS HZ2 H -0.876 10.765 1.604 1.00 . A A . 18 LYS HZ2 1 1 14 9317 1 1 18 LYS N N 3.092 8.366 5.120 1.00 . A A . 18 LYS N 1 1 14 9318 1 1 18 LYS NZ N -0.255 10.175 2.169 1.00 . A A . 18 LYS NZ 1 1 14 9319 1 1 18 LYS O O 4.832 6.475 6.045 1.00 . A A . 18 LYS O 1 1 14 9320 1 1 19 CYS C C 5.650 3.517 5.348 1.00 . A A . 19 CYS C 1 1 14 9321 1 1 19 CYS CA C 4.327 3.760 6.139 1.00 . A A . 19 CYS CA 1 1 14 9322 1 1 19 CYS CB C 3.422 2.547 6.368 1.00 . A A . 19 CYS CB 1 1 14 9323 1 1 19 CYS H H 2.690 4.615 4.806 1.00 . A A . 19 CYS H 1 1 14 9324 1 1 19 CYS HA H 4.555 4.187 7.145 1.00 . A A . 19 CYS HA 1 1 14 9325 1 1 19 CYS HB2 H 2.742 2.349 5.524 1.00 . A A . 19 CYS HB2 1 1 14 9326 1 1 19 CYS HB3 H 4.017 1.634 6.549 1.00 . A A . 19 CYS HB3 1 1 14 9327 1 1 19 CYS N N 3.512 4.767 5.416 1.00 . A A . 19 CYS N 1 1 14 9328 1 1 19 CYS O O 5.757 3.589 4.119 1.00 . A A . 19 CYS O 1 1 14 9329 1 1 19 CYS SG S 2.443 2.984 7.797 1.00 . A A . 19 CYS SG 1 1 14 9330 1 1 20 CYS C C 8.601 2.583 4.663 1.00 . A A . 20 CYS C 1 1 14 9331 1 1 20 CYS CA C 8.111 3.444 5.864 1.00 . A A . 20 CYS CA 1 1 14 9332 1 1 20 CYS CB C 8.945 3.026 7.091 1.00 . A A . 20 CYS CB 1 1 14 9333 1 1 20 CYS H H 6.379 3.322 7.185 1.00 . A A . 20 CYS H 1 1 14 9334 1 1 20 CYS HA H 8.204 4.517 5.741 1.00 . A A . 20 CYS HA 1 1 14 9335 1 1 20 CYS HB2 H 8.474 3.398 7.999 1.00 . A A . 20 CYS HB2 1 1 14 9336 1 1 20 CYS HB3 H 9.040 1.928 7.204 1.00 . A A . 20 CYS HB3 1 1 14 9337 1 1 20 CYS N N 6.674 3.352 6.203 1.00 . A A . 20 CYS N 1 1 14 9338 1 1 20 CYS O O 9.310 3.122 3.808 1.00 . A A . 20 CYS O 1 1 14 9339 1 1 20 CYS SG S 10.567 3.828 6.939 1.00 . A A . 20 CYS SG 1 1 14 9340 1 1 21 ARG C C 7.762 0.281 2.299 1.00 . A A . 21 ARG C 1 1 14 9341 1 1 21 ARG CA C 8.724 0.351 3.536 1.00 . A A . 21 ARG CA 1 1 14 9342 1 1 21 ARG CB C 8.907 -1.026 4.253 1.00 . A A . 21 ARG CB 1 1 14 9343 1 1 21 ARG CD C 11.207 -1.763 3.293 1.00 . A A . 21 ARG CD 1 1 14 9344 1 1 21 ARG CG C 9.721 -2.112 3.508 1.00 . A A . 21 ARG CG 1 1 14 9345 1 1 21 ARG CZ C 13.138 -3.009 2.253 1.00 . A A . 21 ARG CZ 1 1 14 9346 1 1 21 ARG H H 7.556 1.084 5.322 1.00 . A A . 21 ARG H 1 1 14 9347 1 1 21 ARG HA H 9.674 0.728 3.129 1.00 . A A . 21 ARG HA 1 1 14 9348 1 1 21 ARG HB2 H 9.402 -0.890 5.236 1.00 . A A . 21 ARG HB2 1 1 14 9349 1 1 21 ARG HB3 H 7.913 -1.446 4.502 1.00 . A A . 21 ARG HB3 1 1 14 9350 1 1 21 ARG HD2 H 11.304 -0.850 2.677 1.00 . A A . 21 ARG HD2 1 1 14 9351 1 1 21 ARG HD3 H 11.691 -1.541 4.263 1.00 . A A . 21 ARG HD3 1 1 14 9352 1 1 21 ARG HG2 H 9.652 -3.047 4.096 1.00 . A A . 21 ARG HG2 1 1 14 9353 1 1 21 ARG HG3 H 9.245 -2.351 2.540 1.00 . A A . 21 ARG HG3 1 1 14 9354 1 1 21 ARG HH11 H 13.719 -1.188 2.879 1.00 . A A . 21 ARG HH11 1 1 14 9355 1 1 21 ARG HH12 H 14.992 -2.249 2.090 1.00 . A A . 21 ARG HH12 1 1 14 9356 1 1 21 ARG HH21 H 12.795 -4.853 1.553 1.00 . A A . 21 ARG HH21 1 1 14 9357 1 1 21 ARG HH22 H 14.500 -4.194 1.387 1.00 . A A . 21 ARG HH22 1 1 14 9358 1 1 21 ARG N N 8.258 1.285 4.615 1.00 . A A . 21 ARG N 1 1 14 9359 1 1 21 ARG NE N 11.923 -2.894 2.622 1.00 . A A . 21 ARG NE 1 1 14 9360 1 1 21 ARG NH1 N 14.043 -2.050 2.425 1.00 . A A . 21 ARG NH1 1 1 14 9361 1 1 21 ARG NH2 N 13.516 -4.133 1.672 1.00 . A A . 21 ARG NH2 1 1 14 9362 1 1 21 ARG O O 7.547 -0.759 1.669 1.00 . A A . 21 ARG O 1 1 14 9363 1 1 22 GLY C C 4.875 0.932 1.084 1.00 . A A . 22 GLY C 1 1 14 9364 1 1 22 GLY CA C 6.220 1.646 0.879 1.00 . A A . 22 GLY CA 1 1 14 9365 1 1 22 GLY H H 7.423 2.092 2.750 1.00 . A A . 22 GLY H 1 1 14 9366 1 1 22 GLY HA2 H 6.047 2.731 0.744 1.00 . A A . 22 GLY HA2 1 1 14 9367 1 1 22 GLY HA3 H 6.653 1.309 -0.068 1.00 . A A . 22 GLY HA3 1 1 14 9368 1 1 22 GLY N N 7.210 1.451 1.969 1.00 . A A . 22 GLY N 1 1 14 9369 1 1 22 GLY O O 4.459 0.100 0.274 1.00 . A A . 22 GLY O 1 1 14 9370 1 1 23 ARG C C 1.844 1.564 2.893 1.00 . A A . 23 ARG C 1 1 14 9371 1 1 23 ARG CA C 3.065 0.578 2.740 1.00 . A A . 23 ARG CA 1 1 14 9372 1 1 23 ARG CB C 3.458 -0.036 4.113 1.00 . A A . 23 ARG CB 1 1 14 9373 1 1 23 ARG CD C 3.984 -2.557 3.562 1.00 . A A . 23 ARG CD 1 1 14 9374 1 1 23 ARG CG C 4.445 -1.221 4.177 1.00 . A A . 23 ARG CG 1 1 14 9375 1 1 23 ARG CZ C 4.256 -3.575 1.265 1.00 . A A . 23 ARG CZ 1 1 14 9376 1 1 23 ARG H H 4.867 1.894 2.759 1.00 . A A . 23 ARG H 1 1 14 9377 1 1 23 ARG HA H 2.776 -0.243 2.064 1.00 . A A . 23 ARG HA 1 1 14 9378 1 1 23 ARG HB2 H 3.961 0.746 4.687 1.00 . A A . 23 ARG HB2 1 1 14 9379 1 1 23 ARG HB3 H 2.558 -0.291 4.704 1.00 . A A . 23 ARG HB3 1 1 14 9380 1 1 23 ARG HD2 H 4.546 -3.383 4.039 1.00 . A A . 23 ARG HD2 1 1 14 9381 1 1 23 ARG HD3 H 2.920 -2.739 3.792 1.00 . A A . 23 ARG HD3 1 1 14 9382 1 1 23 ARG HG2 H 5.428 -0.912 3.777 1.00 . A A . 23 ARG HG2 1 1 14 9383 1 1 23 ARG HG3 H 4.638 -1.397 5.253 1.00 . A A . 23 ARG HG3 1 1 14 9384 1 1 23 ARG HH11 H 3.984 -5.013 2.644 1.00 . A A . 23 ARG HH11 1 1 14 9385 1 1 23 ARG HH12 H 4.197 -5.552 0.903 1.00 . A A . 23 ARG HH12 1 1 14 9386 1 1 23 ARG HH21 H 4.540 -2.327 -0.274 1.00 . A A . 23 ARG HH21 1 1 14 9387 1 1 23 ARG HH22 H 4.492 -4.124 -0.645 1.00 . A A . 23 ARG HH22 1 1 14 9388 1 1 23 ARG N N 4.250 1.289 2.204 1.00 . A A . 23 ARG N 1 1 14 9389 1 1 23 ARG NE N 4.196 -2.597 2.080 1.00 . A A . 23 ARG NE 1 1 14 9390 1 1 23 ARG NH1 N 4.133 -4.844 1.643 1.00 . A A . 23 ARG NH1 1 1 14 9391 1 1 23 ARG NH2 N 4.449 -3.316 -0.015 1.00 . A A . 23 ARG NH2 1 1 14 9392 1 1 23 ARG O O 2.044 2.738 3.253 1.00 . A A . 23 ARG O 1 1 14 9393 1 1 24 PRO C C -1.207 2.378 4.027 1.00 . A A . 24 PRO C 1 1 14 9394 1 1 24 PRO CA C -0.618 2.024 2.620 1.00 . A A . 24 PRO CA 1 1 14 9395 1 1 24 PRO CB C -1.592 1.222 1.723 1.00 . A A . 24 PRO CB 1 1 14 9396 1 1 24 PRO CD C 0.243 -0.239 2.177 1.00 . A A . 24 PRO CD 1 1 14 9397 1 1 24 PRO CG C -1.268 -0.248 1.980 1.00 . A A . 24 PRO CG 1 1 14 9398 1 1 24 PRO HA H -0.368 2.990 2.136 1.00 . A A . 24 PRO HA 1 1 14 9399 1 1 24 PRO HB2 H -2.661 1.447 1.900 1.00 . A A . 24 PRO HB2 1 1 14 9400 1 1 24 PRO HB3 H -1.404 1.463 0.658 1.00 . A A . 24 PRO HB3 1 1 14 9401 1 1 24 PRO HD2 H 0.562 -1.012 2.901 1.00 . A A . 24 PRO HD2 1 1 14 9402 1 1 24 PRO HD3 H 0.746 -0.445 1.212 1.00 . A A . 24 PRO HD3 1 1 14 9403 1 1 24 PRO HG2 H -1.773 -0.604 2.896 1.00 . A A . 24 PRO HG2 1 1 14 9404 1 1 24 PRO HG3 H -1.587 -0.907 1.152 1.00 . A A . 24 PRO HG3 1 1 14 9405 1 1 24 PRO N N 0.566 1.124 2.651 1.00 . A A . 24 PRO N 1 1 14 9406 1 1 24 PRO O O -0.717 1.952 5.078 1.00 . A A . 24 PRO O 1 1 14 9407 1 1 25 CYS C C -4.452 3.879 4.899 1.00 . A A . 25 CYS C 1 1 14 9408 1 1 25 CYS CA C -2.924 3.787 5.192 1.00 . A A . 25 CYS CA 1 1 14 9409 1 1 25 CYS CB C -2.253 5.157 5.491 1.00 . A A . 25 CYS CB 1 1 14 9410 1 1 25 CYS H H -2.553 3.481 3.046 1.00 . A A . 25 CYS H 1 1 14 9411 1 1 25 CYS HA H -2.758 3.128 6.066 1.00 . A A . 25 CYS HA 1 1 14 9412 1 1 25 CYS HB2 H -1.317 4.976 6.035 1.00 . A A . 25 CYS HB2 1 1 14 9413 1 1 25 CYS HB3 H -1.991 5.650 4.555 1.00 . A A . 25 CYS HB3 1 1 14 9414 1 1 25 CYS N N -2.264 3.209 3.992 1.00 . A A . 25 CYS N 1 1 14 9415 1 1 25 CYS O O -4.904 4.159 3.783 1.00 . A A . 25 CYS O 1 1 14 9416 1 1 25 CYS SG S -3.289 6.333 6.379 1.00 . A A . 25 CYS SG 1 1 14 9417 1 1 26 ARG C C -7.181 3.991 7.327 1.00 . A A . 26 ARG C 1 1 14 9418 1 1 26 ARG CA C -6.723 3.538 5.917 1.00 . A A . 26 ARG CA 1 1 14 9419 1 1 26 ARG CB C -7.204 2.100 5.584 1.00 . A A . 26 ARG CB 1 1 14 9420 1 1 26 ARG CD C -9.166 0.509 4.999 1.00 . A A . 26 ARG CD 1 1 14 9421 1 1 26 ARG CG C -8.726 1.943 5.357 1.00 . A A . 26 ARG CG 1 1 14 9422 1 1 26 ARG CZ C -9.119 -1.776 6.040 1.00 . A A . 26 ARG CZ 1 1 14 9423 1 1 26 ARG H H -4.752 3.526 6.855 1.00 . A A . 26 ARG H 1 1 14 9424 1 1 26 ARG HA H -7.106 4.230 5.144 1.00 . A A . 26 ARG HA 1 1 14 9425 1 1 26 ARG HB2 H -6.684 1.745 4.673 1.00 . A A . 26 ARG HB2 1 1 14 9426 1 1 26 ARG HB3 H -6.884 1.410 6.387 1.00 . A A . 26 ARG HB3 1 1 14 9427 1 1 26 ARG HD2 H -10.228 0.523 4.692 1.00 . A A . 26 ARG HD2 1 1 14 9428 1 1 26 ARG HD3 H -8.600 0.157 4.115 1.00 . A A . 26 ARG HD3 1 1 14 9429 1 1 26 ARG HG2 H -9.285 2.291 6.247 1.00 . A A . 26 ARG HG2 1 1 14 9430 1 1 26 ARG HG3 H -9.035 2.619 4.538 1.00 . A A . 26 ARG HG3 1 1 14 9431 1 1 26 ARG HH11 H -9.543 -1.844 4.074 1.00 . A A . 26 ARG HH11 1 1 14 9432 1 1 26 ARG HH12 H -9.463 -3.444 4.969 1.00 . A A . 26 ARG HH12 1 1 14 9433 1 1 26 ARG HH21 H -8.716 -1.972 7.992 1.00 . A A . 26 ARG HH21 1 1 14 9434 1 1 26 ARG HH22 H -9.026 -3.509 7.038 1.00 . A A . 26 ARG HH22 1 1 14 9435 1 1 26 ARG N N -5.239 3.602 5.951 1.00 . A A . 26 ARG N 1 1 14 9436 1 1 26 ARG NE N -9.006 -0.437 6.134 1.00 . A A . 26 ARG NE 1 1 14 9437 1 1 26 ARG NH1 N -9.404 -2.421 4.911 1.00 . A A . 26 ARG NH1 1 1 14 9438 1 1 26 ARG NH2 N -8.936 -2.492 7.134 1.00 . A A . 26 ARG NH2 1 1 14 9439 1 1 26 ARG O O -6.613 3.548 8.338 1.00 . A A . 26 ARG O 1 1 14 9440 1 1 27 CYS C C -9.135 4.551 9.794 1.00 . A A . 27 CYS C 1 1 14 9441 1 1 27 CYS CA C -8.465 5.512 8.755 1.00 . A A . 27 CYS CA 1 1 14 9442 1 1 27 CYS CB C -9.422 6.742 8.610 1.00 . A A . 27 CYS CB 1 1 14 9443 1 1 27 CYS H H -8.593 5.224 6.557 1.00 . A A . 27 CYS H 1 1 14 9444 1 1 27 CYS HA H -7.463 5.835 9.049 1.00 . A A . 27 CYS HA 1 1 14 9445 1 1 27 CYS HB2 H -10.180 6.528 7.873 1.00 . A A . 27 CYS HB2 1 1 14 9446 1 1 27 CYS HB3 H -10.003 6.947 9.529 1.00 . A A . 27 CYS HB3 1 1 14 9447 1 1 27 CYS N N -8.192 4.883 7.438 1.00 . A A . 27 CYS N 1 1 14 9448 1 1 27 CYS O O -9.652 3.466 9.513 1.00 . A A . 27 CYS O 1 1 14 9449 1 1 27 CYS SG S -8.706 8.344 8.200 1.00 . A A . 27 CYS SG 1 1 14 9450 1 1 28 SER C C -11.152 4.326 12.289 1.00 . A A . 28 SER C 1 1 14 9451 1 1 28 SER CA C -9.590 4.454 12.279 1.00 . A A . 28 SER CA 1 1 14 9452 1 1 28 SER CB C -9.007 5.378 13.403 1.00 . A A . 28 SER CB 1 1 14 9453 1 1 28 SER H H -8.669 6.013 11.042 1.00 . A A . 28 SER H 1 1 14 9454 1 1 28 SER HA H -9.214 3.430 12.438 1.00 . A A . 28 SER HA 1 1 14 9455 1 1 28 SER HB2 H -7.969 5.705 13.200 1.00 . A A . 28 SER HB2 1 1 14 9456 1 1 28 SER HB3 H -9.595 6.309 13.512 1.00 . A A . 28 SER HB3 1 1 14 9457 1 1 28 SER HG H -8.630 5.329 15.287 1.00 . A A . 28 SER HG 1 1 14 9458 1 1 28 SER N N -9.051 5.061 11.039 1.00 . A A . 28 SER N 1 1 14 9459 1 1 28 SER O O -11.853 4.388 11.273 1.00 . A A . 28 SER O 1 1 14 9460 1 1 28 SER OG O -8.988 4.703 14.654 1.00 . A A . 28 SER OG 1 1 14 9461 1 1 29 MET C C -14.097 4.882 13.512 1.00 . A A . 29 MET C 1 1 14 9462 1 1 29 MET CA C -13.079 3.739 13.797 1.00 . A A . 29 MET CA 1 1 14 9463 1 1 29 MET CB C -13.113 3.337 15.301 1.00 . A A . 29 MET CB 1 1 14 9464 1 1 29 MET CE C -13.566 6.296 18.235 1.00 . A A . 29 MET CE 1 1 14 9465 1 1 29 MET CG C -12.776 4.333 16.435 1.00 . A A . 29 MET CG 1 1 14 9466 1 1 29 MET H H -10.922 4.195 14.205 1.00 . A A . 29 MET H 1 1 14 9467 1 1 29 MET HA H -13.390 2.877 13.175 1.00 . A A . 29 MET HA 1 1 14 9468 1 1 29 MET HB2 H -14.104 2.910 15.518 1.00 . A A . 29 MET HB2 1 1 14 9469 1 1 29 MET HB3 H -12.403 2.512 15.409 1.00 . A A . 29 MET HB3 1 1 14 9470 1 1 29 MET HE1 H -12.744 6.930 17.856 1.00 . A A . 29 MET HE1 1 1 14 9471 1 1 29 MET HE2 H -14.347 6.961 18.647 1.00 . A A . 29 MET HE2 1 1 14 9472 1 1 29 MET HE3 H -13.174 5.675 19.061 1.00 . A A . 29 MET HE3 1 1 14 9473 1 1 29 MET HG2 H -12.417 3.779 17.322 1.00 . A A . 29 MET HG2 1 1 14 9474 1 1 29 MET HG3 H -11.958 5.019 16.147 1.00 . A A . 29 MET HG3 1 1 14 9475 1 1 29 MET N N -11.654 4.079 13.498 1.00 . A A . 29 MET N 1 1 14 9476 1 1 29 MET O O -15.170 4.645 12.951 1.00 . A A . 29 MET O 1 1 14 9477 1 1 29 MET SD S -14.244 5.267 16.919 1.00 . A A . 29 MET SD 1 1 14 9478 1 1 30 ILE C C -14.551 7.837 12.250 1.00 . A A . 30 ILE C 1 1 14 9479 1 1 30 ILE CA C -14.558 7.330 13.744 1.00 . A A . 30 ILE CA 1 1 14 9480 1 1 30 ILE CB C -14.023 8.390 14.795 1.00 . A A . 30 ILE CB 1 1 14 9481 1 1 30 ILE CD1 C -14.827 10.546 16.044 1.00 . A A . 30 ILE CD1 1 1 14 9482 1 1 30 ILE CG1 C -15.005 9.603 14.843 1.00 . A A . 30 ILE CG1 1 1 14 9483 1 1 30 ILE CG2 C -12.593 8.917 14.463 1.00 . A A . 30 ILE CG2 1 1 14 9484 1 1 30 ILE H H -12.778 6.024 14.313 1.00 . A A . 30 ILE H 1 1 14 9485 1 1 30 ILE HA H -15.612 7.084 13.968 1.00 . A A . 30 ILE HA 1 1 14 9486 1 1 30 ILE HB H -14.002 7.918 15.796 1.00 . A A . 30 ILE HB 1 1 14 9487 1 1 30 ILE HD11 H -14.910 10.003 17.004 1.00 . A A . 30 ILE HD11 1 1 14 9488 1 1 30 ILE HD12 H -13.846 11.055 16.031 1.00 . A A . 30 ILE HD12 1 1 14 9489 1 1 30 ILE HD13 H -15.601 11.335 16.045 1.00 . A A . 30 ILE HD13 1 1 14 9490 1 1 30 ILE HG12 H -14.949 10.192 13.907 1.00 . A A . 30 ILE HG12 1 1 14 9491 1 1 30 ILE HG13 H -16.046 9.229 14.882 1.00 . A A . 30 ILE HG13 1 1 14 9492 1 1 30 ILE HG21 H -11.868 8.095 14.322 1.00 . A A . 30 ILE HG21 1 1 14 9493 1 1 30 ILE HG22 H -12.567 9.538 13.550 1.00 . A A . 30 ILE HG22 1 1 14 9494 1 1 30 ILE HG23 H -12.190 9.541 15.282 1.00 . A A . 30 ILE HG23 1 1 14 9495 1 1 30 ILE N N -13.726 6.100 13.917 1.00 . A A . 30 ILE N 1 1 14 9496 1 1 30 ILE O O -15.601 8.293 11.787 1.00 . A A . 30 ILE O 1 1 14 9497 1 1 31 GLY C C -12.152 9.251 9.865 1.00 . A A . 31 GLY C 1 1 14 9498 1 1 31 GLY CA C -13.306 8.259 10.131 1.00 . A A . 31 GLY CA 1 1 14 9499 1 1 31 GLY H H -12.625 7.445 12.100 1.00 . A A . 31 GLY H 1 1 14 9500 1 1 31 GLY HA2 H -13.176 7.383 9.469 1.00 . A A . 31 GLY HA2 1 1 14 9501 1 1 31 GLY HA3 H -14.244 8.732 9.781 1.00 . A A . 31 GLY HA3 1 1 14 9502 1 1 31 GLY N N -13.421 7.752 11.525 1.00 . A A . 31 GLY N 1 1 14 9503 1 1 31 GLY O O -11.543 9.195 8.794 1.00 . A A . 31 GLY O 1 1 14 9504 1 1 32 THR C C -9.618 10.584 11.763 1.00 . A A . 32 THR C 1 1 14 9505 1 1 32 THR CA C -10.712 11.089 10.768 1.00 . A A . 32 THR CA 1 1 14 9506 1 1 32 THR CB C -11.137 12.547 11.149 1.00 . A A . 32 THR CB 1 1 14 9507 1 1 32 THR CG2 C -12.095 13.174 10.116 1.00 . A A . 32 THR CG2 1 1 14 9508 1 1 32 THR H H -12.393 9.975 11.687 1.00 . A A . 32 THR H 1 1 14 9509 1 1 32 THR HA H -10.279 11.114 9.747 1.00 . A A . 32 THR HA 1 1 14 9510 1 1 32 THR HB H -10.216 13.159 11.202 1.00 . A A . 32 THR HB 1 1 14 9511 1 1 32 THR HG1 H -12.592 12.023 12.302 1.00 . A A . 32 THR HG1 1 1 14 9512 1 1 32 THR HG21 H -11.647 13.192 9.106 1.00 . A A . 32 THR HG21 1 1 14 9513 1 1 32 THR HG22 H -13.053 12.626 10.045 1.00 . A A . 32 THR HG22 1 1 14 9514 1 1 32 THR HG23 H -12.337 14.219 10.381 1.00 . A A . 32 THR HG23 1 1 14 9515 1 1 32 THR N N -11.885 10.163 10.814 1.00 . A A . 32 THR N 1 1 14 9516 1 1 32 THR O O -9.879 9.776 12.663 1.00 . A A . 32 THR O 1 1 14 9517 1 1 32 THR OG1 O -11.807 12.565 12.411 1.00 . A A . 32 THR OG1 1 1 14 9518 1 1 33 ASN C C -6.808 9.220 11.886 1.00 . A A . 33 ASN C 1 1 14 9519 1 1 33 ASN CA C -7.135 10.677 12.314 1.00 . A A . 33 ASN CA 1 1 14 9520 1 1 33 ASN CB C -7.293 10.786 13.871 1.00 . A A . 33 ASN CB 1 1 14 9521 1 1 33 ASN CG C -7.339 12.228 14.410 1.00 . A A . 33 ASN CG 1 1 14 9522 1 1 33 ASN H H -8.264 11.614 10.700 1.00 . A A . 33 ASN H 1 1 14 9523 1 1 33 ASN HA H -6.301 11.334 11.998 1.00 . A A . 33 ASN HA 1 1 14 9524 1 1 33 ASN HB2 H -8.185 10.254 14.241 1.00 . A A . 33 ASN HB2 1 1 14 9525 1 1 33 ASN HB3 H -6.474 10.223 14.360 1.00 . A A . 33 ASN HB3 1 1 14 9526 1 1 33 ASN HD21 H -5.361 12.201 14.742 1.00 . A A . 33 ASN HD21 1 1 14 9527 1 1 33 ASN HD22 H -6.262 13.741 15.169 1.00 . A A . 33 ASN HD22 1 1 14 9528 1 1 33 ASN N N -8.373 11.087 11.573 1.00 . A A . 33 ASN N 1 1 14 9529 1 1 33 ASN ND2 N -6.204 12.781 14.814 1.00 . A A . 33 ASN ND2 1 1 14 9530 1 1 33 ASN O O -7.052 8.260 12.628 1.00 . A A . 33 ASN O 1 1 14 9531 1 1 33 ASN OD1 O -8.397 12.854 14.466 1.00 . A A . 33 ASN OD1 1 1 14 9532 1 1 34 CYS C C -5.029 6.859 10.772 1.00 . A A . 34 CYS C 1 1 14 9533 1 1 34 CYS CA C -6.111 7.729 10.045 1.00 . A A . 34 CYS CA 1 1 14 9534 1 1 34 CYS CB C -5.657 7.800 8.554 1.00 . A A . 34 CYS CB 1 1 14 9535 1 1 34 CYS H H -6.289 9.956 10.122 1.00 . A A . 34 CYS H 1 1 14 9536 1 1 34 CYS HA H -7.107 7.290 10.110 1.00 . A A . 34 CYS HA 1 1 14 9537 1 1 34 CYS HB2 H -4.813 8.470 8.494 1.00 . A A . 34 CYS HB2 1 1 14 9538 1 1 34 CYS HB3 H -5.301 6.812 8.208 1.00 . A A . 34 CYS HB3 1 1 14 9539 1 1 34 CYS N N -6.259 9.076 10.657 1.00 . A A . 34 CYS N 1 1 14 9540 1 1 34 CYS O O -4.157 7.374 11.482 1.00 . A A . 34 CYS O 1 1 14 9541 1 1 34 CYS SG S -6.933 8.207 7.358 1.00 . A A . 34 CYS SG 1 1 14 9542 1 1 35 GLU C C -3.431 3.899 9.691 1.00 . A A . 35 GLU C 1 1 14 9543 1 1 35 GLU CA C -3.995 4.605 10.964 1.00 . A A . 35 GLU CA 1 1 14 9544 1 1 35 GLU CB C -4.446 3.511 11.975 1.00 . A A . 35 GLU CB 1 1 14 9545 1 1 35 GLU CD C -5.570 2.816 14.159 1.00 . A A . 35 GLU CD 1 1 14 9546 1 1 35 GLU CG C -5.155 3.978 13.255 1.00 . A A . 35 GLU CG 1 1 14 9547 1 1 35 GLU H H -5.804 5.286 9.830 1.00 . A A . 35 GLU H 1 1 14 9548 1 1 35 GLU HA H -3.181 5.178 11.442 1.00 . A A . 35 GLU HA 1 1 14 9549 1 1 35 GLU HB2 H -4.948 2.701 11.432 1.00 . A A . 35 GLU HB2 1 1 14 9550 1 1 35 GLU HB3 H -3.534 2.992 12.328 1.00 . A A . 35 GLU HB3 1 1 14 9551 1 1 35 GLU HE2 H -7.112 1.672 14.483 1.00 . A A . 35 GLU HE2 1 1 14 9552 1 1 35 GLU HG2 H -4.466 4.639 13.813 1.00 . A A . 35 GLU HG2 1 1 14 9553 1 1 35 GLU HG3 H -6.030 4.594 13.001 1.00 . A A . 35 GLU HG3 1 1 14 9554 1 1 35 GLU N N -5.100 5.526 10.548 1.00 . A A . 35 GLU N 1 1 14 9555 1 1 35 GLU O O -3.917 3.997 8.563 1.00 . A A . 35 GLU O 1 1 14 9556 1 1 35 GLU OE1 O -4.827 2.316 15.003 1.00 . A A . 35 GLU OE1 1 1 14 9557 1 1 35 GLU OE2 O -6.855 2.402 13.914 1.00 . A A . 35 GLU OE2 1 1 14 9558 1 1 36 CYS C C -2.086 1.005 8.784 1.00 . A A . 36 CYS C 1 1 14 9559 1 1 36 CYS CA C -1.562 2.465 8.902 1.00 . A A . 36 CYS CA 1 1 14 9560 1 1 36 CYS CB C -0.081 2.500 9.306 1.00 . A A . 36 CYS CB 1 1 14 9561 1 1 36 CYS H H -2.212 3.096 10.952 1.00 . A A . 36 CYS H 1 1 14 9562 1 1 36 CYS HA H -1.656 3.009 7.921 1.00 . A A . 36 CYS HA 1 1 14 9563 1 1 36 CYS HB2 H 0.248 3.535 9.520 1.00 . A A . 36 CYS HB2 1 1 14 9564 1 1 36 CYS HB3 H 0.109 1.908 10.220 1.00 . A A . 36 CYS HB3 1 1 14 9565 1 1 36 CYS N N -2.339 3.182 9.935 1.00 . A A . 36 CYS N 1 1 14 9566 1 1 36 CYS O O -2.376 0.357 9.798 1.00 . A A . 36 CYS O 1 1 14 9567 1 1 36 CYS SG S 0.857 1.822 7.947 1.00 . A A . 36 CYS SG 1 1 14 9568 1 1 37 THR C C -1.094 -1.671 6.942 1.00 . A A . 37 THR C 1 1 14 9569 1 1 37 THR CA C -2.449 -0.963 7.306 1.00 . A A . 37 THR CA 1 1 14 9570 1 1 37 THR CB C -3.490 -1.152 6.161 1.00 . A A . 37 THR CB 1 1 14 9571 1 1 37 THR CG2 C -4.907 -0.762 6.619 1.00 . A A . 37 THR CG2 1 1 14 9572 1 1 37 THR H H -1.867 1.111 6.794 1.00 . A A . 37 THR H 1 1 14 9573 1 1 37 THR HA H -2.895 -1.446 8.198 1.00 . A A . 37 THR HA 1 1 14 9574 1 1 37 THR HB H -3.487 -2.223 5.884 1.00 . A A . 37 THR HB 1 1 14 9575 1 1 37 THR HG1 H -2.296 -0.621 4.745 1.00 . A A . 37 THR HG1 1 1 14 9576 1 1 37 THR HG21 H -4.957 0.291 6.949 1.00 . A A . 37 THR HG21 1 1 14 9577 1 1 37 THR HG22 H -5.646 -0.894 5.808 1.00 . A A . 37 THR HG22 1 1 14 9578 1 1 37 THR HG23 H -5.244 -1.387 7.467 1.00 . A A . 37 THR HG23 1 1 14 9579 1 1 37 THR N N -2.150 0.479 7.551 1.00 . A A . 37 THR N 1 1 14 9580 1 1 37 THR O O -0.533 -1.374 5.880 1.00 . A A . 37 THR O 1 1 14 9581 1 1 37 THR OG1 O -3.172 -0.348 5.026 1.00 . A A . 37 THR OG1 1 1 14 9582 1 1 38 PRO C C 0.818 -4.194 6.212 1.00 . A A . 38 PRO C 1 1 14 9583 1 1 38 PRO CA C 0.741 -3.318 7.502 1.00 . A A . 38 PRO CA 1 1 14 9584 1 1 38 PRO CB C 0.932 -4.192 8.762 1.00 . A A . 38 PRO CB 1 1 14 9585 1 1 38 PRO CD C -1.054 -2.888 9.134 1.00 . A A . 38 PRO CD 1 1 14 9586 1 1 38 PRO CG C 0.137 -3.499 9.863 1.00 . A A . 38 PRO CG 1 1 14 9587 1 1 38 PRO HA H 1.551 -2.570 7.419 1.00 . A A . 38 PRO HA 1 1 14 9588 1 1 38 PRO HB2 H 0.529 -5.216 8.624 1.00 . A A . 38 PRO HB2 1 1 14 9589 1 1 38 PRO HB3 H 1.998 -4.309 9.032 1.00 . A A . 38 PRO HB3 1 1 14 9590 1 1 38 PRO HD2 H -1.926 -3.564 9.080 1.00 . A A . 38 PRO HD2 1 1 14 9591 1 1 38 PRO HD3 H -1.388 -1.976 9.655 1.00 . A A . 38 PRO HD3 1 1 14 9592 1 1 38 PRO HG2 H -0.163 -4.183 10.678 1.00 . A A . 38 PRO HG2 1 1 14 9593 1 1 38 PRO HG3 H 0.748 -2.697 10.313 1.00 . A A . 38 PRO HG3 1 1 14 9594 1 1 38 PRO N N -0.549 -2.614 7.774 1.00 . A A . 38 PRO N 1 1 14 9595 1 1 38 PRO O O 1.895 -4.254 5.615 1.00 . A A . 38 PRO O 1 1 14 9596 1 1 39 ARG C C 0.907 -6.909 4.751 1.00 . A A . 39 ARG C 1 1 14 9597 1 1 39 ARG CA C -0.347 -5.956 4.759 1.00 . A A . 39 ARG CA 1 1 14 9598 1 1 39 ARG CB C -0.553 -5.244 3.377 1.00 . A A . 39 ARG CB 1 1 14 9599 1 1 39 ARG CD C 0.303 -3.778 1.385 1.00 . A A . 39 ARG CD 1 1 14 9600 1 1 39 ARG CG C 0.478 -4.209 2.852 1.00 . A A . 39 ARG CG 1 1 14 9601 1 1 39 ARG CZ C 0.911 -4.654 -0.885 1.00 . A A . 39 ARG CZ 1 1 14 9602 1 1 39 ARG H H -1.082 -4.723 6.442 1.00 . A A . 39 ARG H 1 1 14 9603 1 1 39 ARG HA H -1.220 -6.608 4.953 1.00 . A A . 39 ARG HA 1 1 14 9604 1 1 39 ARG HB2 H -0.663 -6.042 2.618 1.00 . A A . 39 ARG HB2 1 1 14 9605 1 1 39 ARG HB3 H -1.546 -4.755 3.384 1.00 . A A . 39 ARG HB3 1 1 14 9606 1 1 39 ARG HD2 H -0.735 -3.445 1.200 1.00 . A A . 39 ARG HD2 1 1 14 9607 1 1 39 ARG HD3 H 0.944 -2.893 1.213 1.00 . A A . 39 ARG HD3 1 1 14 9608 1 1 39 ARG HG2 H 0.413 -3.305 3.483 1.00 . A A . 39 ARG HG2 1 1 14 9609 1 1 39 ARG HG3 H 1.509 -4.578 2.996 1.00 . A A . 39 ARG HG3 1 1 14 9610 1 1 39 ARG HH11 H 0.568 -2.671 -0.900 1.00 . A A . 39 ARG HH11 1 1 14 9611 1 1 39 ARG HH12 H 1.032 -3.452 -2.494 1.00 . A A . 39 ARG HH12 1 1 14 9612 1 1 39 ARG HH21 H 1.304 -6.602 -1.128 1.00 . A A . 39 ARG HH21 1 1 14 9613 1 1 39 ARG HH22 H 1.421 -5.529 -2.612 1.00 . A A . 39 ARG HH22 1 1 14 9614 1 1 39 ARG N N -0.277 -4.903 5.833 1.00 . A A . 39 ARG N 1 1 14 9615 1 1 39 ARG NE N 0.676 -4.849 0.427 1.00 . A A . 39 ARG NE 1 1 14 9616 1 1 39 ARG NH1 N 0.828 -3.470 -1.489 1.00 . A A . 39 ARG NH1 1 1 14 9617 1 1 39 ARG NH2 N 1.246 -5.701 -1.616 1.00 . A A . 39 ARG NH2 1 1 14 9618 1 1 39 ARG O O 1.726 -6.921 3.826 1.00 . A A . 39 ARG O 1 1 14 9619 1 1 40 LEU C C 1.811 -10.079 5.258 1.00 . A A . 40 LEU C 1 1 14 9620 1 1 40 LEU CA C 2.123 -8.720 5.971 1.00 . A A . 40 LEU CA 1 1 14 9621 1 1 40 LEU CB C 2.393 -8.879 7.507 1.00 . A A . 40 LEU CB 1 1 14 9622 1 1 40 LEU CD1 C -0.030 -8.988 8.536 1.00 . A A . 40 LEU CD1 1 1 14 9623 1 1 40 LEU CD2 C 1.474 -11.040 8.650 1.00 . A A . 40 LEU CD2 1 1 14 9624 1 1 40 LEU CG C 1.422 -9.502 8.565 1.00 . A A . 40 LEU CG 1 1 14 9625 1 1 40 LEU H H 0.269 -7.638 6.509 1.00 . A A . 40 LEU H 1 1 14 9626 1 1 40 LEU HA H 3.043 -8.336 5.497 1.00 . A A . 40 LEU HA 1 1 14 9627 1 1 40 LEU HB2 H 3.360 -9.408 7.604 1.00 . A A . 40 LEU HB2 1 1 14 9628 1 1 40 LEU HB3 H 2.649 -7.868 7.883 1.00 . A A . 40 LEU HB3 1 1 14 9629 1 1 40 LEU HD11 H -0.070 -7.883 8.564 1.00 . A A . 40 LEU HD11 1 1 14 9630 1 1 40 LEU HD12 H -0.572 -9.316 7.630 1.00 . A A . 40 LEU HD12 1 1 14 9631 1 1 40 LEU HD13 H -0.608 -9.348 9.407 1.00 . A A . 40 LEU HD13 1 1 14 9632 1 1 40 LEU HD21 H 2.509 -11.404 8.785 1.00 . A A . 40 LEU HD21 1 1 14 9633 1 1 40 LEU HD22 H 0.895 -11.420 9.512 1.00 . A A . 40 LEU HD22 1 1 14 9634 1 1 40 LEU HD23 H 1.069 -11.537 7.753 1.00 . A A . 40 LEU HD23 1 1 14 9635 1 1 40 LEU HG H 1.822 -9.166 9.541 1.00 . A A . 40 LEU HG 1 1 14 9636 1 1 40 LEU N N 1.013 -7.735 5.810 1.00 . A A . 40 LEU N 1 1 14 9637 1 1 40 LEU O O 2.718 -10.618 4.621 1.00 . A A . 40 LEU O 1 1 14 9638 1 1 41 ILE C C 0.788 -13.056 5.017 1.00 . A A . 41 ILE C 1 1 14 9639 1 1 41 ILE CA C 0.040 -11.767 4.521 1.00 . A A . 41 ILE CA 1 1 14 9640 1 1 41 ILE CB C 0.219 -11.548 2.957 1.00 . A A . 41 ILE CB 1 1 14 9641 1 1 41 ILE CD1 C -1.836 -9.847 2.761 1.00 . A A . 41 ILE CD1 1 1 14 9642 1 1 41 ILE CG1 C -0.368 -10.189 2.441 1.00 . A A . 41 ILE CG1 1 1 14 9643 1 1 41 ILE CG2 C -0.491 -12.699 2.192 1.00 . A A . 41 ILE CG2 1 1 14 9644 1 1 41 ILE H H -0.074 -10.007 5.860 1.00 . A A . 41 ILE H 1 1 14 9645 1 1 41 ILE HA H -1.039 -11.874 4.751 1.00 . A A . 41 ILE HA 1 1 14 9646 1 1 41 ILE HB H 1.290 -11.563 2.683 1.00 . A A . 41 ILE HB 1 1 14 9647 1 1 41 ILE HD11 H -2.019 -9.795 3.850 1.00 . A A . 41 ILE HD11 1 1 14 9648 1 1 41 ILE HD12 H -2.110 -8.862 2.341 1.00 . A A . 41 ILE HD12 1 1 14 9649 1 1 41 ILE HD13 H -2.536 -10.588 2.337 1.00 . A A . 41 ILE HD13 1 1 14 9650 1 1 41 ILE HG12 H 0.260 -9.364 2.825 1.00 . A A . 41 ILE HG12 1 1 14 9651 1 1 41 ILE HG13 H -0.230 -10.129 1.345 1.00 . A A . 41 ILE HG13 1 1 14 9652 1 1 41 ILE HG21 H -1.566 -12.777 2.443 1.00 . A A . 41 ILE HG21 1 1 14 9653 1 1 41 ILE HG22 H -0.419 -12.569 1.096 1.00 . A A . 41 ILE HG22 1 1 14 9654 1 1 41 ILE HG23 H -0.037 -13.682 2.414 1.00 . A A . 41 ILE HG23 1 1 14 9655 1 1 41 ILE N N 0.559 -10.598 5.311 1.00 . A A . 41 ILE N 1 1 14 9656 1 1 41 ILE O O 1.867 -13.396 4.522 1.00 . A A . 41 ILE O 1 1 14 9657 1 1 42 MET C C 2.031 -14.835 7.312 1.00 . A A . 42 MET C 1 1 14 9658 1 1 42 MET CA C 0.640 -15.047 6.607 1.00 . A A . 42 MET CA 1 1 14 9659 1 1 42 MET CB C 0.625 -16.148 5.489 1.00 . A A . 42 MET CB 1 1 14 9660 1 1 42 MET CE C -1.024 -19.168 4.642 1.00 . A A . 42 MET CE 1 1 14 9661 1 1 42 MET CG C 0.831 -17.579 6.015 1.00 . A A . 42 MET CG 1 1 14 9662 1 1 42 MET H H -0.719 -13.340 6.298 1.00 . A A . 42 MET H 1 1 14 9663 1 1 42 MET HA H -0.062 -15.331 7.410 1.00 . A A . 42 MET HA 1 1 14 9664 1 1 42 MET HB2 H -0.349 -16.128 4.965 1.00 . A A . 42 MET HB2 1 1 14 9665 1 1 42 MET HB3 H 1.376 -15.942 4.704 1.00 . A A . 42 MET HB3 1 1 14 9666 1 1 42 MET HE1 H -1.330 -19.610 5.608 1.00 . A A . 42 MET HE1 1 1 14 9667 1 1 42 MET HE2 H -1.639 -18.267 4.462 1.00 . A A . 42 MET HE2 1 1 14 9668 1 1 42 MET HE3 H -1.247 -19.899 3.845 1.00 . A A . 42 MET HE3 1 1 14 9669 1 1 42 MET HG2 H 1.823 -17.678 6.491 1.00 . A A . 42 MET HG2 1 1 14 9670 1 1 42 MET HG3 H 0.087 -17.833 6.792 1.00 . A A . 42 MET HG3 1 1 14 9671 1 1 42 MET N N 0.169 -13.759 5.997 1.00 . A A . 42 MET N 1 1 14 9672 1 1 42 MET O O 2.023 -14.433 8.478 1.00 . A A . 42 MET O 1 1 14 9673 1 1 42 MET SD S 0.735 -18.760 4.650 1.00 . A A . 42 MET SD 1 1 14 9674 1 1 43 GLU C C 4.891 -16.033 8.233 1.00 . A A . 43 GLU C 1 1 14 9675 1 1 43 GLU CA C 4.586 -14.942 7.155 1.00 . A A . 43 GLU CA 1 1 14 9676 1 1 43 GLU CB C 4.851 -13.538 7.794 1.00 . A A . 43 GLU CB 1 1 14 9677 1 1 43 GLU CD C 5.519 -12.213 5.663 1.00 . A A . 43 GLU CD 1 1 14 9678 1 1 43 GLU CG C 4.618 -12.299 6.899 1.00 . A A . 43 GLU CG 1 1 14 9679 1 1 43 GLU H H 3.012 -15.444 5.692 1.00 . A A . 43 GLU H 1 1 14 9680 1 1 43 GLU HA H 5.265 -15.080 6.291 1.00 . A A . 43 GLU HA 1 1 14 9681 1 1 43 GLU HB2 H 4.261 -13.414 8.720 1.00 . A A . 43 GLU HB2 1 1 14 9682 1 1 43 GLU HB3 H 5.901 -13.502 8.145 1.00 . A A . 43 GLU HB3 1 1 14 9683 1 1 43 GLU HE2 H 5.499 -12.714 3.781 1.00 . A A . 43 GLU HE2 1 1 14 9684 1 1 43 GLU HG2 H 3.557 -12.250 6.595 1.00 . A A . 43 GLU HG2 1 1 14 9685 1 1 43 GLU HG3 H 4.779 -11.389 7.506 1.00 . A A . 43 GLU HG3 1 1 14 9686 1 1 43 GLU N N 3.182 -15.101 6.643 1.00 . A A . 43 GLU N 1 1 14 9687 1 1 43 GLU O O 4.110 -16.283 9.159 1.00 . A A . 43 GLU O 1 1 14 9688 1 1 43 GLU OE1 O 6.638 -11.701 5.673 1.00 . A A . 43 GLU OE1 1 1 14 9689 1 1 43 GLU OE2 O 4.933 -12.769 4.554 1.00 . A A . 43 GLU OE2 1 1 14 9690 1 1 44 GLY C C 6.175 -19.111 8.580 1.00 . A A . 44 GLY C 1 1 14 9691 1 1 44 GLY CA C 6.555 -17.693 9.038 1.00 . A A . 44 GLY CA 1 1 14 9692 1 1 44 GLY H H 6.642 -16.327 7.309 1.00 . A A . 44 GLY H 1 1 14 9693 1 1 44 GLY HA2 H 7.653 -17.590 9.141 1.00 . A A . 44 GLY HA2 1 1 14 9694 1 1 44 GLY HA3 H 6.166 -17.520 10.060 1.00 . A A . 44 GLY HA3 1 1 14 9695 1 1 44 GLY N N 6.073 -16.660 8.095 1.00 . A A . 44 GLY N 1 1 14 9696 1 1 44 GLY O O 5.061 -19.565 8.856 1.00 . A A . 44 GLY O 1 1 14 9697 1 1 45 LEU C C 6.791 -22.309 8.430 1.00 . A A . 45 LEU C 1 1 14 9698 1 1 45 LEU CA C 6.868 -21.172 7.350 1.00 . A A . 45 LEU CA 1 1 14 9699 1 1 45 LEU CB C 8.011 -21.452 6.315 1.00 . A A . 45 LEU CB 1 1 14 9700 1 1 45 LEU CD1 C 10.175 -20.638 7.562 1.00 . A A . 45 LEU CD1 1 1 14 9701 1 1 45 LEU CD2 C 9.810 -23.128 7.199 1.00 . A A . 45 LEU CD2 1 1 14 9702 1 1 45 LEU CG C 9.513 -21.708 6.673 1.00 . A A . 45 LEU CG 1 1 14 9703 1 1 45 LEU H H 7.993 -19.304 7.752 1.00 . A A . 45 LEU H 1 1 14 9704 1 1 45 LEU HA H 5.893 -21.187 6.828 1.00 . A A . 45 LEU HA 1 1 14 9705 1 1 45 LEU HB2 H 7.676 -22.311 5.704 1.00 . A A . 45 LEU HB2 1 1 14 9706 1 1 45 LEU HB3 H 7.995 -20.626 5.577 1.00 . A A . 45 LEU HB3 1 1 14 9707 1 1 45 LEU HD11 H 10.028 -19.622 7.152 1.00 . A A . 45 LEU HD11 1 1 14 9708 1 1 45 LEU HD12 H 9.770 -20.642 8.590 1.00 . A A . 45 LEU HD12 1 1 14 9709 1 1 45 LEU HD13 H 11.267 -20.794 7.643 1.00 . A A . 45 LEU HD13 1 1 14 9710 1 1 45 LEU HD21 H 9.358 -23.905 6.556 1.00 . A A . 45 LEU HD21 1 1 14 9711 1 1 45 LEU HD22 H 10.897 -23.329 7.221 1.00 . A A . 45 LEU HD22 1 1 14 9712 1 1 45 LEU HD23 H 9.437 -23.292 8.225 1.00 . A A . 45 LEU HD23 1 1 14 9713 1 1 45 LEU HG H 10.045 -21.653 5.704 1.00 . A A . 45 LEU HG 1 1 14 9714 1 1 45 LEU N N 7.109 -19.803 7.903 1.00 . A A . 45 LEU N 1 1 14 9715 1 1 45 LEU O O 6.176 -23.337 8.133 1.00 . A A . 45 LEU O 1 1 14 9716 1 1 46 SER C C 5.922 -22.585 11.606 1.00 . A A . 46 SER C 1 1 14 9717 1 1 46 SER CA C 7.140 -23.089 10.777 1.00 . A A . 46 SER CA 1 1 14 9718 1 1 46 SER CB C 8.427 -23.165 11.637 1.00 . A A . 46 SER CB 1 1 14 9719 1 1 46 SER H H 7.814 -21.241 9.779 1.00 . A A . 46 SER H 1 1 14 9720 1 1 46 SER HA H 6.939 -24.115 10.404 1.00 . A A . 46 SER HA 1 1 14 9721 1 1 46 SER HB2 H 8.278 -23.868 12.478 1.00 . A A . 46 SER HB2 1 1 14 9722 1 1 46 SER HB3 H 9.255 -23.594 11.042 1.00 . A A . 46 SER HB3 1 1 14 9723 1 1 46 SER HG H 9.633 -22.072 12.666 1.00 . A A . 46 SER HG 1 1 14 9724 1 1 46 SER N N 7.354 -22.148 9.649 1.00 . A A . 46 SER N 1 1 14 9725 1 1 46 SER O O 5.990 -21.553 12.284 1.00 . A A . 46 SER O 1 1 14 9726 1 1 46 SER OG O 8.838 -21.902 12.155 1.00 . A A . 46 SER OG 1 1 14 9727 1 1 47 PHE C C 3.256 -23.612 13.438 1.00 . A A . 47 PHE C 1 1 14 9728 1 1 47 PHE CA C 3.493 -22.881 12.083 1.00 . A A . 47 PHE CA 1 1 14 9729 1 1 47 PHE CB C 2.358 -23.168 11.047 1.00 . A A . 47 PHE CB 1 1 14 9730 1 1 47 PHE CD1 C 1.842 -21.002 9.790 1.00 . A A . 47 PHE CD1 1 1 14 9731 1 1 47 PHE CD2 C 2.925 -22.795 8.588 1.00 . A A . 47 PHE CD2 1 1 14 9732 1 1 47 PHE CE1 C 1.858 -20.221 8.637 1.00 . A A . 47 PHE CE1 1 1 14 9733 1 1 47 PHE CE2 C 2.944 -22.011 7.437 1.00 . A A . 47 PHE CE2 1 1 14 9734 1 1 47 PHE CG C 2.376 -22.296 9.775 1.00 . A A . 47 PHE CG 1 1 14 9735 1 1 47 PHE CZ C 2.409 -20.726 7.462 1.00 . A A . 47 PHE CZ 1 1 14 9736 1 1 47 PHE H H 4.873 -24.140 10.898 1.00 . A A . 47 PHE H 1 1 14 9737 1 1 47 PHE HA H 3.488 -21.799 12.293 1.00 . A A . 47 PHE HA 1 1 14 9738 1 1 47 PHE HB2 H 2.352 -24.242 10.771 1.00 . A A . 47 PHE HB2 1 1 14 9739 1 1 47 PHE HB3 H 1.379 -23.024 11.545 1.00 . A A . 47 PHE HB3 1 1 14 9740 1 1 47 PHE HD1 H 1.415 -20.596 10.697 1.00 . A A . 47 PHE HD1 1 1 14 9741 1 1 47 PHE HD2 H 3.349 -23.789 8.554 1.00 . A A . 47 PHE HD2 1 1 14 9742 1 1 47 PHE HE1 H 1.450 -19.221 8.656 1.00 . A A . 47 PHE HE1 1 1 14 9743 1 1 47 PHE HE2 H 3.379 -22.398 6.527 1.00 . A A . 47 PHE HE2 1 1 14 9744 1 1 47 PHE HZ H 2.432 -20.119 6.569 1.00 . A A . 47 PHE HZ 1 1 14 9745 1 1 47 PHE N N 4.796 -23.312 11.500 1.00 . A A . 47 PHE N 1 1 14 9746 1 1 47 PHE O O 3.260 -22.950 14.480 1.00 . A A . 47 PHE O 1 1 14 9747 1 1 48 ALA C C 4.227 -26.274 15.170 1.00 . A A . 48 ALA C 1 1 14 9748 1 1 48 ALA CA C 2.866 -25.752 14.660 1.00 . A A . 48 ALA CA 1 1 14 9749 1 1 48 ALA CB C 1.919 -26.922 14.333 1.00 . A A . 48 ALA CB 1 1 14 9750 1 1 48 ALA H H 3.092 -25.349 12.489 1.00 . A A . 48 ALA H 1 1 14 9751 1 1 48 ALA HXT H 5.441 -26.004 16.668 1.00 . A A . 48 ALA HXT 1 1 14 9752 1 1 48 ALA HA H 2.389 -25.144 15.454 1.00 . A A . 48 ALA HA 1 1 14 9753 1 1 48 ALA HB1 H 2.320 -27.587 13.543 1.00 . A A . 48 ALA HB1 1 1 14 9754 1 1 48 ALA HB2 H 1.733 -27.551 15.224 1.00 . A A . 48 ALA HB2 1 1 14 9755 1 1 48 ALA HB3 H 0.931 -26.564 13.989 1.00 . A A . 48 ALA HB3 1 1 14 9756 1 1 48 ALA N N 3.072 -24.948 13.431 1.00 . A A . 48 ALA N 1 1 14 9757 1 1 48 ALA O O 4.910 -27.114 14.581 1.00 . A A . 48 ALA O 1 1 14 9758 1 1 48 ALA OXT O 4.592 -25.683 16.353 1.00 . A A . 48 ALA OXT 1 1 15 9759 1 1 1 GLU C C 12.558 7.801 11.711 1.00 . A A . 1 GLU C 1 1 15 9760 1 1 1 GLU CA C 11.913 6.389 11.718 1.00 . A A . 1 GLU CA 1 1 15 9761 1 1 1 GLU CB C 10.572 6.396 12.506 1.00 . A A . 1 GLU CB 1 1 15 9762 1 1 1 GLU CD C 8.430 5.109 13.157 1.00 . A A . 1 GLU CD 1 1 15 9763 1 1 1 GLU CG C 9.696 5.141 12.293 1.00 . A A . 1 GLU CG 1 1 15 9764 1 1 1 GLU H1 H 13.763 5.424 11.837 1.00 . A A . 1 GLU H1 1 1 15 9765 1 1 1 GLU H2 H 12.507 4.496 12.375 1.00 . A A . 1 GLU H2 1 1 15 9766 1 1 1 GLU HA H 11.720 6.057 10.678 1.00 . A A . 1 GLU HA 1 1 15 9767 1 1 1 GLU HB2 H 10.761 6.549 13.587 1.00 . A A . 1 GLU HB2 1 1 15 9768 1 1 1 GLU HB3 H 9.974 7.275 12.194 1.00 . A A . 1 GLU HB3 1 1 15 9769 1 1 1 GLU HE2 H 6.733 6.045 13.338 1.00 . A A . 1 GLU HE2 1 1 15 9770 1 1 1 GLU HG2 H 9.408 5.064 11.228 1.00 . A A . 1 GLU HG2 1 1 15 9771 1 1 1 GLU HG3 H 10.287 4.230 12.504 1.00 . A A . 1 GLU HG3 1 1 15 9772 1 1 1 GLU N N 12.874 5.454 12.348 1.00 . A A . 1 GLU N 1 1 15 9773 1 1 1 GLU O O 12.632 8.476 12.744 1.00 . A A . 1 GLU O 1 1 15 9774 1 1 1 GLU OE1 O 8.249 4.294 14.061 1.00 . A A . 1 GLU OE1 1 1 15 9775 1 1 1 GLU OE2 O 7.525 6.074 12.797 1.00 . A A . 1 GLU OE2 1 1 15 9776 1 1 2 ASP C C 12.233 10.510 9.852 1.00 . A A . 2 ASP C 1 1 15 9777 1 1 2 ASP CA C 13.458 9.648 10.289 1.00 . A A . 2 ASP CA 1 1 15 9778 1 1 2 ASP CB C 14.594 9.653 9.222 1.00 . A A . 2 ASP CB 1 1 15 9779 1 1 2 ASP CG C 15.935 9.078 9.706 1.00 . A A . 2 ASP CG 1 1 15 9780 1 1 2 ASP H H 12.872 7.585 9.742 1.00 . A A . 2 ASP H 1 1 15 9781 1 1 2 ASP HA H 13.859 10.085 11.218 1.00 . A A . 2 ASP HA 1 1 15 9782 1 1 2 ASP HB2 H 14.276 9.134 8.297 1.00 . A A . 2 ASP HB2 1 1 15 9783 1 1 2 ASP HB3 H 14.787 10.695 8.903 1.00 . A A . 2 ASP HB3 1 1 15 9784 1 1 2 ASP HD2 H 15.328 7.422 8.883 1.00 . A A . 2 ASP HD2 1 1 15 9785 1 1 2 ASP N N 12.997 8.245 10.518 1.00 . A A . 2 ASP N 1 1 15 9786 1 1 2 ASP O O 11.835 11.409 10.599 1.00 . A A . 2 ASP O 1 1 15 9787 1 1 2 ASP OD1 O 16.768 9.734 10.329 1.00 . A A . 2 ASP OD1 1 1 15 9788 1 1 2 ASP OD2 O 16.086 7.757 9.367 1.00 . A A . 2 ASP OD2 1 1 15 9789 1 1 3 ASN C C 9.654 9.765 7.328 1.00 . A A . 3 ASN C 1 1 15 9790 1 1 3 ASN CA C 10.336 10.809 8.247 1.00 . A A . 3 ASN CA 1 1 15 9791 1 1 3 ASN CB C 10.560 12.162 7.567 1.00 . A A . 3 ASN CB 1 1 15 9792 1 1 3 ASN CG C 9.304 12.924 7.092 1.00 . A A . 3 ASN CG 1 1 15 9793 1 1 3 ASN H H 11.986 9.359 8.264 1.00 . A A . 3 ASN H 1 1 15 9794 1 1 3 ASN HA H 9.684 10.989 9.132 1.00 . A A . 3 ASN HA 1 1 15 9795 1 1 3 ASN HB2 H 10.952 12.702 8.429 1.00 . A A . 3 ASN HB2 1 1 15 9796 1 1 3 ASN HB3 H 11.357 12.129 6.797 1.00 . A A . 3 ASN HB3 1 1 15 9797 1 1 3 ASN HD21 H 9.932 12.822 5.190 1.00 . A A . 3 ASN HD21 1 1 15 9798 1 1 3 ASN HD22 H 8.335 13.670 5.503 1.00 . A A . 3 ASN HD22 1 1 15 9799 1 1 3 ASN N N 11.644 10.231 8.674 1.00 . A A . 3 ASN N 1 1 15 9800 1 1 3 ASN ND2 N 9.178 13.165 5.797 1.00 . A A . 3 ASN ND2 1 1 15 9801 1 1 3 ASN O O 9.544 9.834 6.100 1.00 . A A . 3 ASN O 1 1 15 9802 1 1 3 ASN OD1 O 8.440 13.298 7.886 1.00 . A A . 3 ASN OD1 1 1 15 9803 1 1 4 CYS C C 7.579 7.055 8.875 1.00 . A A . 4 CYS C 1 1 15 9804 1 1 4 CYS CA C 8.323 7.685 7.648 1.00 . A A . 4 CYS CA 1 1 15 9805 1 1 4 CYS CB C 9.136 6.617 6.917 1.00 . A A . 4 CYS CB 1 1 15 9806 1 1 4 CYS H H 9.507 9.098 9.033 1.00 . A A . 4 CYS H 1 1 15 9807 1 1 4 CYS HA H 7.574 8.042 6.922 1.00 . A A . 4 CYS HA 1 1 15 9808 1 1 4 CYS HB2 H 8.337 5.927 6.748 1.00 . A A . 4 CYS HB2 1 1 15 9809 1 1 4 CYS HB3 H 9.418 6.840 5.879 1.00 . A A . 4 CYS HB3 1 1 15 9810 1 1 4 CYS N N 9.188 8.798 8.098 1.00 . A A . 4 CYS N 1 1 15 9811 1 1 4 CYS O O 7.940 7.283 10.038 1.00 . A A . 4 CYS O 1 1 15 9812 1 1 4 CYS SG S 10.321 5.615 7.822 1.00 . A A . 4 CYS SG 1 1 15 9813 1 1 5 ILE C C 5.957 4.080 9.567 1.00 . A A . 5 ILE C 1 1 15 9814 1 1 5 ILE CA C 5.711 5.600 9.694 1.00 . A A . 5 ILE CA 1 1 15 9815 1 1 5 ILE CB C 4.160 5.879 9.627 1.00 . A A . 5 ILE CB 1 1 15 9816 1 1 5 ILE CD1 C 2.493 7.648 8.896 1.00 . A A . 5 ILE CD1 1 1 15 9817 1 1 5 ILE CG1 C 3.887 7.378 9.414 1.00 . A A . 5 ILE CG1 1 1 15 9818 1 1 5 ILE CG2 C 3.466 5.390 10.944 1.00 . A A . 5 ILE CG2 1 1 15 9819 1 1 5 ILE H H 6.449 6.035 7.565 1.00 . A A . 5 ILE H 1 1 15 9820 1 1 5 ILE HA H 6.043 5.973 10.667 1.00 . A A . 5 ILE HA 1 1 15 9821 1 1 5 ILE HB H 3.663 5.338 8.823 1.00 . A A . 5 ILE HB 1 1 15 9822 1 1 5 ILE HD11 H 1.768 7.105 9.507 1.00 . A A . 5 ILE HD11 1 1 15 9823 1 1 5 ILE HD12 H 2.234 8.718 8.942 1.00 . A A . 5 ILE HD12 1 1 15 9824 1 1 5 ILE HD13 H 2.364 7.302 7.857 1.00 . A A . 5 ILE HD13 1 1 15 9825 1 1 5 ILE HG12 H 4.077 7.917 10.338 1.00 . A A . 5 ILE HG12 1 1 15 9826 1 1 5 ILE HG13 H 4.566 7.807 8.665 1.00 . A A . 5 ILE HG13 1 1 15 9827 1 1 5 ILE HG21 H 3.872 5.833 11.868 1.00 . A A . 5 ILE HG21 1 1 15 9828 1 1 5 ILE HG22 H 2.375 5.586 10.961 1.00 . A A . 5 ILE HG22 1 1 15 9829 1 1 5 ILE HG23 H 3.531 4.291 11.046 1.00 . A A . 5 ILE HG23 1 1 15 9830 1 1 5 ILE N N 6.527 6.239 8.588 1.00 . A A . 5 ILE N 1 1 15 9831 1 1 5 ILE O O 5.241 3.362 8.866 1.00 . A A . 5 ILE O 1 1 15 9832 1 1 6 ALA C C 6.495 1.095 10.869 1.00 . A A . 6 ALA C 1 1 15 9833 1 1 6 ALA CA C 7.385 2.128 10.075 1.00 . A A . 6 ALA CA 1 1 15 9834 1 1 6 ALA CB C 8.847 2.029 10.549 1.00 . A A . 6 ALA CB 1 1 15 9835 1 1 6 ALA H H 7.376 4.211 10.932 1.00 . A A . 6 ALA H 1 1 15 9836 1 1 6 ALA HA H 7.308 1.892 8.985 1.00 . A A . 6 ALA HA 1 1 15 9837 1 1 6 ALA HB1 H 9.505 2.744 10.020 1.00 . A A . 6 ALA HB1 1 1 15 9838 1 1 6 ALA HB2 H 8.947 2.223 11.635 1.00 . A A . 6 ALA HB2 1 1 15 9839 1 1 6 ALA HB3 H 9.261 1.022 10.359 1.00 . A A . 6 ALA HB3 1 1 15 9840 1 1 6 ALA N N 6.974 3.558 10.261 1.00 . A A . 6 ALA N 1 1 15 9841 1 1 6 ALA O O 6.905 -0.037 11.145 1.00 . A A . 6 ALA O 1 1 15 9842 1 1 7 GLU C C 3.239 0.052 11.461 1.00 . A A . 7 GLU C 1 1 15 9843 1 1 7 GLU CA C 4.369 0.836 12.153 1.00 . A A . 7 GLU CA 1 1 15 9844 1 1 7 GLU CB C 3.777 1.929 13.092 1.00 . A A . 7 GLU CB 1 1 15 9845 1 1 7 GLU CD C 4.109 3.744 14.866 1.00 . A A . 7 GLU CD 1 1 15 9846 1 1 7 GLU CG C 4.772 2.644 14.036 1.00 . A A . 7 GLU CG 1 1 15 9847 1 1 7 GLU H H 5.251 2.544 11.034 1.00 . A A . 7 GLU H 1 1 15 9848 1 1 7 GLU HA H 4.906 0.117 12.734 1.00 . A A . 7 GLU HA 1 1 15 9849 1 1 7 GLU HB2 H 3.240 2.676 12.483 1.00 . A A . 7 GLU HB2 1 1 15 9850 1 1 7 GLU HB3 H 2.994 1.472 13.729 1.00 . A A . 7 GLU HB3 1 1 15 9851 1 1 7 GLU HE2 H 3.132 3.951 16.537 1.00 . A A . 7 GLU HE2 1 1 15 9852 1 1 7 GLU HG2 H 5.250 1.910 14.710 1.00 . A A . 7 GLU HG2 1 1 15 9853 1 1 7 GLU HG3 H 5.600 3.095 13.457 1.00 . A A . 7 GLU HG3 1 1 15 9854 1 1 7 GLU N N 5.278 1.529 11.224 1.00 . A A . 7 GLU N 1 1 15 9855 1 1 7 GLU O O 2.821 0.322 10.334 1.00 . A A . 7 GLU O 1 1 15 9856 1 1 7 GLU OE1 O 4.082 4.926 14.524 1.00 . A A . 7 GLU OE1 1 1 15 9857 1 1 7 GLU OE2 O 3.549 3.258 16.020 1.00 . A A . 7 GLU OE2 1 1 15 9858 1 1 8 ASP C C 0.527 -1.069 12.981 1.00 . A A . 8 ASP C 1 1 15 9859 1 1 8 ASP CA C 1.503 -1.658 11.942 1.00 . A A . 8 ASP CA 1 1 15 9860 1 1 8 ASP CB C 1.559 -3.180 12.116 1.00 . A A . 8 ASP CB 1 1 15 9861 1 1 8 ASP CG C 2.432 -3.889 11.066 1.00 . A A . 8 ASP CG 1 1 15 9862 1 1 8 ASP H H 3.214 -1.019 13.151 1.00 . A A . 8 ASP H 1 1 15 9863 1 1 8 ASP HA H 1.208 -1.464 10.896 1.00 . A A . 8 ASP HA 1 1 15 9864 1 1 8 ASP HB2 H 1.844 -3.377 13.147 1.00 . A A . 8 ASP HB2 1 1 15 9865 1 1 8 ASP HB3 H 0.537 -3.593 12.024 1.00 . A A . 8 ASP HB3 1 1 15 9866 1 1 8 ASP HD2 H 0.942 -5.132 10.921 1.00 . A A . 8 ASP HD2 1 1 15 9867 1 1 8 ASP N N 2.748 -0.928 12.241 1.00 . A A . 8 ASP N 1 1 15 9868 1 1 8 ASP O O 0.706 -1.066 14.206 1.00 . A A . 8 ASP O 1 1 15 9869 1 1 8 ASP OD1 O 3.550 -3.503 10.731 1.00 . A A . 8 ASP OD1 1 1 15 9870 1 1 8 ASP OD2 O 1.812 -4.992 10.540 1.00 . A A . 8 ASP OD2 1 1 15 9871 1 1 9 TYR C C -0.955 1.576 13.728 1.00 . A A . 9 TYR C 1 1 15 9872 1 1 9 TYR CA C -1.576 0.318 12.976 1.00 . A A . 9 TYR CA 1 1 15 9873 1 1 9 TYR CB C -2.459 -0.605 13.892 1.00 . A A . 9 TYR CB 1 1 15 9874 1 1 9 TYR CD1 C -4.250 -1.564 12.318 1.00 . A A . 9 TYR CD1 1 1 15 9875 1 1 9 TYR CD2 C -2.580 -3.074 13.194 1.00 . A A . 9 TYR CD2 1 1 15 9876 1 1 9 TYR CE1 C -4.782 -2.602 11.551 1.00 . A A . 9 TYR CE1 1 1 15 9877 1 1 9 TYR CE2 C -3.103 -4.104 12.411 1.00 . A A . 9 TYR CE2 1 1 15 9878 1 1 9 TYR CG C -3.150 -1.792 13.155 1.00 . A A . 9 TYR CG 1 1 15 9879 1 1 9 TYR CZ C -4.225 -3.875 11.627 1.00 . A A . 9 TYR CZ 1 1 15 9880 1 1 9 TYR H H -0.446 -0.853 11.391 1.00 . A A . 9 TYR H 1 1 15 9881 1 1 9 TYR HA H -2.207 0.745 12.176 1.00 . A A . 9 TYR HA 1 1 15 9882 1 1 9 TYR HB2 H -1.870 -0.976 14.754 1.00 . A A . 9 TYR HB2 1 1 15 9883 1 1 9 TYR HB3 H -3.247 0.015 14.361 1.00 . A A . 9 TYR HB3 1 1 15 9884 1 1 9 TYR HD1 H -4.656 -0.568 12.219 1.00 . A A . 9 TYR HD1 1 1 15 9885 1 1 9 TYR HD2 H -1.688 -3.259 13.775 1.00 . A A . 9 TYR HD2 1 1 15 9886 1 1 9 TYR HE1 H -5.570 -2.418 10.828 1.00 . A A . 9 TYR HE1 1 1 15 9887 1 1 9 TYR HE2 H -2.605 -5.063 12.325 1.00 . A A . 9 TYR HE2 1 1 15 9888 1 1 9 TYR HH H -4.230 -5.696 11.054 1.00 . A A . 9 TYR HH 1 1 15 9889 1 1 9 TYR N N -0.516 -0.547 12.364 1.00 . A A . 9 TYR N 1 1 15 9890 1 1 9 TYR O O -1.410 1.972 14.805 1.00 . A A . 9 TYR O 1 1 15 9891 1 1 9 TYR OH O -4.748 -4.903 10.894 1.00 . A A . 9 TYR OH 1 1 15 9892 1 1 10 GLY C C -0.364 4.741 13.294 1.00 . A A . 10 GLY C 1 1 15 9893 1 1 10 GLY CA C 0.606 3.569 13.465 1.00 . A A . 10 GLY CA 1 1 15 9894 1 1 10 GLY H H 0.378 1.738 12.248 1.00 . A A . 10 GLY H 1 1 15 9895 1 1 10 GLY HA2 H 1.165 3.585 14.409 1.00 . A A . 10 GLY HA2 1 1 15 9896 1 1 10 GLY HA3 H 1.406 3.809 12.745 1.00 . A A . 10 GLY HA3 1 1 15 9897 1 1 10 GLY N N 0.041 2.240 13.081 1.00 . A A . 10 GLY N 1 1 15 9898 1 1 10 GLY O O -1.520 4.538 12.949 1.00 . A A . 10 GLY O 1 1 15 9899 1 1 11 LYS C C -0.160 7.656 11.749 1.00 . A A . 11 LYS C 1 1 15 9900 1 1 11 LYS CA C -0.711 7.179 13.128 1.00 . A A . 11 LYS CA 1 1 15 9901 1 1 11 LYS CB C -0.616 8.358 14.119 1.00 . A A . 11 LYS CB 1 1 15 9902 1 1 11 LYS CD C -0.844 9.279 16.548 1.00 . A A . 11 LYS CD 1 1 15 9903 1 1 11 LYS CE C -1.976 10.317 16.381 1.00 . A A . 11 LYS CE 1 1 15 9904 1 1 11 LYS CG C -0.876 8.048 15.612 1.00 . A A . 11 LYS CG 1 1 15 9905 1 1 11 LYS H H 1.112 5.975 13.638 1.00 . A A . 11 LYS H 1 1 15 9906 1 1 11 LYS HA H -1.793 6.905 13.049 1.00 . A A . 11 LYS HA 1 1 15 9907 1 1 11 LYS HB2 H 0.345 8.862 13.964 1.00 . A A . 11 LYS HB2 1 1 15 9908 1 1 11 LYS HB3 H -1.357 9.112 13.793 1.00 . A A . 11 LYS HB3 1 1 15 9909 1 1 11 LYS HD2 H -0.836 8.925 17.596 1.00 . A A . 11 LYS HD2 1 1 15 9910 1 1 11 LYS HD3 H 0.127 9.794 16.423 1.00 . A A . 11 LYS HD3 1 1 15 9911 1 1 11 LYS HE2 H -1.759 11.194 17.018 1.00 . A A . 11 LYS HE2 1 1 15 9912 1 1 11 LYS HE3 H -2.003 10.706 15.347 1.00 . A A . 11 LYS HE3 1 1 15 9913 1 1 11 LYS HG2 H -1.841 7.520 15.722 1.00 . A A . 11 LYS HG2 1 1 15 9914 1 1 11 LYS HG3 H -0.113 7.330 15.967 1.00 . A A . 11 LYS HG3 1 1 15 9915 1 1 11 LYS HZ1 H -3.301 9.453 17.710 1.00 . A A . 11 LYS HZ1 1 1 15 9916 1 1 11 LYS HZ2 H -3.538 8.983 16.162 1.00 . A A . 11 LYS HZ2 1 1 15 9917 1 1 11 LYS N N 0.092 5.975 13.522 1.00 . A A . 11 LYS N 1 1 15 9918 1 1 11 LYS NZ N -3.309 9.796 16.743 1.00 . A A . 11 LYS NZ 1 1 15 9919 1 1 11 LYS O O 1.047 7.859 11.593 1.00 . A A . 11 LYS O 1 1 15 9920 1 1 12 CYS C C -1.892 9.564 9.170 1.00 . A A . 12 CYS C 1 1 15 9921 1 1 12 CYS CA C -0.790 8.526 9.490 1.00 . A A . 12 CYS CA 1 1 15 9922 1 1 12 CYS CB C -0.730 7.472 8.352 1.00 . A A . 12 CYS CB 1 1 15 9923 1 1 12 CYS H H -1.994 7.799 11.238 1.00 . A A . 12 CYS H 1 1 15 9924 1 1 12 CYS HA H 0.170 9.074 9.515 1.00 . A A . 12 CYS HA 1 1 15 9925 1 1 12 CYS HB2 H -0.490 7.932 7.380 1.00 . A A . 12 CYS HB2 1 1 15 9926 1 1 12 CYS HB3 H 0.064 6.737 8.490 1.00 . A A . 12 CYS HB3 1 1 15 9927 1 1 12 CYS N N -1.072 7.867 10.803 1.00 . A A . 12 CYS N 1 1 15 9928 1 1 12 CYS O O -2.858 9.747 9.923 1.00 . A A . 12 CYS O 1 1 15 9929 1 1 12 CYS SG S -2.173 6.462 8.179 1.00 . A A . 12 CYS SG 1 1 15 9930 1 1 13 THR C C -2.864 11.199 6.025 1.00 . A A . 13 THR C 1 1 15 9931 1 1 13 THR CA C -2.798 11.230 7.583 1.00 . A A . 13 THR CA 1 1 15 9932 1 1 13 THR CB C -2.569 12.728 8.097 1.00 . A A . 13 THR CB 1 1 15 9933 1 1 13 THR CG2 C -1.613 12.932 9.296 1.00 . A A . 13 THR CG2 1 1 15 9934 1 1 13 THR H H -0.854 10.034 7.518 1.00 . A A . 13 THR H 1 1 15 9935 1 1 13 THR HA H -3.785 10.879 7.965 1.00 . A A . 13 THR HA 1 1 15 9936 1 1 13 THR HB H -3.580 13.105 8.336 1.00 . A A . 13 THR HB 1 1 15 9937 1 1 13 THR HG1 H -1.949 14.442 7.480 1.00 . A A . 13 THR HG1 1 1 15 9938 1 1 13 THR HG21 H -1.941 12.371 10.187 1.00 . A A . 13 THR HG21 1 1 15 9939 1 1 13 THR HG22 H -0.579 12.617 9.055 1.00 . A A . 13 THR HG22 1 1 15 9940 1 1 13 THR HG23 H -1.557 13.999 9.582 1.00 . A A . 13 THR HG23 1 1 15 9941 1 1 13 THR N N -1.722 10.286 8.041 1.00 . A A . 13 THR N 1 1 15 9942 1 1 13 THR O O -1.883 10.959 5.309 1.00 . A A . 13 THR O 1 1 15 9943 1 1 13 THR OG1 O -1.987 13.561 7.100 1.00 . A A . 13 THR OG1 1 1 15 9944 1 1 14 TRP C C -3.793 13.296 3.853 1.00 . A A . 14 TRP C 1 1 15 9945 1 1 14 TRP CA C -4.314 11.844 4.094 1.00 . A A . 14 TRP CA 1 1 15 9946 1 1 14 TRP CB C -5.823 11.732 3.747 1.00 . A A . 14 TRP CB 1 1 15 9947 1 1 14 TRP CD1 C -5.884 9.066 3.618 1.00 . A A . 14 TRP CD1 1 1 15 9948 1 1 14 TRP CD2 C -7.850 10.092 3.856 1.00 . A A . 14 TRP CD2 1 1 15 9949 1 1 14 TRP CE2 C -8.053 8.695 3.738 1.00 . A A . 14 TRP CE2 1 1 15 9950 1 1 14 TRP CE3 C -8.958 10.964 4.034 1.00 . A A . 14 TRP CE3 1 1 15 9951 1 1 14 TRP CG C -6.488 10.342 3.768 1.00 . A A . 14 TRP CG 1 1 15 9952 1 1 14 TRP CH2 C -10.438 9.031 3.970 1.00 . A A . 14 TRP CH2 1 1 15 9953 1 1 14 TRP CZ2 C -9.363 8.158 3.795 1.00 . A A . 14 TRP CZ2 1 1 15 9954 1 1 14 TRP CZ3 C -10.239 10.412 4.091 1.00 . A A . 14 TRP CZ3 1 1 15 9955 1 1 14 TRP H H -4.768 11.718 6.269 1.00 . A A . 14 TRP H 1 1 15 9956 1 1 14 TRP HA H -3.762 11.119 3.461 1.00 . A A . 14 TRP HA 1 1 15 9957 1 1 14 TRP HB2 H -6.399 12.414 4.403 1.00 . A A . 14 TRP HB2 1 1 15 9958 1 1 14 TRP HB3 H -5.978 12.138 2.729 1.00 . A A . 14 TRP HB3 1 1 15 9959 1 1 14 TRP HD1 H -4.821 8.875 3.554 1.00 . A A . 14 TRP HD1 1 1 15 9960 1 1 14 TRP HE1 H -6.680 7.028 3.498 1.00 . A A . 14 TRP HE1 1 1 15 9961 1 1 14 TRP HE3 H -8.822 12.031 4.130 1.00 . A A . 14 TRP HE3 1 1 15 9962 1 1 14 TRP HH2 H -11.441 8.633 4.024 1.00 . A A . 14 TRP HH2 1 1 15 9963 1 1 14 TRP HZ2 H -9.531 7.094 3.712 1.00 . A A . 14 TRP HZ2 1 1 15 9964 1 1 14 TRP HZ3 H -11.090 11.061 4.234 1.00 . A A . 14 TRP HZ3 1 1 15 9965 1 1 14 TRP N N -4.068 11.555 5.535 1.00 . A A . 14 TRP N 1 1 15 9966 1 1 14 TRP NE1 N -6.843 8.037 3.587 1.00 . A A . 14 TRP NE1 1 1 15 9967 1 1 14 TRP O O -4.403 14.281 4.288 1.00 . A A . 14 TRP O 1 1 15 9968 1 1 15 GLY C C -0.907 14.752 4.353 1.00 . A A . 15 GLY C 1 1 15 9969 1 1 15 GLY CA C -1.841 14.653 3.119 1.00 . A A . 15 GLY CA 1 1 15 9970 1 1 15 GLY H H -2.214 12.491 2.924 1.00 . A A . 15 GLY H 1 1 15 9971 1 1 15 GLY HA2 H -1.251 14.658 2.184 1.00 . A A . 15 GLY HA2 1 1 15 9972 1 1 15 GLY HA3 H -2.501 15.538 3.060 1.00 . A A . 15 GLY HA3 1 1 15 9973 1 1 15 GLY N N -2.619 13.390 3.208 1.00 . A A . 15 GLY N 1 1 15 9974 1 1 15 GLY O O -1.104 15.597 5.229 1.00 . A A . 15 GLY O 1 1 15 9975 1 1 16 GLY C C 2.061 12.630 5.242 1.00 . A A . 16 GLY C 1 1 15 9976 1 1 16 GLY CA C 0.929 13.605 5.581 1.00 . A A . 16 GLY CA 1 1 15 9977 1 1 16 GLY H H 0.091 13.214 3.588 1.00 . A A . 16 GLY H 1 1 15 9978 1 1 16 GLY HA2 H 1.333 14.498 6.079 1.00 . A A . 16 GLY HA2 1 1 15 9979 1 1 16 GLY HA3 H 0.281 13.145 6.351 1.00 . A A . 16 GLY HA3 1 1 15 9980 1 1 16 GLY N N 0.081 13.847 4.395 1.00 . A A . 16 GLY N 1 1 15 9981 1 1 16 GLY O O 2.502 12.478 4.095 1.00 . A A . 16 GLY O 1 1 15 9982 1 1 17 THR C C 2.534 9.527 5.879 1.00 . A A . 17 THR C 1 1 15 9983 1 1 17 THR CA C 3.433 10.790 6.159 1.00 . A A . 17 THR CA 1 1 15 9984 1 1 17 THR CB C 4.324 10.560 7.443 1.00 . A A . 17 THR CB 1 1 15 9985 1 1 17 THR CG2 C 5.637 9.831 7.100 1.00 . A A . 17 THR CG2 1 1 15 9986 1 1 17 THR H H 2.118 12.320 7.177 1.00 . A A . 17 THR H 1 1 15 9987 1 1 17 THR HA H 4.109 10.985 5.299 1.00 . A A . 17 THR HA 1 1 15 9988 1 1 17 THR HB H 3.790 9.920 8.174 1.00 . A A . 17 THR HB 1 1 15 9989 1 1 17 THR HG1 H 5.183 12.282 7.360 1.00 . A A . 17 THR HG1 1 1 15 9990 1 1 17 THR HG21 H 5.459 8.846 6.639 1.00 . A A . 17 THR HG21 1 1 15 9991 1 1 17 THR HG22 H 6.293 10.388 6.408 1.00 . A A . 17 THR HG22 1 1 15 9992 1 1 17 THR HG23 H 6.225 9.624 8.015 1.00 . A A . 17 THR HG23 1 1 15 9993 1 1 17 THR N N 2.504 11.948 6.302 1.00 . A A . 17 THR N 1 1 15 9994 1 1 17 THR O O 1.428 9.343 6.425 1.00 . A A . 17 THR O 1 1 15 9995 1 1 17 THR OG1 O 4.695 11.803 8.034 1.00 . A A . 17 THR OG1 1 1 15 9996 1 1 18 LYS C C 3.596 6.339 5.456 1.00 . A A . 18 LYS C 1 1 15 9997 1 1 18 LYS CA C 2.640 7.302 4.707 1.00 . A A . 18 LYS CA 1 1 15 9998 1 1 18 LYS CB C 2.618 6.995 3.177 1.00 . A A . 18 LYS CB 1 1 15 9999 1 1 18 LYS CD C 2.052 7.643 0.718 1.00 . A A . 18 LYS CD 1 1 15 10000 1 1 18 LYS CE C 0.973 6.593 0.382 1.00 . A A . 18 LYS CE 1 1 15 10001 1 1 18 LYS CG C 2.094 8.075 2.199 1.00 . A A . 18 LYS CG 1 1 15 10002 1 1 18 LYS H H 4.064 8.979 4.759 1.00 . A A . 18 LYS H 1 1 15 10003 1 1 18 LYS HA H 1.616 7.104 5.068 1.00 . A A . 18 LYS HA 1 1 15 10004 1 1 18 LYS HB2 H 3.602 6.604 2.871 1.00 . A A . 18 LYS HB2 1 1 15 10005 1 1 18 LYS HB3 H 1.970 6.106 3.053 1.00 . A A . 18 LYS HB3 1 1 15 10006 1 1 18 LYS HD2 H 1.877 8.548 0.106 1.00 . A A . 18 LYS HD2 1 1 15 10007 1 1 18 LYS HD3 H 3.052 7.276 0.415 1.00 . A A . 18 LYS HD3 1 1 15 10008 1 1 18 LYS HE2 H 1.142 5.661 0.950 1.00 . A A . 18 LYS HE2 1 1 15 10009 1 1 18 LYS HE3 H -0.027 6.960 0.677 1.00 . A A . 18 LYS HE3 1 1 15 10010 1 1 18 LYS HG2 H 1.092 8.417 2.519 1.00 . A A . 18 LYS HG2 1 1 15 10011 1 1 18 LYS HG3 H 2.742 8.968 2.274 1.00 . A A . 18 LYS HG3 1 1 15 10012 1 1 18 LYS HZ1 H 1.883 5.925 -1.346 1.00 . A A . 18 LYS HZ1 1 1 15 10013 1 1 18 LYS HZ2 H 0.805 7.126 -1.605 1.00 . A A . 18 LYS HZ2 1 1 15 10014 1 1 18 LYS N N 3.112 8.685 5.002 1.00 . A A . 18 LYS N 1 1 15 10015 1 1 18 LYS NZ N 0.963 6.274 -1.057 1.00 . A A . 18 LYS NZ 1 1 15 10016 1 1 18 LYS O O 4.579 6.701 6.125 1.00 . A A . 18 LYS O 1 1 15 10017 1 1 19 CYS C C 5.224 3.573 5.440 1.00 . A A . 19 CYS C 1 1 15 10018 1 1 19 CYS CA C 3.930 4.041 6.210 1.00 . A A . 19 CYS CA 1 1 15 10019 1 1 19 CYS CB C 2.834 3.016 6.575 1.00 . A A . 19 CYS CB 1 1 15 10020 1 1 19 CYS H H 2.524 4.885 4.644 1.00 . A A . 19 CYS H 1 1 15 10021 1 1 19 CYS HA H 4.198 4.543 7.169 1.00 . A A . 19 CYS HA 1 1 15 10022 1 1 19 CYS HB2 H 2.425 2.490 5.726 1.00 . A A . 19 CYS HB2 1 1 15 10023 1 1 19 CYS HB3 H 3.252 2.279 7.290 1.00 . A A . 19 CYS HB3 1 1 15 10024 1 1 19 CYS N N 3.267 5.052 5.350 1.00 . A A . 19 CYS N 1 1 15 10025 1 1 19 CYS O O 5.259 3.329 4.230 1.00 . A A . 19 CYS O 1 1 15 10026 1 1 19 CYS SG S 1.451 3.976 7.255 1.00 . A A . 19 CYS SG 1 1 15 10027 1 1 20 CYS C C 8.182 2.527 4.757 1.00 . A A . 20 CYS C 1 1 15 10028 1 1 20 CYS CA C 7.742 3.556 5.838 1.00 . A A . 20 CYS CA 1 1 15 10029 1 1 20 CYS CB C 8.593 3.220 7.088 1.00 . A A . 20 CYS CB 1 1 15 10030 1 1 20 CYS H H 6.068 3.814 7.214 1.00 . A A . 20 CYS H 1 1 15 10031 1 1 20 CYS HA H 7.903 4.593 5.556 1.00 . A A . 20 CYS HA 1 1 15 10032 1 1 20 CYS HB2 H 8.187 3.721 7.967 1.00 . A A . 20 CYS HB2 1 1 15 10033 1 1 20 CYS HB3 H 8.629 2.142 7.327 1.00 . A A . 20 CYS HB3 1 1 15 10034 1 1 20 CYS N N 6.307 3.597 6.240 1.00 . A A . 20 CYS N 1 1 15 10035 1 1 20 CYS O O 8.878 2.927 3.819 1.00 . A A . 20 CYS O 1 1 15 10036 1 1 20 CYS SG S 10.276 3.837 6.883 1.00 . A A . 20 CYS SG 1 1 15 10037 1 1 21 ARG C C 7.538 -0.170 2.784 1.00 . A A . 21 ARG C 1 1 15 10038 1 1 21 ARG CA C 8.400 0.127 4.055 1.00 . A A . 21 ARG CA 1 1 15 10039 1 1 21 ARG CB C 8.489 -1.136 4.964 1.00 . A A . 21 ARG CB 1 1 15 10040 1 1 21 ARG CD C 9.143 -2.162 7.251 1.00 . A A . 21 ARG CD 1 1 15 10041 1 1 21 ARG CG C 9.423 -1.068 6.201 1.00 . A A . 21 ARG CG 1 1 15 10042 1 1 21 ARG CZ C 6.946 -2.699 8.403 1.00 . A A . 21 ARG CZ 1 1 15 10043 1 1 21 ARG H H 7.172 1.122 5.656 1.00 . A A . 21 ARG H 1 1 15 10044 1 1 21 ARG HA H 9.394 0.416 3.683 1.00 . A A . 21 ARG HA 1 1 15 10045 1 1 21 ARG HB2 H 7.468 -1.412 5.289 1.00 . A A . 21 ARG HB2 1 1 15 10046 1 1 21 ARG HB3 H 8.821 -2.002 4.359 1.00 . A A . 21 ARG HB3 1 1 15 10047 1 1 21 ARG HD2 H 9.140 -3.160 6.774 1.00 . A A . 21 ARG HD2 1 1 15 10048 1 1 21 ARG HD3 H 9.973 -2.179 7.980 1.00 . A A . 21 ARG HD3 1 1 15 10049 1 1 21 ARG HG2 H 10.470 -1.152 5.857 1.00 . A A . 21 ARG HG2 1 1 15 10050 1 1 21 ARG HG3 H 9.368 -0.079 6.691 1.00 . A A . 21 ARG HG3 1 1 15 10051 1 1 21 ARG HH11 H 7.836 -4.391 7.783 1.00 . A A . 21 ARG HH11 1 1 15 10052 1 1 21 ARG HH12 H 6.220 -4.558 8.635 1.00 . A A . 21 ARG HH12 1 1 15 10053 1 1 21 ARG HH21 H 5.874 -1.162 9.106 1.00 . A A . 21 ARG HH21 1 1 15 10054 1 1 21 ARG HH22 H 5.182 -2.846 9.336 1.00 . A A . 21 ARG HH22 1 1 15 10055 1 1 21 ARG N N 7.845 1.236 4.907 1.00 . A A . 21 ARG N 1 1 15 10056 1 1 21 ARG NE N 7.854 -1.909 7.982 1.00 . A A . 21 ARG NE 1 1 15 10057 1 1 21 ARG NH1 N 7.007 -4.018 8.259 1.00 . A A . 21 ARG NH1 1 1 15 10058 1 1 21 ARG NH2 N 5.894 -2.183 9.009 1.00 . A A . 21 ARG NH2 1 1 15 10059 1 1 21 ARG O O 7.366 -1.309 2.335 1.00 . A A . 21 ARG O 1 1 15 10060 1 1 22 GLY C C 4.641 0.274 1.635 1.00 . A A . 22 GLY C 1 1 15 10061 1 1 22 GLY CA C 5.970 0.895 1.170 1.00 . A A . 22 GLY CA 1 1 15 10062 1 1 22 GLY H H 7.178 1.665 2.928 1.00 . A A . 22 GLY H 1 1 15 10063 1 1 22 GLY HA2 H 5.798 1.926 0.806 1.00 . A A . 22 GLY HA2 1 1 15 10064 1 1 22 GLY HA3 H 6.335 0.339 0.307 1.00 . A A . 22 GLY HA3 1 1 15 10065 1 1 22 GLY N N 7.004 0.919 2.233 1.00 . A A . 22 GLY N 1 1 15 10066 1 1 22 GLY O O 4.167 -0.723 1.084 1.00 . A A . 22 GLY O 1 1 15 10067 1 1 23 ARG C C 1.768 1.351 3.286 1.00 . A A . 23 ARG C 1 1 15 10068 1 1 23 ARG CA C 2.972 0.352 3.460 1.00 . A A . 23 ARG CA 1 1 15 10069 1 1 23 ARG CB C 3.376 0.193 4.949 1.00 . A A . 23 ARG CB 1 1 15 10070 1 1 23 ARG CD C 4.354 -2.273 4.881 1.00 . A A . 23 ARG CD 1 1 15 10071 1 1 23 ARG CG C 4.443 -0.824 5.392 1.00 . A A . 23 ARG CG 1 1 15 10072 1 1 23 ARG CZ C 2.836 -4.224 5.359 1.00 . A A . 23 ARG CZ 1 1 15 10073 1 1 23 ARG H H 4.675 1.671 3.016 1.00 . A A . 23 ARG H 1 1 15 10074 1 1 23 ARG HA H 2.693 -0.651 3.121 1.00 . A A . 23 ARG HA 1 1 15 10075 1 1 23 ARG HB2 H 3.826 1.134 5.278 1.00 . A A . 23 ARG HB2 1 1 15 10076 1 1 23 ARG HB3 H 2.470 0.035 5.565 1.00 . A A . 23 ARG HB3 1 1 15 10077 1 1 23 ARG HD2 H 4.369 -2.293 3.775 1.00 . A A . 23 ARG HD2 1 1 15 10078 1 1 23 ARG HD3 H 5.262 -2.818 5.204 1.00 . A A . 23 ARG HD3 1 1 15 10079 1 1 23 ARG HG2 H 5.420 -0.404 5.097 1.00 . A A . 23 ARG HG2 1 1 15 10080 1 1 23 ARG HG3 H 4.470 -0.809 6.501 1.00 . A A . 23 ARG HG3 1 1 15 10081 1 1 23 ARG HH11 H 4.527 -4.834 4.458 1.00 . A A . 23 ARG HH11 1 1 15 10082 1 1 23 ARG HH12 H 3.289 -6.122 4.874 1.00 . A A . 23 ARG HH12 1 1 15 10083 1 1 23 ARG HH21 H 1.083 -3.861 6.252 1.00 . A A . 23 ARG HH21 1 1 15 10084 1 1 23 ARG HH22 H 1.465 -5.604 5.824 1.00 . A A . 23 ARG HH22 1 1 15 10085 1 1 23 ARG N N 4.106 0.885 2.692 1.00 . A A . 23 ARG N 1 1 15 10086 1 1 23 ARG NE N 3.137 -2.985 5.386 1.00 . A A . 23 ARG NE 1 1 15 10087 1 1 23 ARG NH1 N 3.633 -5.156 4.844 1.00 . A A . 23 ARG NH1 1 1 15 10088 1 1 23 ARG NH2 N 1.677 -4.601 5.863 1.00 . A A . 23 ARG NH2 1 1 15 10089 1 1 23 ARG O O 1.948 2.577 3.459 1.00 . A A . 23 ARG O 1 1 15 10090 1 1 24 PRO C C -1.202 2.172 4.295 1.00 . A A . 24 PRO C 1 1 15 10091 1 1 24 PRO CA C -0.689 1.717 2.895 1.00 . A A . 24 PRO CA 1 1 15 10092 1 1 24 PRO CB C -1.651 0.797 2.101 1.00 . A A . 24 PRO CB 1 1 15 10093 1 1 24 PRO CD C 0.219 -0.565 2.725 1.00 . A A . 24 PRO CD 1 1 15 10094 1 1 24 PRO CG C -1.295 -0.622 2.538 1.00 . A A . 24 PRO CG 1 1 15 10095 1 1 24 PRO HA H -0.514 2.645 2.320 1.00 . A A . 24 PRO HA 1 1 15 10096 1 1 24 PRO HB2 H -2.723 1.023 2.252 1.00 . A A . 24 PRO HB2 1 1 15 10097 1 1 24 PRO HB3 H -1.468 0.909 1.015 1.00 . A A . 24 PRO HB3 1 1 15 10098 1 1 24 PRO HD2 H 0.533 -1.211 3.567 1.00 . A A . 24 PRO HD2 1 1 15 10099 1 1 24 PRO HD3 H 0.739 -0.917 1.813 1.00 . A A . 24 PRO HD3 1 1 15 10100 1 1 24 PRO HG2 H -1.794 -0.865 3.496 1.00 . A A . 24 PRO HG2 1 1 15 10101 1 1 24 PRO HG3 H -1.607 -1.387 1.802 1.00 . A A . 24 PRO HG3 1 1 15 10102 1 1 24 PRO N N 0.524 0.865 2.970 1.00 . A A . 24 PRO N 1 1 15 10103 1 1 24 PRO O O -0.504 2.053 5.309 1.00 . A A . 24 PRO O 1 1 15 10104 1 1 25 CYS C C -4.555 2.802 5.554 1.00 . A A . 25 CYS C 1 1 15 10105 1 1 25 CYS CA C -3.050 3.199 5.577 1.00 . A A . 25 CYS CA 1 1 15 10106 1 1 25 CYS CB C -2.848 4.737 5.720 1.00 . A A . 25 CYS CB 1 1 15 10107 1 1 25 CYS H H -2.830 2.868 3.394 1.00 . A A . 25 CYS H 1 1 15 10108 1 1 25 CYS HA H -2.566 2.712 6.446 1.00 . A A . 25 CYS HA 1 1 15 10109 1 1 25 CYS HB2 H -2.500 5.197 4.788 1.00 . A A . 25 CYS HB2 1 1 15 10110 1 1 25 CYS HB3 H -3.779 5.228 6.049 1.00 . A A . 25 CYS HB3 1 1 15 10111 1 1 25 CYS N N -2.415 2.736 4.323 1.00 . A A . 25 CYS N 1 1 15 10112 1 1 25 CYS O O -5.270 3.049 4.576 1.00 . A A . 25 CYS O 1 1 15 10113 1 1 25 CYS SG S -1.588 5.014 6.947 1.00 . A A . 25 CYS SG 1 1 15 10114 1 1 26 ARG C C -6.824 2.982 7.997 1.00 . A A . 26 ARG C 1 1 15 10115 1 1 26 ARG CA C -6.463 1.934 6.920 1.00 . A A . 26 ARG CA 1 1 15 10116 1 1 26 ARG CB C -6.737 0.462 7.371 1.00 . A A . 26 ARG CB 1 1 15 10117 1 1 26 ARG CD C -7.629 0.235 9.799 1.00 . A A . 26 ARG CD 1 1 15 10118 1 1 26 ARG CG C -6.448 0.008 8.829 1.00 . A A . 26 ARG CG 1 1 15 10119 1 1 26 ARG CZ C -8.015 0.173 12.273 1.00 . A A . 26 ARG CZ 1 1 15 10120 1 1 26 ARG H H -4.364 2.192 7.466 1.00 . A A . 26 ARG H 1 1 15 10121 1 1 26 ARG HA H -7.054 2.104 5.997 1.00 . A A . 26 ARG HA 1 1 15 10122 1 1 26 ARG HB2 H -7.793 0.226 7.140 1.00 . A A . 26 ARG HB2 1 1 15 10123 1 1 26 ARG HB3 H -6.184 -0.213 6.690 1.00 . A A . 26 ARG HB3 1 1 15 10124 1 1 26 ARG HD2 H -7.987 1.277 9.748 1.00 . A A . 26 ARG HD2 1 1 15 10125 1 1 26 ARG HD3 H -8.489 -0.388 9.493 1.00 . A A . 26 ARG HD3 1 1 15 10126 1 1 26 ARG HG2 H -6.215 -1.069 8.827 1.00 . A A . 26 ARG HG2 1 1 15 10127 1 1 26 ARG HG3 H -5.524 0.494 9.197 1.00 . A A . 26 ARG HG3 1 1 15 10128 1 1 26 ARG HH11 H -9.553 1.017 11.287 1.00 . A A . 26 ARG HH11 1 1 15 10129 1 1 26 ARG HH12 H -9.691 0.906 13.113 1.00 . A A . 26 ARG HH12 1 1 15 10130 1 1 26 ARG HH21 H -6.623 -0.619 13.474 1.00 . A A . 26 ARG HH21 1 1 15 10131 1 1 26 ARG HH22 H -8.141 0.039 14.267 1.00 . A A . 26 ARG HH22 1 1 15 10132 1 1 26 ARG N N -5.017 2.183 6.666 1.00 . A A . 26 ARG N 1 1 15 10133 1 1 26 ARG NE N -7.255 -0.089 11.194 1.00 . A A . 26 ARG NE 1 1 15 10134 1 1 26 ARG NH1 N -9.210 0.759 12.219 1.00 . A A . 26 ARG NH1 1 1 15 10135 1 1 26 ARG NH2 N -7.545 -0.170 13.458 1.00 . A A . 26 ARG NH2 1 1 15 10136 1 1 26 ARG O O -6.211 3.012 9.074 1.00 . A A . 26 ARG O 1 1 15 10137 1 1 27 CYS C C -8.824 4.679 9.882 1.00 . A A . 27 CYS C 1 1 15 10138 1 1 27 CYS CA C -8.010 5.035 8.593 1.00 . A A . 27 CYS CA 1 1 15 10139 1 1 27 CYS CB C -8.759 6.121 7.795 1.00 . A A . 27 CYS CB 1 1 15 10140 1 1 27 CYS H H -8.230 3.773 6.789 1.00 . A A . 27 CYS H 1 1 15 10141 1 1 27 CYS HA H -6.997 5.406 8.820 1.00 . A A . 27 CYS HA 1 1 15 10142 1 1 27 CYS HB2 H -9.762 5.808 7.525 1.00 . A A . 27 CYS HB2 1 1 15 10143 1 1 27 CYS HB3 H -8.903 7.026 8.413 1.00 . A A . 27 CYS HB3 1 1 15 10144 1 1 27 CYS N N -7.796 3.864 7.714 1.00 . A A . 27 CYS N 1 1 15 10145 1 1 27 CYS O O -9.416 3.604 10.035 1.00 . A A . 27 CYS O 1 1 15 10146 1 1 27 CYS SG S -7.813 6.617 6.356 1.00 . A A . 27 CYS SG 1 1 15 10147 1 1 28 SER C C -11.260 5.630 11.671 1.00 . A A . 28 SER C 1 1 15 10148 1 1 28 SER CA C -9.729 5.681 12.006 1.00 . A A . 28 SER CA 1 1 15 10149 1 1 28 SER CB C -9.311 6.975 12.764 1.00 . A A . 28 SER CB 1 1 15 10150 1 1 28 SER H H -8.301 6.487 10.533 1.00 . A A . 28 SER H 1 1 15 10151 1 1 28 SER HA H -9.534 4.804 12.652 1.00 . A A . 28 SER HA 1 1 15 10152 1 1 28 SER HB2 H -9.313 7.864 12.102 1.00 . A A . 28 SER HB2 1 1 15 10153 1 1 28 SER HB3 H -10.008 7.242 13.577 1.00 . A A . 28 SER HB3 1 1 15 10154 1 1 28 SER HG H -7.831 7.632 13.805 1.00 . A A . 28 SER HG 1 1 15 10155 1 1 28 SER N N -8.858 5.666 10.797 1.00 . A A . 28 SER N 1 1 15 10156 1 1 28 SER O O -11.695 5.542 10.516 1.00 . A A . 28 SER O 1 1 15 10157 1 1 28 SER OG O -8.027 6.806 13.358 1.00 . A A . 28 SER OG 1 1 15 10158 1 1 29 MET C C -14.317 6.584 11.908 1.00 . A A . 29 MET C 1 1 15 10159 1 1 29 MET CA C -13.553 5.464 12.683 1.00 . A A . 29 MET CA 1 1 15 10160 1 1 29 MET CB C -14.069 5.428 14.150 1.00 . A A . 29 MET CB 1 1 15 10161 1 1 29 MET CE C -16.182 3.719 16.331 1.00 . A A . 29 MET CE 1 1 15 10162 1 1 29 MET CG C -13.795 4.115 14.906 1.00 . A A . 29 MET CG 1 1 15 10163 1 1 29 MET H H -11.581 5.877 13.607 1.00 . A A . 29 MET H 1 1 15 10164 1 1 29 MET HA H -13.783 4.504 12.181 1.00 . A A . 29 MET HA 1 1 15 10165 1 1 29 MET HB2 H -13.664 6.279 14.733 1.00 . A A . 29 MET HB2 1 1 15 10166 1 1 29 MET HB3 H -15.159 5.601 14.152 1.00 . A A . 29 MET HB3 1 1 15 10167 1 1 29 MET HE1 H -16.242 2.703 15.899 1.00 . A A . 29 MET HE1 1 1 15 10168 1 1 29 MET HE2 H -16.727 3.713 17.293 1.00 . A A . 29 MET HE2 1 1 15 10169 1 1 29 MET HE3 H -16.700 4.417 15.650 1.00 . A A . 29 MET HE3 1 1 15 10170 1 1 29 MET HG2 H -14.229 3.247 14.375 1.00 . A A . 29 MET HG2 1 1 15 10171 1 1 29 MET HG3 H -12.708 3.927 14.975 1.00 . A A . 29 MET HG3 1 1 15 10172 1 1 29 MET N N -12.071 5.655 12.738 1.00 . A A . 29 MET N 1 1 15 10173 1 1 29 MET O O -15.308 6.283 11.237 1.00 . A A . 29 MET O 1 1 15 10174 1 1 29 MET SD S -14.463 4.211 16.583 1.00 . A A . 29 MET SD 1 1 15 10175 1 1 30 ILE C C -14.086 8.971 9.745 1.00 . A A . 30 ILE C 1 1 15 10176 1 1 30 ILE CA C -14.473 8.999 11.268 1.00 . A A . 30 ILE CA 1 1 15 10177 1 1 30 ILE CB C -14.041 10.378 11.924 1.00 . A A . 30 ILE CB 1 1 15 10178 1 1 30 ILE CD1 C -12.024 11.926 12.580 1.00 . A A . 30 ILE CD1 1 1 15 10179 1 1 30 ILE CG1 C -12.513 10.505 12.257 1.00 . A A . 30 ILE CG1 1 1 15 10180 1 1 30 ILE CG2 C -14.857 10.551 13.234 1.00 . A A . 30 ILE CG2 1 1 15 10181 1 1 30 ILE H H -12.954 7.871 12.493 1.00 . A A . 30 ILE H 1 1 15 10182 1 1 30 ILE HA H -15.572 8.910 11.306 1.00 . A A . 30 ILE HA 1 1 15 10183 1 1 30 ILE HB H -14.292 11.209 11.236 1.00 . A A . 30 ILE HB 1 1 15 10184 1 1 30 ILE HD11 H -12.248 12.631 11.758 1.00 . A A . 30 ILE HD11 1 1 15 10185 1 1 30 ILE HD12 H -12.486 12.327 13.500 1.00 . A A . 30 ILE HD12 1 1 15 10186 1 1 30 ILE HD13 H -10.929 11.943 12.733 1.00 . A A . 30 ILE HD13 1 1 15 10187 1 1 30 ILE HG12 H -12.232 9.830 13.087 1.00 . A A . 30 ILE HG12 1 1 15 10188 1 1 30 ILE HG13 H -11.917 10.156 11.399 1.00 . A A . 30 ILE HG13 1 1 15 10189 1 1 30 ILE HG21 H -15.946 10.492 13.047 1.00 . A A . 30 ILE HG21 1 1 15 10190 1 1 30 ILE HG22 H -14.614 9.782 13.992 1.00 . A A . 30 ILE HG22 1 1 15 10191 1 1 30 ILE HG23 H -14.682 11.536 13.704 1.00 . A A . 30 ILE HG23 1 1 15 10192 1 1 30 ILE N N -13.862 7.844 12.007 1.00 . A A . 30 ILE N 1 1 15 10193 1 1 30 ILE O O -14.980 9.161 8.915 1.00 . A A . 30 ILE O 1 1 15 10194 1 1 31 GLY C C -10.992 9.549 7.816 1.00 . A A . 31 GLY C 1 1 15 10195 1 1 31 GLY CA C -12.336 8.811 7.976 1.00 . A A . 31 GLY CA 1 1 15 10196 1 1 31 GLY H H -12.183 8.758 10.192 1.00 . A A . 31 GLY H 1 1 15 10197 1 1 31 GLY HA2 H -12.227 7.779 7.594 1.00 . A A . 31 GLY HA2 1 1 15 10198 1 1 31 GLY HA3 H -13.079 9.290 7.309 1.00 . A A . 31 GLY HA3 1 1 15 10199 1 1 31 GLY N N -12.813 8.736 9.382 1.00 . A A . 31 GLY N 1 1 15 10200 1 1 31 GLY O O -10.054 9.016 7.219 1.00 . A A . 31 GLY O 1 1 15 10201 1 1 32 THR C C -8.908 11.149 9.789 1.00 . A A . 32 THR C 1 1 15 10202 1 1 32 THR CA C -9.644 11.549 8.466 1.00 . A A . 32 THR CA 1 1 15 10203 1 1 32 THR CB C -9.937 13.088 8.455 1.00 . A A . 32 THR CB 1 1 15 10204 1 1 32 THR CG2 C -10.496 13.569 7.101 1.00 . A A . 32 THR CG2 1 1 15 10205 1 1 32 THR H H -11.734 10.980 8.947 1.00 . A A . 32 THR H 1 1 15 10206 1 1 32 THR HA H -8.983 11.311 7.608 1.00 . A A . 32 THR HA 1 1 15 10207 1 1 32 THR HB H -8.985 13.616 8.655 1.00 . A A . 32 THR HB 1 1 15 10208 1 1 32 THR HG1 H -11.696 12.947 9.232 1.00 . A A . 32 THR HG1 1 1 15 10209 1 1 32 THR HG21 H -9.803 13.339 6.271 1.00 . A A . 32 THR HG21 1 1 15 10210 1 1 32 THR HG22 H -11.470 13.103 6.858 1.00 . A A . 32 THR HG22 1 1 15 10211 1 1 32 THR HG23 H -10.651 14.663 7.100 1.00 . A A . 32 THR HG23 1 1 15 10212 1 1 32 THR N N -10.919 10.777 8.355 1.00 . A A . 32 THR N 1 1 15 10213 1 1 32 THR O O -9.479 10.523 10.689 1.00 . A A . 32 THR O 1 1 15 10214 1 1 32 THR OG1 O -10.896 13.428 9.457 1.00 . A A . 32 THR OG1 1 1 15 10215 1 1 33 ASN C C -6.477 9.509 10.867 1.00 . A A . 33 ASN C 1 1 15 10216 1 1 33 ASN CA C -6.651 11.058 10.951 1.00 . A A . 33 ASN CA 1 1 15 10217 1 1 33 ASN CB C -7.151 11.495 12.375 1.00 . A A . 33 ASN CB 1 1 15 10218 1 1 33 ASN CG C -7.019 13.002 12.665 1.00 . A A . 33 ASN CG 1 1 15 10219 1 1 33 ASN H H -7.221 11.863 8.993 1.00 . A A . 33 ASN H 1 1 15 10220 1 1 33 ASN HA H -5.662 11.520 10.761 1.00 . A A . 33 ASN HA 1 1 15 10221 1 1 33 ASN HB2 H -8.180 11.150 12.583 1.00 . A A . 33 ASN HB2 1 1 15 10222 1 1 33 ASN HB3 H -6.571 10.954 13.148 1.00 . A A . 33 ASN HB3 1 1 15 10223 1 1 33 ASN HD21 H -8.981 13.269 12.338 1.00 . A A . 33 ASN HD21 1 1 15 10224 1 1 33 ASN HD22 H -7.996 14.751 12.786 1.00 . A A . 33 ASN HD22 1 1 15 10225 1 1 33 ASN N N -7.601 11.495 9.871 1.00 . A A . 33 ASN N 1 1 15 10226 1 1 33 ASN ND2 N -8.110 13.750 12.589 1.00 . A A . 33 ASN ND2 1 1 15 10227 1 1 33 ASN O O -6.889 8.759 11.755 1.00 . A A . 33 ASN O 1 1 15 10228 1 1 33 ASN OD1 O -5.935 13.503 12.962 1.00 . A A . 33 ASN OD1 1 1 15 10229 1 1 34 CYS C C -4.755 6.835 10.352 1.00 . A A . 34 CYS C 1 1 15 10230 1 1 34 CYS CA C -5.783 7.591 9.447 1.00 . A A . 34 CYS CA 1 1 15 10231 1 1 34 CYS CB C -5.390 7.467 7.957 1.00 . A A . 34 CYS CB 1 1 15 10232 1 1 34 CYS H H -5.705 9.773 9.060 1.00 . A A . 34 CYS H 1 1 15 10233 1 1 34 CYS HA H -6.783 7.151 9.580 1.00 . A A . 34 CYS HA 1 1 15 10234 1 1 34 CYS HB2 H -4.426 7.936 7.784 1.00 . A A . 34 CYS HB2 1 1 15 10235 1 1 34 CYS HB3 H -5.261 6.406 7.674 1.00 . A A . 34 CYS HB3 1 1 15 10236 1 1 34 CYS N N -5.856 9.042 9.767 1.00 . A A . 34 CYS N 1 1 15 10237 1 1 34 CYS O O -4.043 7.426 11.171 1.00 . A A . 34 CYS O 1 1 15 10238 1 1 34 CYS SG S -6.684 8.156 6.923 1.00 . A A . 34 CYS SG 1 1 15 10239 1 1 35 GLU C C -2.912 3.828 9.685 1.00 . A A . 35 GLU C 1 1 15 10240 1 1 35 GLU CA C -3.629 4.650 10.799 1.00 . A A . 35 GLU CA 1 1 15 10241 1 1 35 GLU CB C -4.195 3.643 11.842 1.00 . A A . 35 GLU CB 1 1 15 10242 1 1 35 GLU CD C -5.782 3.082 13.782 1.00 . A A . 35 GLU CD 1 1 15 10243 1 1 35 GLU CG C -5.182 4.182 12.901 1.00 . A A . 35 GLU CG 1 1 15 10244 1 1 35 GLU H H -5.339 5.164 9.445 1.00 . A A . 35 GLU H 1 1 15 10245 1 1 35 GLU HA H -2.893 5.316 11.290 1.00 . A A . 35 GLU HA 1 1 15 10246 1 1 35 GLU HB2 H -4.530 2.745 11.309 1.00 . A A . 35 GLU HB2 1 1 15 10247 1 1 35 GLU HB3 H -3.354 3.203 12.404 1.00 . A A . 35 GLU HB3 1 1 15 10248 1 1 35 GLU HE2 H -7.528 2.436 14.352 1.00 . A A . 35 GLU HE2 1 1 15 10249 1 1 35 GLU HG2 H -4.655 4.915 13.543 1.00 . A A . 35 GLU HG2 1 1 15 10250 1 1 35 GLU HG3 H -5.992 4.754 12.413 1.00 . A A . 35 GLU HG3 1 1 15 10251 1 1 35 GLU N N -4.699 5.499 10.184 1.00 . A A . 35 GLU N 1 1 15 10252 1 1 35 GLU O O -3.358 3.774 8.542 1.00 . A A . 35 GLU O 1 1 15 10253 1 1 35 GLU OE1 O -5.107 2.263 14.406 1.00 . A A . 35 GLU OE1 1 1 15 10254 1 1 35 GLU OE2 O -7.153 3.125 13.798 1.00 . A A . 35 GLU OE2 1 1 15 10255 1 1 36 CYS C C -1.424 1.009 8.861 1.00 . A A . 36 CYS C 1 1 15 10256 1 1 36 CYS CA C -0.901 2.454 9.071 1.00 . A A . 36 CYS CA 1 1 15 10257 1 1 36 CYS CB C 0.584 2.423 9.615 1.00 . A A . 36 CYS CB 1 1 15 10258 1 1 36 CYS H H -1.721 3.213 11.066 1.00 . A A . 36 CYS H 1 1 15 10259 1 1 36 CYS HA H -0.918 2.987 8.088 1.00 . A A . 36 CYS HA 1 1 15 10260 1 1 36 CYS HB2 H 0.641 2.127 10.655 1.00 . A A . 36 CYS HB2 1 1 15 10261 1 1 36 CYS HB3 H 1.230 1.646 9.166 1.00 . A A . 36 CYS HB3 1 1 15 10262 1 1 36 CYS N N -1.792 3.180 10.043 1.00 . A A . 36 CYS N 1 1 15 10263 1 1 36 CYS O O -2.209 0.485 9.659 1.00 . A A . 36 CYS O 1 1 15 10264 1 1 36 CYS SG S 1.382 3.955 9.223 1.00 . A A . 36 CYS SG 1 1 15 10265 1 1 37 THR C C -2.680 -1.435 7.154 1.00 . A A . 37 THR C 1 1 15 10266 1 1 37 THR CA C -1.158 -1.112 7.486 1.00 . A A . 37 THR CA 1 1 15 10267 1 1 37 THR CB C -0.516 -1.876 8.723 1.00 . A A . 37 THR CB 1 1 15 10268 1 1 37 THR CG2 C -1.516 -2.569 9.676 1.00 . A A . 37 THR CG2 1 1 15 10269 1 1 37 THR H H -0.333 0.921 7.181 1.00 . A A . 37 THR H 1 1 15 10270 1 1 37 THR HA H -0.609 -1.419 6.578 1.00 . A A . 37 THR HA 1 1 15 10271 1 1 37 THR HB H 0.129 -1.174 9.232 1.00 . A A . 37 THR HB 1 1 15 10272 1 1 37 THR HG1 H 1.004 -2.443 7.694 1.00 . A A . 37 THR HG1 1 1 15 10273 1 1 37 THR HG21 H -2.253 -1.859 10.088 1.00 . A A . 37 THR HG21 1 1 15 10274 1 1 37 THR HG22 H -2.101 -3.374 9.202 1.00 . A A . 37 THR HG22 1 1 15 10275 1 1 37 THR HG23 H -0.998 -3.014 10.537 1.00 . A A . 37 THR HG23 1 1 15 10276 1 1 37 THR N N -0.964 0.358 7.761 1.00 . A A . 37 THR N 1 1 15 10277 1 1 37 THR O O -3.571 -0.607 7.369 1.00 . A A . 37 THR O 1 1 15 10278 1 1 37 THR OG1 O 0.364 -2.888 8.254 1.00 . A A . 37 THR OG1 1 1 15 10279 1 1 38 PRO C C -5.336 -3.308 7.444 1.00 . A A . 38 PRO C 1 1 15 10280 1 1 38 PRO CA C -4.385 -3.065 6.243 1.00 . A A . 38 PRO CA 1 1 15 10281 1 1 38 PRO CB C -4.115 -4.366 5.465 1.00 . A A . 38 PRO CB 1 1 15 10282 1 1 38 PRO CD C -2.010 -3.696 6.364 1.00 . A A . 38 PRO CD 1 1 15 10283 1 1 38 PRO CG C -2.851 -4.941 6.103 1.00 . A A . 38 PRO CG 1 1 15 10284 1 1 38 PRO HA H -4.864 -2.310 5.588 1.00 . A A . 38 PRO HA 1 1 15 10285 1 1 38 PRO HB2 H -4.956 -5.085 5.462 1.00 . A A . 38 PRO HB2 1 1 15 10286 1 1 38 PRO HB3 H -3.910 -4.114 4.420 1.00 . A A . 38 PRO HB3 1 1 15 10287 1 1 38 PRO HD2 H -1.370 -3.848 7.229 1.00 . A A . 38 PRO HD2 1 1 15 10288 1 1 38 PRO HD3 H -1.307 -3.383 5.576 1.00 . A A . 38 PRO HD3 1 1 15 10289 1 1 38 PRO HG2 H -3.105 -5.437 7.061 1.00 . A A . 38 PRO HG2 1 1 15 10290 1 1 38 PRO HG3 H -2.332 -5.694 5.499 1.00 . A A . 38 PRO HG3 1 1 15 10291 1 1 38 PRO N N -3.003 -2.638 6.602 1.00 . A A . 38 PRO N 1 1 15 10292 1 1 38 PRO O O -4.870 -3.404 8.579 1.00 . A A . 38 PRO O 1 1 15 10293 1 1 39 ARG C C -7.661 -5.506 8.142 1.00 . A A . 39 ARG C 1 1 15 10294 1 1 39 ARG CA C -7.604 -3.944 8.230 1.00 . A A . 39 ARG CA 1 1 15 10295 1 1 39 ARG CB C -8.989 -3.272 8.003 1.00 . A A . 39 ARG CB 1 1 15 10296 1 1 39 ARG CD C -9.946 -3.191 10.482 1.00 . A A . 39 ARG CD 1 1 15 10297 1 1 39 ARG CG C -10.121 -3.621 9.008 1.00 . A A . 39 ARG CG 1 1 15 10298 1 1 39 ARG CZ C -8.734 -3.946 12.547 1.00 . A A . 39 ARG CZ 1 1 15 10299 1 1 39 ARG H H -6.917 -3.390 6.197 1.00 . A A . 39 ARG H 1 1 15 10300 1 1 39 ARG HA H -7.246 -3.651 9.236 1.00 . A A . 39 ARG HA 1 1 15 10301 1 1 39 ARG HB2 H -8.865 -2.173 7.999 1.00 . A A . 39 ARG HB2 1 1 15 10302 1 1 39 ARG HB3 H -9.354 -3.513 6.985 1.00 . A A . 39 ARG HB3 1 1 15 10303 1 1 39 ARG HD2 H -9.660 -2.124 10.538 1.00 . A A . 39 ARG HD2 1 1 15 10304 1 1 39 ARG HD3 H -10.930 -3.262 10.983 1.00 . A A . 39 ARG HD3 1 1 15 10305 1 1 39 ARG HG2 H -11.042 -3.135 8.635 1.00 . A A . 39 ARG HG2 1 1 15 10306 1 1 39 ARG HG3 H -10.351 -4.702 8.959 1.00 . A A . 39 ARG HG3 1 1 15 10307 1 1 39 ARG HH11 H -10.118 -2.544 12.952 1.00 . A A . 39 ARG HH11 1 1 15 10308 1 1 39 ARG HH12 H -9.130 -3.176 14.363 1.00 . A A . 39 ARG HH12 1 1 15 10309 1 1 39 ARG HH21 H -7.303 -5.338 12.401 1.00 . A A . 39 ARG HH21 1 1 15 10310 1 1 39 ARG HH22 H -7.642 -4.653 14.069 1.00 . A A . 39 ARG HH22 1 1 15 10311 1 1 39 ARG N N -6.651 -3.472 7.184 1.00 . A A . 39 ARG N 1 1 15 10312 1 1 39 ARG NE N -8.962 -4.019 11.224 1.00 . A A . 39 ARG NE 1 1 15 10313 1 1 39 ARG NH1 N -9.396 -3.139 13.373 1.00 . A A . 39 ARG NH1 1 1 15 10314 1 1 39 ARG NH2 N -7.798 -4.725 13.058 1.00 . A A . 39 ARG NH2 1 1 15 10315 1 1 39 ARG O O -8.538 -6.099 7.506 1.00 . A A . 39 ARG O 1 1 15 10316 1 1 40 LEU C C -5.259 -7.872 9.704 1.00 . A A . 40 LEU C 1 1 15 10317 1 1 40 LEU CA C -6.398 -7.600 8.687 1.00 . A A . 40 LEU CA 1 1 15 10318 1 1 40 LEU CB C -5.965 -8.048 7.250 1.00 . A A . 40 LEU CB 1 1 15 10319 1 1 40 LEU CD1 C -6.842 -10.482 7.264 1.00 . A A . 40 LEU CD1 1 1 15 10320 1 1 40 LEU CD2 C -5.035 -9.789 5.637 1.00 . A A . 40 LEU CD2 1 1 15 10321 1 1 40 LEU CG C -5.631 -9.554 7.038 1.00 . A A . 40 LEU CG 1 1 15 10322 1 1 40 LEU H H -5.999 -5.516 9.250 1.00 . A A . 40 LEU H 1 1 15 10323 1 1 40 LEU HA H -7.326 -8.136 8.971 1.00 . A A . 40 LEU HA 1 1 15 10324 1 1 40 LEU HB2 H -6.755 -7.765 6.528 1.00 . A A . 40 LEU HB2 1 1 15 10325 1 1 40 LEU HB3 H -5.088 -7.443 6.944 1.00 . A A . 40 LEU HB3 1 1 15 10326 1 1 40 LEU HD11 H -7.680 -10.247 6.581 1.00 . A A . 40 LEU HD11 1 1 15 10327 1 1 40 LEU HD12 H -6.577 -11.544 7.108 1.00 . A A . 40 LEU HD12 1 1 15 10328 1 1 40 LEU HD13 H -7.228 -10.405 8.297 1.00 . A A . 40 LEU HD13 1 1 15 10329 1 1 40 LEU HD21 H -4.124 -9.182 5.476 1.00 . A A . 40 LEU HD21 1 1 15 10330 1 1 40 LEU HD22 H -4.739 -10.845 5.491 1.00 . A A . 40 LEU HD22 1 1 15 10331 1 1 40 LEU HD23 H -5.748 -9.532 4.831 1.00 . A A . 40 LEU HD23 1 1 15 10332 1 1 40 LEU HG H -4.850 -9.843 7.764 1.00 . A A . 40 LEU HG 1 1 15 10333 1 1 40 LEU N N -6.654 -6.142 8.768 1.00 . A A . 40 LEU N 1 1 15 10334 1 1 40 LEU O O -4.123 -7.424 9.504 1.00 . A A . 40 LEU O 1 1 15 10335 1 1 41 ILE C C -4.093 -10.550 11.380 1.00 . A A . 41 ILE C 1 1 15 10336 1 1 41 ILE CA C -4.525 -9.087 11.754 1.00 . A A . 41 ILE CA 1 1 15 10337 1 1 41 ILE CB C -5.061 -8.987 13.246 1.00 . A A . 41 ILE CB 1 1 15 10338 1 1 41 ILE CD1 C -7.781 -8.925 13.082 1.00 . A A . 41 ILE CD1 1 1 15 10339 1 1 41 ILE CG1 C -6.475 -9.626 13.515 1.00 . A A . 41 ILE CG1 1 1 15 10340 1 1 41 ILE CG2 C -5.084 -7.482 13.631 1.00 . A A . 41 ILE CG2 1 1 15 10341 1 1 41 ILE H H -6.534 -8.957 10.814 1.00 . A A . 41 ILE H 1 1 15 10342 1 1 41 ILE HA H -3.615 -8.454 11.685 1.00 . A A . 41 ILE HA 1 1 15 10343 1 1 41 ILE HB H -4.364 -9.514 13.925 1.00 . A A . 41 ILE HB 1 1 15 10344 1 1 41 ILE HD11 H -7.866 -7.906 13.501 1.00 . A A . 41 ILE HD11 1 1 15 10345 1 1 41 ILE HD12 H -7.885 -8.847 11.986 1.00 . A A . 41 ILE HD12 1 1 15 10346 1 1 41 ILE HD13 H -8.662 -9.489 13.440 1.00 . A A . 41 ILE HD13 1 1 15 10347 1 1 41 ILE HG12 H -6.495 -10.655 13.113 1.00 . A A . 41 ILE HG12 1 1 15 10348 1 1 41 ILE HG13 H -6.556 -9.774 14.608 1.00 . A A . 41 ILE HG13 1 1 15 10349 1 1 41 ILE HG21 H -5.737 -6.877 12.974 1.00 . A A . 41 ILE HG21 1 1 15 10350 1 1 41 ILE HG22 H -5.437 -7.332 14.668 1.00 . A A . 41 ILE HG22 1 1 15 10351 1 1 41 ILE HG23 H -4.074 -7.034 13.577 1.00 . A A . 41 ILE HG23 1 1 15 10352 1 1 41 ILE N N -5.560 -8.638 10.768 1.00 . A A . 41 ILE N 1 1 15 10353 1 1 41 ILE O O -4.348 -11.530 12.088 1.00 . A A . 41 ILE O 1 1 15 10354 1 1 42 MET C C -1.754 -11.407 8.637 1.00 . A A . 42 MET C 1 1 15 10355 1 1 42 MET CA C -2.741 -11.893 9.740 1.00 . A A . 42 MET CA 1 1 15 10356 1 1 42 MET CB C -3.799 -12.895 9.184 1.00 . A A . 42 MET CB 1 1 15 10357 1 1 42 MET CE C -3.686 -16.835 7.827 1.00 . A A . 42 MET CE 1 1 15 10358 1 1 42 MET CG C -3.235 -14.269 8.789 1.00 . A A . 42 MET CG 1 1 15 10359 1 1 42 MET H H -3.215 -9.745 9.784 1.00 . A A . 42 MET H 1 1 15 10360 1 1 42 MET HA H -2.189 -12.379 10.570 1.00 . A A . 42 MET HA 1 1 15 10361 1 1 42 MET HB2 H -4.582 -13.070 9.945 1.00 . A A . 42 MET HB2 1 1 15 10362 1 1 42 MET HB3 H -4.336 -12.457 8.321 1.00 . A A . 42 MET HB3 1 1 15 10363 1 1 42 MET HE1 H -3.183 -17.234 8.727 1.00 . A A . 42 MET HE1 1 1 15 10364 1 1 42 MET HE2 H -4.378 -17.609 7.450 1.00 . A A . 42 MET HE2 1 1 15 10365 1 1 42 MET HE3 H -2.920 -16.654 7.052 1.00 . A A . 42 MET HE3 1 1 15 10366 1 1 42 MET HG2 H -2.478 -14.172 7.989 1.00 . A A . 42 MET HG2 1 1 15 10367 1 1 42 MET HG3 H -2.737 -14.751 9.651 1.00 . A A . 42 MET HG3 1 1 15 10368 1 1 42 MET N N -3.377 -10.649 10.243 1.00 . A A . 42 MET N 1 1 15 10369 1 1 42 MET O O -2.141 -11.221 7.477 1.00 . A A . 42 MET O 1 1 15 10370 1 1 42 MET SD S -4.584 -15.318 8.210 1.00 . A A . 42 MET SD 1 1 15 10371 1 1 43 GLU C C 1.871 -10.909 8.301 1.00 . A A . 43 GLU C 1 1 15 10372 1 1 43 GLU CA C 0.441 -10.301 8.218 1.00 . A A . 43 GLU CA 1 1 15 10373 1 1 43 GLU CB C 0.467 -8.836 8.745 1.00 . A A . 43 GLU CB 1 1 15 10374 1 1 43 GLU CD C -0.756 -6.601 9.094 1.00 . A A . 43 GLU CD 1 1 15 10375 1 1 43 GLU CG C -0.834 -8.024 8.537 1.00 . A A . 43 GLU CG 1 1 15 10376 1 1 43 GLU H H -0.315 -11.312 10.028 1.00 . A A . 43 GLU H 1 1 15 10377 1 1 43 GLU HA H 0.114 -10.282 7.158 1.00 . A A . 43 GLU HA 1 1 15 10378 1 1 43 GLU HB2 H 0.745 -8.830 9.816 1.00 . A A . 43 GLU HB2 1 1 15 10379 1 1 43 GLU HB3 H 1.285 -8.289 8.236 1.00 . A A . 43 GLU HB3 1 1 15 10380 1 1 43 GLU HE2 H 0.063 -4.892 8.660 1.00 . A A . 43 GLU HE2 1 1 15 10381 1 1 43 GLU HG2 H -1.087 -7.981 7.461 1.00 . A A . 43 GLU HG2 1 1 15 10382 1 1 43 GLU HG3 H -1.684 -8.538 9.019 1.00 . A A . 43 GLU HG3 1 1 15 10383 1 1 43 GLU N N -0.499 -11.119 9.038 1.00 . A A . 43 GLU N 1 1 15 10384 1 1 43 GLU O O 2.333 -11.352 9.360 1.00 . A A . 43 GLU O 1 1 15 10385 1 1 43 GLU OE1 O -1.328 -6.238 10.122 1.00 . A A . 43 GLU OE1 1 1 15 10386 1 1 43 GLU OE2 O 0.017 -5.786 8.312 1.00 . A A . 43 GLU OE2 1 1 15 10387 1 1 44 GLY C C 5.037 -10.467 7.622 1.00 . A A . 44 GLY C 1 1 15 10388 1 1 44 GLY CA C 3.960 -11.403 7.039 1.00 . A A . 44 GLY CA 1 1 15 10389 1 1 44 GLY H H 2.095 -10.425 6.374 1.00 . A A . 44 GLY H 1 1 15 10390 1 1 44 GLY HA2 H 4.030 -12.397 7.522 1.00 . A A . 44 GLY HA2 1 1 15 10391 1 1 44 GLY HA3 H 4.171 -11.600 5.971 1.00 . A A . 44 GLY HA3 1 1 15 10392 1 1 44 GLY N N 2.578 -10.877 7.157 1.00 . A A . 44 GLY N 1 1 15 10393 1 1 44 GLY O O 5.513 -10.706 8.735 1.00 . A A . 44 GLY O 1 1 15 10394 1 1 45 LEU C C 5.527 -7.355 8.242 1.00 . A A . 45 LEU C 1 1 15 10395 1 1 45 LEU CA C 6.334 -8.354 7.363 1.00 . A A . 45 LEU CA 1 1 15 10396 1 1 45 LEU CB C 6.995 -7.608 6.161 1.00 . A A . 45 LEU CB 1 1 15 10397 1 1 45 LEU CD1 C 9.365 -8.650 6.209 1.00 . A A . 45 LEU CD1 1 1 15 10398 1 1 45 LEU CD2 C 7.668 -9.525 4.530 1.00 . A A . 45 LEU CD2 1 1 15 10399 1 1 45 LEU CG C 8.129 -8.305 5.353 1.00 . A A . 45 LEU CG 1 1 15 10400 1 1 45 LEU H H 4.906 -9.318 5.977 1.00 . A A . 45 LEU H 1 1 15 10401 1 1 45 LEU HA H 7.142 -8.819 7.964 1.00 . A A . 45 LEU HA 1 1 15 10402 1 1 45 LEU HB2 H 6.212 -7.266 5.455 1.00 . A A . 45 LEU HB2 1 1 15 10403 1 1 45 LEU HB3 H 7.429 -6.662 6.540 1.00 . A A . 45 LEU HB3 1 1 15 10404 1 1 45 LEU HD11 H 9.732 -7.769 6.767 1.00 . A A . 45 LEU HD11 1 1 15 10405 1 1 45 LEU HD12 H 9.153 -9.444 6.950 1.00 . A A . 45 LEU HD12 1 1 15 10406 1 1 45 LEU HD13 H 10.206 -9.006 5.585 1.00 . A A . 45 LEU HD13 1 1 15 10407 1 1 45 LEU HD21 H 6.794 -9.282 3.898 1.00 . A A . 45 LEU HD21 1 1 15 10408 1 1 45 LEU HD22 H 8.465 -9.880 3.851 1.00 . A A . 45 LEU HD22 1 1 15 10409 1 1 45 LEU HD23 H 7.385 -10.380 5.171 1.00 . A A . 45 LEU HD23 1 1 15 10410 1 1 45 LEU HG H 8.471 -7.557 4.613 1.00 . A A . 45 LEU HG 1 1 15 10411 1 1 45 LEU N N 5.389 -9.398 6.879 1.00 . A A . 45 LEU N 1 1 15 10412 1 1 45 LEU O O 4.726 -6.560 7.734 1.00 . A A . 45 LEU O 1 1 15 10413 1 1 46 SER C C 5.588 -6.505 11.857 1.00 . A A . 46 SER C 1 1 15 10414 1 1 46 SER CA C 4.804 -6.808 10.551 1.00 . A A . 46 SER CA 1 1 15 10415 1 1 46 SER CB C 3.590 -7.732 10.846 1.00 . A A . 46 SER CB 1 1 15 10416 1 1 46 SER H H 6.386 -8.177 9.859 1.00 . A A . 46 SER H 1 1 15 10417 1 1 46 SER HA H 4.419 -5.859 10.129 1.00 . A A . 46 SER HA 1 1 15 10418 1 1 46 SER HB2 H 2.922 -7.263 11.593 1.00 . A A . 46 SER HB2 1 1 15 10419 1 1 46 SER HB3 H 2.976 -7.839 9.934 1.00 . A A . 46 SER HB3 1 1 15 10420 1 1 46 SER HG H 3.137 -9.506 11.446 1.00 . A A . 46 SER HG 1 1 15 10421 1 1 46 SER N N 5.704 -7.466 9.573 1.00 . A A . 46 SER N 1 1 15 10422 1 1 46 SER O O 6.026 -7.413 12.573 1.00 . A A . 46 SER O 1 1 15 10423 1 1 46 SER OG O 3.960 -9.031 11.304 1.00 . A A . 46 SER OG 1 1 15 10424 1 1 47 PHE C C 5.565 -3.307 13.739 1.00 . A A . 47 PHE C 1 1 15 10425 1 1 47 PHE CA C 6.160 -4.730 13.512 1.00 . A A . 47 PHE CA 1 1 15 10426 1 1 47 PHE CB C 7.720 -4.701 13.620 1.00 . A A . 47 PHE CB 1 1 15 10427 1 1 47 PHE CD1 C 8.819 -2.470 13.024 1.00 . A A . 47 PHE CD1 1 1 15 10428 1 1 47 PHE CD2 C 9.063 -4.313 11.481 1.00 . A A . 47 PHE CD2 1 1 15 10429 1 1 47 PHE CE1 C 9.584 -1.665 12.184 1.00 . A A . 47 PHE CE1 1 1 15 10430 1 1 47 PHE CE2 C 9.838 -3.510 10.650 1.00 . A A . 47 PHE CE2 1 1 15 10431 1 1 47 PHE CG C 8.547 -3.799 12.676 1.00 . A A . 47 PHE CG 1 1 15 10432 1 1 47 PHE CZ C 10.094 -2.185 10.998 1.00 . A A . 47 PHE CZ 1 1 15 10433 1 1 47 PHE H H 5.311 -4.560 11.486 1.00 . A A . 47 PHE H 1 1 15 10434 1 1 47 PHE HA H 5.767 -5.418 14.289 1.00 . A A . 47 PHE HA 1 1 15 10435 1 1 47 PHE HB2 H 7.979 -4.442 14.665 1.00 . A A . 47 PHE HB2 1 1 15 10436 1 1 47 PHE HB3 H 8.089 -5.742 13.535 1.00 . A A . 47 PHE HB3 1 1 15 10437 1 1 47 PHE HD1 H 8.435 -2.054 13.945 1.00 . A A . 47 PHE HD1 1 1 15 10438 1 1 47 PHE HD2 H 8.868 -5.337 11.194 1.00 . A A . 47 PHE HD2 1 1 15 10439 1 1 47 PHE HE1 H 9.781 -0.637 12.452 1.00 . A A . 47 PHE HE1 1 1 15 10440 1 1 47 PHE HE2 H 10.235 -3.913 9.729 1.00 . A A . 47 PHE HE2 1 1 15 10441 1 1 47 PHE HZ H 10.687 -1.560 10.347 1.00 . A A . 47 PHE HZ 1 1 15 10442 1 1 47 PHE N N 5.719 -5.204 12.172 1.00 . A A . 47 PHE N 1 1 15 10443 1 1 47 PHE O O 5.575 -2.452 12.845 1.00 . A A . 47 PHE O 1 1 15 10444 1 1 48 ALA C C 5.825 -0.945 16.029 1.00 . A A . 48 ALA C 1 1 15 10445 1 1 48 ALA CA C 4.638 -1.712 15.406 1.00 . A A . 48 ALA CA 1 1 15 10446 1 1 48 ALA CB C 3.477 -1.891 16.404 1.00 . A A . 48 ALA CB 1 1 15 10447 1 1 48 ALA H H 5.160 -3.843 15.631 1.00 . A A . 48 ALA H 1 1 15 10448 1 1 48 ALA HXT H 7.298 0.195 15.458 1.00 . A A . 48 ALA HXT 1 1 15 10449 1 1 48 ALA HA H 4.251 -1.125 14.554 1.00 . A A . 48 ALA HA 1 1 15 10450 1 1 48 ALA HB1 H 3.772 -2.466 17.303 1.00 . A A . 48 ALA HB1 1 1 15 10451 1 1 48 ALA HB2 H 3.094 -0.914 16.752 1.00 . A A . 48 ALA HB2 1 1 15 10452 1 1 48 ALA HB3 H 2.621 -2.418 15.942 1.00 . A A . 48 ALA HB3 1 1 15 10453 1 1 48 ALA N N 5.100 -3.054 14.977 1.00 . A A . 48 ALA N 1 1 15 10454 1 1 48 ALA O O 6.103 -0.942 17.230 1.00 . A A . 48 ALA O 1 1 15 10455 1 1 48 ALA OXT O 6.555 -0.278 15.076 1.00 . A A . 48 ALA OXT 1 1 16 10456 1 1 1 GLU C C 15.121 10.347 5.696 1.00 . A A . 1 GLU C 1 1 16 10457 1 1 1 GLU CA C 15.783 11.445 4.823 1.00 . A A . 1 GLU CA 1 1 16 10458 1 1 1 GLU CB C 14.756 12.014 3.801 1.00 . A A . 1 GLU CB 1 1 16 10459 1 1 1 GLU CD C 15.261 14.548 3.926 1.00 . A A . 1 GLU CD 1 1 16 10460 1 1 1 GLU CG C 15.174 13.296 3.044 1.00 . A A . 1 GLU CG 1 1 16 10461 1 1 1 GLU H1 H 17.628 10.465 4.777 1.00 . A A . 1 GLU H1 1 1 16 10462 1 1 1 GLU H2 H 17.423 11.529 3.530 1.00 . A A . 1 GLU H2 1 1 16 10463 1 1 1 GLU HA H 16.154 12.268 5.466 1.00 . A A . 1 GLU HA 1 1 16 10464 1 1 1 GLU HB2 H 14.497 11.236 3.057 1.00 . A A . 1 GLU HB2 1 1 16 10465 1 1 1 GLU HB3 H 13.798 12.225 4.317 1.00 . A A . 1 GLU HB3 1 1 16 10466 1 1 1 GLU HE2 H 14.088 15.882 4.722 1.00 . A A . 1 GLU HE2 1 1 16 10467 1 1 1 GLU HG2 H 16.140 13.139 2.529 1.00 . A A . 1 GLU HG2 1 1 16 10468 1 1 1 GLU HG3 H 14.448 13.488 2.232 1.00 . A A . 1 GLU HG3 1 1 16 10469 1 1 1 GLU N N 16.938 10.842 4.118 1.00 . A A . 1 GLU N 1 1 16 10470 1 1 1 GLU O O 14.518 9.399 5.179 1.00 . A A . 1 GLU O 1 1 16 10471 1 1 1 GLU OE1 O 16.321 14.996 4.363 1.00 . A A . 1 GLU OE1 1 1 16 10472 1 1 1 GLU OE2 O 14.029 15.100 4.169 1.00 . A A . 1 GLU OE2 1 1 16 10473 1 1 2 ASP C C 13.300 10.409 8.556 1.00 . A A . 2 ASP C 1 1 16 10474 1 1 2 ASP CA C 14.535 9.630 8.012 1.00 . A A . 2 ASP CA 1 1 16 10475 1 1 2 ASP CB C 15.526 9.219 9.145 1.00 . A A . 2 ASP CB 1 1 16 10476 1 1 2 ASP CG C 16.233 10.308 9.981 1.00 . A A . 2 ASP CG 1 1 16 10477 1 1 2 ASP H H 15.747 11.342 7.321 1.00 . A A . 2 ASP H 1 1 16 10478 1 1 2 ASP HA H 14.193 8.688 7.536 1.00 . A A . 2 ASP HA 1 1 16 10479 1 1 2 ASP HB2 H 14.999 8.530 9.834 1.00 . A A . 2 ASP HB2 1 1 16 10480 1 1 2 ASP HB3 H 16.317 8.585 8.701 1.00 . A A . 2 ASP HB3 1 1 16 10481 1 1 2 ASP HD2 H 14.945 9.847 11.366 1.00 . A A . 2 ASP HD2 1 1 16 10482 1 1 2 ASP N N 15.222 10.511 7.028 1.00 . A A . 2 ASP N 1 1 16 10483 1 1 2 ASP O O 13.434 11.375 9.315 1.00 . A A . 2 ASP O 1 1 16 10484 1 1 2 ASP OD1 O 17.187 10.966 9.567 1.00 . A A . 2 ASP OD1 1 1 16 10485 1 1 2 ASP OD2 O 15.676 10.453 11.226 1.00 . A A . 2 ASP OD2 1 1 16 10486 1 1 3 ASN C C 9.730 9.688 7.835 1.00 . A A . 3 ASN C 1 1 16 10487 1 1 3 ASN CA C 10.797 10.489 8.639 1.00 . A A . 3 ASN CA 1 1 16 10488 1 1 3 ASN CB C 10.560 12.012 8.448 1.00 . A A . 3 ASN CB 1 1 16 10489 1 1 3 ASN CG C 10.794 12.687 7.073 1.00 . A A . 3 ASN CG 1 1 16 10490 1 1 3 ASN H H 12.080 9.077 7.644 1.00 . A A . 3 ASN H 1 1 16 10491 1 1 3 ASN HA H 10.728 10.278 9.727 1.00 . A A . 3 ASN HA 1 1 16 10492 1 1 3 ASN HB2 H 9.519 12.135 8.799 1.00 . A A . 3 ASN HB2 1 1 16 10493 1 1 3 ASN HB3 H 11.160 12.567 9.192 1.00 . A A . 3 ASN HB3 1 1 16 10494 1 1 3 ASN HD21 H 8.861 13.209 6.970 1.00 . A A . 3 ASN HD21 1 1 16 10495 1 1 3 ASN HD22 H 9.941 13.714 5.576 1.00 . A A . 3 ASN HD22 1 1 16 10496 1 1 3 ASN N N 12.095 9.974 8.140 1.00 . A A . 3 ASN N 1 1 16 10497 1 1 3 ASN ND2 N 9.759 13.259 6.477 1.00 . A A . 3 ASN ND2 1 1 16 10498 1 1 3 ASN O O 9.284 10.028 6.733 1.00 . A A . 3 ASN O 1 1 16 10499 1 1 3 ASN OD1 O 11.908 12.714 6.549 1.00 . A A . 3 ASN OD1 1 1 16 10500 1 1 4 CYS C C 7.529 6.966 9.061 1.00 . A A . 4 CYS C 1 1 16 10501 1 1 4 CYS CA C 8.420 7.579 7.924 1.00 . A A . 4 CYS CA 1 1 16 10502 1 1 4 CYS CB C 9.202 6.487 7.202 1.00 . A A . 4 CYS CB 1 1 16 10503 1 1 4 CYS H H 10.015 8.478 9.256 1.00 . A A . 4 CYS H 1 1 16 10504 1 1 4 CYS HA H 7.747 8.021 7.171 1.00 . A A . 4 CYS HA 1 1 16 10505 1 1 4 CYS HB2 H 8.368 5.862 6.967 1.00 . A A . 4 CYS HB2 1 1 16 10506 1 1 4 CYS HB3 H 9.568 6.750 6.199 1.00 . A A . 4 CYS HB3 1 1 16 10507 1 1 4 CYS N N 9.370 8.580 8.470 1.00 . A A . 4 CYS N 1 1 16 10508 1 1 4 CYS O O 7.776 7.180 10.255 1.00 . A A . 4 CYS O 1 1 16 10509 1 1 4 CYS SG S 10.294 5.393 8.128 1.00 . A A . 4 CYS SG 1 1 16 10510 1 1 5 ILE C C 5.895 3.998 9.568 1.00 . A A . 5 ILE C 1 1 16 10511 1 1 5 ILE CA C 5.586 5.508 9.688 1.00 . A A . 5 ILE CA 1 1 16 10512 1 1 5 ILE CB C 4.039 5.776 9.484 1.00 . A A . 5 ILE CB 1 1 16 10513 1 1 5 ILE CD1 C 2.393 7.713 9.068 1.00 . A A . 5 ILE CD1 1 1 16 10514 1 1 5 ILE CG1 C 3.810 7.290 9.326 1.00 . A A . 5 ILE CG1 1 1 16 10515 1 1 5 ILE CG2 C 3.217 5.201 10.694 1.00 . A A . 5 ILE CG2 1 1 16 10516 1 1 5 ILE H H 6.482 5.988 7.636 1.00 . A A . 5 ILE H 1 1 16 10517 1 1 5 ILE HA H 5.827 5.870 10.696 1.00 . A A . 5 ILE HA 1 1 16 10518 1 1 5 ILE HB H 3.633 5.292 8.595 1.00 . A A . 5 ILE HB 1 1 16 10519 1 1 5 ILE HD11 H 2.008 7.250 8.142 1.00 . A A . 5 ILE HD11 1 1 16 10520 1 1 5 ILE HD12 H 1.777 7.404 9.920 1.00 . A A . 5 ILE HD12 1 1 16 10521 1 1 5 ILE HD13 H 2.277 8.804 8.991 1.00 . A A . 5 ILE HD13 1 1 16 10522 1 1 5 ILE HG12 H 4.165 7.804 10.209 1.00 . A A . 5 ILE HG12 1 1 16 10523 1 1 5 ILE HG13 H 4.404 7.667 8.479 1.00 . A A . 5 ILE HG13 1 1 16 10524 1 1 5 ILE HG21 H 3.344 4.109 10.813 1.00 . A A . 5 ILE HG21 1 1 16 10525 1 1 5 ILE HG22 H 3.455 5.659 11.674 1.00 . A A . 5 ILE HG22 1 1 16 10526 1 1 5 ILE HG23 H 2.120 5.314 10.567 1.00 . A A . 5 ILE HG23 1 1 16 10527 1 1 5 ILE N N 6.483 6.180 8.665 1.00 . A A . 5 ILE N 1 1 16 10528 1 1 5 ILE O O 5.237 3.240 8.854 1.00 . A A . 5 ILE O 1 1 16 10529 1 1 6 ALA C C 6.452 1.110 11.056 1.00 . A A . 6 ALA C 1 1 16 10530 1 1 6 ALA CA C 7.344 2.102 10.204 1.00 . A A . 6 ALA CA 1 1 16 10531 1 1 6 ALA CB C 8.800 2.060 10.706 1.00 . A A . 6 ALA CB 1 1 16 10532 1 1 6 ALA H H 7.265 4.211 10.974 1.00 . A A . 6 ALA H 1 1 16 10533 1 1 6 ALA HA H 7.291 1.805 9.126 1.00 . A A . 6 ALA HA 1 1 16 10534 1 1 6 ALA HB1 H 9.457 2.732 10.124 1.00 . A A . 6 ALA HB1 1 1 16 10535 1 1 6 ALA HB2 H 8.883 2.354 11.770 1.00 . A A . 6 ALA HB2 1 1 16 10536 1 1 6 ALA HB3 H 9.226 1.044 10.613 1.00 . A A . 6 ALA HB3 1 1 16 10537 1 1 6 ALA N N 6.915 3.533 10.297 1.00 . A A . 6 ALA N 1 1 16 10538 1 1 6 ALA O O 6.872 0.001 11.404 1.00 . A A . 6 ALA O 1 1 16 10539 1 1 7 GLU C C 3.162 0.099 11.734 1.00 . A A . 7 GLU C 1 1 16 10540 1 1 7 GLU CA C 4.321 0.904 12.363 1.00 . A A . 7 GLU CA 1 1 16 10541 1 1 7 GLU CB C 3.788 2.057 13.263 1.00 . A A . 7 GLU CB 1 1 16 10542 1 1 7 GLU CD C 5.844 3.547 13.870 1.00 . A A . 7 GLU CD 1 1 16 10543 1 1 7 GLU CG C 4.731 2.612 14.360 1.00 . A A . 7 GLU CG 1 1 16 10544 1 1 7 GLU H H 5.187 2.547 11.134 1.00 . A A . 7 GLU H 1 1 16 10545 1 1 7 GLU HA H 4.840 0.208 12.986 1.00 . A A . 7 GLU HA 1 1 16 10546 1 1 7 GLU HB2 H 3.424 2.884 12.635 1.00 . A A . 7 GLU HB2 1 1 16 10547 1 1 7 GLU HB3 H 2.890 1.704 13.804 1.00 . A A . 7 GLU HB3 1 1 16 10548 1 1 7 GLU HE2 H 6.063 5.352 13.175 1.00 . A A . 7 GLU HE2 1 1 16 10549 1 1 7 GLU HG2 H 4.125 3.169 15.099 1.00 . A A . 7 GLU HG2 1 1 16 10550 1 1 7 GLU HG3 H 5.175 1.776 14.932 1.00 . A A . 7 GLU HG3 1 1 16 10551 1 1 7 GLU N N 5.227 1.548 11.387 1.00 . A A . 7 GLU N 1 1 16 10552 1 1 7 GLU O O 2.769 0.278 10.583 1.00 . A A . 7 GLU O 1 1 16 10553 1 1 7 GLU OE1 O 7.030 3.223 13.829 1.00 . A A . 7 GLU OE1 1 1 16 10554 1 1 7 GLU OE2 O 5.363 4.771 13.482 1.00 . A A . 7 GLU OE2 1 1 16 10555 1 1 8 ASP C C 0.374 -0.759 13.279 1.00 . A A . 8 ASP C 1 1 16 10556 1 1 8 ASP CA C 1.363 -1.539 12.370 1.00 . A A . 8 ASP CA 1 1 16 10557 1 1 8 ASP CB C 1.387 -3.040 12.784 1.00 . A A . 8 ASP CB 1 1 16 10558 1 1 8 ASP CG C 2.719 -3.786 12.558 1.00 . A A . 8 ASP CG 1 1 16 10559 1 1 8 ASP H H 3.096 -0.817 13.506 1.00 . A A . 8 ASP H 1 1 16 10560 1 1 8 ASP HA H 1.077 -1.491 11.293 1.00 . A A . 8 ASP HA 1 1 16 10561 1 1 8 ASP HB2 H 1.038 -3.110 13.824 1.00 . A A . 8 ASP HB2 1 1 16 10562 1 1 8 ASP HB3 H 0.630 -3.564 12.182 1.00 . A A . 8 ASP HB3 1 1 16 10563 1 1 8 ASP HD2 H 2.062 -4.108 10.755 1.00 . A A . 8 ASP HD2 1 1 16 10564 1 1 8 ASP N N 2.630 -0.794 12.592 1.00 . A A . 8 ASP N 1 1 16 10565 1 1 8 ASP O O 0.555 -0.595 14.493 1.00 . A A . 8 ASP O 1 1 16 10566 1 1 8 ASP OD1 O 3.578 -3.900 13.431 1.00 . A A . 8 ASP OD1 1 1 16 10567 1 1 8 ASP OD2 O 2.834 -4.299 11.292 1.00 . A A . 8 ASP OD2 1 1 16 10568 1 1 9 TYR C C -0.916 2.037 13.743 1.00 . A A . 9 TYR C 1 1 16 10569 1 1 9 TYR CA C -1.639 0.753 13.148 1.00 . A A . 9 TYR CA 1 1 16 10570 1 1 9 TYR CB C -2.560 0.049 14.199 1.00 . A A . 9 TYR CB 1 1 16 10571 1 1 9 TYR CD1 C -4.667 -0.519 12.864 1.00 . A A . 9 TYR CD1 1 1 16 10572 1 1 9 TYR CD2 C -3.321 -2.338 13.709 1.00 . A A . 9 TYR CD2 1 1 16 10573 1 1 9 TYR CE1 C -5.539 -1.435 12.283 1.00 . A A . 9 TYR CE1 1 1 16 10574 1 1 9 TYR CE2 C -4.201 -3.253 13.136 1.00 . A A . 9 TYR CE2 1 1 16 10575 1 1 9 TYR CG C -3.550 -0.964 13.584 1.00 . A A . 9 TYR CG 1 1 16 10576 1 1 9 TYR CZ C -5.306 -2.801 12.419 1.00 . A A . 9 TYR CZ 1 1 16 10577 1 1 9 TYR H H -0.674 -0.636 11.666 1.00 . A A . 9 TYR H 1 1 16 10578 1 1 9 TYR HA H -2.259 1.128 12.317 1.00 . A A . 9 TYR HA 1 1 16 10579 1 1 9 TYR HB2 H -1.967 -0.412 15.012 1.00 . A A . 9 TYR HB2 1 1 16 10580 1 1 9 TYR HB3 H -3.166 0.814 14.722 1.00 . A A . 9 TYR HB3 1 1 16 10581 1 1 9 TYR HD1 H -4.854 0.537 12.734 1.00 . A A . 9 TYR HD1 1 1 16 10582 1 1 9 TYR HD2 H -2.449 -2.704 14.232 1.00 . A A . 9 TYR HD2 1 1 16 10583 1 1 9 TYR HE1 H -6.393 -1.081 11.723 1.00 . A A . 9 TYR HE1 1 1 16 10584 1 1 9 TYR HE2 H -4.013 -4.312 13.235 1.00 . A A . 9 TYR HE2 1 1 16 10585 1 1 9 TYR HH H -6.860 -3.225 11.387 1.00 . A A . 9 TYR HH 1 1 16 10586 1 1 9 TYR N N -0.659 -0.253 12.613 1.00 . A A . 9 TYR N 1 1 16 10587 1 1 9 TYR O O -1.373 2.609 14.739 1.00 . A A . 9 TYR O 1 1 16 10588 1 1 9 TYR OH O -6.160 -3.703 11.837 1.00 . A A . 9 TYR OH 1 1 16 10589 1 1 10 GLY C C 0.024 5.001 12.753 1.00 . A A . 10 GLY C 1 1 16 10590 1 1 10 GLY CA C 0.771 3.856 13.396 1.00 . A A . 10 GLY CA 1 1 16 10591 1 1 10 GLY H H 0.504 1.921 12.326 1.00 . A A . 10 GLY H 1 1 16 10592 1 1 10 GLY HA2 H 0.964 3.984 14.464 1.00 . A A . 10 GLY HA2 1 1 16 10593 1 1 10 GLY HA3 H 1.770 4.022 13.016 1.00 . A A . 10 GLY HA3 1 1 16 10594 1 1 10 GLY N N 0.160 2.535 13.079 1.00 . A A . 10 GLY N 1 1 16 10595 1 1 10 GLY O O -0.451 4.922 11.620 1.00 . A A . 10 GLY O 1 1 16 10596 1 1 11 LYS C C -0.261 7.965 11.973 1.00 . A A . 11 LYS C 1 1 16 10597 1 1 11 LYS CA C -0.933 7.221 13.159 1.00 . A A . 11 LYS CA 1 1 16 10598 1 1 11 LYS CB C -1.132 8.222 14.299 1.00 . A A . 11 LYS CB 1 1 16 10599 1 1 11 LYS CD C -2.374 10.247 15.290 1.00 . A A . 11 LYS CD 1 1 16 10600 1 1 11 LYS CE C -3.437 11.351 15.121 1.00 . A A . 11 LYS CE 1 1 16 10601 1 1 11 LYS CG C -2.203 9.316 14.071 1.00 . A A . 11 LYS CG 1 1 16 10602 1 1 11 LYS H H 0.571 5.928 14.322 1.00 . A A . 11 LYS H 1 1 16 10603 1 1 11 LYS HA H -1.935 6.803 12.906 1.00 . A A . 11 LYS HA 1 1 16 10604 1 1 11 LYS HB2 H -1.462 7.624 15.149 1.00 . A A . 11 LYS HB2 1 1 16 10605 1 1 11 LYS HB3 H -0.167 8.687 14.524 1.00 . A A . 11 LYS HB3 1 1 16 10606 1 1 11 LYS HD2 H -2.654 9.634 16.167 1.00 . A A . 11 LYS HD2 1 1 16 10607 1 1 11 LYS HD3 H -1.402 10.704 15.558 1.00 . A A . 11 LYS HD3 1 1 16 10608 1 1 11 LYS HE2 H -4.405 10.912 14.819 1.00 . A A . 11 LYS HE2 1 1 16 10609 1 1 11 LYS HE3 H -3.621 11.831 16.099 1.00 . A A . 11 LYS HE3 1 1 16 10610 1 1 11 LYS HG2 H -1.935 9.920 13.184 1.00 . A A . 11 LYS HG2 1 1 16 10611 1 1 11 LYS HG3 H -3.173 8.841 13.827 1.00 . A A . 11 LYS HG3 1 1 16 10612 1 1 11 LYS HZ1 H -3.793 13.097 14.075 1.00 . A A . 11 LYS HZ1 1 1 16 10613 1 1 11 LYS HZ2 H -2.944 11.992 13.219 1.00 . A A . 11 LYS HZ2 1 1 16 10614 1 1 11 LYS N N -0.054 6.076 13.521 1.00 . A A . 11 LYS N 1 1 16 10615 1 1 11 LYS NZ N -3.047 12.397 14.156 1.00 . A A . 11 LYS NZ 1 1 16 10616 1 1 11 LYS O O 0.901 8.385 11.963 1.00 . A A . 11 LYS O 1 1 16 10617 1 1 12 CYS C C -1.954 9.388 9.063 1.00 . A A . 12 CYS C 1 1 16 10618 1 1 12 CYS CA C -0.831 8.480 9.616 1.00 . A A . 12 CYS CA 1 1 16 10619 1 1 12 CYS CB C -0.672 7.209 8.737 1.00 . A A . 12 CYS CB 1 1 16 10620 1 1 12 CYS H H -2.021 7.751 11.432 1.00 . A A . 12 CYS H 1 1 16 10621 1 1 12 CYS HA H 0.125 9.048 9.597 1.00 . A A . 12 CYS HA 1 1 16 10622 1 1 12 CYS HB2 H -0.311 7.467 7.725 1.00 . A A . 12 CYS HB2 1 1 16 10623 1 1 12 CYS HB3 H 0.075 6.520 9.149 1.00 . A A . 12 CYS HB3 1 1 16 10624 1 1 12 CYS N N -1.136 8.049 10.998 1.00 . A A . 12 CYS N 1 1 16 10625 1 1 12 CYS O O -2.929 9.746 9.735 1.00 . A A . 12 CYS O 1 1 16 10626 1 1 12 CYS SG S -2.120 6.207 8.567 1.00 . A A . 12 CYS SG 1 1 16 10627 1 1 13 THR C C -2.716 10.235 5.563 1.00 . A A . 13 THR C 1 1 16 10628 1 1 13 THR CA C -2.713 10.658 7.065 1.00 . A A . 13 THR CA 1 1 16 10629 1 1 13 THR CB C -2.256 12.145 7.218 1.00 . A A . 13 THR CB 1 1 16 10630 1 1 13 THR CG2 C -3.230 13.245 6.781 1.00 . A A . 13 THR CG2 1 1 16 10631 1 1 13 THR H H -0.846 9.479 7.411 1.00 . A A . 13 THR H 1 1 16 10632 1 1 13 THR HA H -3.738 10.518 7.488 1.00 . A A . 13 THR HA 1 1 16 10633 1 1 13 THR HB H -1.408 12.217 6.560 1.00 . A A . 13 THR HB 1 1 16 10634 1 1 13 THR HG1 H -2.810 12.384 9.049 1.00 . A A . 13 THR HG1 1 1 16 10635 1 1 13 THR HG21 H -4.196 13.199 7.305 1.00 . A A . 13 THR HG21 1 1 16 10636 1 1 13 THR HG22 H -2.775 14.237 6.976 1.00 . A A . 13 THR HG22 1 1 16 10637 1 1 13 THR HG23 H -3.397 13.228 5.690 1.00 . A A . 13 THR HG23 1 1 16 10638 1 1 13 THR N N -1.756 9.788 7.799 1.00 . A A . 13 THR N 1 1 16 10639 1 1 13 THR O O -1.829 9.566 5.022 1.00 . A A . 13 THR O 1 1 16 10640 1 1 13 THR OG1 O -1.977 12.470 8.580 1.00 . A A . 13 THR OG1 1 1 16 10641 1 1 14 TRP C C -3.478 12.059 2.931 1.00 . A A . 14 TRP C 1 1 16 10642 1 1 14 TRP CA C -3.952 10.666 3.443 1.00 . A A . 14 TRP CA 1 1 16 10643 1 1 14 TRP CB C -5.428 10.359 3.060 1.00 . A A . 14 TRP CB 1 1 16 10644 1 1 14 TRP CD1 C -5.187 7.725 2.997 1.00 . A A . 14 TRP CD1 1 1 16 10645 1 1 14 TRP CD2 C -7.141 8.478 3.753 1.00 . A A . 14 TRP CD2 1 1 16 10646 1 1 14 TRP CE2 C -7.145 7.058 3.741 1.00 . A A . 14 TRP CE2 1 1 16 10647 1 1 14 TRP CE3 C -8.288 9.193 4.186 1.00 . A A . 14 TRP CE3 1 1 16 10648 1 1 14 TRP CG C -5.906 8.910 3.290 1.00 . A A . 14 TRP CG 1 1 16 10649 1 1 14 TRP CH2 C -9.411 7.068 4.587 1.00 . A A . 14 TRP CH2 1 1 16 10650 1 1 14 TRP CZ2 C -8.294 6.347 4.164 1.00 . A A . 14 TRP CZ2 1 1 16 10651 1 1 14 TRP CZ3 C -9.409 8.469 4.597 1.00 . A A . 14 TRP CZ3 1 1 16 10652 1 1 14 TRP H H -4.211 11.353 5.586 1.00 . A A . 14 TRP H 1 1 16 10653 1 1 14 TRP HA H -3.315 9.878 2.991 1.00 . A A . 14 TRP HA 1 1 16 10654 1 1 14 TRP HB2 H -6.106 11.069 3.573 1.00 . A A . 14 TRP HB2 1 1 16 10655 1 1 14 TRP HB3 H -5.569 10.573 1.984 1.00 . A A . 14 TRP HB3 1 1 16 10656 1 1 14 TRP HD1 H -4.186 7.698 2.592 1.00 . A A . 14 TRP HD1 1 1 16 10657 1 1 14 TRP HE1 H -5.653 5.591 3.165 1.00 . A A . 14 TRP HE1 1 1 16 10658 1 1 14 TRP HE3 H -8.303 10.273 4.202 1.00 . A A . 14 TRP HE3 1 1 16 10659 1 1 14 TRP HH2 H -10.291 6.537 4.917 1.00 . A A . 14 TRP HH2 1 1 16 10660 1 1 14 TRP HZ2 H -8.310 5.266 4.162 1.00 . A A . 14 TRP HZ2 1 1 16 10661 1 1 14 TRP HZ3 H -10.288 8.998 4.933 1.00 . A A . 14 TRP HZ3 1 1 16 10662 1 1 14 TRP N N -3.785 10.693 4.924 1.00 . A A . 14 TRP N 1 1 16 10663 1 1 14 TRP NE1 N -5.934 6.570 3.284 1.00 . A A . 14 TRP NE1 1 1 16 10664 1 1 14 TRP O O -4.250 13.024 2.934 1.00 . A A . 14 TRP O 1 1 16 10665 1 1 15 GLY C C -0.301 13.736 3.159 1.00 . A A . 15 GLY C 1 1 16 10666 1 1 15 GLY CA C -1.536 13.459 2.261 1.00 . A A . 15 GLY CA 1 1 16 10667 1 1 15 GLY H H -1.642 11.308 2.706 1.00 . A A . 15 GLY H 1 1 16 10668 1 1 15 GLY HA2 H -1.216 13.461 1.204 1.00 . A A . 15 GLY HA2 1 1 16 10669 1 1 15 GLY HA3 H -2.233 14.315 2.349 1.00 . A A . 15 GLY HA3 1 1 16 10670 1 1 15 GLY N N -2.197 12.153 2.537 1.00 . A A . 15 GLY N 1 1 16 10671 1 1 15 GLY O O 0.701 14.267 2.673 1.00 . A A . 15 GLY O 1 1 16 10672 1 1 16 GLY C C 1.856 12.307 5.064 1.00 . A A . 16 GLY C 1 1 16 10673 1 1 16 GLY CA C 0.771 13.352 5.390 1.00 . A A . 16 GLY CA 1 1 16 10674 1 1 16 GLY H H -1.246 12.864 4.668 1.00 . A A . 16 GLY H 1 1 16 10675 1 1 16 GLY HA2 H 1.189 14.340 5.568 1.00 . A A . 16 GLY HA2 1 1 16 10676 1 1 16 GLY HA3 H 0.372 13.150 6.397 1.00 . A A . 16 GLY HA3 1 1 16 10677 1 1 16 GLY N N -0.377 13.367 4.454 1.00 . A A . 16 GLY N 1 1 16 10678 1 1 16 GLY O O 2.085 11.923 3.911 1.00 . A A . 16 GLY O 1 1 16 10679 1 1 17 THR C C 2.534 9.363 5.862 1.00 . A A . 17 THR C 1 1 16 10680 1 1 17 THR CA C 3.419 10.651 6.050 1.00 . A A . 17 THR CA 1 1 16 10681 1 1 17 THR CB C 4.329 10.469 7.333 1.00 . A A . 17 THR CB 1 1 16 10682 1 1 17 THR CG2 C 5.652 9.742 7.006 1.00 . A A . 17 THR CG2 1 1 16 10683 1 1 17 THR H H 2.246 12.379 6.967 1.00 . A A . 17 THR H 1 1 16 10684 1 1 17 THR HA H 4.077 10.808 5.167 1.00 . A A . 17 THR HA 1 1 16 10685 1 1 17 THR HB H 3.810 9.841 8.088 1.00 . A A . 17 THR HB 1 1 16 10686 1 1 17 THR HG1 H 5.240 11.546 8.643 1.00 . A A . 17 THR HG1 1 1 16 10687 1 1 17 THR HG21 H 5.491 8.731 6.594 1.00 . A A . 17 THR HG21 1 1 16 10688 1 1 17 THR HG22 H 6.291 10.276 6.281 1.00 . A A . 17 THR HG22 1 1 16 10689 1 1 17 THR HG23 H 6.255 9.586 7.921 1.00 . A A . 17 THR HG23 1 1 16 10690 1 1 17 THR N N 2.492 11.825 6.138 1.00 . A A . 17 THR N 1 1 16 10691 1 1 17 THR O O 1.457 9.179 6.457 1.00 . A A . 17 THR O 1 1 16 10692 1 1 17 THR OG1 O 4.689 11.735 7.880 1.00 . A A . 17 THR OG1 1 1 16 10693 1 1 18 LYS C C 3.659 6.172 5.450 1.00 . A A . 18 LYS C 1 1 16 10694 1 1 18 LYS CA C 2.603 7.100 4.799 1.00 . A A . 18 LYS CA 1 1 16 10695 1 1 18 LYS CB C 2.402 6.783 3.281 1.00 . A A . 18 LYS CB 1 1 16 10696 1 1 18 LYS CD C 0.219 8.170 2.797 1.00 . A A . 18 LYS CD 1 1 16 10697 1 1 18 LYS CE C -0.821 7.029 2.829 1.00 . A A . 18 LYS CE 1 1 16 10698 1 1 18 LYS CG C 1.660 7.797 2.372 1.00 . A A . 18 LYS CG 1 1 16 10699 1 1 18 LYS H H 4.017 8.782 4.702 1.00 . A A . 18 LYS H 1 1 16 10700 1 1 18 LYS HA H 1.634 6.888 5.279 1.00 . A A . 18 LYS HA 1 1 16 10701 1 1 18 LYS HB2 H 3.376 6.505 2.847 1.00 . A A . 18 LYS HB2 1 1 16 10702 1 1 18 LYS HB3 H 1.847 5.829 3.212 1.00 . A A . 18 LYS HB3 1 1 16 10703 1 1 18 LYS HD2 H 0.264 8.628 3.801 1.00 . A A . 18 LYS HD2 1 1 16 10704 1 1 18 LYS HD3 H -0.151 8.982 2.143 1.00 . A A . 18 LYS HD3 1 1 16 10705 1 1 18 LYS HE2 H -0.467 6.200 3.467 1.00 . A A . 18 LYS HE2 1 1 16 10706 1 1 18 LYS HE3 H -1.748 7.394 3.306 1.00 . A A . 18 LYS HE3 1 1 16 10707 1 1 18 LYS HG2 H 2.259 8.724 2.305 1.00 . A A . 18 LYS HG2 1 1 16 10708 1 1 18 LYS HG3 H 1.642 7.403 1.339 1.00 . A A . 18 LYS HG3 1 1 16 10709 1 1 18 LYS HZ1 H -0.330 6.086 1.058 1.00 . A A . 18 LYS HZ1 1 1 16 10710 1 1 18 LYS HZ2 H -1.840 5.740 1.578 1.00 . A A . 18 LYS HZ2 1 1 16 10711 1 1 18 LYS N N 3.080 8.494 5.002 1.00 . A A . 18 LYS N 1 1 16 10712 1 1 18 LYS NZ N -1.160 6.504 1.493 1.00 . A A . 18 LYS NZ 1 1 16 10713 1 1 18 LYS O O 4.670 6.566 6.059 1.00 . A A . 18 LYS O 1 1 16 10714 1 1 19 CYS C C 5.494 3.606 5.319 1.00 . A A . 19 CYS C 1 1 16 10715 1 1 19 CYS CA C 4.168 3.873 6.099 1.00 . A A . 19 CYS CA 1 1 16 10716 1 1 19 CYS CB C 3.296 2.634 6.342 1.00 . A A . 19 CYS CB 1 1 16 10717 1 1 19 CYS H H 2.581 4.734 4.696 1.00 . A A . 19 CYS H 1 1 16 10718 1 1 19 CYS HA H 4.374 4.336 7.092 1.00 . A A . 19 CYS HA 1 1 16 10719 1 1 19 CYS HB2 H 2.646 2.427 5.481 1.00 . A A . 19 CYS HB2 1 1 16 10720 1 1 19 CYS HB3 H 3.927 1.727 6.533 1.00 . A A . 19 CYS HB3 1 1 16 10721 1 1 19 CYS N N 3.374 4.876 5.346 1.00 . A A . 19 CYS N 1 1 16 10722 1 1 19 CYS O O 5.611 3.664 4.089 1.00 . A A . 19 CYS O 1 1 16 10723 1 1 19 CYS SG S 2.269 3.007 7.752 1.00 . A A . 19 CYS SG 1 1 16 10724 1 1 20 CYS C C 8.441 2.644 4.634 1.00 . A A . 20 CYS C 1 1 16 10725 1 1 20 CYS CA C 7.947 3.480 5.849 1.00 . A A . 20 CYS CA 1 1 16 10726 1 1 20 CYS CB C 8.724 2.984 7.088 1.00 . A A . 20 CYS CB 1 1 16 10727 1 1 20 CYS H H 6.203 3.409 7.160 1.00 . A A . 20 CYS H 1 1 16 10728 1 1 20 CYS HA H 8.083 4.551 5.738 1.00 . A A . 20 CYS HA 1 1 16 10729 1 1 20 CYS HB2 H 8.250 3.354 7.996 1.00 . A A . 20 CYS HB2 1 1 16 10730 1 1 20 CYS HB3 H 8.765 1.882 7.186 1.00 . A A . 20 CYS HB3 1 1 16 10731 1 1 20 CYS N N 6.505 3.424 6.180 1.00 . A A . 20 CYS N 1 1 16 10732 1 1 20 CYS O O 9.154 3.204 3.796 1.00 . A A . 20 CYS O 1 1 16 10733 1 1 20 CYS SG S 10.388 3.683 7.063 1.00 . A A . 20 CYS SG 1 1 16 10734 1 1 21 ARG C C 7.856 0.303 2.213 1.00 . A A . 21 ARG C 1 1 16 10735 1 1 21 ARG CA C 8.698 0.413 3.530 1.00 . A A . 21 ARG CA 1 1 16 10736 1 1 21 ARG CB C 8.847 -0.953 4.268 1.00 . A A . 21 ARG CB 1 1 16 10737 1 1 21 ARG CD C 9.960 -3.303 4.333 1.00 . A A . 21 ARG CD 1 1 16 10738 1 1 21 ARG CG C 9.892 -1.918 3.656 1.00 . A A . 21 ARG CG 1 1 16 10739 1 1 21 ARG CZ C 10.465 -4.066 6.689 1.00 . A A . 21 ARG CZ 1 1 16 10740 1 1 21 ARG H H 7.420 1.103 5.253 1.00 . A A . 21 ARG H 1 1 16 10741 1 1 21 ARG HA H 9.669 0.812 3.203 1.00 . A A . 21 ARG HA 1 1 16 10742 1 1 21 ARG HB2 H 9.152 -0.797 5.323 1.00 . A A . 21 ARG HB2 1 1 16 10743 1 1 21 ARG HB3 H 7.864 -1.459 4.330 1.00 . A A . 21 ARG HB3 1 1 16 10744 1 1 21 ARG HD2 H 8.959 -3.775 4.329 1.00 . A A . 21 ARG HD2 1 1 16 10745 1 1 21 ARG HD3 H 10.612 -3.970 3.740 1.00 . A A . 21 ARG HD3 1 1 16 10746 1 1 21 ARG HG2 H 9.664 -2.080 2.587 1.00 . A A . 21 ARG HG2 1 1 16 10747 1 1 21 ARG HG3 H 10.892 -1.444 3.665 1.00 . A A . 21 ARG HG3 1 1 16 10748 1 1 21 ARG HH11 H 9.512 -5.509 5.665 1.00 . A A . 21 ARG HH11 1 1 16 10749 1 1 21 ARG HH12 H 9.958 -5.874 7.407 1.00 . A A . 21 ARG HH12 1 1 16 10750 1 1 21 ARG HH21 H 11.412 -2.785 7.903 1.00 . A A . 21 ARG HH21 1 1 16 10751 1 1 21 ARG HH22 H 10.965 -4.426 8.594 1.00 . A A . 21 ARG HH22 1 1 16 10752 1 1 21 ARG N N 8.119 1.343 4.557 1.00 . A A . 21 ARG N 1 1 16 10753 1 1 21 ARG NE N 10.489 -3.221 5.735 1.00 . A A . 21 ARG NE 1 1 16 10754 1 1 21 ARG NH1 N 9.922 -5.274 6.575 1.00 . A A . 21 ARG NH1 1 1 16 10755 1 1 21 ARG NH2 N 11.004 -3.725 7.846 1.00 . A A . 21 ARG NH2 1 1 16 10756 1 1 21 ARG O O 7.770 -0.743 1.561 1.00 . A A . 21 ARG O 1 1 16 10757 1 1 22 GLY C C 4.937 0.759 1.099 1.00 . A A . 22 GLY C 1 1 16 10758 1 1 22 GLY CA C 6.227 1.523 0.770 1.00 . A A . 22 GLY CA 1 1 16 10759 1 1 22 GLY H H 7.351 2.059 2.665 1.00 . A A . 22 GLY H 1 1 16 10760 1 1 22 GLY HA2 H 6.006 2.589 0.571 1.00 . A A . 22 GLY HA2 1 1 16 10761 1 1 22 GLY HA3 H 6.638 1.139 -0.166 1.00 . A A . 22 GLY HA3 1 1 16 10762 1 1 22 GLY N N 7.243 1.431 1.851 1.00 . A A . 22 GLY N 1 1 16 10763 1 1 22 GLY O O 4.609 -0.260 0.486 1.00 . A A . 22 GLY O 1 1 16 10764 1 1 23 ARG C C 1.897 1.609 2.813 1.00 . A A . 23 ARG C 1 1 16 10765 1 1 23 ARG CA C 3.131 0.637 2.788 1.00 . A A . 23 ARG CA 1 1 16 10766 1 1 23 ARG CB C 3.575 0.294 4.233 1.00 . A A . 23 ARG CB 1 1 16 10767 1 1 23 ARG CD C 5.170 -0.853 5.964 1.00 . A A . 23 ARG CD 1 1 16 10768 1 1 23 ARG CG C 4.644 -0.765 4.517 1.00 . A A . 23 ARG CG 1 1 16 10769 1 1 23 ARG CZ C 4.281 -1.716 8.150 1.00 . A A . 23 ARG CZ 1 1 16 10770 1 1 23 ARG H H 4.796 2.048 2.565 1.00 . A A . 23 ARG H 1 1 16 10771 1 1 23 ARG HA H 2.865 -0.309 2.282 1.00 . A A . 23 ARG HA 1 1 16 10772 1 1 23 ARG HB2 H 4.076 1.201 4.575 1.00 . A A . 23 ARG HB2 1 1 16 10773 1 1 23 ARG HB3 H 2.698 0.111 4.883 1.00 . A A . 23 ARG HB3 1 1 16 10774 1 1 23 ARG HD2 H 6.063 -1.506 5.974 1.00 . A A . 23 ARG HD2 1 1 16 10775 1 1 23 ARG HD3 H 5.527 0.135 6.310 1.00 . A A . 23 ARG HD3 1 1 16 10776 1 1 23 ARG HG2 H 4.273 -1.744 4.203 1.00 . A A . 23 ARG HG2 1 1 16 10777 1 1 23 ARG HG3 H 5.517 -0.491 3.908 1.00 . A A . 23 ARG HG3 1 1 16 10778 1 1 23 ARG HH11 H 6.223 -1.219 8.301 1.00 . A A . 23 ARG HH11 1 1 16 10779 1 1 23 ARG HH12 H 5.410 -1.882 9.806 1.00 . A A . 23 ARG HH12 1 1 16 10780 1 1 23 ARG HH21 H 2.366 -2.281 8.244 1.00 . A A . 23 ARG HH21 1 1 16 10781 1 1 23 ARG HH22 H 3.369 -2.443 9.772 1.00 . A A . 23 ARG HH22 1 1 16 10782 1 1 23 ARG N N 4.263 1.297 2.109 1.00 . A A . 23 ARG N 1 1 16 10783 1 1 23 ARG NE N 4.155 -1.398 6.921 1.00 . A A . 23 ARG NE 1 1 16 10784 1 1 23 ARG NH1 N 5.422 -1.593 8.822 1.00 . A A . 23 ARG NH1 1 1 16 10785 1 1 23 ARG NH2 N 3.233 -2.194 8.786 1.00 . A A . 23 ARG NH2 1 1 16 10786 1 1 23 ARG O O 2.070 2.787 3.176 1.00 . A A . 23 ARG O 1 1 16 10787 1 1 24 PRO C C -1.110 2.268 4.000 1.00 . A A . 24 PRO C 1 1 16 10788 1 1 24 PRO CA C -0.560 2.041 2.553 1.00 . A A . 24 PRO CA 1 1 16 10789 1 1 24 PRO CB C -1.543 1.290 1.626 1.00 . A A . 24 PRO CB 1 1 16 10790 1 1 24 PRO CD C 0.343 -0.172 1.955 1.00 . A A . 24 PRO CD 1 1 16 10791 1 1 24 PRO CG C -1.171 -0.187 1.755 1.00 . A A . 24 PRO CG 1 1 16 10792 1 1 24 PRO HA H -0.340 3.044 2.134 1.00 . A A . 24 PRO HA 1 1 16 10793 1 1 24 PRO HB2 H -2.609 1.472 1.858 1.00 . A A . 24 PRO HB2 1 1 16 10794 1 1 24 PRO HB3 H -1.396 1.620 0.579 1.00 . A A . 24 PRO HB3 1 1 16 10795 1 1 24 PRO HD2 H 0.659 -0.974 2.647 1.00 . A A . 24 PRO HD2 1 1 16 10796 1 1 24 PRO HD3 H 0.865 -0.325 0.991 1.00 . A A . 24 PRO HD3 1 1 16 10797 1 1 24 PRO HG2 H -1.671 -0.628 2.637 1.00 . A A . 24 PRO HG2 1 1 16 10798 1 1 24 PRO HG3 H -1.479 -0.781 0.875 1.00 . A A . 24 PRO HG3 1 1 16 10799 1 1 24 PRO N N 0.641 1.170 2.496 1.00 . A A . 24 PRO N 1 1 16 10800 1 1 24 PRO O O -0.660 1.673 4.988 1.00 . A A . 24 PRO O 1 1 16 10801 1 1 25 CYS C C -4.386 3.336 5.017 1.00 . A A . 25 CYS C 1 1 16 10802 1 1 25 CYS CA C -2.861 3.442 5.327 1.00 . A A . 25 CYS CA 1 1 16 10803 1 1 25 CYS CB C -2.497 4.852 5.863 1.00 . A A . 25 CYS CB 1 1 16 10804 1 1 25 CYS H H -2.379 3.577 3.183 1.00 . A A . 25 CYS H 1 1 16 10805 1 1 25 CYS HA H -2.598 2.703 6.112 1.00 . A A . 25 CYS HA 1 1 16 10806 1 1 25 CYS HB2 H -1.891 5.405 5.136 1.00 . A A . 25 CYS HB2 1 1 16 10807 1 1 25 CYS HB3 H -3.399 5.426 6.109 1.00 . A A . 25 CYS HB3 1 1 16 10808 1 1 25 CYS N N -2.109 3.159 4.080 1.00 . A A . 25 CYS N 1 1 16 10809 1 1 25 CYS O O -4.871 3.670 3.929 1.00 . A A . 25 CYS O 1 1 16 10810 1 1 25 CYS SG S -1.562 4.727 7.361 1.00 . A A . 25 CYS SG 1 1 16 10811 1 1 26 ARG C C -6.971 3.474 7.430 1.00 . A A . 26 ARG C 1 1 16 10812 1 1 26 ARG CA C -6.616 2.873 6.049 1.00 . A A . 26 ARG CA 1 1 16 10813 1 1 26 ARG CB C -7.235 1.454 5.876 1.00 . A A . 26 ARG CB 1 1 16 10814 1 1 26 ARG CD C -6.290 0.360 3.702 1.00 . A A . 26 ARG CD 1 1 16 10815 1 1 26 ARG CG C -7.489 1.012 4.414 1.00 . A A . 26 ARG CG 1 1 16 10816 1 1 26 ARG CZ C -5.804 -0.594 1.435 1.00 . A A . 26 ARG CZ 1 1 16 10817 1 1 26 ARG H H -4.620 2.783 6.919 1.00 . A A . 26 ARG H 1 1 16 10818 1 1 26 ARG HA H -7.001 3.526 5.239 1.00 . A A . 26 ARG HA 1 1 16 10819 1 1 26 ARG HB2 H -6.661 0.686 6.430 1.00 . A A . 26 ARG HB2 1 1 16 10820 1 1 26 ARG HB3 H -8.230 1.448 6.362 1.00 . A A . 26 ARG HB3 1 1 16 10821 1 1 26 ARG HD2 H -5.398 1.007 3.760 1.00 . A A . 26 ARG HD2 1 1 16 10822 1 1 26 ARG HD3 H -6.030 -0.583 4.220 1.00 . A A . 26 ARG HD3 1 1 16 10823 1 1 26 ARG HG2 H -8.323 0.284 4.416 1.00 . A A . 26 ARG HG2 1 1 16 10824 1 1 26 ARG HG3 H -7.868 1.872 3.830 1.00 . A A . 26 ARG HG3 1 1 16 10825 1 1 26 ARG HH11 H -4.338 -0.986 2.756 1.00 . A A . 26 ARG HH11 1 1 16 10826 1 1 26 ARG HH12 H -4.115 -1.617 1.047 1.00 . A A . 26 ARG HH12 1 1 16 10827 1 1 26 ARG HH21 H -7.114 -0.337 -0.056 1.00 . A A . 26 ARG HH21 1 1 16 10828 1 1 26 ARG HH22 H -5.582 -1.273 -0.435 1.00 . A A . 26 ARG HH22 1 1 16 10829 1 1 26 ARG N N -5.129 2.859 6.026 1.00 . A A . 26 ARG N 1 1 16 10830 1 1 26 ARG NE N -6.603 0.087 2.279 1.00 . A A . 26 ARG NE 1 1 16 10831 1 1 26 ARG NH1 N -4.632 -1.121 1.782 1.00 . A A . 26 ARG NH1 1 1 16 10832 1 1 26 ARG NH2 N -6.208 -0.751 0.188 1.00 . A A . 26 ARG NH2 1 1 16 10833 1 1 26 ARG O O -6.358 3.142 8.459 1.00 . A A . 26 ARG O 1 1 16 10834 1 1 27 CYS C C -8.847 4.398 9.862 1.00 . A A . 27 CYS C 1 1 16 10835 1 1 27 CYS CA C -8.166 5.191 8.697 1.00 . A A . 27 CYS CA 1 1 16 10836 1 1 27 CYS CB C -9.067 6.434 8.399 1.00 . A A . 27 CYS CB 1 1 16 10837 1 1 27 CYS H H -8.394 4.627 6.567 1.00 . A A . 27 CYS H 1 1 16 10838 1 1 27 CYS HA H -7.139 5.497 8.924 1.00 . A A . 27 CYS HA 1 1 16 10839 1 1 27 CYS HB2 H -9.862 6.162 7.718 1.00 . A A . 27 CYS HB2 1 1 16 10840 1 1 27 CYS HB3 H -9.602 6.803 9.295 1.00 . A A . 27 CYS HB3 1 1 16 10841 1 1 27 CYS N N -7.957 4.397 7.466 1.00 . A A . 27 CYS N 1 1 16 10842 1 1 27 CYS O O -9.402 3.303 9.731 1.00 . A A . 27 CYS O 1 1 16 10843 1 1 27 CYS SG S -8.258 7.906 7.749 1.00 . A A . 27 CYS SG 1 1 16 10844 1 1 28 SER C C -10.927 4.644 12.294 1.00 . A A . 28 SER C 1 1 16 10845 1 1 28 SER CA C -9.357 4.676 12.320 1.00 . A A . 28 SER CA 1 1 16 10846 1 1 28 SER CB C -8.750 5.716 13.322 1.00 . A A . 28 SER CB 1 1 16 10847 1 1 28 SER H H -8.326 5.995 10.906 1.00 . A A . 28 SER H 1 1 16 10848 1 1 28 SER HA H -9.048 3.666 12.631 1.00 . A A . 28 SER HA 1 1 16 10849 1 1 28 SER HB2 H -7.690 5.959 13.111 1.00 . A A . 28 SER HB2 1 1 16 10850 1 1 28 SER HB3 H -9.289 6.682 13.280 1.00 . A A . 28 SER HB3 1 1 16 10851 1 1 28 SER HG H -8.275 4.417 14.657 1.00 . A A . 28 SER HG 1 1 16 10852 1 1 28 SER N N -8.749 5.069 11.027 1.00 . A A . 28 SER N 1 1 16 10853 1 1 28 SER O O -11.597 4.620 11.257 1.00 . A A . 28 SER O 1 1 16 10854 1 1 28 SER OG O -8.799 5.221 14.654 1.00 . A A . 28 SER OG 1 1 16 10855 1 1 29 MET C C -13.836 5.651 13.275 1.00 . A A . 29 MET C 1 1 16 10856 1 1 29 MET CA C -12.936 4.497 13.815 1.00 . A A . 29 MET CA 1 1 16 10857 1 1 29 MET CB C -13.035 4.447 15.364 1.00 . A A . 29 MET CB 1 1 16 10858 1 1 29 MET CE C -14.217 5.335 18.535 1.00 . A A . 29 MET CE 1 1 16 10859 1 1 29 MET CG C -12.620 5.646 16.246 1.00 . A A . 29 MET CG 1 1 16 10860 1 1 29 MET H H -10.747 4.770 14.211 1.00 . A A . 29 MET H 1 1 16 10861 1 1 29 MET HA H -13.334 3.559 13.382 1.00 . A A . 29 MET HA 1 1 16 10862 1 1 29 MET HB2 H -14.075 4.202 15.618 1.00 . A A . 29 MET HB2 1 1 16 10863 1 1 29 MET HB3 H -12.423 3.604 15.688 1.00 . A A . 29 MET HB3 1 1 16 10864 1 1 29 MET HE1 H -14.554 6.381 18.414 1.00 . A A . 29 MET HE1 1 1 16 10865 1 1 29 MET HE2 H -14.899 4.682 17.962 1.00 . A A . 29 MET HE2 1 1 16 10866 1 1 29 MET HE3 H -14.306 5.069 19.604 1.00 . A A . 29 MET HE3 1 1 16 10867 1 1 29 MET HG2 H -11.635 6.041 15.937 1.00 . A A . 29 MET HG2 1 1 16 10868 1 1 29 MET HG3 H -13.342 6.475 16.149 1.00 . A A . 29 MET HG3 1 1 16 10869 1 1 29 MET N N -11.474 4.600 13.509 1.00 . A A . 29 MET N 1 1 16 10870 1 1 29 MET O O -14.973 5.425 12.855 1.00 . A A . 29 MET O 1 1 16 10871 1 1 29 MET SD S -12.511 5.139 17.978 1.00 . A A . 29 MET SD 1 1 16 10872 1 1 30 ILE C C -14.080 8.165 11.330 1.00 . A A . 30 ILE C 1 1 16 10873 1 1 30 ILE CA C -13.984 8.126 12.898 1.00 . A A . 30 ILE CA 1 1 16 10874 1 1 30 ILE CB C -13.199 9.394 13.444 1.00 . A A . 30 ILE CB 1 1 16 10875 1 1 30 ILE CD1 C -12.091 10.442 15.585 1.00 . A A . 30 ILE CD1 1 1 16 10876 1 1 30 ILE CG1 C -13.038 9.380 14.999 1.00 . A A . 30 ILE CG1 1 1 16 10877 1 1 30 ILE CG2 C -13.964 10.693 13.055 1.00 . A A . 30 ILE CG2 1 1 16 10878 1 1 30 ILE H H -12.346 6.763 13.714 1.00 . A A . 30 ILE H 1 1 16 10879 1 1 30 ILE HA H -15.009 8.125 13.313 1.00 . A A . 30 ILE HA 1 1 16 10880 1 1 30 ILE HB H -12.187 9.425 12.994 1.00 . A A . 30 ILE HB 1 1 16 10881 1 1 30 ILE HD11 H -11.089 10.395 15.120 1.00 . A A . 30 ILE HD11 1 1 16 10882 1 1 30 ILE HD12 H -12.476 11.468 15.450 1.00 . A A . 30 ILE HD12 1 1 16 10883 1 1 30 ILE HD13 H -11.953 10.291 16.672 1.00 . A A . 30 ILE HD13 1 1 16 10884 1 1 30 ILE HG12 H -14.025 9.442 15.497 1.00 . A A . 30 ILE HG12 1 1 16 10885 1 1 30 ILE HG13 H -12.618 8.412 15.317 1.00 . A A . 30 ILE HG13 1 1 16 10886 1 1 30 ILE HG21 H -14.073 10.803 11.961 1.00 . A A . 30 ILE HG21 1 1 16 10887 1 1 30 ILE HG22 H -14.982 10.725 13.488 1.00 . A A . 30 ILE HG22 1 1 16 10888 1 1 30 ILE HG23 H -13.437 11.606 13.388 1.00 . A A . 30 ILE HG23 1 1 16 10889 1 1 30 ILE N N -13.289 6.867 13.314 1.00 . A A . 30 ILE N 1 1 16 10890 1 1 30 ILE O O -15.174 8.382 10.801 1.00 . A A . 30 ILE O 1 1 16 10891 1 1 31 GLY C C -11.681 9.127 8.727 1.00 . A A . 31 GLY C 1 1 16 10892 1 1 31 GLY CA C -12.854 8.218 9.163 1.00 . A A . 31 GLY CA 1 1 16 10893 1 1 31 GLY H H -12.151 7.807 11.257 1.00 . A A . 31 GLY H 1 1 16 10894 1 1 31 GLY HA2 H -12.747 7.236 8.668 1.00 . A A . 31 GLY HA2 1 1 16 10895 1 1 31 GLY HA3 H -13.788 8.646 8.749 1.00 . A A . 31 GLY HA3 1 1 16 10896 1 1 31 GLY N N -12.948 7.984 10.629 1.00 . A A . 31 GLY N 1 1 16 10897 1 1 31 GLY O O -11.049 8.850 7.706 1.00 . A A . 31 GLY O 1 1 16 10898 1 1 32 THR C C -9.224 10.752 10.545 1.00 . A A . 32 THR C 1 1 16 10899 1 1 32 THR CA C -10.182 11.039 9.342 1.00 . A A . 32 THR CA 1 1 16 10900 1 1 32 THR CB C -10.546 12.561 9.303 1.00 . A A . 32 THR CB 1 1 16 10901 1 1 32 THR CG2 C -11.357 12.942 8.049 1.00 . A A . 32 THR CG2 1 1 16 10902 1 1 32 THR H H -11.947 10.196 10.369 1.00 . A A . 32 THR H 1 1 16 10903 1 1 32 THR HA H -9.656 10.789 8.398 1.00 . A A . 32 THR HA 1 1 16 10904 1 1 32 THR HB H -9.596 13.130 9.304 1.00 . A A . 32 THR HB 1 1 16 10905 1 1 32 THR HG1 H -12.136 12.404 10.383 1.00 . A A . 32 THR HG1 1 1 16 10906 1 1 32 THR HG21 H -10.814 12.684 7.121 1.00 . A A . 32 THR HG21 1 1 16 10907 1 1 32 THR HG22 H -12.338 12.432 8.012 1.00 . A A . 32 THR HG22 1 1 16 10908 1 1 32 THR HG23 H -11.554 14.029 8.017 1.00 . A A . 32 THR HG23 1 1 16 10909 1 1 32 THR N N -11.404 10.195 9.497 1.00 . A A . 32 THR N 1 1 16 10910 1 1 32 THR O O -9.622 10.201 11.578 1.00 . A A . 32 THR O 1 1 16 10911 1 1 32 THR OG1 O -11.330 12.923 10.440 1.00 . A A . 32 THR OG1 1 1 16 10912 1 1 33 ASN C C -6.517 9.281 11.148 1.00 . A A . 33 ASN C 1 1 16 10913 1 1 33 ASN CA C -6.788 10.805 11.286 1.00 . A A . 33 ASN CA 1 1 16 10914 1 1 33 ASN CB C -7.061 11.187 12.782 1.00 . A A . 33 ASN CB 1 1 16 10915 1 1 33 ASN CG C -7.091 12.701 13.067 1.00 . A A . 33 ASN CG 1 1 16 10916 1 1 33 ASN H H -7.719 11.424 9.412 1.00 . A A . 33 ASN H 1 1 16 10917 1 1 33 ASN HA H -5.895 11.362 10.940 1.00 . A A . 33 ASN HA 1 1 16 10918 1 1 33 ASN HB2 H -7.964 10.694 13.186 1.00 . A A . 33 ASN HB2 1 1 16 10919 1 1 33 ASN HB3 H -6.264 10.744 13.406 1.00 . A A . 33 ASN HB3 1 1 16 10920 1 1 33 ASN HD21 H -9.080 12.642 13.319 1.00 . A A . 33 ASN HD21 1 1 16 10921 1 1 33 ASN HD22 H -8.258 14.271 13.510 1.00 . A A . 33 ASN HD22 1 1 16 10922 1 1 33 ASN N N -7.933 11.131 10.371 1.00 . A A . 33 ASN N 1 1 16 10923 1 1 33 ASN ND2 N -8.263 13.263 13.321 1.00 . A A . 33 ASN ND2 1 1 16 10924 1 1 33 ASN O O -6.899 8.473 12.005 1.00 . A A . 33 ASN O 1 1 16 10925 1 1 33 ASN OD1 O -6.061 13.374 13.063 1.00 . A A . 33 ASN OD1 1 1 16 10926 1 1 34 CYS C C -4.717 6.693 10.563 1.00 . A A . 34 CYS C 1 1 16 10927 1 1 34 CYS CA C -5.734 7.466 9.663 1.00 . A A . 34 CYS CA 1 1 16 10928 1 1 34 CYS CB C -5.238 7.318 8.188 1.00 . A A . 34 CYS CB 1 1 16 10929 1 1 34 CYS H H -5.771 9.672 9.354 1.00 . A A . 34 CYS H 1 1 16 10930 1 1 34 CYS HA H -6.734 7.063 9.770 1.00 . A A . 34 CYS HA 1 1 16 10931 1 1 34 CYS HB2 H -4.412 7.998 8.041 1.00 . A A . 34 CYS HB2 1 1 16 10932 1 1 34 CYS HB3 H -4.846 6.302 7.995 1.00 . A A . 34 CYS HB3 1 1 16 10933 1 1 34 CYS N N -5.861 8.901 10.029 1.00 . A A . 34 CYS N 1 1 16 10934 1 1 34 CYS O O -3.980 7.283 11.358 1.00 . A A . 34 CYS O 1 1 16 10935 1 1 34 CYS SG S -6.507 7.511 6.937 1.00 . A A . 34 CYS SG 1 1 16 10936 1 1 35 GLU C C -3.017 3.549 9.899 1.00 . A A . 35 GLU C 1 1 16 10937 1 1 35 GLU CA C -3.607 4.502 11.004 1.00 . A A . 35 GLU CA 1 1 16 10938 1 1 35 GLU CB C -4.103 3.624 12.191 1.00 . A A . 35 GLU CB 1 1 16 10939 1 1 35 GLU CD C -5.546 3.184 14.253 1.00 . A A . 35 GLU CD 1 1 16 10940 1 1 35 GLU CG C -5.178 4.175 13.148 1.00 . A A . 35 GLU CG 1 1 16 10941 1 1 35 GLU H H -5.361 5.025 9.676 1.00 . A A . 35 GLU H 1 1 16 10942 1 1 35 GLU HA H -2.803 5.167 11.373 1.00 . A A . 35 GLU HA 1 1 16 10943 1 1 35 GLU HB2 H -4.350 2.614 11.823 1.00 . A A . 35 GLU HB2 1 1 16 10944 1 1 35 GLU HB3 H -3.210 3.426 12.810 1.00 . A A . 35 GLU HB3 1 1 16 10945 1 1 35 GLU HE2 H -4.888 2.587 15.985 1.00 . A A . 35 GLU HE2 1 1 16 10946 1 1 35 GLU HG2 H -4.833 5.129 13.593 1.00 . A A . 35 GLU HG2 1 1 16 10947 1 1 35 GLU HG3 H -6.089 4.421 12.576 1.00 . A A . 35 GLU HG3 1 1 16 10948 1 1 35 GLU N N -4.690 5.348 10.399 1.00 . A A . 35 GLU N 1 1 16 10949 1 1 35 GLU O O -3.536 3.417 8.785 1.00 . A A . 35 GLU O 1 1 16 10950 1 1 35 GLU OE1 O -6.531 2.447 14.201 1.00 . A A . 35 GLU OE1 1 1 16 10951 1 1 35 GLU OE2 O -4.653 3.211 15.294 1.00 . A A . 35 GLU OE2 1 1 16 10952 1 1 36 CYS C C -1.698 0.694 9.049 1.00 . A A . 36 CYS C 1 1 16 10953 1 1 36 CYS CA C -1.063 2.103 9.271 1.00 . A A . 36 CYS CA 1 1 16 10954 1 1 36 CYS CB C 0.413 1.894 9.792 1.00 . A A . 36 CYS CB 1 1 16 10955 1 1 36 CYS H H -1.712 2.975 11.246 1.00 . A A . 36 CYS H 1 1 16 10956 1 1 36 CYS HA H -1.037 2.668 8.303 1.00 . A A . 36 CYS HA 1 1 16 10957 1 1 36 CYS HB2 H 0.907 2.771 10.257 1.00 . A A . 36 CYS HB2 1 1 16 10958 1 1 36 CYS HB3 H 0.436 1.133 10.585 1.00 . A A . 36 CYS HB3 1 1 16 10959 1 1 36 CYS N N -1.897 2.879 10.241 1.00 . A A . 36 CYS N 1 1 16 10960 1 1 36 CYS O O -2.321 0.120 9.950 1.00 . A A . 36 CYS O 1 1 16 10961 1 1 36 CYS SG S 1.358 1.365 8.369 1.00 . A A . 36 CYS SG 1 1 16 10962 1 1 37 THR C C -0.733 -2.248 8.002 1.00 . A A . 37 THR C 1 1 16 10963 1 1 37 THR CA C -1.902 -1.290 7.568 1.00 . A A . 37 THR CA 1 1 16 10964 1 1 37 THR CB C -2.208 -1.522 6.055 1.00 . A A . 37 THR CB 1 1 16 10965 1 1 37 THR CG2 C -3.439 -0.724 5.593 1.00 . A A . 37 THR CG2 1 1 16 10966 1 1 37 THR H H -1.004 0.695 7.151 1.00 . A A . 37 THR H 1 1 16 10967 1 1 37 THR HA H -2.829 -1.532 8.122 1.00 . A A . 37 THR HA 1 1 16 10968 1 1 37 THR HB H -2.404 -2.602 5.913 1.00 . A A . 37 THR HB 1 1 16 10969 1 1 37 THR HG1 H -0.994 -0.181 5.391 1.00 . A A . 37 THR HG1 1 1 16 10970 1 1 37 THR HG21 H -4.341 -0.995 6.174 1.00 . A A . 37 THR HG21 1 1 16 10971 1 1 37 THR HG22 H -3.296 0.367 5.697 1.00 . A A . 37 THR HG22 1 1 16 10972 1 1 37 THR HG23 H -3.661 -0.924 4.531 1.00 . A A . 37 THR HG23 1 1 16 10973 1 1 37 THR N N -1.492 0.118 7.849 1.00 . A A . 37 THR N 1 1 16 10974 1 1 37 THR O O 0.375 -2.082 7.478 1.00 . A A . 37 THR O 1 1 16 10975 1 1 37 THR OG1 O -1.110 -1.121 5.236 1.00 . A A . 37 THR OG1 1 1 16 10976 1 1 38 PRO C C 0.733 -5.030 8.007 1.00 . A A . 38 PRO C 1 1 16 10977 1 1 38 PRO CA C 0.115 -4.283 9.240 1.00 . A A . 38 PRO CA 1 1 16 10978 1 1 38 PRO CB C -0.635 -5.237 10.203 1.00 . A A . 38 PRO CB 1 1 16 10979 1 1 38 PRO CD C -2.133 -3.400 9.729 1.00 . A A . 38 PRO CD 1 1 16 10980 1 1 38 PRO CG C -1.780 -4.424 10.802 1.00 . A A . 38 PRO CG 1 1 16 10981 1 1 38 PRO HA H 0.954 -3.788 9.753 1.00 . A A . 38 PRO HA 1 1 16 10982 1 1 38 PRO HB2 H -1.066 -6.111 9.679 1.00 . A A . 38 PRO HB2 1 1 16 10983 1 1 38 PRO HB3 H 0.033 -5.646 10.983 1.00 . A A . 38 PRO HB3 1 1 16 10984 1 1 38 PRO HD2 H -2.959 -3.750 9.099 1.00 . A A . 38 PRO HD2 1 1 16 10985 1 1 38 PRO HD3 H -2.450 -2.447 10.190 1.00 . A A . 38 PRO HD3 1 1 16 10986 1 1 38 PRO HG2 H -2.644 -5.056 11.079 1.00 . A A . 38 PRO HG2 1 1 16 10987 1 1 38 PRO HG3 H -1.459 -3.908 11.725 1.00 . A A . 38 PRO HG3 1 1 16 10988 1 1 38 PRO N N -0.916 -3.255 8.913 1.00 . A A . 38 PRO N 1 1 16 10989 1 1 38 PRO O O 1.941 -4.908 7.805 1.00 . A A . 38 PRO O 1 1 16 10990 1 1 39 ARG C C 1.448 -7.380 5.945 1.00 . A A . 39 ARG C 1 1 16 10991 1 1 39 ARG CA C 0.194 -6.430 5.908 1.00 . A A . 39 ARG CA 1 1 16 10992 1 1 39 ARG CB C 0.388 -5.370 4.772 1.00 . A A . 39 ARG CB 1 1 16 10993 1 1 39 ARG CD C 1.757 -3.591 3.474 1.00 . A A . 39 ARG CD 1 1 16 10994 1 1 39 ARG CG C 1.521 -4.312 4.815 1.00 . A A . 39 ARG CG 1 1 16 10995 1 1 39 ARG CZ C 2.931 -4.039 1.302 1.00 . A A . 39 ARG CZ 1 1 16 10996 1 1 39 ARG H H -1.068 -5.700 7.559 1.00 . A A . 39 ARG H 1 1 16 10997 1 1 39 ARG HA H -0.686 -7.061 5.670 1.00 . A A . 39 ARG HA 1 1 16 10998 1 1 39 ARG HB2 H 0.485 -5.938 3.826 1.00 . A A . 39 ARG HB2 1 1 16 10999 1 1 39 ARG HB3 H -0.569 -4.827 4.643 1.00 . A A . 39 ARG HB3 1 1 16 11000 1 1 39 ARG HD2 H 0.791 -3.329 3.002 1.00 . A A . 39 ARG HD2 1 1 16 11001 1 1 39 ARG HD3 H 2.266 -2.630 3.666 1.00 . A A . 39 ARG HD3 1 1 16 11002 1 1 39 ARG HG2 H 1.258 -3.550 5.568 1.00 . A A . 39 ARG HG2 1 1 16 11003 1 1 39 ARG HG3 H 2.469 -4.754 5.175 1.00 . A A . 39 ARG HG3 1 1 16 11004 1 1 39 ARG HH11 H 1.968 -2.273 1.294 1.00 . A A . 39 ARG HH11 1 1 16 11005 1 1 39 ARG HH12 H 2.884 -2.734 -0.227 1.00 . A A . 39 ARG HH12 1 1 16 11006 1 1 39 ARG HH21 H 3.962 -5.739 1.063 1.00 . A A . 39 ARG HH21 1 1 16 11007 1 1 39 ARG HH22 H 3.938 -4.565 -0.347 1.00 . A A . 39 ARG HH22 1 1 16 11008 1 1 39 ARG N N -0.106 -5.733 7.206 1.00 . A A . 39 ARG N 1 1 16 11009 1 1 39 ARG NE N 2.586 -4.406 2.550 1.00 . A A . 39 ARG NE 1 1 16 11010 1 1 39 ARG NH1 N 2.557 -2.896 0.731 1.00 . A A . 39 ARG NH1 1 1 16 11011 1 1 39 ARG NH2 N 3.687 -4.864 0.601 1.00 . A A . 39 ARG NH2 1 1 16 11012 1 1 39 ARG O O 2.542 -7.036 6.399 1.00 . A A . 39 ARG O 1 1 16 11013 1 1 40 LEU C C 2.861 -10.213 6.404 1.00 . A A . 40 LEU C 1 1 16 11014 1 1 40 LEU CA C 2.322 -9.608 5.065 1.00 . A A . 40 LEU CA 1 1 16 11015 1 1 40 LEU CB C 3.480 -8.964 4.222 1.00 . A A . 40 LEU CB 1 1 16 11016 1 1 40 LEU CD1 C 5.186 -9.120 2.342 1.00 . A A . 40 LEU CD1 1 1 16 11017 1 1 40 LEU CD2 C 5.262 -10.864 4.156 1.00 . A A . 40 LEU CD2 1 1 16 11018 1 1 40 LEU CG C 4.339 -9.925 3.350 1.00 . A A . 40 LEU CG 1 1 16 11019 1 1 40 LEU H H 0.300 -8.736 5.035 1.00 . A A . 40 LEU H 1 1 16 11020 1 1 40 LEU HA H 1.851 -10.416 4.472 1.00 . A A . 40 LEU HA 1 1 16 11021 1 1 40 LEU HB2 H 3.020 -8.234 3.526 1.00 . A A . 40 LEU HB2 1 1 16 11022 1 1 40 LEU HB3 H 4.142 -8.344 4.858 1.00 . A A . 40 LEU HB3 1 1 16 11023 1 1 40 LEU HD11 H 4.554 -8.487 1.691 1.00 . A A . 40 LEU HD11 1 1 16 11024 1 1 40 LEU HD12 H 5.908 -8.450 2.847 1.00 . A A . 40 LEU HD12 1 1 16 11025 1 1 40 LEU HD13 H 5.765 -9.781 1.671 1.00 . A A . 40 LEU HD13 1 1 16 11026 1 1 40 LEU HD21 H 5.938 -10.305 4.830 1.00 . A A . 40 LEU HD21 1 1 16 11027 1 1 40 LEU HD22 H 4.686 -11.571 4.778 1.00 . A A . 40 LEU HD22 1 1 16 11028 1 1 40 LEU HD23 H 5.895 -11.485 3.495 1.00 . A A . 40 LEU HD23 1 1 16 11029 1 1 40 LEU HG H 3.651 -10.558 2.759 1.00 . A A . 40 LEU HG 1 1 16 11030 1 1 40 LEU N N 1.260 -8.591 5.367 1.00 . A A . 40 LEU N 1 1 16 11031 1 1 40 LEU O O 3.663 -9.597 7.115 1.00 . A A . 40 LEU O 1 1 16 11032 1 1 41 ILE C C 3.869 -13.407 7.144 1.00 . A A . 41 ILE C 1 1 16 11033 1 1 41 ILE CA C 2.993 -12.285 7.801 1.00 . A A . 41 ILE CA 1 1 16 11034 1 1 41 ILE CB C 1.803 -12.831 8.697 1.00 . A A . 41 ILE CB 1 1 16 11035 1 1 41 ILE CD1 C 3.072 -12.730 10.989 1.00 . A A . 41 ILE CD1 1 1 16 11036 1 1 41 ILE CG1 C 2.335 -13.593 9.952 1.00 . A A . 41 ILE CG1 1 1 16 11037 1 1 41 ILE CG2 C 0.878 -13.824 7.932 1.00 . A A . 41 ILE CG2 1 1 16 11038 1 1 41 ILE H H 1.770 -11.846 6.016 1.00 . A A . 41 ILE H 1 1 16 11039 1 1 41 ILE HA H 3.651 -11.663 8.440 1.00 . A A . 41 ILE HA 1 1 16 11040 1 1 41 ILE HB H 1.185 -11.978 9.040 1.00 . A A . 41 ILE HB 1 1 16 11041 1 1 41 ILE HD11 H 2.449 -11.883 11.333 1.00 . A A . 41 ILE HD11 1 1 16 11042 1 1 41 ILE HD12 H 3.336 -13.325 11.882 1.00 . A A . 41 ILE HD12 1 1 16 11043 1 1 41 ILE HD13 H 4.015 -12.314 10.591 1.00 . A A . 41 ILE HD13 1 1 16 11044 1 1 41 ILE HG12 H 1.485 -14.064 10.482 1.00 . A A . 41 ILE HG12 1 1 16 11045 1 1 41 ILE HG13 H 2.985 -14.438 9.657 1.00 . A A . 41 ILE HG13 1 1 16 11046 1 1 41 ILE HG21 H 0.464 -13.379 7.009 1.00 . A A . 41 ILE HG21 1 1 16 11047 1 1 41 ILE HG22 H 1.394 -14.758 7.642 1.00 . A A . 41 ILE HG22 1 1 16 11048 1 1 41 ILE HG23 H 0.008 -14.120 8.549 1.00 . A A . 41 ILE HG23 1 1 16 11049 1 1 41 ILE N N 2.427 -11.453 6.699 1.00 . A A . 41 ILE N 1 1 16 11050 1 1 41 ILE O O 3.460 -14.061 6.175 1.00 . A A . 41 ILE O 1 1 16 11051 1 1 42 MET C C 5.620 -16.030 7.968 1.00 . A A . 42 MET C 1 1 16 11052 1 1 42 MET CA C 5.990 -14.704 7.236 1.00 . A A . 42 MET CA 1 1 16 11053 1 1 42 MET CB C 7.457 -14.280 7.530 1.00 . A A . 42 MET CB 1 1 16 11054 1 1 42 MET CE C 11.203 -15.767 6.444 1.00 . A A . 42 MET CE 1 1 16 11055 1 1 42 MET CG C 8.523 -15.195 6.900 1.00 . A A . 42 MET CG 1 1 16 11056 1 1 42 MET H H 5.301 -13.031 8.505 1.00 . A A . 42 MET H 1 1 16 11057 1 1 42 MET HA H 5.891 -14.840 6.138 1.00 . A A . 42 MET HA 1 1 16 11058 1 1 42 MET HB2 H 7.634 -13.257 7.146 1.00 . A A . 42 MET HB2 1 1 16 11059 1 1 42 MET HB3 H 7.634 -14.213 8.621 1.00 . A A . 42 MET HB3 1 1 16 11060 1 1 42 MET HE1 H 10.969 -16.813 6.716 1.00 . A A . 42 MET HE1 1 1 16 11061 1 1 42 MET HE2 H 11.053 -15.652 5.355 1.00 . A A . 42 MET HE2 1 1 16 11062 1 1 42 MET HE3 H 12.270 -15.587 6.664 1.00 . A A . 42 MET HE3 1 1 16 11063 1 1 42 MET HG2 H 8.403 -16.240 7.239 1.00 . A A . 42 MET HG2 1 1 16 11064 1 1 42 MET HG3 H 8.429 -15.202 5.798 1.00 . A A . 42 MET HG3 1 1 16 11065 1 1 42 MET N N 5.075 -13.631 7.704 1.00 . A A . 42 MET N 1 1 16 11066 1 1 42 MET O O 5.876 -16.188 9.167 1.00 . A A . 42 MET O 1 1 16 11067 1 1 42 MET SD S 10.166 -14.611 7.362 1.00 . A A . 42 MET SD 1 1 16 11068 1 1 43 GLU C C 5.578 -19.326 6.830 1.00 . A A . 43 GLU C 1 1 16 11069 1 1 43 GLU CA C 4.740 -18.346 7.694 1.00 . A A . 43 GLU CA 1 1 16 11070 1 1 43 GLU CB C 3.222 -18.642 7.581 1.00 . A A . 43 GLU CB 1 1 16 11071 1 1 43 GLU CD C 2.842 -20.201 9.618 1.00 . A A . 43 GLU CD 1 1 16 11072 1 1 43 GLU CG C 2.722 -20.012 8.101 1.00 . A A . 43 GLU CG 1 1 16 11073 1 1 43 GLU H H 4.860 -16.695 6.237 1.00 . A A . 43 GLU H 1 1 16 11074 1 1 43 GLU HA H 5.023 -18.448 8.763 1.00 . A A . 43 GLU HA 1 1 16 11075 1 1 43 GLU HB2 H 2.691 -17.864 8.151 1.00 . A A . 43 GLU HB2 1 1 16 11076 1 1 43 GLU HB3 H 2.887 -18.520 6.532 1.00 . A A . 43 GLU HB3 1 1 16 11077 1 1 43 GLU HE2 H 4.110 -20.876 10.931 1.00 . A A . 43 GLU HE2 1 1 16 11078 1 1 43 GLU HG2 H 1.657 -20.126 7.825 1.00 . A A . 43 GLU HG2 1 1 16 11079 1 1 43 GLU HG3 H 3.237 -20.836 7.574 1.00 . A A . 43 GLU HG3 1 1 16 11080 1 1 43 GLU N N 5.018 -16.967 7.214 1.00 . A A . 43 GLU N 1 1 16 11081 1 1 43 GLU O O 5.599 -19.268 5.595 1.00 . A A . 43 GLU O 1 1 16 11082 1 1 43 GLU OE1 O 1.960 -19.877 10.412 1.00 . A A . 43 GLU OE1 1 1 16 11083 1 1 43 GLU OE2 O 4.038 -20.764 9.980 1.00 . A A . 43 GLU OE2 1 1 16 11084 1 1 44 GLY C C 8.671 -20.523 6.899 1.00 . A A . 44 GLY C 1 1 16 11085 1 1 44 GLY CA C 7.262 -21.141 6.933 1.00 . A A . 44 GLY CA 1 1 16 11086 1 1 44 GLY H H 6.054 -20.185 8.540 1.00 . A A . 44 GLY H 1 1 16 11087 1 1 44 GLY HA2 H 7.271 -22.086 7.506 1.00 . A A . 44 GLY HA2 1 1 16 11088 1 1 44 GLY HA3 H 6.957 -21.441 5.911 1.00 . A A . 44 GLY HA3 1 1 16 11089 1 1 44 GLY N N 6.274 -20.221 7.538 1.00 . A A . 44 GLY N 1 1 16 11090 1 1 44 GLY O O 9.087 -19.994 5.864 1.00 . A A . 44 GLY O 1 1 16 11091 1 1 45 LEU C C 11.788 -21.130 7.872 1.00 . A A . 45 LEU C 1 1 16 11092 1 1 45 LEU CA C 10.746 -20.012 8.181 1.00 . A A . 45 LEU CA 1 1 16 11093 1 1 45 LEU CB C 10.900 -19.410 9.616 1.00 . A A . 45 LEU CB 1 1 16 11094 1 1 45 LEU CD1 C 8.734 -17.978 9.886 1.00 . A A . 45 LEU CD1 1 1 16 11095 1 1 45 LEU CD2 C 10.803 -17.418 11.201 1.00 . A A . 45 LEU CD2 1 1 16 11096 1 1 45 LEU CG C 10.277 -18.005 9.875 1.00 . A A . 45 LEU CG 1 1 16 11097 1 1 45 LEU H H 8.906 -21.059 8.818 1.00 . A A . 45 LEU H 1 1 16 11098 1 1 45 LEU HA H 10.911 -19.199 7.455 1.00 . A A . 45 LEU HA 1 1 16 11099 1 1 45 LEU HB2 H 10.550 -20.128 10.385 1.00 . A A . 45 LEU HB2 1 1 16 11100 1 1 45 LEU HB3 H 11.987 -19.319 9.811 1.00 . A A . 45 LEU HB3 1 1 16 11101 1 1 45 LEU HD11 H 8.309 -18.691 10.617 1.00 . A A . 45 LEU HD11 1 1 16 11102 1 1 45 LEU HD12 H 8.343 -16.975 10.140 1.00 . A A . 45 LEU HD12 1 1 16 11103 1 1 45 LEU HD13 H 8.309 -18.225 8.897 1.00 . A A . 45 LEU HD13 1 1 16 11104 1 1 45 LEU HD21 H 11.907 -17.349 11.207 1.00 . A A . 45 LEU HD21 1 1 16 11105 1 1 45 LEU HD22 H 10.424 -16.394 11.376 1.00 . A A . 45 LEU HD22 1 1 16 11106 1 1 45 LEU HD23 H 10.509 -18.031 12.074 1.00 . A A . 45 LEU HD23 1 1 16 11107 1 1 45 LEU HG H 10.616 -17.327 9.070 1.00 . A A . 45 LEU HG 1 1 16 11108 1 1 45 LEU N N 9.382 -20.593 8.038 1.00 . A A . 45 LEU N 1 1 16 11109 1 1 45 LEU O O 12.413 -21.086 6.808 1.00 . A A . 45 LEU O 1 1 16 11110 1 1 46 SER C C 11.575 -24.441 7.891 1.00 . A A . 46 SER C 1 1 16 11111 1 1 46 SER CA C 12.624 -23.416 8.424 1.00 . A A . 46 SER CA 1 1 16 11112 1 1 46 SER CB C 13.368 -23.914 9.690 1.00 . A A . 46 SER CB 1 1 16 11113 1 1 46 SER H H 11.322 -22.038 9.572 1.00 . A A . 46 SER H 1 1 16 11114 1 1 46 SER HA H 13.376 -23.269 7.631 1.00 . A A . 46 SER HA 1 1 16 11115 1 1 46 SER HB2 H 12.685 -24.025 10.554 1.00 . A A . 46 SER HB2 1 1 16 11116 1 1 46 SER HB3 H 13.796 -24.918 9.511 1.00 . A A . 46 SER HB3 1 1 16 11117 1 1 46 SER HG H 15.006 -22.993 9.273 1.00 . A A . 46 SER HG 1 1 16 11118 1 1 46 SER N N 11.927 -22.142 8.751 1.00 . A A . 46 SER N 1 1 16 11119 1 1 46 SER O O 11.582 -24.735 6.692 1.00 . A A . 46 SER O 1 1 16 11120 1 1 46 SER OG O 14.429 -23.031 10.039 1.00 . A A . 46 SER OG 1 1 16 11121 1 1 47 PHE C C 8.354 -25.411 9.370 1.00 . A A . 47 PHE C 1 1 16 11122 1 1 47 PHE CA C 9.468 -25.706 8.324 1.00 . A A . 47 PHE CA 1 1 16 11123 1 1 47 PHE CB C 9.804 -27.226 8.240 1.00 . A A . 47 PHE CB 1 1 16 11124 1 1 47 PHE CD1 C 8.513 -28.184 6.257 1.00 . A A . 47 PHE CD1 1 1 16 11125 1 1 47 PHE CD2 C 7.829 -28.824 8.484 1.00 . A A . 47 PHE CD2 1 1 16 11126 1 1 47 PHE CE1 C 7.494 -28.968 5.720 1.00 . A A . 47 PHE CE1 1 1 16 11127 1 1 47 PHE CE2 C 6.810 -29.607 7.945 1.00 . A A . 47 PHE CE2 1 1 16 11128 1 1 47 PHE CG C 8.687 -28.105 7.644 1.00 . A A . 47 PHE CG 1 1 16 11129 1 1 47 PHE CZ C 6.644 -29.678 6.564 1.00 . A A . 47 PHE CZ 1 1 16 11130 1 1 47 PHE H H 10.787 -24.584 9.706 1.00 . A A . 47 PHE H 1 1 16 11131 1 1 47 PHE HA H 9.141 -25.360 7.321 1.00 . A A . 47 PHE HA 1 1 16 11132 1 1 47 PHE HB2 H 10.714 -27.365 7.623 1.00 . A A . 47 PHE HB2 1 1 16 11133 1 1 47 PHE HB3 H 10.104 -27.608 9.236 1.00 . A A . 47 PHE HB3 1 1 16 11134 1 1 47 PHE HD1 H 9.162 -27.633 5.591 1.00 . A A . 47 PHE HD1 1 1 16 11135 1 1 47 PHE HD2 H 7.942 -28.775 9.558 1.00 . A A . 47 PHE HD2 1 1 16 11136 1 1 47 PHE HE1 H 7.363 -29.025 4.650 1.00 . A A . 47 PHE HE1 1 1 16 11137 1 1 47 PHE HE2 H 6.149 -30.158 8.598 1.00 . A A . 47 PHE HE2 1 1 16 11138 1 1 47 PHE HZ H 5.854 -30.286 6.147 1.00 . A A . 47 PHE HZ 1 1 16 11139 1 1 47 PHE N N 10.663 -24.936 8.751 1.00 . A A . 47 PHE N 1 1 16 11140 1 1 47 PHE O O 8.407 -25.897 10.506 1.00 . A A . 47 PHE O 1 1 16 11141 1 1 48 ALA C C 4.961 -24.054 8.958 1.00 . A A . 48 ALA C 1 1 16 11142 1 1 48 ALA CA C 6.211 -24.240 9.842 1.00 . A A . 48 ALA CA 1 1 16 11143 1 1 48 ALA CB C 6.534 -22.943 10.613 1.00 . A A . 48 ALA CB 1 1 16 11144 1 1 48 ALA H H 7.431 -24.264 8.004 1.00 . A A . 48 ALA H 1 1 16 11145 1 1 48 ALA HXT H 3.250 -24.920 8.626 1.00 . A A . 48 ALA HXT 1 1 16 11146 1 1 48 ALA HA H 6.013 -25.042 10.580 1.00 . A A . 48 ALA HA 1 1 16 11147 1 1 48 ALA HB1 H 6.740 -22.086 9.943 1.00 . A A . 48 ALA HB1 1 1 16 11148 1 1 48 ALA HB2 H 5.698 -22.647 11.273 1.00 . A A . 48 ALA HB2 1 1 16 11149 1 1 48 ALA HB3 H 7.420 -23.067 11.264 1.00 . A A . 48 ALA HB3 1 1 16 11150 1 1 48 ALA N N 7.351 -24.607 8.968 1.00 . A A . 48 ALA N 1 1 16 11151 1 1 48 ALA O O 4.814 -23.138 8.147 1.00 . A A . 48 ALA O 1 1 16 11152 1 1 48 ALA OXT O 4.028 -25.035 9.177 1.00 . A A . 48 ALA OXT 1 1 17 11153 1 1 1 GLU C C 8.287 12.866 5.961 1.00 . A A . 1 GLU C 1 1 17 11154 1 1 1 GLU CA C 7.739 12.057 4.748 1.00 . A A . 1 GLU CA 1 1 17 11155 1 1 1 GLU CB C 8.498 10.702 4.603 1.00 . A A . 1 GLU CB 1 1 17 11156 1 1 1 GLU CD C 10.659 9.322 4.414 1.00 . A A . 1 GLU CD 1 1 17 11157 1 1 1 GLU CG C 10.032 10.718 4.373 1.00 . A A . 1 GLU CG 1 1 17 11158 1 1 1 GLU H1 H 8.871 13.080 3.318 1.00 . A A . 1 GLU H1 1 1 17 11159 1 1 1 GLU H2 H 7.371 13.730 3.551 1.00 . A A . 1 GLU H2 1 1 17 11160 1 1 1 GLU HA H 6.659 11.865 4.902 1.00 . A A . 1 GLU HA 1 1 17 11161 1 1 1 GLU HB2 H 8.293 10.106 5.513 1.00 . A A . 1 GLU HB2 1 1 17 11162 1 1 1 GLU HB3 H 8.025 10.118 3.790 1.00 . A A . 1 GLU HB3 1 1 17 11163 1 1 1 GLU HE2 H 10.868 7.758 3.273 1.00 . A A . 1 GLU HE2 1 1 17 11164 1 1 1 GLU HG2 H 10.270 11.200 3.408 1.00 . A A . 1 GLU HG2 1 1 17 11165 1 1 1 GLU HG3 H 10.527 11.338 5.143 1.00 . A A . 1 GLU HG3 1 1 17 11166 1 1 1 GLU N N 7.889 12.846 3.502 1.00 . A A . 1 GLU N 1 1 17 11167 1 1 1 GLU O O 9.295 13.578 5.865 1.00 . A A . 1 GLU O 1 1 17 11168 1 1 1 GLU OE1 O 11.263 8.881 5.392 1.00 . A A . 1 GLU OE1 1 1 17 11169 1 1 1 GLU OE2 O 10.471 8.631 3.244 1.00 . A A . 1 GLU OE2 1 1 17 11170 1 1 2 ASP C C 8.765 11.952 9.192 1.00 . A A . 2 ASP C 1 1 17 11171 1 1 2 ASP CA C 8.170 13.175 8.432 1.00 . A A . 2 ASP CA 1 1 17 11172 1 1 2 ASP CB C 7.033 13.858 9.247 1.00 . A A . 2 ASP CB 1 1 17 11173 1 1 2 ASP CG C 6.491 15.166 8.651 1.00 . A A . 2 ASP CG 1 1 17 11174 1 1 2 ASP H H 6.827 12.059 7.076 1.00 . A A . 2 ASP H 1 1 17 11175 1 1 2 ASP HA H 8.967 13.934 8.288 1.00 . A A . 2 ASP HA 1 1 17 11176 1 1 2 ASP HB2 H 6.196 13.155 9.421 1.00 . A A . 2 ASP HB2 1 1 17 11177 1 1 2 ASP HB3 H 7.409 14.094 10.260 1.00 . A A . 2 ASP HB3 1 1 17 11178 1 1 2 ASP HD2 H 5.119 14.036 7.855 1.00 . A A . 2 ASP HD2 1 1 17 11179 1 1 2 ASP N N 7.639 12.684 7.128 1.00 . A A . 2 ASP N 1 1 17 11180 1 1 2 ASP O O 8.109 11.329 10.034 1.00 . A A . 2 ASP O 1 1 17 11181 1 1 2 ASP OD1 O 7.011 16.265 8.840 1.00 . A A . 2 ASP OD1 1 1 17 11182 1 1 2 ASP OD2 O 5.370 14.962 7.885 1.00 . A A . 2 ASP OD2 1 1 17 11183 1 1 3 ASN C C 10.132 8.996 9.123 1.00 . A A . 3 ASN C 1 1 17 11184 1 1 3 ASN CA C 10.803 10.404 9.341 1.00 . A A . 3 ASN CA 1 1 17 11185 1 1 3 ASN CB C 11.062 10.595 10.867 1.00 . A A . 3 ASN CB 1 1 17 11186 1 1 3 ASN CG C 11.880 11.832 11.297 1.00 . A A . 3 ASN CG 1 1 17 11187 1 1 3 ASN H H 10.363 12.117 8.019 1.00 . A A . 3 ASN H 1 1 17 11188 1 1 3 ASN HA H 11.728 10.366 8.756 1.00 . A A . 3 ASN HA 1 1 17 11189 1 1 3 ASN HB2 H 10.073 10.606 11.358 1.00 . A A . 3 ASN HB2 1 1 17 11190 1 1 3 ASN HB3 H 11.559 9.697 11.286 1.00 . A A . 3 ASN HB3 1 1 17 11191 1 1 3 ASN HD21 H 13.594 10.815 11.070 1.00 . A A . 3 ASN HD21 1 1 17 11192 1 1 3 ASN HD22 H 13.721 12.560 11.623 1.00 . A A . 3 ASN HD22 1 1 17 11193 1 1 3 ASN N N 10.027 11.605 8.839 1.00 . A A . 3 ASN N 1 1 17 11194 1 1 3 ASN ND2 N 13.200 11.727 11.328 1.00 . A A . 3 ASN ND2 1 1 17 11195 1 1 3 ASN O O 10.508 8.001 9.750 1.00 . A A . 3 ASN O 1 1 17 11196 1 1 3 ASN OD1 O 11.327 12.888 11.604 1.00 . A A . 3 ASN OD1 1 1 17 11197 1 1 4 CYS C C 7.517 7.188 9.024 1.00 . A A . 4 CYS C 1 1 17 11198 1 1 4 CYS CA C 8.327 7.776 7.803 1.00 . A A . 4 CYS CA 1 1 17 11199 1 1 4 CYS CB C 9.176 6.681 7.145 1.00 . A A . 4 CYS CB 1 1 17 11200 1 1 4 CYS H H 9.036 9.919 7.908 1.00 . A A . 4 CYS H 1 1 17 11201 1 1 4 CYS HA H 7.619 8.095 7.021 1.00 . A A . 4 CYS HA 1 1 17 11202 1 1 4 CYS HB2 H 8.373 6.002 6.936 1.00 . A A . 4 CYS HB2 1 1 17 11203 1 1 4 CYS HB3 H 9.526 6.922 6.131 1.00 . A A . 4 CYS HB3 1 1 17 11204 1 1 4 CYS N N 9.185 8.940 8.182 1.00 . A A . 4 CYS N 1 1 17 11205 1 1 4 CYS O O 7.709 7.562 10.187 1.00 . A A . 4 CYS O 1 1 17 11206 1 1 4 CYS SG S 10.319 5.654 8.092 1.00 . A A . 4 CYS SG 1 1 17 11207 1 1 5 ILE C C 6.171 4.106 9.695 1.00 . A A . 5 ILE C 1 1 17 11208 1 1 5 ILE CA C 5.740 5.583 9.783 1.00 . A A . 5 ILE CA 1 1 17 11209 1 1 5 ILE CB C 4.175 5.737 9.590 1.00 . A A . 5 ILE CB 1 1 17 11210 1 1 5 ILE CD1 C 2.381 7.508 9.140 1.00 . A A . 5 ILE CD1 1 1 17 11211 1 1 5 ILE CG1 C 3.819 7.225 9.484 1.00 . A A . 5 ILE CG1 1 1 17 11212 1 1 5 ILE CG2 C 3.377 5.073 10.767 1.00 . A A . 5 ILE CG2 1 1 17 11213 1 1 5 ILE H H 6.579 6.002 7.697 1.00 . A A . 5 ILE H 1 1 17 11214 1 1 5 ILE HA H 5.980 5.998 10.776 1.00 . A A . 5 ILE HA 1 1 17 11215 1 1 5 ILE HB H 3.814 5.264 8.683 1.00 . A A . 5 ILE HB 1 1 17 11216 1 1 5 ILE HD11 H 2.108 7.067 8.165 1.00 . A A . 5 ILE HD11 1 1 17 11217 1 1 5 ILE HD12 H 1.721 7.089 9.913 1.00 . A A . 5 ILE HD12 1 1 17 11218 1 1 5 ILE HD13 H 2.181 8.588 9.102 1.00 . A A . 5 ILE HD13 1 1 17 11219 1 1 5 ILE HG12 H 4.070 7.740 10.401 1.00 . A A . 5 ILE HG12 1 1 17 11220 1 1 5 ILE HG13 H 4.419 7.682 8.685 1.00 . A A . 5 ILE HG13 1 1 17 11221 1 1 5 ILE HG21 H 3.605 3.998 10.885 1.00 . A A . 5 ILE HG21 1 1 17 11222 1 1 5 ILE HG22 H 3.512 5.557 11.749 1.00 . A A . 5 ILE HG22 1 1 17 11223 1 1 5 ILE HG23 H 2.282 5.073 10.576 1.00 . A A . 5 ILE HG23 1 1 17 11224 1 1 5 ILE N N 6.562 6.270 8.711 1.00 . A A . 5 ILE N 1 1 17 11225 1 1 5 ILE O O 5.677 3.339 8.876 1.00 . A A . 5 ILE O 1 1 17 11226 1 1 6 ALA C C 6.661 1.140 11.007 1.00 . A A . 6 ALA C 1 1 17 11227 1 1 6 ALA CA C 7.622 2.247 10.406 1.00 . A A . 6 ALA CA 1 1 17 11228 1 1 6 ALA CB C 8.979 2.235 11.133 1.00 . A A . 6 ALA CB 1 1 17 11229 1 1 6 ALA H H 7.320 4.303 11.287 1.00 . A A . 6 ALA H 1 1 17 11230 1 1 6 ALA HA H 7.751 2.036 9.313 1.00 . A A . 6 ALA HA 1 1 17 11231 1 1 6 ALA HB1 H 9.678 2.983 10.713 1.00 . A A . 6 ALA HB1 1 1 17 11232 1 1 6 ALA HB2 H 8.874 2.446 12.215 1.00 . A A . 6 ALA HB2 1 1 17 11233 1 1 6 ALA HB3 H 9.475 1.252 11.038 1.00 . A A . 6 ALA HB3 1 1 17 11234 1 1 6 ALA N N 7.099 3.648 10.538 1.00 . A A . 6 ALA N 1 1 17 11235 1 1 6 ALA O O 7.087 0.022 11.313 1.00 . A A . 6 ALA O 1 1 17 11236 1 1 7 GLU C C 3.163 0.197 11.077 1.00 . A A . 7 GLU C 1 1 17 11237 1 1 7 GLU CA C 4.358 0.701 11.911 1.00 . A A . 7 GLU CA 1 1 17 11238 1 1 7 GLU CB C 3.868 1.640 13.064 1.00 . A A . 7 GLU CB 1 1 17 11239 1 1 7 GLU CD C 4.310 2.936 15.226 1.00 . A A . 7 GLU CD 1 1 17 11240 1 1 7 GLU CG C 4.892 1.989 14.169 1.00 . A A . 7 GLU CG 1 1 17 11241 1 1 7 GLU H H 5.321 2.506 11.005 1.00 . A A . 7 GLU H 1 1 17 11242 1 1 7 GLU HA H 4.775 -0.194 12.327 1.00 . A A . 7 GLU HA 1 1 17 11243 1 1 7 GLU HB2 H 3.467 2.572 12.629 1.00 . A A . 7 GLU HB2 1 1 17 11244 1 1 7 GLU HB3 H 2.997 1.177 13.568 1.00 . A A . 7 GLU HB3 1 1 17 11245 1 1 7 GLU HE2 H 3.813 2.932 17.108 1.00 . A A . 7 GLU HE2 1 1 17 11246 1 1 7 GLU HG2 H 5.264 1.061 14.643 1.00 . A A . 7 GLU HG2 1 1 17 11247 1 1 7 GLU HG3 H 5.782 2.474 13.729 1.00 . A A . 7 GLU HG3 1 1 17 11248 1 1 7 GLU N N 5.371 1.487 11.166 1.00 . A A . 7 GLU N 1 1 17 11249 1 1 7 GLU O O 2.847 0.667 9.987 1.00 . A A . 7 GLU O 1 1 17 11250 1 1 7 GLU OE1 O 4.003 4.105 14.992 1.00 . A A . 7 GLU OE1 1 1 17 11251 1 1 7 GLU OE2 O 4.179 2.334 16.451 1.00 . A A . 7 GLU OE2 1 1 17 11252 1 1 8 ASP C C 0.330 -0.762 12.540 1.00 . A A . 8 ASP C 1 1 17 11253 1 1 8 ASP CA C 1.174 -1.316 11.375 1.00 . A A . 8 ASP CA 1 1 17 11254 1 1 8 ASP CB C 1.003 -2.861 11.326 1.00 . A A . 8 ASP CB 1 1 17 11255 1 1 8 ASP CG C 1.905 -3.681 12.272 1.00 . A A . 8 ASP CG 1 1 17 11256 1 1 8 ASP H H 2.944 -1.036 12.619 1.00 . A A . 8 ASP H 1 1 17 11257 1 1 8 ASP HA H 0.856 -0.945 10.375 1.00 . A A . 8 ASP HA 1 1 17 11258 1 1 8 ASP HB2 H -0.062 -3.114 11.486 1.00 . A A . 8 ASP HB2 1 1 17 11259 1 1 8 ASP HB3 H 1.226 -3.125 10.287 1.00 . A A . 8 ASP HB3 1 1 17 11260 1 1 8 ASP HD2 H 3.103 -3.822 10.744 1.00 . A A . 8 ASP HD2 1 1 17 11261 1 1 8 ASP N N 2.507 -0.780 11.727 1.00 . A A . 8 ASP N 1 1 17 11262 1 1 8 ASP O O 0.613 -0.933 13.729 1.00 . A A . 8 ASP O 1 1 17 11263 1 1 8 ASP OD1 O 1.611 -3.917 13.444 1.00 . A A . 8 ASP OD1 1 1 17 11264 1 1 8 ASP OD2 O 3.056 -4.106 11.660 1.00 . A A . 8 ASP OD2 1 1 17 11265 1 1 9 TYR C C -0.834 2.007 13.651 1.00 . A A . 9 TYR C 1 1 17 11266 1 1 9 TYR CA C -1.604 0.798 12.969 1.00 . A A . 9 TYR CA 1 1 17 11267 1 1 9 TYR CB C -2.322 -0.121 14.025 1.00 . A A . 9 TYR CB 1 1 17 11268 1 1 9 TYR CD1 C -4.263 -1.153 12.711 1.00 . A A . 9 TYR CD1 1 1 17 11269 1 1 9 TYR CD2 C -2.476 -2.604 13.442 1.00 . A A . 9 TYR CD2 1 1 17 11270 1 1 9 TYR CE1 C -4.832 -2.214 12.009 1.00 . A A . 9 TYR CE1 1 1 17 11271 1 1 9 TYR CE2 C -3.036 -3.656 12.725 1.00 . A A . 9 TYR CE2 1 1 17 11272 1 1 9 TYR CG C -3.076 -1.338 13.430 1.00 . A A . 9 TYR CG 1 1 17 11273 1 1 9 TYR CZ C -4.217 -3.464 12.015 1.00 . A A . 9 TYR CZ 1 1 17 11274 1 1 9 TYR H H -0.811 -0.175 11.100 1.00 . A A . 9 TYR H 1 1 17 11275 1 1 9 TYR HA H -2.368 1.267 12.326 1.00 . A A . 9 TYR HA 1 1 17 11276 1 1 9 TYR HB2 H -1.615 -0.451 14.809 1.00 . A A . 9 TYR HB2 1 1 17 11277 1 1 9 TYR HB3 H -3.051 0.498 14.581 1.00 . A A . 9 TYR HB3 1 1 17 11278 1 1 9 TYR HD1 H -4.713 -0.173 12.646 1.00 . A A . 9 TYR HD1 1 1 17 11279 1 1 9 TYR HD2 H -1.530 -2.767 13.936 1.00 . A A . 9 TYR HD2 1 1 17 11280 1 1 9 TYR HE1 H -5.733 -2.057 11.434 1.00 . A A . 9 TYR HE1 1 1 17 11281 1 1 9 TYR HE2 H -2.529 -4.610 12.694 1.00 . A A . 9 TYR HE2 1 1 17 11282 1 1 9 TYR HH H -4.204 -5.278 11.411 1.00 . A A . 9 TYR HH 1 1 17 11283 1 1 9 TYR N N -0.705 -0.054 12.116 1.00 . A A . 9 TYR N 1 1 17 11284 1 1 9 TYR O O -1.220 2.461 14.733 1.00 . A A . 9 TYR O 1 1 17 11285 1 1 9 TYR OH O -4.756 -4.501 11.300 1.00 . A A . 9 TYR OH 1 1 17 11286 1 1 10 GLY C C 0.072 5.015 12.701 1.00 . A A . 10 GLY C 1 1 17 11287 1 1 10 GLY CA C 0.833 3.866 13.349 1.00 . A A . 10 GLY CA 1 1 17 11288 1 1 10 GLY H H 0.429 2.104 12.092 1.00 . A A . 10 GLY H 1 1 17 11289 1 1 10 GLY HA2 H 0.971 3.970 14.430 1.00 . A A . 10 GLY HA2 1 1 17 11290 1 1 10 GLY HA3 H 1.854 4.009 12.999 1.00 . A A . 10 GLY HA3 1 1 17 11291 1 1 10 GLY N N 0.195 2.580 12.972 1.00 . A A . 10 GLY N 1 1 17 11292 1 1 10 GLY O O -0.478 4.918 11.602 1.00 . A A . 10 GLY O 1 1 17 11293 1 1 11 LYS C C -0.223 8.013 11.842 1.00 . A A . 11 LYS C 1 1 17 11294 1 1 11 LYS CA C -0.824 7.270 13.076 1.00 . A A . 11 LYS CA 1 1 17 11295 1 1 11 LYS CB C -0.964 8.299 14.219 1.00 . A A . 11 LYS CB 1 1 17 11296 1 1 11 LYS CD C -2.668 6.988 15.763 1.00 . A A . 11 LYS CD 1 1 17 11297 1 1 11 LYS CE C -3.984 7.789 15.664 1.00 . A A . 11 LYS CE 1 1 17 11298 1 1 11 LYS CG C -1.346 7.785 15.631 1.00 . A A . 11 LYS CG 1 1 17 11299 1 1 11 LYS H H 0.725 5.995 14.199 1.00 . A A . 11 LYS H 1 1 17 11300 1 1 11 LYS HA H -1.843 6.877 12.858 1.00 . A A . 11 LYS HA 1 1 17 11301 1 1 11 LYS HB2 H -0.041 8.883 14.250 1.00 . A A . 11 LYS HB2 1 1 17 11302 1 1 11 LYS HB3 H -1.720 9.048 13.919 1.00 . A A . 11 LYS HB3 1 1 17 11303 1 1 11 LYS HD2 H -2.679 6.134 15.059 1.00 . A A . 11 LYS HD2 1 1 17 11304 1 1 11 LYS HD3 H -2.657 6.512 16.761 1.00 . A A . 11 LYS HD3 1 1 17 11305 1 1 11 LYS HE2 H -4.807 7.182 16.086 1.00 . A A . 11 LYS HE2 1 1 17 11306 1 1 11 LYS HE3 H -3.933 8.697 16.294 1.00 . A A . 11 LYS HE3 1 1 17 11307 1 1 11 LYS HG2 H -0.520 7.151 16.005 1.00 . A A . 11 LYS HG2 1 1 17 11308 1 1 11 LYS HG3 H -1.369 8.643 16.329 1.00 . A A . 11 LYS HG3 1 1 17 11309 1 1 11 LYS HZ1 H -5.257 8.655 14.287 1.00 . A A . 11 LYS HZ1 1 1 17 11310 1 1 11 LYS HZ2 H -4.500 7.322 13.719 1.00 . A A . 11 LYS HZ2 1 1 17 11311 1 1 11 LYS N N 0.060 6.119 13.427 1.00 . A A . 11 LYS N 1 1 17 11312 1 1 11 LYS NZ N -4.356 8.165 14.287 1.00 . A A . 11 LYS NZ 1 1 17 11313 1 1 11 LYS O O 0.931 8.450 11.802 1.00 . A A . 11 LYS O 1 1 17 11314 1 1 12 CYS C C -1.965 9.536 9.019 1.00 . A A . 12 CYS C 1 1 17 11315 1 1 12 CYS CA C -0.837 8.580 9.484 1.00 . A A . 12 CYS CA 1 1 17 11316 1 1 12 CYS CB C -0.758 7.370 8.514 1.00 . A A . 12 CYS CB 1 1 17 11317 1 1 12 CYS H H -2.017 7.809 11.231 1.00 . A A . 12 CYS H 1 1 17 11318 1 1 12 CYS HA H 0.136 9.115 9.462 1.00 . A A . 12 CYS HA 1 1 17 11319 1 1 12 CYS HB2 H -0.469 7.684 7.496 1.00 . A A . 12 CYS HB2 1 1 17 11320 1 1 12 CYS HB3 H 0.005 6.652 8.821 1.00 . A A . 12 CYS HB3 1 1 17 11321 1 1 12 CYS N N -1.110 8.099 10.861 1.00 . A A . 12 CYS N 1 1 17 11322 1 1 12 CYS O O -2.968 9.770 9.706 1.00 . A A . 12 CYS O 1 1 17 11323 1 1 12 CYS SG S -2.233 6.389 8.387 1.00 . A A . 12 CYS SG 1 1 17 11324 1 1 13 THR C C -2.754 10.552 5.593 1.00 . A A . 13 THR C 1 1 17 11325 1 1 13 THR CA C -2.882 10.837 7.123 1.00 . A A . 13 THR CA 1 1 17 11326 1 1 13 THR CB C -2.845 12.409 7.405 1.00 . A A . 13 THR CB 1 1 17 11327 1 1 13 THR CG2 C -2.017 12.897 8.616 1.00 . A A . 13 THR CG2 1 1 17 11328 1 1 13 THR H H -0.905 9.773 7.358 1.00 . A A . 13 THR H 1 1 17 11329 1 1 13 THR HA H -3.868 10.442 7.467 1.00 . A A . 13 THR HA 1 1 17 11330 1 1 13 THR HB H -3.906 12.703 7.504 1.00 . A A . 13 THR HB 1 1 17 11331 1 1 13 THR HG1 H -2.771 12.906 5.549 1.00 . A A . 13 THR HG1 1 1 17 11332 1 1 13 THR HG21 H -2.362 12.452 9.564 1.00 . A A . 13 THR HG21 1 1 17 11333 1 1 13 THR HG22 H -0.941 12.659 8.499 1.00 . A A . 13 THR HG22 1 1 17 11334 1 1 13 THR HG23 H -2.081 13.996 8.726 1.00 . A A . 13 THR HG23 1 1 17 11335 1 1 13 THR N N -1.784 10.085 7.807 1.00 . A A . 13 THR N 1 1 17 11336 1 1 13 THR O O -1.672 10.322 5.034 1.00 . A A . 13 THR O 1 1 17 11337 1 1 13 THR OG1 O -2.265 13.140 6.330 1.00 . A A . 13 THR OG1 1 1 17 11338 1 1 14 TRP C C -3.680 12.172 3.025 1.00 . A A . 14 TRP C 1 1 17 11339 1 1 14 TRP CA C -3.986 10.695 3.431 1.00 . A A . 14 TRP CA 1 1 17 11340 1 1 14 TRP CB C -5.379 10.222 2.929 1.00 . A A . 14 TRP CB 1 1 17 11341 1 1 14 TRP CD1 C -4.815 7.643 2.818 1.00 . A A . 14 TRP CD1 1 1 17 11342 1 1 14 TRP CD2 C -6.857 8.128 3.559 1.00 . A A . 14 TRP CD2 1 1 17 11343 1 1 14 TRP CE2 C -6.676 6.719 3.535 1.00 . A A . 14 TRP CE2 1 1 17 11344 1 1 14 TRP CE3 C -8.095 8.682 3.980 1.00 . A A . 14 TRP CE3 1 1 17 11345 1 1 14 TRP CG C -5.684 8.721 3.116 1.00 . A A . 14 TRP CG 1 1 17 11346 1 1 14 TRP CH2 C -8.936 6.424 4.344 1.00 . A A . 14 TRP CH2 1 1 17 11347 1 1 14 TRP CZ2 C -7.729 5.860 3.930 1.00 . A A . 14 TRP CZ2 1 1 17 11348 1 1 14 TRP CZ3 C -9.117 7.813 4.367 1.00 . A A . 14 TRP CZ3 1 1 17 11349 1 1 14 TRP H H -4.702 10.906 5.541 1.00 . A A . 14 TRP H 1 1 17 11350 1 1 14 TRP HA H -3.223 10.014 3.001 1.00 . A A . 14 TRP HA 1 1 17 11351 1 1 14 TRP HB2 H -6.176 10.834 3.394 1.00 . A A . 14 TRP HB2 1 1 17 11352 1 1 14 TRP HB3 H -5.461 10.438 1.847 1.00 . A A . 14 TRP HB3 1 1 17 11353 1 1 14 TRP HD1 H -3.812 7.753 2.431 1.00 . A A . 14 TRP HD1 1 1 17 11354 1 1 14 TRP HE1 H -5.004 5.464 2.949 1.00 . A A . 14 TRP HE1 1 1 17 11355 1 1 14 TRP HE3 H -8.250 9.751 4.006 1.00 . A A . 14 TRP HE3 1 1 17 11356 1 1 14 TRP HH2 H -9.745 5.778 4.653 1.00 . A A . 14 TRP HH2 1 1 17 11357 1 1 14 TRP HZ2 H -7.606 4.787 3.910 1.00 . A A . 14 TRP HZ2 1 1 17 11358 1 1 14 TRP HZ3 H -10.062 8.220 4.695 1.00 . A A . 14 TRP HZ3 1 1 17 11359 1 1 14 TRP N N -3.914 10.676 4.923 1.00 . A A . 14 TRP N 1 1 17 11360 1 1 14 TRP NE1 N -5.408 6.398 3.085 1.00 . A A . 14 TRP NE1 1 1 17 11361 1 1 14 TRP O O -4.508 13.078 3.169 1.00 . A A . 14 TRP O 1 1 17 11362 1 1 15 GLY C C -0.987 14.059 3.650 1.00 . A A . 15 GLY C 1 1 17 11363 1 1 15 GLY CA C -1.822 13.715 2.386 1.00 . A A . 15 GLY CA 1 1 17 11364 1 1 15 GLY H H -1.863 11.520 2.518 1.00 . A A . 15 GLY H 1 1 17 11365 1 1 15 GLY HA2 H -1.178 13.705 1.487 1.00 . A A . 15 GLY HA2 1 1 17 11366 1 1 15 GLY HA3 H -2.584 14.494 2.202 1.00 . A A . 15 GLY HA3 1 1 17 11367 1 1 15 GLY N N -2.430 12.373 2.577 1.00 . A A . 15 GLY N 1 1 17 11368 1 1 15 GLY O O -1.311 14.991 4.390 1.00 . A A . 15 GLY O 1 1 17 11369 1 1 16 GLY C C 2.018 12.253 4.991 1.00 . A A . 16 GLY C 1 1 17 11370 1 1 16 GLY CA C 0.850 13.238 5.132 1.00 . A A . 16 GLY CA 1 1 17 11371 1 1 16 GLY H H 0.188 12.537 3.161 1.00 . A A . 16 GLY H 1 1 17 11372 1 1 16 GLY HA2 H 1.207 14.204 5.512 1.00 . A A . 16 GLY HA2 1 1 17 11373 1 1 16 GLY HA3 H 0.170 12.883 5.930 1.00 . A A . 16 GLY HA3 1 1 17 11374 1 1 16 GLY N N 0.066 13.259 3.878 1.00 . A A . 16 GLY N 1 1 17 11375 1 1 16 GLY O O 2.535 11.973 3.901 1.00 . A A . 16 GLY O 1 1 17 11376 1 1 17 THR C C 2.463 9.276 6.048 1.00 . A A . 17 THR C 1 1 17 11377 1 1 17 THR CA C 3.354 10.557 6.195 1.00 . A A . 17 THR CA 1 1 17 11378 1 1 17 THR CB C 4.195 10.450 7.528 1.00 . A A . 17 THR CB 1 1 17 11379 1 1 17 THR CG2 C 5.549 9.748 7.290 1.00 . A A . 17 THR CG2 1 1 17 11380 1 1 17 THR H H 1.960 12.184 6.945 1.00 . A A . 17 THR H 1 1 17 11381 1 1 17 THR HA H 4.068 10.657 5.348 1.00 . A A . 17 THR HA 1 1 17 11382 1 1 17 THR HB H 3.655 9.833 8.279 1.00 . A A . 17 THR HB 1 1 17 11383 1 1 17 THR HG1 H 3.637 12.156 8.221 1.00 . A A . 17 THR HG1 1 1 17 11384 1 1 17 THR HG21 H 6.196 10.255 6.556 1.00 . A A . 17 THR HG21 1 1 17 11385 1 1 17 THR HG22 H 6.139 9.663 8.224 1.00 . A A . 17 THR HG22 1 1 17 11386 1 1 17 THR HG23 H 5.430 8.713 6.923 1.00 . A A . 17 THR HG23 1 1 17 11387 1 1 17 THR N N 2.407 11.713 6.150 1.00 . A A . 17 THR N 1 1 17 11388 1 1 17 THR O O 1.378 9.134 6.632 1.00 . A A . 17 THR O 1 1 17 11389 1 1 17 THR OG1 O 4.486 11.746 8.043 1.00 . A A . 17 THR OG1 1 1 17 11390 1 1 18 LYS C C 3.681 6.078 5.630 1.00 . A A . 18 LYS C 1 1 17 11391 1 1 18 LYS CA C 2.519 6.961 5.111 1.00 . A A . 18 LYS CA 1 1 17 11392 1 1 18 LYS CB C 2.101 6.615 3.651 1.00 . A A . 18 LYS CB 1 1 17 11393 1 1 18 LYS CD C 1.600 8.786 2.250 1.00 . A A . 18 LYS CD 1 1 17 11394 1 1 18 LYS CE C 0.475 9.648 1.646 1.00 . A A . 18 LYS CE 1 1 17 11395 1 1 18 LYS CG C 1.058 7.515 2.938 1.00 . A A . 18 LYS CG 1 1 17 11396 1 1 18 LYS H H 3.956 8.617 4.953 1.00 . A A . 18 LYS H 1 1 17 11397 1 1 18 LYS HA H 1.636 6.736 5.731 1.00 . A A . 18 LYS HA 1 1 17 11398 1 1 18 LYS HB2 H 2.990 6.384 3.046 1.00 . A A . 18 LYS HB2 1 1 17 11399 1 1 18 LYS HB3 H 1.615 5.622 3.707 1.00 . A A . 18 LYS HB3 1 1 17 11400 1 1 18 LYS HD2 H 2.171 9.398 2.971 1.00 . A A . 18 LYS HD2 1 1 17 11401 1 1 18 LYS HD3 H 2.323 8.497 1.464 1.00 . A A . 18 LYS HD3 1 1 17 11402 1 1 18 LYS HE2 H -0.087 9.074 0.887 1.00 . A A . 18 LYS HE2 1 1 17 11403 1 1 18 LYS HE3 H -0.257 9.930 2.427 1.00 . A A . 18 LYS HE3 1 1 17 11404 1 1 18 LYS HG2 H 0.545 6.905 2.170 1.00 . A A . 18 LYS HG2 1 1 17 11405 1 1 18 LYS HG3 H 0.265 7.785 3.661 1.00 . A A . 18 LYS HG3 1 1 17 11406 1 1 18 LYS HZ1 H 0.241 11.414 0.602 1.00 . A A . 18 LYS HZ1 1 1 17 11407 1 1 18 LYS HZ2 H 1.638 10.637 0.256 1.00 . A A . 18 LYS HZ2 1 1 17 11408 1 1 18 LYS N N 3.009 8.358 5.246 1.00 . A A . 18 LYS N 1 1 17 11409 1 1 18 LYS NZ N 1.004 10.876 1.027 1.00 . A A . 18 LYS NZ 1 1 17 11410 1 1 18 LYS O O 4.748 6.519 6.101 1.00 . A A . 18 LYS O 1 1 17 11411 1 1 19 CYS C C 5.602 3.569 5.378 1.00 . A A . 19 CYS C 1 1 17 11412 1 1 19 CYS CA C 4.361 3.838 6.282 1.00 . A A . 19 CYS CA 1 1 17 11413 1 1 19 CYS CB C 3.609 2.579 6.747 1.00 . A A . 19 CYS CB 1 1 17 11414 1 1 19 CYS H H 2.568 4.586 5.050 1.00 . A A . 19 CYS H 1 1 17 11415 1 1 19 CYS HA H 4.645 4.377 7.211 1.00 . A A . 19 CYS HA 1 1 17 11416 1 1 19 CYS HB2 H 2.829 2.274 6.027 1.00 . A A . 19 CYS HB2 1 1 17 11417 1 1 19 CYS HB3 H 4.296 1.713 6.854 1.00 . A A . 19 CYS HB3 1 1 17 11418 1 1 19 CYS N N 3.434 4.767 5.588 1.00 . A A . 19 CYS N 1 1 17 11419 1 1 19 CYS O O 5.625 3.556 4.144 1.00 . A A . 19 CYS O 1 1 17 11420 1 1 19 CYS SG S 2.901 3.011 8.346 1.00 . A A . 19 CYS SG 1 1 17 11421 1 1 20 CYS C C 8.573 2.695 4.663 1.00 . A A . 20 CYS C 1 1 17 11422 1 1 20 CYS CA C 8.091 3.568 5.857 1.00 . A A . 20 CYS CA 1 1 17 11423 1 1 20 CYS CB C 8.880 3.150 7.117 1.00 . A A . 20 CYS CB 1 1 17 11424 1 1 20 CYS H H 6.386 3.511 7.189 1.00 . A A . 20 CYS H 1 1 17 11425 1 1 20 CYS HA H 8.197 4.638 5.722 1.00 . A A . 20 CYS HA 1 1 17 11426 1 1 20 CYS HB2 H 8.389 3.529 8.016 1.00 . A A . 20 CYS HB2 1 1 17 11427 1 1 20 CYS HB3 H 8.970 2.054 7.245 1.00 . A A . 20 CYS HB3 1 1 17 11428 1 1 20 CYS N N 6.660 3.486 6.200 1.00 . A A . 20 CYS N 1 1 17 11429 1 1 20 CYS O O 9.257 3.229 3.785 1.00 . A A . 20 CYS O 1 1 17 11430 1 1 20 CYS SG S 10.507 3.923 7.066 1.00 . A A . 20 CYS SG 1 1 17 11431 1 1 21 ARG C C 7.739 0.304 2.367 1.00 . A A . 21 ARG C 1 1 17 11432 1 1 21 ARG CA C 8.721 0.439 3.582 1.00 . A A . 21 ARG CA 1 1 17 11433 1 1 21 ARG CB C 8.954 -0.911 4.330 1.00 . A A . 21 ARG CB 1 1 17 11434 1 1 21 ARG CD C 10.049 -3.231 4.389 1.00 . A A . 21 ARG CD 1 1 17 11435 1 1 21 ARG CG C 9.868 -1.919 3.598 1.00 . A A . 21 ARG CG 1 1 17 11436 1 1 21 ARG CZ C 12.166 -4.429 3.677 1.00 . A A . 21 ARG CZ 1 1 17 11437 1 1 21 ARG H H 7.565 1.179 5.365 1.00 . A A . 21 ARG H 1 1 17 11438 1 1 21 ARG HA H 9.649 0.833 3.143 1.00 . A A . 21 ARG HA 1 1 17 11439 1 1 21 ARG HB2 H 9.426 -0.729 5.318 1.00 . A A . 21 ARG HB2 1 1 17 11440 1 1 21 ARG HB3 H 7.981 -1.386 4.563 1.00 . A A . 21 ARG HB3 1 1 17 11441 1 1 21 ARG HD2 H 10.476 -3.029 5.390 1.00 . A A . 21 ARG HD2 1 1 17 11442 1 1 21 ARG HD3 H 9.063 -3.697 4.574 1.00 . A A . 21 ARG HD3 1 1 17 11443 1 1 21 ARG HG2 H 9.460 -2.151 2.597 1.00 . A A . 21 ARG HG2 1 1 17 11444 1 1 21 ARG HG3 H 10.855 -1.452 3.418 1.00 . A A . 21 ARG HG3 1 1 17 11445 1 1 21 ARG HH11 H 12.592 -3.021 5.048 1.00 . A A . 21 ARG HH11 1 1 17 11446 1 1 21 ARG HH12 H 13.994 -4.014 4.403 1.00 . A A . 21 ARG HH12 1 1 17 11447 1 1 21 ARG HH21 H 11.987 -5.881 2.310 1.00 . A A . 21 ARG HH21 1 1 17 11448 1 1 21 ARG HH22 H 13.671 -5.532 2.951 1.00 . A A . 21 ARG HH22 1 1 17 11449 1 1 21 ARG N N 8.253 1.389 4.645 1.00 . A A . 21 ARG N 1 1 17 11450 1 1 21 ARG NE N 10.910 -4.206 3.644 1.00 . A A . 21 ARG NE 1 1 17 11451 1 1 21 ARG NH1 N 13.003 -3.752 4.457 1.00 . A A . 21 ARG NH1 1 1 17 11452 1 1 21 ARG NH2 N 12.658 -5.376 2.900 1.00 . A A . 21 ARG NH2 1 1 17 11453 1 1 21 ARG O O 7.576 -0.756 1.754 1.00 . A A . 21 ARG O 1 1 17 11454 1 1 22 GLY C C 4.754 0.720 1.387 1.00 . A A . 22 GLY C 1 1 17 11455 1 1 22 GLY CA C 6.017 1.515 1.024 1.00 . A A . 22 GLY CA 1 1 17 11456 1 1 22 GLY H H 7.292 2.090 2.803 1.00 . A A . 22 GLY H 1 1 17 11457 1 1 22 GLY HA2 H 5.762 2.580 0.863 1.00 . A A . 22 GLY HA2 1 1 17 11458 1 1 22 GLY HA3 H 6.385 1.164 0.058 1.00 . A A . 22 GLY HA3 1 1 17 11459 1 1 22 GLY N N 7.103 1.429 2.034 1.00 . A A . 22 GLY N 1 1 17 11460 1 1 22 GLY O O 4.381 -0.245 0.715 1.00 . A A . 22 GLY O 1 1 17 11461 1 1 23 ARG C C 1.805 1.366 3.271 1.00 . A A . 23 ARG C 1 1 17 11462 1 1 23 ARG CA C 3.067 0.439 3.177 1.00 . A A . 23 ARG CA 1 1 17 11463 1 1 23 ARG CB C 3.585 0.039 4.581 1.00 . A A . 23 ARG CB 1 1 17 11464 1 1 23 ARG CD C 3.945 -2.524 4.854 1.00 . A A . 23 ARG CD 1 1 17 11465 1 1 23 ARG CG C 4.583 -1.131 4.685 1.00 . A A . 23 ARG CG 1 1 17 11466 1 1 23 ARG CZ C 4.028 -3.097 7.319 1.00 . A A . 23 ARG CZ 1 1 17 11467 1 1 23 ARG H H 4.727 1.875 2.958 1.00 . A A . 23 ARG H 1 1 17 11468 1 1 23 ARG HA H 2.812 -0.492 2.637 1.00 . A A . 23 ARG HA 1 1 17 11469 1 1 23 ARG HB2 H 4.144 0.898 4.965 1.00 . A A . 23 ARG HB2 1 1 17 11470 1 1 23 ARG HB3 H 2.749 -0.116 5.290 1.00 . A A . 23 ARG HB3 1 1 17 11471 1 1 23 ARG HD2 H 3.119 -2.661 4.133 1.00 . A A . 23 ARG HD2 1 1 17 11472 1 1 23 ARG HD3 H 4.685 -3.309 4.608 1.00 . A A . 23 ARG HD3 1 1 17 11473 1 1 23 ARG HG2 H 5.253 -1.120 3.808 1.00 . A A . 23 ARG HG2 1 1 17 11474 1 1 23 ARG HG3 H 5.259 -0.929 5.541 1.00 . A A . 23 ARG HG3 1 1 17 11475 1 1 23 ARG HH11 H 5.835 -3.352 6.477 1.00 . A A . 23 ARG HH11 1 1 17 11476 1 1 23 ARG HH12 H 5.693 -3.690 8.275 1.00 . A A . 23 ARG HH12 1 1 17 11477 1 1 23 ARG HH21 H 2.341 -2.904 8.378 1.00 . A A . 23 ARG HH21 1 1 17 11478 1 1 23 ARG HH22 H 3.844 -3.450 9.279 1.00 . A A . 23 ARG HH22 1 1 17 11479 1 1 23 ARG N N 4.153 1.166 2.485 1.00 . A A . 23 ARG N 1 1 17 11480 1 1 23 ARG NE N 3.433 -2.729 6.251 1.00 . A A . 23 ARG NE 1 1 17 11481 1 1 23 ARG NH1 N 5.319 -3.412 7.361 1.00 . A A . 23 ARG NH1 1 1 17 11482 1 1 23 ARG NH2 N 3.334 -3.158 8.438 1.00 . A A . 23 ARG NH2 1 1 17 11483 1 1 23 ARG O O 1.941 2.524 3.711 1.00 . A A . 23 ARG O 1 1 17 11484 1 1 24 PRO C C -1.282 2.073 4.209 1.00 . A A . 24 PRO C 1 1 17 11485 1 1 24 PRO CA C -0.632 1.780 2.821 1.00 . A A . 24 PRO CA 1 1 17 11486 1 1 24 PRO CB C -1.552 0.982 1.869 1.00 . A A . 24 PRO CB 1 1 17 11487 1 1 24 PRO CD C 0.309 -0.450 2.363 1.00 . A A . 24 PRO CD 1 1 17 11488 1 1 24 PRO CG C -1.197 -0.484 2.110 1.00 . A A . 24 PRO CG 1 1 17 11489 1 1 24 PRO HA H -0.383 2.763 2.371 1.00 . A A . 24 PRO HA 1 1 17 11490 1 1 24 PRO HB2 H -2.631 1.181 2.014 1.00 . A A . 24 PRO HB2 1 1 17 11491 1 1 24 PRO HB3 H -1.329 1.252 0.818 1.00 . A A . 24 PRO HB3 1 1 17 11492 1 1 24 PRO HD2 H 0.612 -1.238 3.079 1.00 . A A . 24 PRO HD2 1 1 17 11493 1 1 24 PRO HD3 H 0.862 -0.616 1.419 1.00 . A A . 24 PRO HD3 1 1 17 11494 1 1 24 PRO HG2 H -1.729 -0.865 3.002 1.00 . A A . 24 PRO HG2 1 1 17 11495 1 1 24 PRO HG3 H -1.475 -1.134 1.261 1.00 . A A . 24 PRO HG3 1 1 17 11496 1 1 24 PRO N N 0.571 0.911 2.885 1.00 . A A . 24 PRO N 1 1 17 11497 1 1 24 PRO O O -0.894 1.514 5.244 1.00 . A A . 24 PRO O 1 1 17 11498 1 1 25 CYS C C -4.574 3.125 5.136 1.00 . A A . 25 CYS C 1 1 17 11499 1 1 25 CYS CA C -3.054 3.354 5.397 1.00 . A A . 25 CYS CA 1 1 17 11500 1 1 25 CYS CB C -2.757 4.836 5.753 1.00 . A A . 25 CYS CB 1 1 17 11501 1 1 25 CYS H H -2.504 3.349 3.262 1.00 . A A . 25 CYS H 1 1 17 11502 1 1 25 CYS HA H -2.742 2.732 6.260 1.00 . A A . 25 CYS HA 1 1 17 11503 1 1 25 CYS HB2 H -2.237 5.352 4.933 1.00 . A A . 25 CYS HB2 1 1 17 11504 1 1 25 CYS HB3 H -3.687 5.384 5.977 1.00 . A A . 25 CYS HB3 1 1 17 11505 1 1 25 CYS N N -2.285 2.967 4.189 1.00 . A A . 25 CYS N 1 1 17 11506 1 1 25 CYS O O -5.113 3.302 4.038 1.00 . A A . 25 CYS O 1 1 17 11507 1 1 25 CYS SG S -1.723 4.867 7.207 1.00 . A A . 25 CYS SG 1 1 17 11508 1 1 26 ARG C C -7.075 3.301 7.658 1.00 . A A . 26 ARG C 1 1 17 11509 1 1 26 ARG CA C -6.710 2.580 6.335 1.00 . A A . 26 ARG CA 1 1 17 11510 1 1 26 ARG CB C -7.105 1.079 6.330 1.00 . A A . 26 ARG CB 1 1 17 11511 1 1 26 ARG CD C -8.932 -0.706 6.208 1.00 . A A . 26 ARG CD 1 1 17 11512 1 1 26 ARG CG C -8.622 0.800 6.286 1.00 . A A . 26 ARG CG 1 1 17 11513 1 1 26 ARG CZ C -10.962 -2.160 6.002 1.00 . A A . 26 ARG CZ 1 1 17 11514 1 1 26 ARG H H -4.684 2.783 7.094 1.00 . A A . 26 ARG H 1 1 17 11515 1 1 26 ARG HA H -7.204 3.079 5.477 1.00 . A A . 26 ARG HA 1 1 17 11516 1 1 26 ARG HB2 H -6.643 0.595 5.448 1.00 . A A . 26 ARG HB2 1 1 17 11517 1 1 26 ARG HB3 H -6.660 0.567 7.206 1.00 . A A . 26 ARG HB3 1 1 17 11518 1 1 26 ARG HD2 H -8.452 -1.142 5.311 1.00 . A A . 26 ARG HD2 1 1 17 11519 1 1 26 ARG HD3 H -8.496 -1.229 7.081 1.00 . A A . 26 ARG HD3 1 1 17 11520 1 1 26 ARG HG2 H -9.105 1.237 7.181 1.00 . A A . 26 ARG HG2 1 1 17 11521 1 1 26 ARG HG3 H -9.065 1.320 5.415 1.00 . A A . 26 ARG HG3 1 1 17 11522 1 1 26 ARG HH11 H -9.252 -3.214 5.873 1.00 . A A . 26 ARG HH11 1 1 17 11523 1 1 26 ARG HH12 H -10.825 -4.151 5.738 1.00 . A A . 26 ARG HH12 1 1 17 11524 1 1 26 ARG HH21 H -12.788 -1.343 6.095 1.00 . A A . 26 ARG HH21 1 1 17 11525 1 1 26 ARG HH22 H -12.691 -3.160 5.857 1.00 . A A . 26 ARG HH22 1 1 17 11526 1 1 26 ARG N N -5.238 2.723 6.229 1.00 . A A . 26 ARG N 1 1 17 11527 1 1 26 ARG NE N -10.394 -0.950 6.164 1.00 . A A . 26 ARG NE 1 1 17 11528 1 1 26 ARG NH1 N -10.275 -3.293 5.858 1.00 . A A . 26 ARG NH1 1 1 17 11529 1 1 26 ARG NH2 N -12.281 -2.228 5.983 1.00 . A A . 26 ARG NH2 1 1 17 11530 1 1 26 ARG O O -6.434 3.059 8.696 1.00 . A A . 26 ARG O 1 1 17 11531 1 1 27 CYS C C -8.869 4.347 10.086 1.00 . A A . 27 CYS C 1 1 17 11532 1 1 27 CYS CA C -8.265 5.084 8.841 1.00 . A A . 27 CYS CA 1 1 17 11533 1 1 27 CYS CB C -9.224 6.278 8.519 1.00 . A A . 27 CYS CB 1 1 17 11534 1 1 27 CYS H H -8.543 4.370 6.757 1.00 . A A . 27 CYS H 1 1 17 11535 1 1 27 CYS HA H -7.242 5.447 9.004 1.00 . A A . 27 CYS HA 1 1 17 11536 1 1 27 CYS HB2 H -10.047 5.941 7.906 1.00 . A A . 27 CYS HB2 1 1 17 11537 1 1 27 CYS HB3 H -9.722 6.681 9.421 1.00 . A A . 27 CYS HB3 1 1 17 11538 1 1 27 CYS N N -8.079 4.207 7.657 1.00 . A A . 27 CYS N 1 1 17 11539 1 1 27 CYS O O -9.398 3.232 10.044 1.00 . A A . 27 CYS O 1 1 17 11540 1 1 27 CYS SG S -8.516 7.743 7.747 1.00 . A A . 27 CYS SG 1 1 17 11541 1 1 28 SER C C -10.843 4.666 12.593 1.00 . A A . 28 SER C 1 1 17 11542 1 1 28 SER CA C -9.276 4.743 12.549 1.00 . A A . 28 SER CA 1 1 17 11543 1 1 28 SER CB C -8.653 5.847 13.469 1.00 . A A . 28 SER CB 1 1 17 11544 1 1 28 SER H H -8.353 6.014 11.018 1.00 . A A . 28 SER H 1 1 17 11545 1 1 28 SER HA H -8.929 3.760 12.904 1.00 . A A . 28 SER HA 1 1 17 11546 1 1 28 SER HB2 H -7.607 6.094 13.203 1.00 . A A . 28 SER HB2 1 1 17 11547 1 1 28 SER HB3 H -9.212 6.799 13.398 1.00 . A A . 28 SER HB3 1 1 17 11548 1 1 28 SER HG H -8.257 6.147 15.327 1.00 . A A . 28 SER HG 1 1 17 11549 1 1 28 SER N N -8.737 5.083 11.209 1.00 . A A . 28 SER N 1 1 17 11550 1 1 28 SER O O -11.551 4.542 11.587 1.00 . A A . 28 SER O 1 1 17 11551 1 1 28 SER OG O -8.642 5.423 14.827 1.00 . A A . 28 SER OG 1 1 17 11552 1 1 29 MET C C -13.740 5.588 13.682 1.00 . A A . 29 MET C 1 1 17 11553 1 1 29 MET CA C -12.781 4.463 14.181 1.00 . A A . 29 MET CA 1 1 17 11554 1 1 29 MET CB C -12.846 4.378 15.733 1.00 . A A . 29 MET CB 1 1 17 11555 1 1 29 MET CE C -14.779 5.232 18.494 1.00 . A A . 29 MET CE 1 1 17 11556 1 1 29 MET CG C -14.084 3.649 16.283 1.00 . A A . 29 MET CG 1 1 17 11557 1 1 29 MET H H -10.606 4.922 14.494 1.00 . A A . 29 MET H 1 1 17 11558 1 1 29 MET HA H -13.115 3.509 13.729 1.00 . A A . 29 MET HA 1 1 17 11559 1 1 29 MET HB2 H -11.946 3.878 16.123 1.00 . A A . 29 MET HB2 1 1 17 11560 1 1 29 MET HB3 H -12.790 5.388 16.182 1.00 . A A . 29 MET HB3 1 1 17 11561 1 1 29 MET HE1 H -15.806 5.308 18.092 1.00 . A A . 29 MET HE1 1 1 17 11562 1 1 29 MET HE2 H -14.831 5.367 19.590 1.00 . A A . 29 MET HE2 1 1 17 11563 1 1 29 MET HE3 H -14.181 6.062 18.076 1.00 . A A . 29 MET HE3 1 1 17 11564 1 1 29 MET HG2 H -15.020 4.122 15.933 1.00 . A A . 29 MET HG2 1 1 17 11565 1 1 29 MET HG3 H -14.107 2.605 15.920 1.00 . A A . 29 MET HG3 1 1 17 11566 1 1 29 MET N N -11.346 4.685 13.827 1.00 . A A . 29 MET N 1 1 17 11567 1 1 29 MET O O -14.844 5.294 13.215 1.00 . A A . 29 MET O 1 1 17 11568 1 1 29 MET SD S -14.044 3.632 18.090 1.00 . A A . 29 MET SD 1 1 17 11569 1 1 30 ILE C C -14.184 8.220 11.875 1.00 . A A . 30 ILE C 1 1 17 11570 1 1 30 ILE CA C -14.127 8.049 13.439 1.00 . A A . 30 ILE CA 1 1 17 11571 1 1 30 ILE CB C -13.516 9.264 14.264 1.00 . A A . 30 ILE CB 1 1 17 11572 1 1 30 ILE CD1 C -14.550 11.407 12.951 1.00 . A A . 30 ILE CD1 1 1 17 11573 1 1 30 ILE CG1 C -14.463 10.511 14.204 1.00 . A A . 30 ILE CG1 1 1 17 11574 1 1 30 ILE CG2 C -12.098 9.687 13.773 1.00 . A A . 30 ILE CG2 1 1 17 11575 1 1 30 ILE H H -12.317 6.872 14.095 1.00 . A A . 30 ILE H 1 1 17 11576 1 1 30 ILE HA H -15.173 7.886 13.749 1.00 . A A . 30 ILE HA 1 1 17 11577 1 1 30 ILE HB H -13.442 8.971 15.330 1.00 . A A . 30 ILE HB 1 1 17 11578 1 1 30 ILE HD11 H -13.575 11.858 12.693 1.00 . A A . 30 ILE HD11 1 1 17 11579 1 1 30 ILE HD12 H -14.914 10.869 12.061 1.00 . A A . 30 ILE HD12 1 1 17 11580 1 1 30 ILE HD13 H -15.250 12.245 13.120 1.00 . A A . 30 ILE HD13 1 1 17 11581 1 1 30 ILE HG12 H -15.489 10.190 14.467 1.00 . A A . 30 ILE HG12 1 1 17 11582 1 1 30 ILE HG13 H -14.179 11.176 15.042 1.00 . A A . 30 ILE HG13 1 1 17 11583 1 1 30 ILE HG21 H -11.379 8.848 13.813 1.00 . A A . 30 ILE HG21 1 1 17 11584 1 1 30 ILE HG22 H -12.089 10.072 12.739 1.00 . A A . 30 ILE HG22 1 1 17 11585 1 1 30 ILE HG23 H -11.676 10.486 14.411 1.00 . A A . 30 ILE HG23 1 1 17 11586 1 1 30 ILE N N -13.310 6.854 13.815 1.00 . A A . 30 ILE N 1 1 17 11587 1 1 30 ILE O O -15.282 8.439 11.354 1.00 . A A . 30 ILE O 1 1 17 11588 1 1 31 GLY C C -11.841 9.183 9.183 1.00 . A A . 31 GLY C 1 1 17 11589 1 1 31 GLY CA C -13.016 8.312 9.676 1.00 . A A . 31 GLY CA 1 1 17 11590 1 1 31 GLY H H -12.232 7.979 11.741 1.00 . A A . 31 GLY H 1 1 17 11591 1 1 31 GLY HA2 H -12.954 7.322 9.188 1.00 . A A . 31 GLY HA2 1 1 17 11592 1 1 31 GLY HA3 H -13.952 8.758 9.291 1.00 . A A . 31 GLY HA3 1 1 17 11593 1 1 31 GLY N N -13.062 8.089 11.146 1.00 . A A . 31 GLY N 1 1 17 11594 1 1 31 GLY O O -11.212 8.842 8.179 1.00 . A A . 31 GLY O 1 1 17 11595 1 1 32 THR C C -9.291 10.811 10.728 1.00 . A A . 32 THR C 1 1 17 11596 1 1 32 THR CA C -10.366 11.149 9.645 1.00 . A A . 32 THR CA 1 1 17 11597 1 1 32 THR CB C -10.725 12.671 9.717 1.00 . A A . 32 THR CB 1 1 17 11598 1 1 32 THR CG2 C -11.653 13.115 8.569 1.00 . A A . 32 THR CG2 1 1 17 11599 1 1 32 THR H H -12.105 10.346 10.754 1.00 . A A . 32 THR H 1 1 17 11600 1 1 32 THR HA H -9.938 10.944 8.641 1.00 . A A . 32 THR HA 1 1 17 11601 1 1 32 THR HB H -9.776 13.239 9.652 1.00 . A A . 32 THR HB 1 1 17 11602 1 1 32 THR HG1 H -12.208 12.471 10.932 1.00 . A A . 32 THR HG1 1 1 17 11603 1 1 32 THR HG21 H -11.204 12.907 7.580 1.00 . A A . 32 THR HG21 1 1 17 11604 1 1 32 THR HG22 H -12.634 12.605 8.602 1.00 . A A . 32 THR HG22 1 1 17 11605 1 1 32 THR HG23 H -11.850 14.201 8.614 1.00 . A A . 32 THR HG23 1 1 17 11606 1 1 32 THR N N -11.577 10.304 9.874 1.00 . A A . 32 THR N 1 1 17 11607 1 1 32 THR O O -9.584 10.220 11.774 1.00 . A A . 32 THR O 1 1 17 11608 1 1 32 THR OG1 O -11.392 12.976 10.942 1.00 . A A . 32 THR OG1 1 1 17 11609 1 1 33 ASN C C -6.566 9.341 11.113 1.00 . A A . 33 ASN C 1 1 17 11610 1 1 33 ASN CA C -6.804 10.870 11.251 1.00 . A A . 33 ASN CA 1 1 17 11611 1 1 33 ASN CB C -6.934 11.284 12.758 1.00 . A A . 33 ASN CB 1 1 17 11612 1 1 33 ASN CG C -6.858 12.800 13.016 1.00 . A A . 33 ASN CG 1 1 17 11613 1 1 33 ASN H H -7.898 11.531 9.482 1.00 . A A . 33 ASN H 1 1 17 11614 1 1 33 ASN HA H -5.938 11.405 10.813 1.00 . A A . 33 ASN HA 1 1 17 11615 1 1 33 ASN HB2 H -7.829 10.850 13.241 1.00 . A A . 33 ASN HB2 1 1 17 11616 1 1 33 ASN HB3 H -6.112 10.807 13.326 1.00 . A A . 33 ASN HB3 1 1 17 11617 1 1 33 ASN HD21 H -8.849 12.893 13.247 1.00 . A A . 33 ASN HD21 1 1 17 11618 1 1 33 ASN HD22 H -7.909 14.459 13.425 1.00 . A A . 33 ASN HD22 1 1 17 11619 1 1 33 ASN N N -8.025 11.202 10.445 1.00 . A A . 33 ASN N 1 1 17 11620 1 1 33 ASN ND2 N -7.988 13.451 13.252 1.00 . A A . 33 ASN ND2 1 1 17 11621 1 1 33 ASN O O -6.858 8.552 12.021 1.00 . A A . 33 ASN O 1 1 17 11622 1 1 33 ASN OD1 O -5.781 13.396 13.007 1.00 . A A . 33 ASN OD1 1 1 17 11623 1 1 34 CYS C C -4.795 6.782 10.471 1.00 . A A . 34 CYS C 1 1 17 11624 1 1 34 CYS CA C -5.887 7.498 9.610 1.00 . A A . 34 CYS CA 1 1 17 11625 1 1 34 CYS CB C -5.451 7.302 8.120 1.00 . A A . 34 CYS CB 1 1 17 11626 1 1 34 CYS H H -6.012 9.701 9.246 1.00 . A A . 34 CYS H 1 1 17 11627 1 1 34 CYS HA H -6.875 7.071 9.784 1.00 . A A . 34 CYS HA 1 1 17 11628 1 1 34 CYS HB2 H -4.650 7.999 7.914 1.00 . A A . 34 CYS HB2 1 1 17 11629 1 1 34 CYS HB3 H -5.039 6.289 7.950 1.00 . A A . 34 CYS HB3 1 1 17 11630 1 1 34 CYS N N -6.031 8.941 9.940 1.00 . A A . 34 CYS N 1 1 17 11631 1 1 34 CYS O O -3.979 7.416 11.145 1.00 . A A . 34 CYS O 1 1 17 11632 1 1 34 CYS SG S -6.768 7.401 6.907 1.00 . A A . 34 CYS SG 1 1 17 11633 1 1 35 GLU C C -3.131 3.696 9.788 1.00 . A A . 35 GLU C 1 1 17 11634 1 1 35 GLU CA C -3.663 4.616 10.944 1.00 . A A . 35 GLU CA 1 1 17 11635 1 1 35 GLU CB C -4.068 3.725 12.154 1.00 . A A . 35 GLU CB 1 1 17 11636 1 1 35 GLU CD C -5.252 3.344 14.386 1.00 . A A . 35 GLU CD 1 1 17 11637 1 1 35 GLU CG C -5.054 4.286 13.198 1.00 . A A . 35 GLU CG 1 1 17 11638 1 1 35 GLU H H -5.513 5.068 9.750 1.00 . A A . 35 GLU H 1 1 17 11639 1 1 35 GLU HA H -2.849 5.286 11.276 1.00 . A A . 35 GLU HA 1 1 17 11640 1 1 35 GLU HB2 H -4.358 2.721 11.801 1.00 . A A . 35 GLU HB2 1 1 17 11641 1 1 35 GLU HB3 H -3.127 3.516 12.696 1.00 . A A . 35 GLU HB3 1 1 17 11642 1 1 35 GLU HE2 H -4.360 2.851 16.044 1.00 . A A . 35 GLU HE2 1 1 17 11643 1 1 35 GLU HG2 H -4.699 5.270 13.559 1.00 . A A . 35 GLU HG2 1 1 17 11644 1 1 35 GLU HG3 H -6.031 4.474 12.720 1.00 . A A . 35 GLU HG3 1 1 17 11645 1 1 35 GLU N N -4.792 5.433 10.397 1.00 . A A . 35 GLU N 1 1 17 11646 1 1 35 GLU O O -3.696 3.595 8.695 1.00 . A A . 35 GLU O 1 1 17 11647 1 1 35 GLU OE1 O -6.216 2.588 14.498 1.00 . A A . 35 GLU OE1 1 1 17 11648 1 1 35 GLU OE2 O -4.233 3.444 15.299 1.00 . A A . 35 GLU OE2 1 1 17 11649 1 1 36 CYS C C -1.923 0.733 9.092 1.00 . A A . 36 CYS C 1 1 17 11650 1 1 36 CYS CA C -1.294 2.157 9.062 1.00 . A A . 36 CYS CA 1 1 17 11651 1 1 36 CYS CB C 0.242 2.170 9.395 1.00 . A A . 36 CYS CB 1 1 17 11652 1 1 36 CYS H H -1.774 3.081 11.055 1.00 . A A . 36 CYS H 1 1 17 11653 1 1 36 CYS HA H -1.418 2.581 8.036 1.00 . A A . 36 CYS HA 1 1 17 11654 1 1 36 CYS HB2 H 0.473 2.231 10.476 1.00 . A A . 36 CYS HB2 1 1 17 11655 1 1 36 CYS HB3 H 0.768 1.233 9.155 1.00 . A A . 36 CYS HB3 1 1 17 11656 1 1 36 CYS N N -2.005 3.015 10.057 1.00 . A A . 36 CYS N 1 1 17 11657 1 1 36 CYS O O -2.703 0.367 9.982 1.00 . A A . 36 CYS O 1 1 17 11658 1 1 36 CYS SG S 0.979 3.458 8.394 1.00 . A A . 36 CYS SG 1 1 17 11659 1 1 37 THR C C -1.112 -2.366 7.278 1.00 . A A . 37 THR C 1 1 17 11660 1 1 37 THR CA C -2.191 -1.440 7.946 1.00 . A A . 37 THR CA 1 1 17 11661 1 1 37 THR CB C -3.543 -1.430 7.157 1.00 . A A . 37 THR CB 1 1 17 11662 1 1 37 THR CG2 C -3.488 -0.882 5.714 1.00 . A A . 37 THR CG2 1 1 17 11663 1 1 37 THR H H -1.066 0.372 7.313 1.00 . A A . 37 THR H 1 1 17 11664 1 1 37 THR HA H -2.399 -1.820 8.962 1.00 . A A . 37 THR HA 1 1 17 11665 1 1 37 THR HB H -4.249 -0.860 7.782 1.00 . A A . 37 THR HB 1 1 17 11666 1 1 37 THR HG1 H -4.112 -3.089 7.947 1.00 . A A . 37 THR HG1 1 1 17 11667 1 1 37 THR HG21 H -2.796 -1.457 5.072 1.00 . A A . 37 THR HG21 1 1 17 11668 1 1 37 THR HG22 H -4.483 -0.922 5.235 1.00 . A A . 37 THR HG22 1 1 17 11669 1 1 37 THR HG23 H -3.169 0.175 5.689 1.00 . A A . 37 THR HG23 1 1 17 11670 1 1 37 THR N N -1.645 -0.058 8.045 1.00 . A A . 37 THR N 1 1 17 11671 1 1 37 THR O O -0.476 -1.958 6.296 1.00 . A A . 37 THR O 1 1 17 11672 1 1 37 THR OG1 O -4.031 -2.762 7.048 1.00 . A A . 37 THR OG1 1 1 17 11673 1 1 38 PRO C C -0.392 -5.224 5.845 1.00 . A A . 38 PRO C 1 1 17 11674 1 1 38 PRO CA C 0.086 -4.569 7.177 1.00 . A A . 38 PRO CA 1 1 17 11675 1 1 38 PRO CB C 0.289 -5.580 8.327 1.00 . A A . 38 PRO CB 1 1 17 11676 1 1 38 PRO CD C -1.599 -4.189 8.936 1.00 . A A . 38 PRO CD 1 1 17 11677 1 1 38 PRO CG C -1.017 -5.589 9.124 1.00 . A A . 38 PRO CG 1 1 17 11678 1 1 38 PRO HA H 1.038 -4.050 6.959 1.00 . A A . 38 PRO HA 1 1 17 11679 1 1 38 PRO HB2 H 0.567 -6.593 7.986 1.00 . A A . 38 PRO HB2 1 1 17 11680 1 1 38 PRO HB3 H 1.114 -5.238 8.980 1.00 . A A . 38 PRO HB3 1 1 17 11681 1 1 38 PRO HD2 H -2.688 -4.220 8.780 1.00 . A A . 38 PRO HD2 1 1 17 11682 1 1 38 PRO HD3 H -1.451 -3.543 9.817 1.00 . A A . 38 PRO HD3 1 1 17 11683 1 1 38 PRO HG2 H -1.704 -6.348 8.707 1.00 . A A . 38 PRO HG2 1 1 17 11684 1 1 38 PRO HG3 H -0.863 -5.844 10.189 1.00 . A A . 38 PRO HG3 1 1 17 11685 1 1 38 PRO N N -0.899 -3.628 7.761 1.00 . A A . 38 PRO N 1 1 17 11686 1 1 38 PRO O O -1.590 -5.256 5.538 1.00 . A A . 38 PRO O 1 1 17 11687 1 1 39 ARG C C -0.312 -7.910 4.214 1.00 . A A . 39 ARG C 1 1 17 11688 1 1 39 ARG CA C 0.269 -6.520 3.814 1.00 . A A . 39 ARG CA 1 1 17 11689 1 1 39 ARG CB C 1.559 -6.685 2.959 1.00 . A A . 39 ARG CB 1 1 17 11690 1 1 39 ARG CD C 1.424 -4.394 1.635 1.00 . A A . 39 ARG CD 1 1 17 11691 1 1 39 ARG CG C 2.260 -5.390 2.467 1.00 . A A . 39 ARG CG 1 1 17 11692 1 1 39 ARG CZ C 0.313 -4.277 -0.611 1.00 . A A . 39 ARG CZ 1 1 17 11693 1 1 39 ARG H H 1.523 -5.686 5.438 1.00 . A A . 39 ARG H 1 1 17 11694 1 1 39 ARG HA H -0.472 -5.955 3.212 1.00 . A A . 39 ARG HA 1 1 17 11695 1 1 39 ARG HB2 H 2.306 -7.282 3.518 1.00 . A A . 39 ARG HB2 1 1 17 11696 1 1 39 ARG HB3 H 1.320 -7.302 2.072 1.00 . A A . 39 ARG HB3 1 1 17 11697 1 1 39 ARG HD2 H 0.548 -4.049 2.218 1.00 . A A . 39 ARG HD2 1 1 17 11698 1 1 39 ARG HD3 H 2.033 -3.488 1.454 1.00 . A A . 39 ARG HD3 1 1 17 11699 1 1 39 ARG HG2 H 2.657 -4.855 3.348 1.00 . A A . 39 ARG HG2 1 1 17 11700 1 1 39 ARG HG3 H 3.162 -5.673 1.891 1.00 . A A . 39 ARG HG3 1 1 17 11701 1 1 39 ARG HH11 H 0.252 -2.517 0.363 1.00 . A A . 39 ARG HH11 1 1 17 11702 1 1 39 ARG HH12 H -0.532 -2.584 -1.295 1.00 . A A . 39 ARG HH12 1 1 17 11703 1 1 39 ARG HH21 H 0.241 -5.905 -1.775 1.00 . A A . 39 ARG HH21 1 1 17 11704 1 1 39 ARG HH22 H -0.537 -4.373 -2.420 1.00 . A A . 39 ARG HH22 1 1 17 11705 1 1 39 ARG N N 0.568 -5.775 5.072 1.00 . A A . 39 ARG N 1 1 17 11706 1 1 39 ARG NE N 0.981 -4.962 0.337 1.00 . A A . 39 ARG NE 1 1 17 11707 1 1 39 ARG NH1 N -0.024 -2.993 -0.503 1.00 . A A . 39 ARG NH1 1 1 17 11708 1 1 39 ARG NH2 N -0.028 -4.916 -1.714 1.00 . A A . 39 ARG NH2 1 1 17 11709 1 1 39 ARG O O 0.403 -8.763 4.748 1.00 . A A . 39 ARG O 1 1 17 11710 1 1 40 LEU C C -2.819 -8.771 5.980 1.00 . A A . 40 LEU C 1 1 17 11711 1 1 40 LEU CA C -2.519 -9.170 4.494 1.00 . A A . 40 LEU CA 1 1 17 11712 1 1 40 LEU CB C -1.891 -10.607 4.320 1.00 . A A . 40 LEU CB 1 1 17 11713 1 1 40 LEU CD1 C -2.121 -12.071 6.446 1.00 . A A . 40 LEU CD1 1 1 17 11714 1 1 40 LEU CD2 C -0.168 -12.414 4.898 1.00 . A A . 40 LEU CD2 1 1 17 11715 1 1 40 LEU CG C -1.152 -11.372 5.467 1.00 . A A . 40 LEU CG 1 1 17 11716 1 1 40 LEU H H -2.062 -7.245 3.537 1.00 . A A . 40 LEU H 1 1 17 11717 1 1 40 LEU HA H -3.459 -9.129 3.910 1.00 . A A . 40 LEU HA 1 1 17 11718 1 1 40 LEU HB2 H -2.710 -11.266 3.971 1.00 . A A . 40 LEU HB2 1 1 17 11719 1 1 40 LEU HB3 H -1.237 -10.575 3.426 1.00 . A A . 40 LEU HB3 1 1 17 11720 1 1 40 LEU HD11 H -2.817 -11.360 6.926 1.00 . A A . 40 LEU HD11 1 1 17 11721 1 1 40 LEU HD12 H -2.740 -12.837 5.942 1.00 . A A . 40 LEU HD12 1 1 17 11722 1 1 40 LEU HD13 H -1.579 -12.577 7.266 1.00 . A A . 40 LEU HD13 1 1 17 11723 1 1 40 LEU HD21 H 0.584 -11.943 4.238 1.00 . A A . 40 LEU HD21 1 1 17 11724 1 1 40 LEU HD22 H 0.394 -12.928 5.700 1.00 . A A . 40 LEU HD22 1 1 17 11725 1 1 40 LEU HD23 H -0.682 -13.193 4.304 1.00 . A A . 40 LEU HD23 1 1 17 11726 1 1 40 LEU HG H -0.545 -10.659 6.049 1.00 . A A . 40 LEU HG 1 1 17 11727 1 1 40 LEU N N -1.640 -8.059 3.997 1.00 . A A . 40 LEU N 1 1 17 11728 1 1 40 LEU O O -1.914 -8.667 6.819 1.00 . A A . 40 LEU O 1 1 17 11729 1 1 41 ILE C C -4.663 -8.711 8.650 1.00 . A A . 41 ILE C 1 1 17 11730 1 1 41 ILE CA C -4.471 -7.679 7.489 1.00 . A A . 41 ILE CA 1 1 17 11731 1 1 41 ILE CB C -5.772 -6.824 7.217 1.00 . A A . 41 ILE CB 1 1 17 11732 1 1 41 ILE CD1 C -6.809 -5.051 5.558 1.00 . A A . 41 ILE CD1 1 1 17 11733 1 1 41 ILE CG1 C -5.568 -5.834 6.020 1.00 . A A . 41 ILE CG1 1 1 17 11734 1 1 41 ILE CG2 C -6.132 -5.996 8.484 1.00 . A A . 41 ILE CG2 1 1 17 11735 1 1 41 ILE H H -4.755 -8.594 5.498 1.00 . A A . 41 ILE H 1 1 17 11736 1 1 41 ILE HA H -3.656 -6.972 7.748 1.00 . A A . 41 ILE HA 1 1 17 11737 1 1 41 ILE HB H -6.617 -7.498 6.977 1.00 . A A . 41 ILE HB 1 1 17 11738 1 1 41 ILE HD11 H -7.647 -5.726 5.304 1.00 . A A . 41 ILE HD11 1 1 17 11739 1 1 41 ILE HD12 H -7.168 -4.344 6.328 1.00 . A A . 41 ILE HD12 1 1 17 11740 1 1 41 ILE HD13 H -6.585 -4.452 4.657 1.00 . A A . 41 ILE HD13 1 1 17 11741 1 1 41 ILE HG12 H -4.751 -5.125 6.247 1.00 . A A . 41 ILE HG12 1 1 17 11742 1 1 41 ILE HG13 H -5.213 -6.389 5.133 1.00 . A A . 41 ILE HG13 1 1 17 11743 1 1 41 ILE HG21 H -6.298 -6.635 9.370 1.00 . A A . 41 ILE HG21 1 1 17 11744 1 1 41 ILE HG22 H -5.336 -5.274 8.748 1.00 . A A . 41 ILE HG22 1 1 17 11745 1 1 41 ILE HG23 H -7.066 -5.420 8.354 1.00 . A A . 41 ILE HG23 1 1 17 11746 1 1 41 ILE N N -4.098 -8.467 6.276 1.00 . A A . 41 ILE N 1 1 17 11747 1 1 41 ILE O O -5.672 -9.422 8.718 1.00 . A A . 41 ILE O 1 1 17 11748 1 1 42 MET C C -2.724 -9.080 11.778 1.00 . A A . 42 MET C 1 1 17 11749 1 1 42 MET CA C -3.635 -9.716 10.688 1.00 . A A . 42 MET CA 1 1 17 11750 1 1 42 MET CB C -3.101 -11.107 10.234 1.00 . A A . 42 MET CB 1 1 17 11751 1 1 42 MET CE C -5.036 -12.182 13.408 1.00 . A A . 42 MET CE 1 1 17 11752 1 1 42 MET CG C -3.195 -12.225 11.286 1.00 . A A . 42 MET CG 1 1 17 11753 1 1 42 MET H H -2.878 -8.131 9.356 1.00 . A A . 42 MET H 1 1 17 11754 1 1 42 MET HA H -4.665 -9.840 11.082 1.00 . A A . 42 MET HA 1 1 17 11755 1 1 42 MET HB2 H -3.664 -11.448 9.344 1.00 . A A . 42 MET HB2 1 1 17 11756 1 1 42 MET HB3 H -2.052 -11.023 9.889 1.00 . A A . 42 MET HB3 1 1 17 11757 1 1 42 MET HE1 H -4.284 -12.741 13.993 1.00 . A A . 42 MET HE1 1 1 17 11758 1 1 42 MET HE2 H -4.869 -11.102 13.569 1.00 . A A . 42 MET HE2 1 1 17 11759 1 1 42 MET HE3 H -6.036 -12.435 13.804 1.00 . A A . 42 MET HE3 1 1 17 11760 1 1 42 MET HG2 H -2.720 -13.145 10.898 1.00 . A A . 42 MET HG2 1 1 17 11761 1 1 42 MET HG3 H -2.637 -11.959 12.203 1.00 . A A . 42 MET HG3 1 1 17 11762 1 1 42 MET N N -3.655 -8.776 9.540 1.00 . A A . 42 MET N 1 1 17 11763 1 1 42 MET O O -1.503 -8.983 11.605 1.00 . A A . 42 MET O 1 1 17 11764 1 1 42 MET SD S -4.928 -12.593 11.654 1.00 . A A . 42 MET SD 1 1 17 11765 1 1 43 GLU C C -2.288 -9.112 15.102 1.00 . A A . 43 GLU C 1 1 17 11766 1 1 43 GLU CA C -2.609 -8.028 14.035 1.00 . A A . 43 GLU CA 1 1 17 11767 1 1 43 GLU CB C -3.497 -6.897 14.616 1.00 . A A . 43 GLU CB 1 1 17 11768 1 1 43 GLU CD C -2.920 -6.390 17.104 1.00 . A A . 43 GLU CD 1 1 17 11769 1 1 43 GLU CG C -2.851 -5.936 15.642 1.00 . A A . 43 GLU CG 1 1 17 11770 1 1 43 GLU H H -4.354 -8.795 12.915 1.00 . A A . 43 GLU H 1 1 17 11771 1 1 43 GLU HA H -1.665 -7.568 13.675 1.00 . A A . 43 GLU HA 1 1 17 11772 1 1 43 GLU HB2 H -3.771 -6.261 13.763 1.00 . A A . 43 GLU HB2 1 1 17 11773 1 1 43 GLU HB3 H -4.461 -7.289 14.997 1.00 . A A . 43 GLU HB3 1 1 17 11774 1 1 43 GLU HE2 H -4.233 -6.624 18.521 1.00 . A A . 43 GLU HE2 1 1 17 11775 1 1 43 GLU HG2 H -1.801 -5.725 15.364 1.00 . A A . 43 GLU HG2 1 1 17 11776 1 1 43 GLU HG3 H -3.355 -4.956 15.572 1.00 . A A . 43 GLU HG3 1 1 17 11777 1 1 43 GLU N N -3.337 -8.657 12.899 1.00 . A A . 43 GLU N 1 1 17 11778 1 1 43 GLU O O -3.137 -9.923 15.490 1.00 . A A . 43 GLU O 1 1 17 11779 1 1 43 GLU OE1 O -1.935 -6.742 17.750 1.00 . A A . 43 GLU OE1 1 1 17 11780 1 1 43 GLU OE2 O -4.195 -6.340 17.604 1.00 . A A . 43 GLU OE2 1 1 17 11781 1 1 44 GLY C C -0.720 -9.727 17.984 1.00 . A A . 44 GLY C 1 1 17 11782 1 1 44 GLY CA C -0.492 -10.094 16.504 1.00 . A A . 44 GLY CA 1 1 17 11783 1 1 44 GLY H H -0.502 -8.276 15.215 1.00 . A A . 44 GLY H 1 1 17 11784 1 1 44 GLY HA2 H -0.934 -11.090 16.307 1.00 . A A . 44 GLY HA2 1 1 17 11785 1 1 44 GLY HA3 H 0.586 -10.228 16.285 1.00 . A A . 44 GLY HA3 1 1 17 11786 1 1 44 GLY N N -1.030 -9.085 15.564 1.00 . A A . 44 GLY N 1 1 17 11787 1 1 44 GLY O O -1.854 -9.798 18.467 1.00 . A A . 44 GLY O 1 1 17 11788 1 1 45 LEU C C 0.186 -7.405 20.255 1.00 . A A . 45 LEU C 1 1 17 11789 1 1 45 LEU CA C 0.300 -8.954 20.125 1.00 . A A . 45 LEU CA 1 1 17 11790 1 1 45 LEU CB C 1.567 -9.507 20.854 1.00 . A A . 45 LEU CB 1 1 17 11791 1 1 45 LEU CD1 C 3.068 -11.420 21.601 1.00 . A A . 45 LEU CD1 1 1 17 11792 1 1 45 LEU CD2 C 0.571 -11.667 21.879 1.00 . A A . 45 LEU CD2 1 1 17 11793 1 1 45 LEU CG C 1.691 -11.051 21.014 1.00 . A A . 45 LEU CG 1 1 17 11794 1 1 45 LEU H H 1.240 -9.334 18.156 1.00 . A A . 45 LEU H 1 1 17 11795 1 1 45 LEU HA H -0.590 -9.383 20.611 1.00 . A A . 45 LEU HA 1 1 17 11796 1 1 45 LEU HB2 H 2.473 -9.126 20.342 1.00 . A A . 45 LEU HB2 1 1 17 11797 1 1 45 LEU HB3 H 1.615 -9.056 21.865 1.00 . A A . 45 LEU HB3 1 1 17 11798 1 1 45 LEU HD11 H 3.894 -11.045 20.969 1.00 . A A . 45 LEU HD11 1 1 17 11799 1 1 45 LEU HD12 H 3.215 -11.001 22.614 1.00 . A A . 45 LEU HD12 1 1 17 11800 1 1 45 LEU HD13 H 3.201 -12.516 21.677 1.00 . A A . 45 LEU HD13 1 1 17 11801 1 1 45 LEU HD21 H 0.538 -11.224 22.893 1.00 . A A . 45 LEU HD21 1 1 17 11802 1 1 45 LEU HD22 H -0.426 -11.522 21.425 1.00 . A A . 45 LEU HD22 1 1 17 11803 1 1 45 LEU HD23 H 0.701 -12.758 22.001 1.00 . A A . 45 LEU HD23 1 1 17 11804 1 1 45 LEU HG H 1.632 -11.512 20.010 1.00 . A A . 45 LEU HG 1 1 17 11805 1 1 45 LEU N N 0.361 -9.343 18.685 1.00 . A A . 45 LEU N 1 1 17 11806 1 1 45 LEU O O -0.848 -6.920 20.724 1.00 . A A . 45 LEU O 1 1 17 11807 1 1 46 SER C C 0.395 -4.579 18.679 1.00 . A A . 46 SER C 1 1 17 11808 1 1 46 SER CA C 1.204 -5.156 19.879 1.00 . A A . 46 SER CA 1 1 17 11809 1 1 46 SER CB C 2.665 -4.642 19.833 1.00 . A A . 46 SER CB 1 1 17 11810 1 1 46 SER H H 2.002 -7.192 19.477 1.00 . A A . 46 SER H 1 1 17 11811 1 1 46 SER HA H 0.746 -4.816 20.830 1.00 . A A . 46 SER HA 1 1 17 11812 1 1 46 SER HB2 H 2.680 -3.540 19.926 1.00 . A A . 46 SER HB2 1 1 17 11813 1 1 46 SER HB3 H 3.232 -5.014 20.708 1.00 . A A . 46 SER HB3 1 1 17 11814 1 1 46 SER HG H 4.226 -4.615 18.705 1.00 . A A . 46 SER HG 1 1 17 11815 1 1 46 SER N N 1.213 -6.642 19.832 1.00 . A A . 46 SER N 1 1 17 11816 1 1 46 SER O O 0.549 -5.018 17.532 1.00 . A A . 46 SER O 1 1 17 11817 1 1 46 SER OG O 3.355 -5.013 18.641 1.00 . A A . 46 SER OG 1 1 17 11818 1 1 47 PHE C C -0.426 -1.941 17.087 1.00 . A A . 47 PHE C 1 1 17 11819 1 1 47 PHE CA C -1.301 -2.915 17.934 1.00 . A A . 47 PHE CA 1 1 17 11820 1 1 47 PHE CB C -2.492 -2.236 18.682 1.00 . A A . 47 PHE CB 1 1 17 11821 1 1 47 PHE CD1 C -4.447 -2.455 17.054 1.00 . A A . 47 PHE CD1 1 1 17 11822 1 1 47 PHE CD2 C -3.737 -0.238 17.696 1.00 . A A . 47 PHE CD2 1 1 17 11823 1 1 47 PHE CE1 C -5.446 -1.904 16.256 1.00 . A A . 47 PHE CE1 1 1 17 11824 1 1 47 PHE CE2 C -4.745 0.311 16.908 1.00 . A A . 47 PHE CE2 1 1 17 11825 1 1 47 PHE CG C -3.580 -1.627 17.777 1.00 . A A . 47 PHE CG 1 1 17 11826 1 1 47 PHE CZ C -5.596 -0.521 16.185 1.00 . A A . 47 PHE CZ 1 1 17 11827 1 1 47 PHE H H -0.481 -3.294 19.952 1.00 . A A . 47 PHE H 1 1 17 11828 1 1 47 PHE HA H -1.707 -3.665 17.237 1.00 . A A . 47 PHE HA 1 1 17 11829 1 1 47 PHE HB2 H -2.986 -2.984 19.333 1.00 . A A . 47 PHE HB2 1 1 17 11830 1 1 47 PHE HB3 H -2.112 -1.477 19.396 1.00 . A A . 47 PHE HB3 1 1 17 11831 1 1 47 PHE HD1 H -4.354 -3.529 17.115 1.00 . A A . 47 PHE HD1 1 1 17 11832 1 1 47 PHE HD2 H -3.083 0.423 18.248 1.00 . A A . 47 PHE HD2 1 1 17 11833 1 1 47 PHE HE1 H -6.106 -2.548 15.693 1.00 . A A . 47 PHE HE1 1 1 17 11834 1 1 47 PHE HE2 H -4.867 1.382 16.858 1.00 . A A . 47 PHE HE2 1 1 17 11835 1 1 47 PHE HZ H -6.372 -0.094 15.567 1.00 . A A . 47 PHE HZ 1 1 17 11836 1 1 47 PHE N N -0.453 -3.573 18.965 1.00 . A A . 47 PHE N 1 1 17 11837 1 1 47 PHE O O -0.066 -2.317 15.971 1.00 . A A . 47 PHE O 1 1 17 11838 1 1 48 ALA C C 2.282 -0.241 16.857 1.00 . A A . 48 ALA C 1 1 17 11839 1 1 48 ALA CA C 0.803 0.219 16.882 1.00 . A A . 48 ALA CA 1 1 17 11840 1 1 48 ALA CB C 0.667 1.588 17.574 1.00 . A A . 48 ALA CB 1 1 17 11841 1 1 48 ALA H H -0.435 -0.588 18.542 1.00 . A A . 48 ALA H 1 1 17 11842 1 1 48 ALA HXT H 3.750 -0.662 18.072 1.00 . A A . 48 ALA HXT 1 1 17 11843 1 1 48 ALA HA H 0.458 0.329 15.839 1.00 . A A . 48 ALA HA 1 1 17 11844 1 1 48 ALA HB1 H 0.989 1.569 18.633 1.00 . A A . 48 ALA HB1 1 1 17 11845 1 1 48 ALA HB2 H 1.274 2.358 17.061 1.00 . A A . 48 ALA HB2 1 1 17 11846 1 1 48 ALA HB3 H -0.378 1.951 17.554 1.00 . A A . 48 ALA HB3 1 1 17 11847 1 1 48 ALA N N -0.044 -0.760 17.611 1.00 . A A . 48 ALA N 1 1 17 11848 1 1 48 ALA O O 2.885 -0.479 15.811 1.00 . A A . 48 ALA O 1 1 17 11849 1 1 48 ALA OXT O 2.837 -0.367 18.110 1.00 . A A . 48 ALA OXT 1 1 18 11850 1 1 1 GLU C C 12.979 6.563 11.232 1.00 . A A . 1 GLU C 1 1 18 11851 1 1 1 GLU CA C 12.250 5.212 11.478 1.00 . A A . 1 GLU CA 1 1 18 11852 1 1 1 GLU CB C 11.110 5.363 12.523 1.00 . A A . 1 GLU CB 1 1 18 11853 1 1 1 GLU CD C 8.765 6.267 13.037 1.00 . A A . 1 GLU CD 1 1 18 11854 1 1 1 GLU CG C 9.888 6.150 12.004 1.00 . A A . 1 GLU CG 1 1 18 11855 1 1 1 GLU H1 H 14.006 4.096 11.305 1.00 . A A . 1 GLU H1 1 1 18 11856 1 1 1 GLU H2 H 13.664 4.541 12.860 1.00 . A A . 1 GLU H2 1 1 18 11857 1 1 1 GLU HA H 11.834 4.825 10.526 1.00 . A A . 1 GLU HA 1 1 18 11858 1 1 1 GLU HB2 H 10.760 4.360 12.835 1.00 . A A . 1 GLU HB2 1 1 18 11859 1 1 1 GLU HB3 H 11.494 5.833 13.450 1.00 . A A . 1 GLU HB3 1 1 18 11860 1 1 1 GLU HE2 H 8.176 7.469 14.450 1.00 . A A . 1 GLU HE2 1 1 18 11861 1 1 1 GLU HG2 H 10.192 7.163 11.677 1.00 . A A . 1 GLU HG2 1 1 18 11862 1 1 1 GLU HG3 H 9.487 5.660 11.096 1.00 . A A . 1 GLU HG3 1 1 18 11863 1 1 1 GLU N N 13.241 4.234 11.976 1.00 . A A . 1 GLU N 1 1 18 11864 1 1 1 GLU O O 13.527 7.168 12.162 1.00 . A A . 1 GLU O 1 1 18 11865 1 1 1 GLU OE1 O 7.864 5.439 13.158 1.00 . A A . 1 GLU OE1 1 1 18 11866 1 1 1 GLU OE2 O 8.883 7.398 13.804 1.00 . A A . 1 GLU OE2 1 1 18 11867 1 1 2 ASP C C 12.637 8.944 8.469 1.00 . A A . 2 ASP C 1 1 18 11868 1 1 2 ASP CA C 13.540 8.347 9.587 1.00 . A A . 2 ASP CA 1 1 18 11869 1 1 2 ASP CB C 15.020 8.182 9.115 1.00 . A A . 2 ASP CB 1 1 18 11870 1 1 2 ASP CG C 15.351 7.230 7.947 1.00 . A A . 2 ASP CG 1 1 18 11871 1 1 2 ASP H H 12.465 6.437 9.296 1.00 . A A . 2 ASP H 1 1 18 11872 1 1 2 ASP HA H 13.544 9.036 10.457 1.00 . A A . 2 ASP HA 1 1 18 11873 1 1 2 ASP HB2 H 15.415 9.182 8.856 1.00 . A A . 2 ASP HB2 1 1 18 11874 1 1 2 ASP HB3 H 15.633 7.879 9.985 1.00 . A A . 2 ASP HB3 1 1 18 11875 1 1 2 ASP HD2 H 15.396 5.842 9.310 1.00 . A A . 2 ASP HD2 1 1 18 11876 1 1 2 ASP N N 12.957 7.032 9.972 1.00 . A A . 2 ASP N 1 1 18 11877 1 1 2 ASP O O 12.571 8.423 7.350 1.00 . A A . 2 ASP O 1 1 18 11878 1 1 2 ASP OD1 O 15.454 7.604 6.779 1.00 . A A . 2 ASP OD1 1 1 18 11879 1 1 2 ASP OD2 O 15.516 5.934 8.362 1.00 . A A . 2 ASP OD2 1 1 18 11880 1 1 3 ASN C C 9.732 9.906 7.377 1.00 . A A . 3 ASN C 1 1 18 11881 1 1 3 ASN CA C 10.933 10.773 7.922 1.00 . A A . 3 ASN CA 1 1 18 11882 1 1 3 ASN CB C 11.706 11.361 6.704 1.00 . A A . 3 ASN CB 1 1 18 11883 1 1 3 ASN CG C 12.832 12.376 7.003 1.00 . A A . 3 ASN CG 1 1 18 11884 1 1 3 ASN H H 11.961 10.252 9.812 1.00 . A A . 3 ASN H 1 1 18 11885 1 1 3 ASN HA H 10.472 11.562 8.532 1.00 . A A . 3 ASN HA 1 1 18 11886 1 1 3 ASN HB2 H 12.062 10.496 6.116 1.00 . A A . 3 ASN HB2 1 1 18 11887 1 1 3 ASN HB3 H 11.000 11.883 6.030 1.00 . A A . 3 ASN HB3 1 1 18 11888 1 1 3 ASN HD21 H 14.209 11.096 6.306 1.00 . A A . 3 ASN HD21 1 1 18 11889 1 1 3 ASN HD22 H 14.806 12.718 6.921 1.00 . A A . 3 ASN HD22 1 1 18 11890 1 1 3 ASN N N 11.921 10.042 8.811 1.00 . A A . 3 ASN N 1 1 18 11891 1 1 3 ASN ND2 N 14.076 12.028 6.713 1.00 . A A . 3 ASN ND2 1 1 18 11892 1 1 3 ASN O O 9.097 10.235 6.369 1.00 . A A . 3 ASN O 1 1 18 11893 1 1 3 ASN OD1 O 12.585 13.477 7.494 1.00 . A A . 3 ASN OD1 1 1 18 11894 1 1 4 CYS C C 7.634 7.250 8.884 1.00 . A A . 4 CYS C 1 1 18 11895 1 1 4 CYS CA C 8.458 7.785 7.663 1.00 . A A . 4 CYS CA 1 1 18 11896 1 1 4 CYS CB C 9.219 6.663 6.969 1.00 . A A . 4 CYS CB 1 1 18 11897 1 1 4 CYS H H 10.195 8.727 8.763 1.00 . A A . 4 CYS H 1 1 18 11898 1 1 4 CYS HA H 7.741 8.163 6.915 1.00 . A A . 4 CYS HA 1 1 18 11899 1 1 4 CYS HB2 H 8.381 6.022 6.784 1.00 . A A . 4 CYS HB2 1 1 18 11900 1 1 4 CYS HB3 H 9.546 6.897 5.947 1.00 . A A . 4 CYS HB3 1 1 18 11901 1 1 4 CYS N N 9.427 8.825 8.090 1.00 . A A . 4 CYS N 1 1 18 11902 1 1 4 CYS O O 7.844 7.653 10.034 1.00 . A A . 4 CYS O 1 1 18 11903 1 1 4 CYS SG S 10.379 5.657 7.920 1.00 . A A . 4 CYS SG 1 1 18 11904 1 1 5 ILE C C 6.312 4.183 9.656 1.00 . A A . 5 ILE C 1 1 18 11905 1 1 5 ILE CA C 5.876 5.663 9.704 1.00 . A A . 5 ILE CA 1 1 18 11906 1 1 5 ILE CB C 4.305 5.773 9.554 1.00 . A A . 5 ILE CB 1 1 18 11907 1 1 5 ILE CD1 C 2.435 7.391 8.868 1.00 . A A . 5 ILE CD1 1 1 18 11908 1 1 5 ILE CG1 C 3.883 7.228 9.279 1.00 . A A . 5 ILE CG1 1 1 18 11909 1 1 5 ILE CG2 C 3.590 5.262 10.846 1.00 . A A . 5 ILE CG2 1 1 18 11910 1 1 5 ILE H H 6.650 6.055 7.594 1.00 . A A . 5 ILE H 1 1 18 11911 1 1 5 ILE HA H 6.125 6.106 10.672 1.00 . A A . 5 ILE HA 1 1 18 11912 1 1 5 ILE HB H 3.908 5.157 8.751 1.00 . A A . 5 ILE HB 1 1 18 11913 1 1 5 ILE HD11 H 1.772 6.962 9.630 1.00 . A A . 5 ILE HD11 1 1 18 11914 1 1 5 ILE HD12 H 2.169 8.454 8.765 1.00 . A A . 5 ILE HD12 1 1 18 11915 1 1 5 ILE HD13 H 2.219 6.888 7.908 1.00 . A A . 5 ILE HD13 1 1 18 11916 1 1 5 ILE HG12 H 4.102 7.839 10.152 1.00 . A A . 5 ILE HG12 1 1 18 11917 1 1 5 ILE HG13 H 4.479 7.662 8.463 1.00 . A A . 5 ILE HG13 1 1 18 11918 1 1 5 ILE HG21 H 3.911 4.247 11.138 1.00 . A A . 5 ILE HG21 1 1 18 11919 1 1 5 ILE HG22 H 3.730 5.917 11.723 1.00 . A A . 5 ILE HG22 1 1 18 11920 1 1 5 ILE HG23 H 2.495 5.165 10.694 1.00 . A A . 5 ILE HG23 1 1 18 11921 1 1 5 ILE N N 6.664 6.334 8.604 1.00 . A A . 5 ILE N 1 1 18 11922 1 1 5 ILE O O 5.757 3.391 8.893 1.00 . A A . 5 ILE O 1 1 18 11923 1 1 6 ALA C C 6.704 1.242 10.969 1.00 . A A . 6 ALA C 1 1 18 11924 1 1 6 ALA CA C 7.757 2.338 10.487 1.00 . A A . 6 ALA CA 1 1 18 11925 1 1 6 ALA CB C 8.998 2.296 11.398 1.00 . A A . 6 ALA CB 1 1 18 11926 1 1 6 ALA H H 7.543 4.478 11.188 1.00 . A A . 6 ALA H 1 1 18 11927 1 1 6 ALA HA H 7.982 2.118 9.419 1.00 . A A . 6 ALA HA 1 1 18 11928 1 1 6 ALA HB1 H 9.790 2.982 11.042 1.00 . A A . 6 ALA HB1 1 1 18 11929 1 1 6 ALA HB2 H 8.766 2.572 12.445 1.00 . A A . 6 ALA HB2 1 1 18 11930 1 1 6 ALA HB3 H 9.450 1.288 11.419 1.00 . A A . 6 ALA HB3 1 1 18 11931 1 1 6 ALA N N 7.280 3.770 10.495 1.00 . A A . 6 ALA N 1 1 18 11932 1 1 6 ALA O O 6.948 0.039 10.871 1.00 . A A . 6 ALA O 1 1 18 11933 1 1 7 GLU C C 4.059 -0.351 12.171 1.00 . A A . 7 GLU C 1 1 18 11934 1 1 7 GLU CA C 4.231 1.146 11.727 1.00 . A A . 7 GLU CA 1 1 18 11935 1 1 7 GLU CB C 3.420 1.312 10.384 1.00 . A A . 7 GLU CB 1 1 18 11936 1 1 7 GLU CD C 4.755 -0.304 8.693 1.00 . A A . 7 GLU CD 1 1 18 11937 1 1 7 GLU CG C 3.430 0.233 9.250 1.00 . A A . 7 GLU CG 1 1 18 11938 1 1 7 GLU H H 5.639 2.768 11.312 1.00 . A A . 7 GLU H 1 1 18 11939 1 1 7 GLU HA H 3.805 1.779 12.535 1.00 . A A . 7 GLU HA 1 1 18 11940 1 1 7 GLU HB2 H 2.362 1.377 10.694 1.00 . A A . 7 GLU HB2 1 1 18 11941 1 1 7 GLU HB3 H 3.569 2.321 9.958 1.00 . A A . 7 GLU HB3 1 1 18 11942 1 1 7 GLU HE2 H 6.332 0.312 7.737 1.00 . A A . 7 GLU HE2 1 1 18 11943 1 1 7 GLU HG2 H 2.847 -0.632 9.611 1.00 . A A . 7 GLU HG2 1 1 18 11944 1 1 7 GLU HG3 H 2.843 0.593 8.393 1.00 . A A . 7 GLU HG3 1 1 18 11945 1 1 7 GLU N N 5.552 1.749 11.419 1.00 . A A . 7 GLU N 1 1 18 11946 1 1 7 GLU O O 4.752 -1.302 11.809 1.00 . A A . 7 GLU O 1 1 18 11947 1 1 7 GLU OE1 O 5.089 -1.485 8.781 1.00 . A A . 7 GLU OE1 1 1 18 11948 1 1 7 GLU OE2 O 5.509 0.663 8.083 1.00 . A A . 7 GLU OE2 1 1 18 11949 1 1 8 ASP C C 0.973 -0.845 13.919 1.00 . A A . 8 ASP C 1 1 18 11950 1 1 8 ASP CA C 2.146 -1.630 13.278 1.00 . A A . 8 ASP CA 1 1 18 11951 1 1 8 ASP CB C 2.693 -2.672 14.287 1.00 . A A . 8 ASP CB 1 1 18 11952 1 1 8 ASP CG C 4.206 -2.916 14.294 1.00 . A A . 8 ASP CG 1 1 18 11953 1 1 8 ASP H H 2.525 0.496 13.063 1.00 . A A . 8 ASP H 1 1 18 11954 1 1 8 ASP HA H 1.896 -2.109 12.315 1.00 . A A . 8 ASP HA 1 1 18 11955 1 1 8 ASP HB2 H 2.281 -2.425 15.271 1.00 . A A . 8 ASP HB2 1 1 18 11956 1 1 8 ASP HB3 H 2.215 -3.634 14.024 1.00 . A A . 8 ASP HB3 1 1 18 11957 1 1 8 ASP HD2 H 4.255 -1.463 15.588 1.00 . A A . 8 ASP HD2 1 1 18 11958 1 1 8 ASP N N 2.929 -0.430 12.887 1.00 . A A . 8 ASP N 1 1 18 11959 1 1 8 ASP O O 1.025 -0.336 15.048 1.00 . A A . 8 ASP O 1 1 18 11960 1 1 8 ASP OD1 O 4.760 -3.777 13.611 1.00 . A A . 8 ASP OD1 1 1 18 11961 1 1 8 ASP OD2 O 4.860 -2.064 15.146 1.00 . A A . 8 ASP OD2 1 1 18 11962 1 1 9 TYR C C -0.717 1.667 13.670 1.00 . A A . 9 TYR C 1 1 18 11963 1 1 9 TYR CA C -1.229 0.219 13.290 1.00 . A A . 9 TYR CA 1 1 18 11964 1 1 9 TYR CB C -2.191 -0.411 14.349 1.00 . A A . 9 TYR CB 1 1 18 11965 1 1 9 TYR CD1 C -3.970 -1.549 12.911 1.00 . A A . 9 TYR CD1 1 1 18 11966 1 1 9 TYR CD2 C -2.476 -2.947 14.196 1.00 . A A . 9 TYR CD2 1 1 18 11967 1 1 9 TYR CE1 C -4.561 -2.685 12.362 1.00 . A A . 9 TYR CE1 1 1 18 11968 1 1 9 TYR CE2 C -3.071 -4.082 13.648 1.00 . A A . 9 TYR CE2 1 1 18 11969 1 1 9 TYR CG C -2.921 -1.671 13.831 1.00 . A A . 9 TYR CG 1 1 18 11970 1 1 9 TYR CZ C -4.111 -3.951 12.730 1.00 . A A . 9 TYR CZ 1 1 18 11971 1 1 9 TYR H H 0.126 -1.344 12.304 1.00 . A A . 9 TYR H 1 1 18 11972 1 1 9 TYR HA H -1.796 0.364 12.349 1.00 . A A . 9 TYR HA 1 1 18 11973 1 1 9 TYR HB2 H -1.659 -0.617 15.298 1.00 . A A . 9 TYR HB2 1 1 18 11974 1 1 9 TYR HB3 H -2.959 0.334 14.631 1.00 . A A . 9 TYR HB3 1 1 18 11975 1 1 9 TYR HD1 H -4.307 -0.572 12.593 1.00 . A A . 9 TYR HD1 1 1 18 11976 1 1 9 TYR HD2 H -1.646 -3.065 14.879 1.00 . A A . 9 TYR HD2 1 1 18 11977 1 1 9 TYR HE1 H -5.360 -2.579 11.643 1.00 . A A . 9 TYR HE1 1 1 18 11978 1 1 9 TYR HE2 H -2.712 -5.062 13.927 1.00 . A A . 9 TYR HE2 1 1 18 11979 1 1 9 TYR HH H -4.256 -5.849 12.541 1.00 . A A . 9 TYR HH 1 1 18 11980 1 1 9 TYR N N -0.065 -0.722 13.089 1.00 . A A . 9 TYR N 1 1 18 11981 1 1 9 TYR O O -1.270 2.337 14.549 1.00 . A A . 9 TYR O 1 1 18 11982 1 1 9 TYR OH O -4.684 -5.068 12.180 1.00 . A A . 9 TYR OH 1 1 18 11983 1 1 10 GLY C C 0.018 4.618 12.700 1.00 . A A . 10 GLY C 1 1 18 11984 1 1 10 GLY CA C 0.936 3.485 13.142 1.00 . A A . 10 GLY CA 1 1 18 11985 1 1 10 GLY H H 0.748 1.415 12.334 1.00 . A A . 10 GLY H 1 1 18 11986 1 1 10 GLY HA2 H 1.275 3.609 14.185 1.00 . A A . 10 GLY HA2 1 1 18 11987 1 1 10 GLY HA3 H 1.864 3.623 12.563 1.00 . A A . 10 GLY HA3 1 1 18 11988 1 1 10 GLY N N 0.337 2.139 12.947 1.00 . A A . 10 GLY N 1 1 18 11989 1 1 10 GLY O O -0.900 4.439 11.905 1.00 . A A . 10 GLY O 1 1 18 11990 1 1 11 LYS C C -0.101 7.712 11.753 1.00 . A A . 11 LYS C 1 1 18 11991 1 1 11 LYS CA C -0.614 6.965 13.015 1.00 . A A . 11 LYS CA 1 1 18 11992 1 1 11 LYS CB C -0.634 7.976 14.181 1.00 . A A . 11 LYS CB 1 1 18 11993 1 1 11 LYS CD C -0.987 8.483 16.714 1.00 . A A . 11 LYS CD 1 1 18 11994 1 1 11 LYS CE C 0.279 9.309 17.033 1.00 . A A . 11 LYS CE 1 1 18 11995 1 1 11 LYS CG C -0.859 7.413 15.605 1.00 . A A . 11 LYS CG 1 1 18 11996 1 1 11 LYS H H 1.188 5.751 13.730 1.00 . A A . 11 LYS H 1 1 18 11997 1 1 11 LYS HA H -1.663 6.604 12.885 1.00 . A A . 11 LYS HA 1 1 18 11998 1 1 11 LYS HB2 H 0.275 8.579 14.116 1.00 . A A . 11 LYS HB2 1 1 18 11999 1 1 11 LYS HB3 H -1.443 8.704 13.978 1.00 . A A . 11 LYS HB3 1 1 18 12000 1 1 11 LYS HD2 H -1.802 9.180 16.442 1.00 . A A . 11 LYS HD2 1 1 18 12001 1 1 11 LYS HD3 H -1.341 7.994 17.641 1.00 . A A . 11 LYS HD3 1 1 18 12002 1 1 11 LYS HE2 H 0.659 9.810 16.125 1.00 . A A . 11 LYS HE2 1 1 18 12003 1 1 11 LYS HE3 H 0.012 10.125 17.730 1.00 . A A . 11 LYS HE3 1 1 18 12004 1 1 11 LYS HG2 H -1.783 6.805 15.602 1.00 . A A . 11 LYS HG2 1 1 18 12005 1 1 11 LYS HG3 H -0.050 6.705 15.868 1.00 . A A . 11 LYS HG3 1 1 18 12006 1 1 11 LYS HZ1 H 1.042 8.110 18.533 1.00 . A A . 11 LYS HZ1 1 1 18 12007 1 1 11 LYS HZ2 H 2.153 9.116 17.881 1.00 . A A . 11 LYS HZ2 1 1 18 12008 1 1 11 LYS N N 0.288 5.797 13.238 1.00 . A A . 11 LYS N 1 1 18 12009 1 1 11 LYS NZ N 1.360 8.511 17.644 1.00 . A A . 11 LYS NZ 1 1 18 12010 1 1 11 LYS O O 1.056 8.136 11.649 1.00 . A A . 11 LYS O 1 1 18 12011 1 1 12 CYS C C -1.934 9.432 9.115 1.00 . A A . 12 CYS C 1 1 18 12012 1 1 12 CYS CA C -0.817 8.429 9.477 1.00 . A A . 12 CYS CA 1 1 18 12013 1 1 12 CYS CB C -0.804 7.284 8.433 1.00 . A A . 12 CYS CB 1 1 18 12014 1 1 12 CYS H H -1.934 7.556 11.232 1.00 . A A . 12 CYS H 1 1 18 12015 1 1 12 CYS HA H 0.148 8.972 9.445 1.00 . A A . 12 CYS HA 1 1 18 12016 1 1 12 CYS HB2 H -0.554 7.655 7.423 1.00 . A A . 12 CYS HB2 1 1 18 12017 1 1 12 CYS HB3 H -0.035 6.537 8.656 1.00 . A A . 12 CYS HB3 1 1 18 12018 1 1 12 CYS N N -1.038 7.838 10.824 1.00 . A A . 12 CYS N 1 1 18 12019 1 1 12 CYS O O -2.905 9.639 9.855 1.00 . A A . 12 CYS O 1 1 18 12020 1 1 12 CYS SG S -2.341 6.382 8.352 1.00 . A A . 12 CYS SG 1 1 18 12021 1 1 13 THR C C -2.814 10.672 5.794 1.00 . A A . 13 THR C 1 1 18 12022 1 1 13 THR CA C -2.885 10.867 7.340 1.00 . A A . 13 THR CA 1 1 18 12023 1 1 13 THR CB C -2.814 12.417 7.718 1.00 . A A . 13 THR CB 1 1 18 12024 1 1 13 THR CG2 C -1.935 12.815 8.925 1.00 . A A . 13 THR CG2 1 1 18 12025 1 1 13 THR H H -0.912 9.768 7.427 1.00 . A A . 13 THR H 1 1 18 12026 1 1 13 THR HA H -3.866 10.467 7.697 1.00 . A A . 13 THR HA 1 1 18 12027 1 1 13 THR HB H -3.867 12.716 7.874 1.00 . A A . 13 THR HB 1 1 18 12028 1 1 13 THR HG1 H -1.360 12.908 6.561 1.00 . A A . 13 THR HG1 1 1 18 12029 1 1 13 THR HG21 H -2.252 12.314 9.855 1.00 . A A . 13 THR HG21 1 1 18 12030 1 1 13 THR HG22 H -0.868 12.570 8.753 1.00 . A A . 13 THR HG22 1 1 18 12031 1 1 13 THR HG23 H -1.979 13.905 9.107 1.00 . A A . 13 THR HG23 1 1 18 12032 1 1 13 THR N N -1.777 10.054 7.931 1.00 . A A . 13 THR N 1 1 18 12033 1 1 13 THR O O -1.754 10.477 5.183 1.00 . A A . 13 THR O 1 1 18 12034 1 1 13 THR OG1 O -2.266 13.206 6.671 1.00 . A A . 13 THR OG1 1 1 18 12035 1 1 14 TRP C C -3.864 12.436 3.358 1.00 . A A . 14 TRP C 1 1 18 12036 1 1 14 TRP CA C -4.124 10.933 3.692 1.00 . A A . 14 TRP CA 1 1 18 12037 1 1 14 TRP CB C -5.523 10.438 3.226 1.00 . A A . 14 TRP CB 1 1 18 12038 1 1 14 TRP CD1 C -4.839 7.868 3.355 1.00 . A A . 14 TRP CD1 1 1 18 12039 1 1 14 TRP CD2 C -7.023 8.284 3.441 1.00 . A A . 14 TRP CD2 1 1 18 12040 1 1 14 TRP CE2 C -6.796 6.883 3.514 1.00 . A A . 14 TRP CE2 1 1 18 12041 1 1 14 TRP CE3 C -8.347 8.794 3.463 1.00 . A A . 14 TRP CE3 1 1 18 12042 1 1 14 TRP CG C -5.793 8.919 3.348 1.00 . A A . 14 TRP CG 1 1 18 12043 1 1 14 TRP CH2 C -9.182 6.511 3.635 1.00 . A A . 14 TRP CH2 1 1 18 12044 1 1 14 TRP CZ2 C -7.888 5.988 3.612 1.00 . A A . 14 TRP CZ2 1 1 18 12045 1 1 14 TRP CZ3 C -9.408 7.892 3.561 1.00 . A A . 14 TRP CZ3 1 1 18 12046 1 1 14 TRP H H -4.758 11.042 5.835 1.00 . A A . 14 TRP H 1 1 18 12047 1 1 14 TRP HA H -3.363 10.298 3.192 1.00 . A A . 14 TRP HA 1 1 18 12048 1 1 14 TRP HB2 H -6.316 11.000 3.757 1.00 . A A . 14 TRP HB2 1 1 18 12049 1 1 14 TRP HB3 H -5.657 10.707 2.161 1.00 . A A . 14 TRP HB3 1 1 18 12050 1 1 14 TRP HD1 H -3.770 8.006 3.287 1.00 . A A . 14 TRP HD1 1 1 18 12051 1 1 14 TRP HE1 H -4.985 5.687 3.491 1.00 . A A . 14 TRP HE1 1 1 18 12052 1 1 14 TRP HE3 H -8.538 9.856 3.406 1.00 . A A . 14 TRP HE3 1 1 18 12053 1 1 14 TRP HH2 H -10.024 5.839 3.711 1.00 . A A . 14 TRP HH2 1 1 18 12054 1 1 14 TRP HZ2 H -7.728 4.921 3.666 1.00 . A A . 14 TRP HZ2 1 1 18 12055 1 1 14 TRP HZ3 H -10.421 8.265 3.582 1.00 . A A . 14 TRP HZ3 1 1 18 12056 1 1 14 TRP N N -3.997 10.832 5.176 1.00 . A A . 14 TRP N 1 1 18 12057 1 1 14 TRP NE1 N -5.442 6.605 3.467 1.00 . A A . 14 TRP NE1 1 1 18 12058 1 1 14 TRP O O -4.710 13.315 3.554 1.00 . A A . 14 TRP O 1 1 18 12059 1 1 15 GLY C C -1.125 14.297 4.017 1.00 . A A . 15 GLY C 1 1 18 12060 1 1 15 GLY CA C -2.030 14.038 2.779 1.00 . A A . 15 GLY CA 1 1 18 12061 1 1 15 GLY H H -2.042 11.841 2.805 1.00 . A A . 15 GLY H 1 1 18 12062 1 1 15 GLY HA2 H -1.436 14.095 1.847 1.00 . A A . 15 GLY HA2 1 1 18 12063 1 1 15 GLY HA3 H -2.803 14.823 2.694 1.00 . A A . 15 GLY HA3 1 1 18 12064 1 1 15 GLY N N -2.621 12.681 2.911 1.00 . A A . 15 GLY N 1 1 18 12065 1 1 15 GLY O O -1.400 15.187 4.825 1.00 . A A . 15 GLY O 1 1 18 12066 1 1 16 GLY C C 1.943 12.412 5.097 1.00 . A A . 16 GLY C 1 1 18 12067 1 1 16 GLY CA C 0.775 13.374 5.354 1.00 . A A . 16 GLY CA 1 1 18 12068 1 1 16 GLY H H 0.007 12.797 3.379 1.00 . A A . 16 GLY H 1 1 18 12069 1 1 16 GLY HA2 H 1.146 14.318 5.776 1.00 . A A . 16 GLY HA2 1 1 18 12070 1 1 16 GLY HA3 H 0.139 12.963 6.160 1.00 . A A . 16 GLY HA3 1 1 18 12071 1 1 16 GLY N N -0.071 13.475 4.144 1.00 . A A . 16 GLY N 1 1 18 12072 1 1 16 GLY O O 2.400 12.196 3.967 1.00 . A A . 16 GLY O 1 1 18 12073 1 1 17 THR C C 2.508 9.380 5.904 1.00 . A A . 17 THR C 1 1 18 12074 1 1 17 THR CA C 3.370 10.676 6.133 1.00 . A A . 17 THR CA 1 1 18 12075 1 1 17 THR CB C 4.248 10.507 7.435 1.00 . A A . 17 THR CB 1 1 18 12076 1 1 17 THR CG2 C 5.592 9.800 7.133 1.00 . A A . 17 THR CG2 1 1 18 12077 1 1 17 THR H H 2.000 12.237 7.047 1.00 . A A . 17 THR H 1 1 18 12078 1 1 17 THR HA H 4.056 10.852 5.276 1.00 . A A . 17 THR HA 1 1 18 12079 1 1 17 THR HB H 3.709 9.884 8.181 1.00 . A A . 17 THR HB 1 1 18 12080 1 1 17 THR HG1 H 3.736 12.195 8.208 1.00 . A A . 17 THR HG1 1 1 18 12081 1 1 17 THR HG21 H 5.458 8.794 6.702 1.00 . A A . 17 THR HG21 1 1 18 12082 1 1 17 THR HG22 H 6.241 10.346 6.426 1.00 . A A . 17 THR HG22 1 1 18 12083 1 1 17 THR HG23 H 6.185 9.637 8.054 1.00 . A A . 17 THR HG23 1 1 18 12084 1 1 17 THR N N 2.404 11.815 6.202 1.00 . A A . 17 THR N 1 1 18 12085 1 1 17 THR O O 1.398 9.190 6.440 1.00 . A A . 17 THR O 1 1 18 12086 1 1 17 THR OG1 O 4.574 11.778 7.993 1.00 . A A . 17 THR OG1 1 1 18 12087 1 1 18 LYS C C 3.765 6.202 5.487 1.00 . A A . 18 LYS C 1 1 18 12088 1 1 18 LYS CA C 2.676 7.112 4.854 1.00 . A A . 18 LYS CA 1 1 18 12089 1 1 18 LYS CB C 2.472 6.801 3.338 1.00 . A A . 18 LYS CB 1 1 18 12090 1 1 18 LYS CD C 1.352 7.344 1.049 1.00 . A A . 18 LYS CD 1 1 18 12091 1 1 18 LYS CE C 2.555 7.132 0.108 1.00 . A A . 18 LYS CE 1 1 18 12092 1 1 18 LYS CG C 1.721 7.837 2.464 1.00 . A A . 18 LYS CG 1 1 18 12093 1 1 18 LYS H H 4.060 8.820 4.818 1.00 . A A . 18 LYS H 1 1 18 12094 1 1 18 LYS HA H 1.715 6.874 5.342 1.00 . A A . 18 LYS HA 1 1 18 12095 1 1 18 LYS HB2 H 3.438 6.507 2.898 1.00 . A A . 18 LYS HB2 1 1 18 12096 1 1 18 LYS HB3 H 1.892 5.860 3.285 1.00 . A A . 18 LYS HB3 1 1 18 12097 1 1 18 LYS HD2 H 0.759 6.413 1.129 1.00 . A A . 18 LYS HD2 1 1 18 12098 1 1 18 LYS HD3 H 0.667 8.087 0.598 1.00 . A A . 18 LYS HD3 1 1 18 12099 1 1 18 LYS HE2 H 3.141 8.065 0.015 1.00 . A A . 18 LYS HE2 1 1 18 12100 1 1 18 LYS HE3 H 3.243 6.372 0.521 1.00 . A A . 18 LYS HE3 1 1 18 12101 1 1 18 LYS HG2 H 0.788 8.124 2.984 1.00 . A A . 18 LYS HG2 1 1 18 12102 1 1 18 LYS HG3 H 2.311 8.770 2.390 1.00 . A A . 18 LYS HG3 1 1 18 12103 1 1 18 LYS HZ1 H 1.482 7.396 -1.635 1.00 . A A . 18 LYS HZ1 1 1 18 12104 1 1 18 LYS HZ2 H 1.576 5.833 -1.163 1.00 . A A . 18 LYS HZ2 1 1 18 12105 1 1 18 LYS N N 3.117 8.514 5.081 1.00 . A A . 18 LYS N 1 1 18 12106 1 1 18 LYS NZ N 2.120 6.701 -1.232 1.00 . A A . 18 LYS NZ 1 1 18 12107 1 1 18 LYS O O 4.797 6.604 6.051 1.00 . A A . 18 LYS O 1 1 18 12108 1 1 19 CYS C C 5.575 3.573 5.352 1.00 . A A . 19 CYS C 1 1 18 12109 1 1 19 CYS CA C 4.278 3.905 6.151 1.00 . A A . 19 CYS CA 1 1 18 12110 1 1 19 CYS CB C 3.338 2.737 6.432 1.00 . A A . 19 CYS CB 1 1 18 12111 1 1 19 CYS H H 2.675 4.744 4.771 1.00 . A A . 19 CYS H 1 1 18 12112 1 1 19 CYS HA H 4.535 4.363 7.137 1.00 . A A . 19 CYS HA 1 1 18 12113 1 1 19 CYS HB2 H 2.686 2.523 5.574 1.00 . A A . 19 CYS HB2 1 1 18 12114 1 1 19 CYS HB3 H 3.895 1.819 6.696 1.00 . A A . 19 CYS HB3 1 1 18 12115 1 1 19 CYS N N 3.484 4.906 5.398 1.00 . A A . 19 CYS N 1 1 18 12116 1 1 19 CYS O O 5.643 3.495 4.120 1.00 . A A . 19 CYS O 1 1 18 12117 1 1 19 CYS SG S 2.308 3.245 7.792 1.00 . A A . 19 CYS SG 1 1 18 12118 1 1 20 CYS C C 8.507 2.583 4.702 1.00 . A A . 20 CYS C 1 1 18 12119 1 1 20 CYS CA C 8.053 3.524 5.858 1.00 . A A . 20 CYS CA 1 1 18 12120 1 1 20 CYS CB C 8.852 3.146 7.121 1.00 . A A . 20 CYS CB 1 1 18 12121 1 1 20 CYS H H 6.329 3.580 7.181 1.00 . A A . 20 CYS H 1 1 18 12122 1 1 20 CYS HA H 8.202 4.583 5.678 1.00 . A A . 20 CYS HA 1 1 18 12123 1 1 20 CYS HB2 H 8.392 3.594 8.002 1.00 . A A . 20 CYS HB2 1 1 18 12124 1 1 20 CYS HB3 H 8.914 2.057 7.309 1.00 . A A . 20 CYS HB3 1 1 18 12125 1 1 20 CYS N N 6.614 3.498 6.199 1.00 . A A . 20 CYS N 1 1 18 12126 1 1 20 CYS O O 9.166 3.065 3.777 1.00 . A A . 20 CYS O 1 1 18 12127 1 1 20 CYS SG S 10.496 3.870 6.990 1.00 . A A . 20 CYS SG 1 1 18 12128 1 1 21 ARG C C 7.728 0.001 2.584 1.00 . A A . 21 ARG C 1 1 18 12129 1 1 21 ARG CA C 8.691 0.252 3.795 1.00 . A A . 21 ARG CA 1 1 18 12130 1 1 21 ARG CB C 8.942 -1.026 4.654 1.00 . A A . 21 ARG CB 1 1 18 12131 1 1 21 ARG CD C 10.147 -3.328 4.868 1.00 . A A . 21 ARG CD 1 1 18 12132 1 1 21 ARG CG C 9.910 -2.057 4.022 1.00 . A A . 21 ARG CG 1 1 18 12133 1 1 21 ARG CZ C 12.144 -3.012 6.400 1.00 . A A . 21 ARG CZ 1 1 18 12134 1 1 21 ARG H H 7.531 1.102 5.522 1.00 . A A . 21 ARG H 1 1 18 12135 1 1 21 ARG HA H 9.615 0.628 3.333 1.00 . A A . 21 ARG HA 1 1 18 12136 1 1 21 ARG HB2 H 9.382 -0.752 5.634 1.00 . A A . 21 ARG HB2 1 1 18 12137 1 1 21 ARG HB3 H 7.981 -1.516 4.902 1.00 . A A . 21 ARG HB3 1 1 18 12138 1 1 21 ARG HD2 H 9.181 -3.806 5.113 1.00 . A A . 21 ARG HD2 1 1 18 12139 1 1 21 ARG HD3 H 10.693 -4.078 4.265 1.00 . A A . 21 ARG HD3 1 1 18 12140 1 1 21 ARG HG2 H 9.517 -2.379 3.041 1.00 . A A . 21 ARG HG2 1 1 18 12141 1 1 21 ARG HG3 H 10.879 -1.573 3.797 1.00 . A A . 21 ARG HG3 1 1 18 12142 1 1 21 ARG HH11 H 12.757 -3.431 4.532 1.00 . A A . 21 ARG HH11 1 1 18 12143 1 1 21 ARG HH12 H 14.057 -3.165 5.800 1.00 . A A . 21 ARG HH12 1 1 18 12144 1 1 21 ARG HH21 H 11.773 -2.581 8.320 1.00 . A A . 21 ARG HH21 1 1 18 12145 1 1 21 ARG HH22 H 13.532 -2.713 7.812 1.00 . A A . 21 ARG HH22 1 1 18 12146 1 1 21 ARG N N 8.196 1.276 4.774 1.00 . A A . 21 ARG N 1 1 18 12147 1 1 21 ARG NE N 10.896 -3.054 6.141 1.00 . A A . 21 ARG NE 1 1 18 12148 1 1 21 ARG NH1 N 13.083 -3.225 5.483 1.00 . A A . 21 ARG NH1 1 1 18 12149 1 1 21 ARG NH2 N 12.522 -2.741 7.636 1.00 . A A . 21 ARG NH2 1 1 18 12150 1 1 21 ARG O O 7.604 -1.104 2.047 1.00 . A A . 21 ARG O 1 1 18 12151 1 1 22 GLY C C 4.741 0.435 1.405 1.00 . A A . 22 GLY C 1 1 18 12152 1 1 22 GLY CA C 6.085 1.092 1.059 1.00 . A A . 22 GLY CA 1 1 18 12153 1 1 22 GLY H H 7.240 1.809 2.877 1.00 . A A . 22 GLY H 1 1 18 12154 1 1 22 GLY HA2 H 5.920 2.139 0.739 1.00 . A A . 22 GLY HA2 1 1 18 12155 1 1 22 GLY HA3 H 6.503 0.596 0.177 1.00 . A A . 22 GLY HA3 1 1 18 12156 1 1 22 GLY N N 7.076 1.083 2.162 1.00 . A A . 22 GLY N 1 1 18 12157 1 1 22 GLY O O 4.363 -0.595 0.840 1.00 . A A . 22 GLY O 1 1 18 12158 1 1 23 ARG C C 1.708 1.588 2.968 1.00 . A A . 23 ARG C 1 1 18 12159 1 1 23 ARG CA C 2.865 0.517 3.028 1.00 . A A . 23 ARG CA 1 1 18 12160 1 1 23 ARG CB C 3.207 0.169 4.506 1.00 . A A . 23 ARG CB 1 1 18 12161 1 1 23 ARG CD C 4.810 -1.862 4.241 1.00 . A A . 23 ARG CD 1 1 18 12162 1 1 23 ARG CG C 3.577 -1.257 4.931 1.00 . A A . 23 ARG CG 1 1 18 12163 1 1 23 ARG CZ C 6.065 -4.019 4.626 1.00 . A A . 23 ARG CZ 1 1 18 12164 1 1 23 ARG H H 4.672 1.803 2.766 1.00 . A A . 23 ARG H 1 1 18 12165 1 1 23 ARG HA H 2.543 -0.415 2.528 1.00 . A A . 23 ARG HA 1 1 18 12166 1 1 23 ARG HB2 H 4.038 0.809 4.847 1.00 . A A . 23 ARG HB2 1 1 18 12167 1 1 23 ARG HB3 H 2.346 0.421 5.154 1.00 . A A . 23 ARG HB3 1 1 18 12168 1 1 23 ARG HD2 H 4.574 -2.115 3.190 1.00 . A A . 23 ARG HD2 1 1 18 12169 1 1 23 ARG HD3 H 5.628 -1.120 4.211 1.00 . A A . 23 ARG HD3 1 1 18 12170 1 1 23 ARG HG2 H 3.761 -1.195 6.023 1.00 . A A . 23 ARG HG2 1 1 18 12171 1 1 23 ARG HG3 H 2.696 -1.910 4.818 1.00 . A A . 23 ARG HG3 1 1 18 12172 1 1 23 ARG HH11 H 6.381 -3.348 2.758 1.00 . A A . 23 ARG HH11 1 1 18 12173 1 1 23 ARG HH12 H 7.233 -4.898 3.246 1.00 . A A . 23 ARG HH12 1 1 18 12174 1 1 23 ARG HH21 H 5.904 -4.873 6.429 1.00 . A A . 23 ARG HH21 1 1 18 12175 1 1 23 ARG HH22 H 6.979 -5.707 5.198 1.00 . A A . 23 ARG HH22 1 1 18 12176 1 1 23 ARG N N 4.072 1.070 2.364 1.00 . A A . 23 ARG N 1 1 18 12177 1 1 23 ARG NE N 5.283 -3.077 4.976 1.00 . A A . 23 ARG NE 1 1 18 12178 1 1 23 ARG NH1 N 6.617 -4.096 3.419 1.00 . A A . 23 ARG NH1 1 1 18 12179 1 1 23 ARG NH2 N 6.344 -4.962 5.507 1.00 . A A . 23 ARG NH2 1 1 18 12180 1 1 23 ARG O O 1.943 2.757 3.332 1.00 . A A . 23 ARG O 1 1 18 12181 1 1 24 PRO C C -1.390 2.353 3.965 1.00 . A A . 24 PRO C 1 1 18 12182 1 1 24 PRO CA C -0.713 2.164 2.565 1.00 . A A . 24 PRO CA 1 1 18 12183 1 1 24 PRO CB C -1.625 1.505 1.505 1.00 . A A . 24 PRO CB 1 1 18 12184 1 1 24 PRO CD C 0.095 -0.096 2.010 1.00 . A A . 24 PRO CD 1 1 18 12185 1 1 24 PRO CG C -1.388 0.003 1.658 1.00 . A A . 24 PRO CG 1 1 18 12186 1 1 24 PRO HA H -0.411 3.175 2.225 1.00 . A A . 24 PRO HA 1 1 18 12187 1 1 24 PRO HB2 H -2.694 1.771 1.602 1.00 . A A . 24 PRO HB2 1 1 18 12188 1 1 24 PRO HB3 H -1.319 1.830 0.491 1.00 . A A . 24 PRO HB3 1 1 18 12189 1 1 24 PRO HD2 H 0.279 -0.915 2.732 1.00 . A A . 24 PRO HD2 1 1 18 12190 1 1 24 PRO HD3 H 0.695 -0.300 1.102 1.00 . A A . 24 PRO HD3 1 1 18 12191 1 1 24 PRO HG2 H -2.008 -0.399 2.483 1.00 . A A . 24 PRO HG2 1 1 18 12192 1 1 24 PRO HG3 H -1.649 -0.565 0.746 1.00 . A A . 24 PRO HG3 1 1 18 12193 1 1 24 PRO N N 0.444 1.229 2.573 1.00 . A A . 24 PRO N 1 1 18 12194 1 1 24 PRO O O -0.944 1.802 4.980 1.00 . A A . 24 PRO O 1 1 18 12195 1 1 25 CYS C C -4.758 3.206 5.001 1.00 . A A . 25 CYS C 1 1 18 12196 1 1 25 CYS CA C -3.234 3.449 5.236 1.00 . A A . 25 CYS CA 1 1 18 12197 1 1 25 CYS CB C -2.956 4.919 5.666 1.00 . A A . 25 CYS CB 1 1 18 12198 1 1 25 CYS H H -2.732 3.559 3.087 1.00 . A A . 25 CYS H 1 1 18 12199 1 1 25 CYS HA H -2.901 2.781 6.054 1.00 . A A . 25 CYS HA 1 1 18 12200 1 1 25 CYS HB2 H -2.406 5.478 4.894 1.00 . A A . 25 CYS HB2 1 1 18 12201 1 1 25 CYS HB3 H -3.896 5.461 5.880 1.00 . A A . 25 CYS HB3 1 1 18 12202 1 1 25 CYS N N -2.472 3.155 3.993 1.00 . A A . 25 CYS N 1 1 18 12203 1 1 25 CYS O O -5.297 3.281 3.891 1.00 . A A . 25 CYS O 1 1 18 12204 1 1 25 CYS SG S -1.964 4.852 7.148 1.00 . A A . 25 CYS SG 1 1 18 12205 1 1 26 ARG C C -7.270 3.524 7.506 1.00 . A A . 26 ARG C 1 1 18 12206 1 1 26 ARG CA C -6.899 2.742 6.221 1.00 . A A . 26 ARG CA 1 1 18 12207 1 1 26 ARG CB C -7.283 1.235 6.282 1.00 . A A . 26 ARG CB 1 1 18 12208 1 1 26 ARG CD C -9.687 1.130 7.289 1.00 . A A . 26 ARG CD 1 1 18 12209 1 1 26 ARG CG C -8.774 0.877 6.074 1.00 . A A . 26 ARG CG 1 1 18 12210 1 1 26 ARG CZ C -12.092 0.788 7.904 1.00 . A A . 26 ARG CZ 1 1 18 12211 1 1 26 ARG H H -4.892 3.044 6.996 1.00 . A A . 26 ARG H 1 1 18 12212 1 1 26 ARG HA H -7.389 3.192 5.333 1.00 . A A . 26 ARG HA 1 1 18 12213 1 1 26 ARG HB2 H -6.731 0.711 5.478 1.00 . A A . 26 ARG HB2 1 1 18 12214 1 1 26 ARG HB3 H -6.909 0.769 7.215 1.00 . A A . 26 ARG HB3 1 1 18 12215 1 1 26 ARG HD2 H -9.278 0.625 8.185 1.00 . A A . 26 ARG HD2 1 1 18 12216 1 1 26 ARG HD3 H -9.713 2.209 7.520 1.00 . A A . 26 ARG HD3 1 1 18 12217 1 1 26 ARG HG2 H -9.162 1.410 5.185 1.00 . A A . 26 ARG HG2 1 1 18 12218 1 1 26 ARG HG3 H -8.826 -0.197 5.812 1.00 . A A . 26 ARG HG3 1 1 18 12219 1 1 26 ARG HH11 H -11.053 1.702 9.366 1.00 . A A . 26 ARG HH11 1 1 18 12220 1 1 26 ARG HH12 H -12.834 1.388 9.676 1.00 . A A . 26 ARG HH12 1 1 18 12221 1 1 26 ARG HH21 H -13.335 -0.104 6.613 1.00 . A A . 26 ARG HH21 1 1 18 12222 1 1 26 ARG HH22 H -14.037 0.435 8.221 1.00 . A A . 26 ARG HH22 1 1 18 12223 1 1 26 ARG N N -5.430 2.910 6.127 1.00 . A A . 26 ARG N 1 1 18 12224 1 1 26 ARG NE N -11.070 0.660 7.035 1.00 . A A . 26 ARG NE 1 1 18 12225 1 1 26 ARG NH1 N -11.982 1.351 9.106 1.00 . A A . 26 ARG NH1 1 1 18 12226 1 1 26 ARG NH2 N -13.274 0.326 7.543 1.00 . A A . 26 ARG NH2 1 1 18 12227 1 1 26 ARG O O -6.783 3.217 8.606 1.00 . A A . 26 ARG O 1 1 18 12228 1 1 27 CYS C C -9.228 4.918 9.634 1.00 . A A . 27 CYS C 1 1 18 12229 1 1 27 CYS CA C -8.315 5.505 8.503 1.00 . A A . 27 CYS CA 1 1 18 12230 1 1 27 CYS CB C -8.961 6.802 7.970 1.00 . A A . 27 CYS CB 1 1 18 12231 1 1 27 CYS H H -8.448 4.755 6.425 1.00 . A A . 27 CYS H 1 1 18 12232 1 1 27 CYS HA H -7.295 5.728 8.855 1.00 . A A . 27 CYS HA 1 1 18 12233 1 1 27 CYS HB2 H -9.973 6.631 7.620 1.00 . A A . 27 CYS HB2 1 1 18 12234 1 1 27 CYS HB3 H -9.070 7.542 8.784 1.00 . A A . 27 CYS HB3 1 1 18 12235 1 1 27 CYS N N -8.116 4.563 7.377 1.00 . A A . 27 CYS N 1 1 18 12236 1 1 27 CYS O O -9.908 3.897 9.490 1.00 . A A . 27 CYS O 1 1 18 12237 1 1 27 CYS SG S -7.956 7.577 6.705 1.00 . A A . 27 CYS SG 1 1 18 12238 1 1 28 SER C C -11.670 5.522 11.572 1.00 . A A . 28 SER C 1 1 18 12239 1 1 28 SER CA C -10.146 5.402 11.927 1.00 . A A . 28 SER CA 1 1 18 12240 1 1 28 SER CB C -9.689 6.439 12.995 1.00 . A A . 28 SER CB 1 1 18 12241 1 1 28 SER H H -8.608 6.453 10.743 1.00 . A A . 28 SER H 1 1 18 12242 1 1 28 SER HA H -10.009 4.380 12.328 1.00 . A A . 28 SER HA 1 1 18 12243 1 1 28 SER HB2 H -9.604 7.461 12.577 1.00 . A A . 28 SER HB2 1 1 18 12244 1 1 28 SER HB3 H -10.409 6.543 13.825 1.00 . A A . 28 SER HB3 1 1 18 12245 1 1 28 SER HG H -8.605 5.174 13.958 1.00 . A A . 28 SER HG 1 1 18 12246 1 1 28 SER N N -9.240 5.645 10.768 1.00 . A A . 28 SER N 1 1 18 12247 1 1 28 SER O O -12.081 5.765 10.432 1.00 . A A . 28 SER O 1 1 18 12248 1 1 28 SER OG O -8.450 6.039 13.570 1.00 . A A . 28 SER OG 1 1 18 12249 1 1 29 MET C C -14.749 6.375 11.955 1.00 . A A . 29 MET C 1 1 18 12250 1 1 29 MET CA C -13.985 5.129 12.490 1.00 . A A . 29 MET CA 1 1 18 12251 1 1 29 MET CB C -14.479 4.767 13.921 1.00 . A A . 29 MET CB 1 1 18 12252 1 1 29 MET CE C -15.377 7.875 16.587 1.00 . A A . 29 MET CE 1 1 18 12253 1 1 29 MET CG C -14.363 5.751 15.109 1.00 . A A . 29 MET CG 1 1 18 12254 1 1 29 MET H H -12.024 5.230 13.502 1.00 . A A . 29 MET H 1 1 18 12255 1 1 29 MET HA H -14.213 4.298 11.795 1.00 . A A . 29 MET HA 1 1 18 12256 1 1 29 MET HB2 H -15.532 4.462 13.848 1.00 . A A . 29 MET HB2 1 1 18 12257 1 1 29 MET HB3 H -13.927 3.869 14.217 1.00 . A A . 29 MET HB3 1 1 18 12258 1 1 29 MET HE1 H -14.414 8.398 16.443 1.00 . A A . 29 MET HE1 1 1 18 12259 1 1 29 MET HE2 H -16.158 8.638 16.757 1.00 . A A . 29 MET HE2 1 1 18 12260 1 1 29 MET HE3 H -15.302 7.252 17.497 1.00 . A A . 29 MET HE3 1 1 18 12261 1 1 29 MET HG2 H -14.346 5.187 16.060 1.00 . A A . 29 MET HG2 1 1 18 12262 1 1 29 MET HG3 H -13.419 6.326 15.073 1.00 . A A . 29 MET HG3 1 1 18 12263 1 1 29 MET N N -12.500 5.286 12.600 1.00 . A A . 29 MET N 1 1 18 12264 1 1 29 MET O O -15.669 6.255 11.142 1.00 . A A . 29 MET O 1 1 18 12265 1 1 29 MET SD S -15.782 6.868 15.148 1.00 . A A . 29 MET SD 1 1 18 12266 1 1 30 ILE C C -14.391 9.282 10.574 1.00 . A A . 30 ILE C 1 1 18 12267 1 1 30 ILE CA C -14.884 8.871 12.015 1.00 . A A . 30 ILE CA 1 1 18 12268 1 1 30 ILE CB C -14.500 9.904 13.159 1.00 . A A . 30 ILE CB 1 1 18 12269 1 1 30 ILE CD1 C -16.719 11.288 13.072 1.00 . A A . 30 ILE CD1 1 1 18 12270 1 1 30 ILE CG1 C -15.189 11.286 12.927 1.00 . A A . 30 ILE CG1 1 1 18 12271 1 1 30 ILE CG2 C -12.969 10.180 13.250 1.00 . A A . 30 ILE CG2 1 1 18 12272 1 1 30 ILE H H -13.529 7.351 13.055 1.00 . A A . 30 ILE H 1 1 18 12273 1 1 30 ILE HA H -15.981 8.784 11.939 1.00 . A A . 30 ILE HA 1 1 18 12274 1 1 30 ILE HB H -14.833 9.509 14.138 1.00 . A A . 30 ILE HB 1 1 18 12275 1 1 30 ILE HD11 H -17.037 10.894 14.055 1.00 . A A . 30 ILE HD11 1 1 18 12276 1 1 30 ILE HD12 H -17.123 12.314 12.985 1.00 . A A . 30 ILE HD12 1 1 18 12277 1 1 30 ILE HD13 H -17.212 10.682 12.291 1.00 . A A . 30 ILE HD13 1 1 18 12278 1 1 30 ILE HG12 H -14.801 12.017 13.662 1.00 . A A . 30 ILE HG12 1 1 18 12279 1 1 30 ILE HG13 H -14.915 11.706 11.941 1.00 . A A . 30 ILE HG13 1 1 18 12280 1 1 30 ILE HG21 H -12.383 9.251 13.372 1.00 . A A . 30 ILE HG21 1 1 18 12281 1 1 30 ILE HG22 H -12.572 10.703 12.361 1.00 . A A . 30 ILE HG22 1 1 18 12282 1 1 30 ILE HG23 H -12.726 10.814 14.124 1.00 . A A . 30 ILE HG23 1 1 18 12283 1 1 30 ILE N N -14.328 7.547 12.432 1.00 . A A . 30 ILE N 1 1 18 12284 1 1 30 ILE O O -15.193 9.840 9.821 1.00 . A A . 30 ILE O 1 1 18 12285 1 1 31 GLY C C -11.207 10.174 9.010 1.00 . A A . 31 GLY C 1 1 18 12286 1 1 31 GLY CA C -12.549 9.421 8.898 1.00 . A A . 31 GLY CA 1 1 18 12287 1 1 31 GLY H H -12.567 8.677 10.999 1.00 . A A . 31 GLY H 1 1 18 12288 1 1 31 GLY HA2 H -12.398 8.512 8.287 1.00 . A A . 31 GLY HA2 1 1 18 12289 1 1 31 GLY HA3 H -13.248 10.046 8.310 1.00 . A A . 31 GLY HA3 1 1 18 12290 1 1 31 GLY N N -13.128 9.003 10.202 1.00 . A A . 31 GLY N 1 1 18 12291 1 1 31 GLY O O -10.261 9.865 8.281 1.00 . A A . 31 GLY O 1 1 18 12292 1 1 32 THR C C -9.120 11.044 11.379 1.00 . A A . 32 THR C 1 1 18 12293 1 1 32 THR CA C -9.878 11.862 10.284 1.00 . A A . 32 THR CA 1 1 18 12294 1 1 32 THR CB C -10.177 13.302 10.823 1.00 . A A . 32 THR CB 1 1 18 12295 1 1 32 THR CG2 C -10.777 14.226 9.746 1.00 . A A . 32 THR CG2 1 1 18 12296 1 1 32 THR H H -11.965 11.158 10.540 1.00 . A A . 32 THR H 1 1 18 12297 1 1 32 THR HA H -9.231 11.951 9.387 1.00 . A A . 32 THR HA 1 1 18 12298 1 1 32 THR HB H -9.216 13.732 11.170 1.00 . A A . 32 THR HB 1 1 18 12299 1 1 32 THR HG1 H -10.704 12.700 12.577 1.00 . A A . 32 THR HG1 1 1 18 12300 1 1 32 THR HG21 H -10.112 14.313 8.868 1.00 . A A . 32 THR HG21 1 1 18 12301 1 1 32 THR HG22 H -11.760 13.868 9.385 1.00 . A A . 32 THR HG22 1 1 18 12302 1 1 32 THR HG23 H -10.929 15.248 10.139 1.00 . A A . 32 THR HG23 1 1 18 12303 1 1 32 THR N N -11.144 11.158 9.923 1.00 . A A . 32 THR N 1 1 18 12304 1 1 32 THR O O -9.686 10.188 12.069 1.00 . A A . 32 THR O 1 1 18 12305 1 1 32 THR OG1 O -11.108 13.254 11.905 1.00 . A A . 32 THR OG1 1 1 18 12306 1 1 33 ASN C C -6.670 9.148 11.875 1.00 . A A . 33 ASN C 1 1 18 12307 1 1 33 ASN CA C -6.828 10.613 12.388 1.00 . A A . 33 ASN CA 1 1 18 12308 1 1 33 ASN CB C -7.284 10.647 13.891 1.00 . A A . 33 ASN CB 1 1 18 12309 1 1 33 ASN CG C -7.135 12.020 14.576 1.00 . A A . 33 ASN CG 1 1 18 12310 1 1 33 ASN H H -7.452 11.949 10.764 1.00 . A A . 33 ASN H 1 1 18 12311 1 1 33 ASN HA H -5.840 11.106 12.302 1.00 . A A . 33 ASN HA 1 1 18 12312 1 1 33 ASN HB2 H -8.309 10.254 14.026 1.00 . A A . 33 ASN HB2 1 1 18 12313 1 1 33 ASN HB3 H -6.683 9.922 14.471 1.00 . A A . 33 ASN HB3 1 1 18 12314 1 1 33 ASN HD21 H -9.108 12.351 14.416 1.00 . A A . 33 ASN HD21 1 1 18 12315 1 1 33 ASN HD22 H -8.098 13.663 15.207 1.00 . A A . 33 ASN HD22 1 1 18 12316 1 1 33 ASN N N -7.804 11.334 11.505 1.00 . A A . 33 ASN N 1 1 18 12317 1 1 33 ASN ND2 N -8.225 12.752 14.751 1.00 . A A . 33 ASN ND2 1 1 18 12318 1 1 33 ASN O O -7.036 8.184 12.552 1.00 . A A . 33 ASN O 1 1 18 12319 1 1 33 ASN OD1 O -6.037 12.430 14.951 1.00 . A A . 33 ASN OD1 1 1 18 12320 1 1 34 CYS C C -4.945 6.747 10.701 1.00 . A A . 34 CYS C 1 1 18 12321 1 1 34 CYS CA C -5.995 7.662 9.999 1.00 . A A . 34 CYS CA 1 1 18 12322 1 1 34 CYS CB C -5.572 7.844 8.524 1.00 . A A . 34 CYS CB 1 1 18 12323 1 1 34 CYS H H -5.992 9.886 10.159 1.00 . A A . 34 CYS H 1 1 18 12324 1 1 34 CYS HA H -6.996 7.207 10.023 1.00 . A A . 34 CYS HA 1 1 18 12325 1 1 34 CYS HB2 H -4.567 8.250 8.468 1.00 . A A . 34 CYS HB2 1 1 18 12326 1 1 34 CYS HB3 H -5.523 6.860 8.020 1.00 . A A . 34 CYS HB3 1 1 18 12327 1 1 34 CYS N N -6.101 8.994 10.660 1.00 . A A . 34 CYS N 1 1 18 12328 1 1 34 CYS O O -4.043 7.250 11.384 1.00 . A A . 34 CYS O 1 1 18 12329 1 1 34 CYS SG S -6.765 8.856 7.646 1.00 . A A . 34 CYS SG 1 1 18 12330 1 1 35 GLU C C -3.488 3.636 9.739 1.00 . A A . 35 GLU C 1 1 18 12331 1 1 35 GLU CA C -3.946 4.494 10.960 1.00 . A A . 35 GLU CA 1 1 18 12332 1 1 35 GLU CB C -4.345 3.512 12.103 1.00 . A A . 35 GLU CB 1 1 18 12333 1 1 35 GLU CD C -5.353 2.975 14.378 1.00 . A A . 35 GLU CD 1 1 18 12334 1 1 35 GLU CG C -5.061 4.064 13.343 1.00 . A A . 35 GLU CG 1 1 18 12335 1 1 35 GLU H H -5.774 5.135 9.824 1.00 . A A . 35 GLU H 1 1 18 12336 1 1 35 GLU HA H -3.089 5.103 11.323 1.00 . A A . 35 GLU HA 1 1 18 12337 1 1 35 GLU HB2 H -4.823 2.621 11.674 1.00 . A A . 35 GLU HB2 1 1 18 12338 1 1 35 GLU HB3 H -3.397 3.084 12.487 1.00 . A A . 35 GLU HB3 1 1 18 12339 1 1 35 GLU HE2 H -6.784 1.753 14.875 1.00 . A A . 35 GLU HE2 1 1 18 12340 1 1 35 GLU HG2 H -4.416 4.834 13.805 1.00 . A A . 35 GLU HG2 1 1 18 12341 1 1 35 GLU HG3 H -5.996 4.565 13.046 1.00 . A A . 35 GLU HG3 1 1 18 12342 1 1 35 GLU N N -5.053 5.408 10.519 1.00 . A A . 35 GLU N 1 1 18 12343 1 1 35 GLU O O -4.054 3.616 8.645 1.00 . A A . 35 GLU O 1 1 18 12344 1 1 35 GLU OE1 O -4.545 2.625 15.239 1.00 . A A . 35 GLU OE1 1 1 18 12345 1 1 35 GLU OE2 O -6.605 2.437 14.226 1.00 . A A . 35 GLU OE2 1 1 18 12346 1 1 36 CYS C C -1.965 0.716 8.943 1.00 . A A . 36 CYS C 1 1 18 12347 1 1 36 CYS CA C -1.583 2.219 8.988 1.00 . A A . 36 CYS CA 1 1 18 12348 1 1 36 CYS CB C -0.104 2.438 9.362 1.00 . A A . 36 CYS CB 1 1 18 12349 1 1 36 CYS H H -2.156 2.985 10.998 1.00 . A A . 36 CYS H 1 1 18 12350 1 1 36 CYS HA H -1.750 2.663 7.982 1.00 . A A . 36 CYS HA 1 1 18 12351 1 1 36 CYS HB2 H 0.103 3.503 9.582 1.00 . A A . 36 CYS HB2 1 1 18 12352 1 1 36 CYS HB3 H 0.198 1.851 10.246 1.00 . A A . 36 CYS HB3 1 1 18 12353 1 1 36 CYS N N -2.374 2.952 9.993 1.00 . A A . 36 CYS N 1 1 18 12354 1 1 36 CYS O O -2.445 0.123 9.917 1.00 . A A . 36 CYS O 1 1 18 12355 1 1 36 CYS SG S 0.842 1.940 7.942 1.00 . A A . 36 CYS SG 1 1 18 12356 1 1 37 THR C C -0.280 -1.916 7.886 1.00 . A A . 37 THR C 1 1 18 12357 1 1 37 THR CA C -1.733 -1.375 7.616 1.00 . A A . 37 THR CA 1 1 18 12358 1 1 37 THR CB C -2.209 -1.778 6.182 1.00 . A A . 37 THR CB 1 1 18 12359 1 1 37 THR CG2 C -3.658 -1.332 5.898 1.00 . A A . 37 THR CG2 1 1 18 12360 1 1 37 THR H H -1.285 0.713 7.058 1.00 . A A . 37 THR H 1 1 18 12361 1 1 37 THR HA H -2.454 -1.822 8.327 1.00 . A A . 37 THR HA 1 1 18 12362 1 1 37 THR HB H -2.145 -2.880 6.110 1.00 . A A . 37 THR HB 1 1 18 12363 1 1 37 THR HG1 H -1.728 -1.498 4.336 1.00 . A A . 37 THR HG1 1 1 18 12364 1 1 37 THR HG21 H -4.362 -1.726 6.654 1.00 . A A . 37 THR HG21 1 1 18 12365 1 1 37 THR HG22 H -3.764 -0.230 5.893 1.00 . A A . 37 THR HG22 1 1 18 12366 1 1 37 THR HG23 H -4.002 -1.696 4.913 1.00 . A A . 37 THR HG23 1 1 18 12367 1 1 37 THR N N -1.671 0.101 7.787 1.00 . A A . 37 THR N 1 1 18 12368 1 1 37 THR O O 0.636 -1.492 7.168 1.00 . A A . 37 THR O 1 1 18 12369 1 1 37 THR OG1 O -1.390 -1.181 5.177 1.00 . A A . 37 THR OG1 1 1 18 12370 1 1 38 PRO C C 2.032 -4.016 7.798 1.00 . A A . 38 PRO C 1 1 18 12371 1 1 38 PRO CA C 1.342 -3.450 9.087 1.00 . A A . 38 PRO CA 1 1 18 12372 1 1 38 PRO CB C 1.047 -4.534 10.150 1.00 . A A . 38 PRO CB 1 1 18 12373 1 1 38 PRO CD C -1.001 -3.280 9.863 1.00 . A A . 38 PRO CD 1 1 18 12374 1 1 38 PRO CG C -0.188 -4.045 10.906 1.00 . A A . 38 PRO CG 1 1 18 12375 1 1 38 PRO HA H 2.031 -2.694 9.496 1.00 . A A . 38 PRO HA 1 1 18 12376 1 1 38 PRO HB2 H 0.819 -5.515 9.692 1.00 . A A . 38 PRO HB2 1 1 18 12377 1 1 38 PRO HB3 H 1.907 -4.696 10.826 1.00 . A A . 38 PRO HB3 1 1 18 12378 1 1 38 PRO HD2 H -1.752 -3.929 9.382 1.00 . A A . 38 PRO HD2 1 1 18 12379 1 1 38 PRO HD3 H -1.541 -2.434 10.327 1.00 . A A . 38 PRO HD3 1 1 18 12380 1 1 38 PRO HG2 H -0.762 -4.872 11.362 1.00 . A A . 38 PRO HG2 1 1 18 12381 1 1 38 PRO HG3 H 0.104 -3.370 11.730 1.00 . A A . 38 PRO HG3 1 1 18 12382 1 1 38 PRO N N -0.008 -2.836 8.867 1.00 . A A . 38 PRO N 1 1 18 12383 1 1 38 PRO O O 3.151 -3.610 7.471 1.00 . A A . 38 PRO O 1 1 18 12384 1 1 39 ARG C C 0.375 -5.753 5.026 1.00 . A A . 39 ARG C 1 1 18 12385 1 1 39 ARG CA C 1.723 -5.367 5.713 1.00 . A A . 39 ARG CA 1 1 18 12386 1 1 39 ARG CB C 2.771 -6.521 5.805 1.00 . A A . 39 ARG CB 1 1 18 12387 1 1 39 ARG CD C 4.425 -8.038 4.558 1.00 . A A . 39 ARG CD 1 1 18 12388 1 1 39 ARG CG C 3.374 -6.921 4.442 1.00 . A A . 39 ARG CG 1 1 18 12389 1 1 39 ARG CZ C 6.018 -9.219 3.025 1.00 . A A . 39 ARG CZ 1 1 18 12390 1 1 39 ARG H H 0.418 -5.120 7.475 1.00 . A A . 39 ARG H 1 1 18 12391 1 1 39 ARG HA H 2.165 -4.527 5.150 1.00 . A A . 39 ARG HA 1 1 18 12392 1 1 39 ARG HB2 H 3.603 -6.203 6.463 1.00 . A A . 39 ARG HB2 1 1 18 12393 1 1 39 ARG HB3 H 2.337 -7.410 6.304 1.00 . A A . 39 ARG HB3 1 1 18 12394 1 1 39 ARG HD2 H 5.222 -7.735 5.263 1.00 . A A . 39 ARG HD2 1 1 18 12395 1 1 39 ARG HD3 H 3.963 -8.951 4.980 1.00 . A A . 39 ARG HD3 1 1 18 12396 1 1 39 ARG HG2 H 2.567 -7.242 3.759 1.00 . A A . 39 ARG HG2 1 1 18 12397 1 1 39 ARG HG3 H 3.826 -6.026 3.971 1.00 . A A . 39 ARG HG3 1 1 18 12398 1 1 39 ARG HH11 H 6.250 -9.777 4.945 1.00 . A A . 39 ARG HH11 1 1 18 12399 1 1 39 ARG HH12 H 7.354 -10.561 3.707 1.00 . A A . 39 ARG HH12 1 1 18 12400 1 1 39 ARG HH21 H 5.984 -8.833 1.060 1.00 . A A . 39 ARG HH21 1 1 18 12401 1 1 39 ARG HH22 H 7.212 -10.060 1.655 1.00 . A A . 39 ARG HH22 1 1 18 12402 1 1 39 ARG N N 1.335 -4.904 7.070 1.00 . A A . 39 ARG N 1 1 18 12403 1 1 39 ARG NE N 5.017 -8.342 3.232 1.00 . A A . 39 ARG NE 1 1 18 12404 1 1 39 ARG NH1 N 6.601 -9.926 3.992 1.00 . A A . 39 ARG NH1 1 1 18 12405 1 1 39 ARG NH2 N 6.448 -9.388 1.788 1.00 . A A . 39 ARG NH2 1 1 18 12406 1 1 39 ARG O O -0.135 -4.969 4.221 1.00 . A A . 39 ARG O 1 1 18 12407 1 1 40 LEU C C -2.436 -7.328 6.296 1.00 . A A . 40 LEU C 1 1 18 12408 1 1 40 LEU CA C -1.586 -7.316 4.991 1.00 . A A . 40 LEU CA 1 1 18 12409 1 1 40 LEU CB C -1.608 -8.730 4.329 1.00 . A A . 40 LEU CB 1 1 18 12410 1 1 40 LEU CD1 C -2.159 -8.117 1.876 1.00 . A A . 40 LEU CD1 1 1 18 12411 1 1 40 LEU CD2 C 0.254 -8.584 2.516 1.00 . A A . 40 LEU CD2 1 1 18 12412 1 1 40 LEU CG C -1.223 -8.887 2.829 1.00 . A A . 40 LEU CG 1 1 18 12413 1 1 40 LEU H H 0.348 -7.450 6.055 1.00 . A A . 40 LEU H 1 1 18 12414 1 1 40 LEU HA H -2.011 -6.591 4.268 1.00 . A A . 40 LEU HA 1 1 18 12415 1 1 40 LEU HB2 H -0.999 -9.433 4.930 1.00 . A A . 40 LEU HB2 1 1 18 12416 1 1 40 LEU HB3 H -2.634 -9.141 4.418 1.00 . A A . 40 LEU HB3 1 1 18 12417 1 1 40 LEU HD11 H -3.221 -8.364 2.061 1.00 . A A . 40 LEU HD11 1 1 18 12418 1 1 40 LEU HD12 H -2.054 -7.021 1.979 1.00 . A A . 40 LEU HD12 1 1 18 12419 1 1 40 LEU HD13 H -1.955 -8.364 0.818 1.00 . A A . 40 LEU HD13 1 1 18 12420 1 1 40 LEU HD21 H 0.936 -9.135 3.191 1.00 . A A . 40 LEU HD21 1 1 18 12421 1 1 40 LEU HD22 H 0.519 -8.879 1.484 1.00 . A A . 40 LEU HD22 1 1 18 12422 1 1 40 LEU HD23 H 0.487 -7.508 2.614 1.00 . A A . 40 LEU HD23 1 1 18 12423 1 1 40 LEU HG H -1.366 -9.959 2.597 1.00 . A A . 40 LEU HG 1 1 18 12424 1 1 40 LEU N N -0.206 -6.919 5.375 1.00 . A A . 40 LEU N 1 1 18 12425 1 1 40 LEU O O -2.037 -7.913 7.311 1.00 . A A . 40 LEU O 1 1 18 12426 1 1 41 ILE C C -5.532 -7.880 7.294 1.00 . A A . 41 ILE C 1 1 18 12427 1 1 41 ILE CA C -4.567 -6.654 7.412 1.00 . A A . 41 ILE CA 1 1 18 12428 1 1 41 ILE CB C -5.384 -5.288 7.472 1.00 . A A . 41 ILE CB 1 1 18 12429 1 1 41 ILE CD1 C -6.605 -5.245 5.114 1.00 . A A . 41 ILE CD1 1 1 18 12430 1 1 41 ILE CG1 C -5.671 -4.552 6.115 1.00 . A A . 41 ILE CG1 1 1 18 12431 1 1 41 ILE CG2 C -4.567 -4.301 8.345 1.00 . A A . 41 ILE CG2 1 1 18 12432 1 1 41 ILE H H -3.850 -6.259 5.351 1.00 . A A . 41 ILE H 1 1 18 12433 1 1 41 ILE HA H -3.995 -6.756 8.359 1.00 . A A . 41 ILE HA 1 1 18 12434 1 1 41 ILE HB H -6.364 -5.437 7.964 1.00 . A A . 41 ILE HB 1 1 18 12435 1 1 41 ILE HD11 H -7.570 -5.521 5.578 1.00 . A A . 41 ILE HD11 1 1 18 12436 1 1 41 ILE HD12 H -6.830 -4.582 4.259 1.00 . A A . 41 ILE HD12 1 1 18 12437 1 1 41 ILE HD13 H -6.151 -6.162 4.696 1.00 . A A . 41 ILE HD13 1 1 18 12438 1 1 41 ILE HG12 H -6.132 -3.570 6.336 1.00 . A A . 41 ILE HG12 1 1 18 12439 1 1 41 ILE HG13 H -4.725 -4.300 5.599 1.00 . A A . 41 ILE HG13 1 1 18 12440 1 1 41 ILE HG21 H -4.383 -4.702 9.359 1.00 . A A . 41 ILE HG21 1 1 18 12441 1 1 41 ILE HG22 H -3.581 -4.070 7.900 1.00 . A A . 41 ILE HG22 1 1 18 12442 1 1 41 ILE HG23 H -5.094 -3.339 8.488 1.00 . A A . 41 ILE HG23 1 1 18 12443 1 1 41 ILE N N -3.627 -6.700 6.249 1.00 . A A . 41 ILE N 1 1 18 12444 1 1 41 ILE O O -6.530 -7.868 6.568 1.00 . A A . 41 ILE O 1 1 18 12445 1 1 42 MET C C -5.794 -10.826 9.514 1.00 . A A . 42 MET C 1 1 18 12446 1 1 42 MET CA C -6.036 -10.183 8.117 1.00 . A A . 42 MET CA 1 1 18 12447 1 1 42 MET CB C -5.681 -11.171 6.960 1.00 . A A . 42 MET CB 1 1 18 12448 1 1 42 MET CE C -1.545 -11.890 6.849 1.00 . A A . 42 MET CE 1 1 18 12449 1 1 42 MET CG C -4.321 -11.900 6.930 1.00 . A A . 42 MET CG 1 1 18 12450 1 1 42 MET H H -4.350 -8.843 8.600 1.00 . A A . 42 MET H 1 1 18 12451 1 1 42 MET HA H -7.107 -9.909 8.020 1.00 . A A . 42 MET HA 1 1 18 12452 1 1 42 MET HB2 H -6.465 -11.951 6.941 1.00 . A A . 42 MET HB2 1 1 18 12453 1 1 42 MET HB3 H -5.810 -10.648 5.993 1.00 . A A . 42 MET HB3 1 1 18 12454 1 1 42 MET HE1 H -1.623 -12.581 5.990 1.00 . A A . 42 MET HE1 1 1 18 12455 1 1 42 MET HE2 H -0.594 -11.336 6.758 1.00 . A A . 42 MET HE2 1 1 18 12456 1 1 42 MET HE3 H -1.504 -12.490 7.777 1.00 . A A . 42 MET HE3 1 1 18 12457 1 1 42 MET HG2 H -4.216 -12.582 7.794 1.00 . A A . 42 MET HG2 1 1 18 12458 1 1 42 MET HG3 H -4.267 -12.536 6.030 1.00 . A A . 42 MET HG3 1 1 18 12459 1 1 42 MET N N -5.202 -8.954 8.039 1.00 . A A . 42 MET N 1 1 18 12460 1 1 42 MET O O -4.651 -11.066 9.923 1.00 . A A . 42 MET O 1 1 18 12461 1 1 42 MET SD S -2.938 -10.747 6.887 1.00 . A A . 42 MET SD 1 1 18 12462 1 1 43 GLU C C -7.024 -13.158 11.608 1.00 . A A . 43 GLU C 1 1 18 12463 1 1 43 GLU CA C -6.827 -11.615 11.635 1.00 . A A . 43 GLU CA 1 1 18 12464 1 1 43 GLU CB C -7.934 -10.968 12.514 1.00 . A A . 43 GLU CB 1 1 18 12465 1 1 43 GLU CD C -6.653 -8.840 13.284 1.00 . A A . 43 GLU CD 1 1 18 12466 1 1 43 GLU CG C -7.926 -9.426 12.660 1.00 . A A . 43 GLU CG 1 1 18 12467 1 1 43 GLU H H -7.782 -10.848 9.794 1.00 . A A . 43 GLU H 1 1 18 12468 1 1 43 GLU HA H -5.848 -11.364 12.096 1.00 . A A . 43 GLU HA 1 1 18 12469 1 1 43 GLU HB2 H -8.924 -11.279 12.136 1.00 . A A . 43 GLU HB2 1 1 18 12470 1 1 43 GLU HB3 H -7.882 -11.403 13.531 1.00 . A A . 43 GLU HB3 1 1 18 12471 1 1 43 GLU HE2 H -5.866 -8.548 15.040 1.00 . A A . 43 GLU HE2 1 1 18 12472 1 1 43 GLU HG2 H -8.091 -8.955 11.672 1.00 . A A . 43 GLU HG2 1 1 18 12473 1 1 43 GLU HG3 H -8.797 -9.117 13.267 1.00 . A A . 43 GLU HG3 1 1 18 12474 1 1 43 GLU N N -6.892 -11.094 10.242 1.00 . A A . 43 GLU N 1 1 18 12475 1 1 43 GLU O O -7.961 -13.678 10.991 1.00 . A A . 43 GLU O 1 1 18 12476 1 1 43 GLU OE1 O -5.733 -8.361 12.621 1.00 . A A . 43 GLU OE1 1 1 18 12477 1 1 43 GLU OE2 O -6.664 -8.915 14.654 1.00 . A A . 43 GLU OE2 1 1 18 12478 1 1 44 GLY C C -5.034 -15.994 11.558 1.00 . A A . 44 GLY C 1 1 18 12479 1 1 44 GLY CA C -6.138 -15.339 12.408 1.00 . A A . 44 GLY CA 1 1 18 12480 1 1 44 GLY H H -5.470 -13.278 12.841 1.00 . A A . 44 GLY H 1 1 18 12481 1 1 44 GLY HA2 H -6.020 -15.622 13.471 1.00 . A A . 44 GLY HA2 1 1 18 12482 1 1 44 GLY HA3 H -7.121 -15.761 12.121 1.00 . A A . 44 GLY HA3 1 1 18 12483 1 1 44 GLY N N -6.124 -13.862 12.310 1.00 . A A . 44 GLY N 1 1 18 12484 1 1 44 GLY O O -5.314 -16.471 10.457 1.00 . A A . 44 GLY O 1 1 18 12485 1 1 45 LEU C C -2.238 -15.919 10.118 1.00 . A A . 45 LEU C 1 1 18 12486 1 1 45 LEU CA C -2.570 -16.634 11.481 1.00 . A A . 45 LEU CA 1 1 18 12487 1 1 45 LEU CB C -2.797 -18.188 11.377 1.00 . A A . 45 LEU CB 1 1 18 12488 1 1 45 LEU CD1 C -0.464 -19.052 12.083 1.00 . A A . 45 LEU CD1 1 1 18 12489 1 1 45 LEU CD2 C -1.971 -20.488 10.654 1.00 . A A . 45 LEU CD2 1 1 18 12490 1 1 45 LEU CG C -1.555 -19.043 10.992 1.00 . A A . 45 LEU CG 1 1 18 12491 1 1 45 LEU H H -3.741 -15.582 13.023 1.00 . A A . 45 LEU H 1 1 18 12492 1 1 45 LEU HA H -1.712 -16.426 12.142 1.00 . A A . 45 LEU HA 1 1 18 12493 1 1 45 LEU HB2 H -3.185 -18.569 12.343 1.00 . A A . 45 LEU HB2 1 1 18 12494 1 1 45 LEU HB3 H -3.613 -18.395 10.657 1.00 . A A . 45 LEU HB3 1 1 18 12495 1 1 45 LEU HD11 H -0.840 -19.454 13.043 1.00 . A A . 45 LEU HD11 1 1 18 12496 1 1 45 LEU HD12 H 0.405 -19.668 11.787 1.00 . A A . 45 LEU HD12 1 1 18 12497 1 1 45 LEU HD13 H -0.073 -18.038 12.283 1.00 . A A . 45 LEU HD13 1 1 18 12498 1 1 45 LEU HD21 H -2.704 -20.517 9.826 1.00 . A A . 45 LEU HD21 1 1 18 12499 1 1 45 LEU HD22 H -1.107 -21.098 10.332 1.00 . A A . 45 LEU HD22 1 1 18 12500 1 1 45 LEU HD23 H -2.432 -21.002 11.519 1.00 . A A . 45 LEU HD23 1 1 18 12501 1 1 45 LEU HG H -1.106 -18.619 10.075 1.00 . A A . 45 LEU HG 1 1 18 12502 1 1 45 LEU N N -3.793 -16.022 12.098 1.00 . A A . 45 LEU N 1 1 18 12503 1 1 45 LEU O O -1.591 -14.868 10.159 1.00 . A A . 45 LEU O 1 1 18 12504 1 1 46 SER C C -3.360 -16.277 6.583 1.00 . A A . 46 SER C 1 1 18 12505 1 1 46 SER CA C -2.259 -15.914 7.619 1.00 . A A . 46 SER CA 1 1 18 12506 1 1 46 SER CB C -0.892 -16.500 7.174 1.00 . A A . 46 SER CB 1 1 18 12507 1 1 46 SER H H -3.142 -17.348 9.051 1.00 . A A . 46 SER H 1 1 18 12508 1 1 46 SER HA H -2.165 -14.811 7.683 1.00 . A A . 46 SER HA 1 1 18 12509 1 1 46 SER HB2 H -0.598 -16.079 6.194 1.00 . A A . 46 SER HB2 1 1 18 12510 1 1 46 SER HB3 H -0.096 -16.186 7.875 1.00 . A A . 46 SER HB3 1 1 18 12511 1 1 46 SER HG H -0.010 -18.174 6.811 1.00 . A A . 46 SER HG 1 1 18 12512 1 1 46 SER N N -2.638 -16.461 8.949 1.00 . A A . 46 SER N 1 1 18 12513 1 1 46 SER O O -3.824 -17.421 6.507 1.00 . A A . 46 SER O 1 1 18 12514 1 1 46 SER OG O -0.895 -17.923 7.086 1.00 . A A . 46 SER OG 1 1 18 12515 1 1 47 PHE C C -4.173 -14.655 3.440 1.00 . A A . 47 PHE C 1 1 18 12516 1 1 47 PHE CA C -4.715 -15.460 4.652 1.00 . A A . 47 PHE CA 1 1 18 12517 1 1 47 PHE CB C -6.135 -14.949 5.044 1.00 . A A . 47 PHE CB 1 1 18 12518 1 1 47 PHE CD1 C -7.443 -17.008 5.784 1.00 . A A . 47 PHE CD1 1 1 18 12519 1 1 47 PHE CD2 C -6.983 -15.298 7.428 1.00 . A A . 47 PHE CD2 1 1 18 12520 1 1 47 PHE CE1 C -8.107 -17.758 6.751 1.00 . A A . 47 PHE CE1 1 1 18 12521 1 1 47 PHE CE2 C -7.656 -16.048 8.390 1.00 . A A . 47 PHE CE2 1 1 18 12522 1 1 47 PHE CG C -6.873 -15.773 6.116 1.00 . A A . 47 PHE CG 1 1 18 12523 1 1 47 PHE CZ C -8.213 -17.278 8.053 1.00 . A A . 47 PHE CZ 1 1 18 12524 1 1 47 PHE H H -3.276 -14.382 5.934 1.00 . A A . 47 PHE H 1 1 18 12525 1 1 47 PHE HA H -4.803 -16.534 4.385 1.00 . A A . 47 PHE HA 1 1 18 12526 1 1 47 PHE HB2 H -6.090 -13.885 5.344 1.00 . A A . 47 PHE HB2 1 1 18 12527 1 1 47 PHE HB3 H -6.771 -14.934 4.136 1.00 . A A . 47 PHE HB3 1 1 18 12528 1 1 47 PHE HD1 H -7.368 -17.394 4.777 1.00 . A A . 47 PHE HD1 1 1 18 12529 1 1 47 PHE HD2 H -6.544 -14.351 7.711 1.00 . A A . 47 PHE HD2 1 1 18 12530 1 1 47 PHE HE1 H -8.541 -18.712 6.491 1.00 . A A . 47 PHE HE1 1 1 18 12531 1 1 47 PHE HE2 H -7.737 -15.683 9.402 1.00 . A A . 47 PHE HE2 1 1 18 12532 1 1 47 PHE HZ H -8.728 -17.860 8.804 1.00 . A A . 47 PHE HZ 1 1 18 12533 1 1 47 PHE N N -3.745 -15.279 5.767 1.00 . A A . 47 PHE N 1 1 18 12534 1 1 47 PHE O O -4.113 -13.420 3.469 1.00 . A A . 47 PHE O 1 1 18 12535 1 1 48 ALA C C -4.359 -14.445 0.135 1.00 . A A . 48 ALA C 1 1 18 12536 1 1 48 ALA CA C -3.228 -14.766 1.140 1.00 . A A . 48 ALA CA 1 1 18 12537 1 1 48 ALA CB C -2.210 -15.750 0.531 1.00 . A A . 48 ALA CB 1 1 18 12538 1 1 48 ALA H H -3.887 -16.394 2.477 1.00 . A A . 48 ALA H 1 1 18 12539 1 1 48 ALA HXT H -5.759 -15.334 -0.892 1.00 . A A . 48 ALA HXT 1 1 18 12540 1 1 48 ALA HA H -2.695 -13.823 1.372 1.00 . A A . 48 ALA HA 1 1 18 12541 1 1 48 ALA HB1 H -2.661 -16.727 0.270 1.00 . A A . 48 ALA HB1 1 1 18 12542 1 1 48 ALA HB2 H -1.760 -15.343 -0.395 1.00 . A A . 48 ALA HB2 1 1 18 12543 1 1 48 ALA HB3 H -1.372 -15.951 1.224 1.00 . A A . 48 ALA HB3 1 1 18 12544 1 1 48 ALA N N -3.785 -15.378 2.373 1.00 . A A . 48 ALA N 1 1 18 12545 1 1 48 ALA O O -4.599 -13.302 -0.250 1.00 . A A . 48 ALA O 1 1 18 12546 1 1 48 ALA OXT O -5.061 -15.557 -0.272 1.00 . A A . 48 ALA OXT 1 1 19 12547 1 1 1 GLU C C 13.038 12.586 5.320 1.00 . A A . 1 GLU C 1 1 19 12548 1 1 1 GLU CA C 13.055 13.765 4.312 1.00 . A A . 1 GLU CA 1 1 19 12549 1 1 1 GLU CB C 11.771 13.737 3.432 1.00 . A A . 1 GLU CB 1 1 19 12550 1 1 1 GLU CD C 11.198 16.256 3.262 1.00 . A A . 1 GLU CD 1 1 19 12551 1 1 1 GLU CG C 11.530 14.958 2.514 1.00 . A A . 1 GLU CG 1 1 19 12552 1 1 1 GLU H1 H 14.276 12.749 2.954 1.00 . A A . 1 GLU H1 1 1 19 12553 1 1 1 GLU H2 H 14.333 14.391 2.781 1.00 . A A . 1 GLU H2 1 1 19 12554 1 1 1 GLU HA H 13.106 14.730 4.855 1.00 . A A . 1 GLU HA 1 1 19 12555 1 1 1 GLU HB2 H 11.770 12.825 2.804 1.00 . A A . 1 GLU HB2 1 1 19 12556 1 1 1 GLU HB3 H 10.882 13.622 4.082 1.00 . A A . 1 GLU HB3 1 1 19 12557 1 1 1 GLU HE2 H 12.081 17.880 3.870 1.00 . A A . 1 GLU HE2 1 1 19 12558 1 1 1 GLU HG2 H 12.395 15.113 1.843 1.00 . A A . 1 GLU HG2 1 1 19 12559 1 1 1 GLU HG3 H 10.686 14.730 1.837 1.00 . A A . 1 GLU HG3 1 1 19 12560 1 1 1 GLU N N 14.268 13.635 3.471 1.00 . A A . 1 GLU N 1 1 19 12561 1 1 1 GLU O O 12.934 11.417 4.928 1.00 . A A . 1 GLU O 1 1 19 12562 1 1 1 GLU OE1 O 10.074 16.527 3.682 1.00 . A A . 1 GLU OE1 1 1 19 12563 1 1 1 GLU OE2 O 12.294 17.069 3.404 1.00 . A A . 1 GLU OE2 1 1 19 12564 1 1 2 ASP C C 11.710 12.165 8.486 1.00 . A A . 2 ASP C 1 1 19 12565 1 1 2 ASP CA C 13.041 11.914 7.723 1.00 . A A . 2 ASP CA 1 1 19 12566 1 1 2 ASP CB C 14.271 12.053 8.665 1.00 . A A . 2 ASP CB 1 1 19 12567 1 1 2 ASP CG C 15.603 11.582 8.060 1.00 . A A . 2 ASP CG 1 1 19 12568 1 1 2 ASP H H 13.194 13.922 6.810 1.00 . A A . 2 ASP H 1 1 19 12569 1 1 2 ASP HA H 13.049 10.876 7.329 1.00 . A A . 2 ASP HA 1 1 19 12570 1 1 2 ASP HB2 H 14.374 13.094 9.031 1.00 . A A . 2 ASP HB2 1 1 19 12571 1 1 2 ASP HB3 H 14.099 11.453 9.579 1.00 . A A . 2 ASP HB3 1 1 19 12572 1 1 2 ASP HD2 H 15.834 13.445 7.544 1.00 . A A . 2 ASP HD2 1 1 19 12573 1 1 2 ASP N N 13.119 12.916 6.623 1.00 . A A . 2 ASP N 1 1 19 12574 1 1 2 ASP O O 11.632 13.026 9.369 1.00 . A A . 2 ASP O 1 1 19 12575 1 1 2 ASP OD1 O 15.988 10.414 8.099 1.00 . A A . 2 ASP OD1 1 1 19 12576 1 1 2 ASP OD2 O 16.299 12.608 7.474 1.00 . A A . 2 ASP OD2 1 1 19 12577 1 1 3 ASN C C 8.545 10.385 7.874 1.00 . A A . 3 ASN C 1 1 19 12578 1 1 3 ASN CA C 9.353 11.332 8.790 1.00 . A A . 3 ASN CA 1 1 19 12579 1 1 3 ASN CB C 8.639 12.689 8.957 1.00 . A A . 3 ASN CB 1 1 19 12580 1 1 3 ASN CG C 7.153 12.693 9.386 1.00 . A A . 3 ASN CG 1 1 19 12581 1 1 3 ASN H H 10.890 10.610 7.488 1.00 . A A . 3 ASN H 1 1 19 12582 1 1 3 ASN HA H 9.501 10.912 9.811 1.00 . A A . 3 ASN HA 1 1 19 12583 1 1 3 ASN HB2 H 9.186 13.065 9.823 1.00 . A A . 3 ASN HB2 1 1 19 12584 1 1 3 ASN HB3 H 8.837 13.375 8.109 1.00 . A A . 3 ASN HB3 1 1 19 12585 1 1 3 ASN HD21 H 6.681 13.858 7.823 1.00 . A A . 3 ASN HD21 1 1 19 12586 1 1 3 ASN HD22 H 5.315 13.359 8.941 1.00 . A A . 3 ASN HD22 1 1 19 12587 1 1 3 ASN N N 10.670 11.393 8.112 1.00 . A A . 3 ASN N 1 1 19 12588 1 1 3 ASN ND2 N 6.295 13.371 8.639 1.00 . A A . 3 ASN ND2 1 1 19 12589 1 1 3 ASN O O 7.951 10.726 6.845 1.00 . A A . 3 ASN O 1 1 19 12590 1 1 3 ASN OD1 O 6.769 12.084 10.384 1.00 . A A . 3 ASN OD1 1 1 19 12591 1 1 4 CYS C C 6.972 7.362 9.035 1.00 . A A . 4 CYS C 1 1 19 12592 1 1 4 CYS CA C 7.808 8.015 7.877 1.00 . A A . 4 CYS CA 1 1 19 12593 1 1 4 CYS CB C 8.758 7.008 7.241 1.00 . A A . 4 CYS CB 1 1 19 12594 1 1 4 CYS H H 9.256 9.266 9.161 1.00 . A A . 4 CYS H 1 1 19 12595 1 1 4 CYS HA H 7.108 8.308 7.077 1.00 . A A . 4 CYS HA 1 1 19 12596 1 1 4 CYS HB2 H 8.039 6.238 7.040 1.00 . A A . 4 CYS HB2 1 1 19 12597 1 1 4 CYS HB3 H 9.109 7.276 6.233 1.00 . A A . 4 CYS HB3 1 1 19 12598 1 1 4 CYS N N 8.591 9.169 8.380 1.00 . A A . 4 CYS N 1 1 19 12599 1 1 4 CYS O O 7.138 7.699 10.214 1.00 . A A . 4 CYS O 1 1 19 12600 1 1 4 CYS SG S 9.997 6.164 8.237 1.00 . A A . 4 CYS SG 1 1 19 12601 1 1 5 ILE C C 5.962 4.242 9.740 1.00 . A A . 5 ILE C 1 1 19 12602 1 1 5 ILE CA C 5.299 5.629 9.738 1.00 . A A . 5 ILE CA 1 1 19 12603 1 1 5 ILE CB C 3.745 5.446 9.479 1.00 . A A . 5 ILE CB 1 1 19 12604 1 1 5 ILE CD1 C 3.203 7.924 9.899 1.00 . A A . 5 ILE CD1 1 1 19 12605 1 1 5 ILE CG1 C 3.067 6.731 8.987 1.00 . A A . 5 ILE CG1 1 1 19 12606 1 1 5 ILE CG2 C 3.025 4.948 10.774 1.00 . A A . 5 ILE CG2 1 1 19 12607 1 1 5 ILE H H 6.161 6.115 7.673 1.00 . A A . 5 ILE H 1 1 19 12608 1 1 5 ILE HA H 5.406 6.134 10.716 1.00 . A A . 5 ILE HA 1 1 19 12609 1 1 5 ILE HB H 3.490 4.690 8.754 1.00 . A A . 5 ILE HB 1 1 19 12610 1 1 5 ILE HD11 H 3.137 7.625 10.950 1.00 . A A . 5 ILE HD11 1 1 19 12611 1 1 5 ILE HD12 H 4.189 8.382 9.714 1.00 . A A . 5 ILE HD12 1 1 19 12612 1 1 5 ILE HD13 H 2.404 8.632 9.667 1.00 . A A . 5 ILE HD13 1 1 19 12613 1 1 5 ILE HG12 H 3.429 7.055 8.005 1.00 . A A . 5 ILE HG12 1 1 19 12614 1 1 5 ILE HG13 H 2.032 6.478 8.755 1.00 . A A . 5 ILE HG13 1 1 19 12615 1 1 5 ILE HG21 H 3.159 5.587 11.664 1.00 . A A . 5 ILE HG21 1 1 19 12616 1 1 5 ILE HG22 H 1.930 4.867 10.614 1.00 . A A . 5 ILE HG22 1 1 19 12617 1 1 5 ILE HG23 H 3.340 3.928 11.058 1.00 . A A . 5 ILE HG23 1 1 19 12618 1 1 5 ILE N N 6.062 6.406 8.679 1.00 . A A . 5 ILE N 1 1 19 12619 1 1 5 ILE O O 5.660 3.386 8.910 1.00 . A A . 5 ILE O 1 1 19 12620 1 1 6 ALA C C 6.803 1.428 11.135 1.00 . A A . 6 ALA C 1 1 19 12621 1 1 6 ALA CA C 7.625 2.674 10.625 1.00 . A A . 6 ALA CA 1 1 19 12622 1 1 6 ALA CB C 8.887 2.883 11.486 1.00 . A A . 6 ALA CB 1 1 19 12623 1 1 6 ALA H H 6.934 4.674 11.407 1.00 . A A . 6 ALA H 1 1 19 12624 1 1 6 ALA HA H 7.874 2.481 9.557 1.00 . A A . 6 ALA HA 1 1 19 12625 1 1 6 ALA HB1 H 9.504 3.726 11.120 1.00 . A A . 6 ALA HB1 1 1 19 12626 1 1 6 ALA HB2 H 8.647 3.084 12.548 1.00 . A A . 6 ALA HB2 1 1 19 12627 1 1 6 ALA HB3 H 9.540 1.991 11.467 1.00 . A A . 6 ALA HB3 1 1 19 12628 1 1 6 ALA N N 6.878 3.971 10.669 1.00 . A A . 6 ALA N 1 1 19 12629 1 1 6 ALA O O 7.371 0.346 11.312 1.00 . A A . 6 ALA O 1 1 19 12630 1 1 7 GLU C C 3.245 0.399 11.371 1.00 . A A . 7 GLU C 1 1 19 12631 1 1 7 GLU CA C 4.608 0.598 12.026 1.00 . A A . 7 GLU CA 1 1 19 12632 1 1 7 GLU CB C 4.414 1.066 13.511 1.00 . A A . 7 GLU CB 1 1 19 12633 1 1 7 GLU CD C 6.803 1.356 14.538 1.00 . A A . 7 GLU CD 1 1 19 12634 1 1 7 GLU CG C 5.468 0.601 14.543 1.00 . A A . 7 GLU CG 1 1 19 12635 1 1 7 GLU H H 5.276 2.596 11.225 1.00 . A A . 7 GLU H 1 1 19 12636 1 1 7 GLU HA H 5.054 -0.374 11.947 1.00 . A A . 7 GLU HA 1 1 19 12637 1 1 7 GLU HB2 H 4.278 2.164 13.572 1.00 . A A . 7 GLU HB2 1 1 19 12638 1 1 7 GLU HB3 H 3.444 0.691 13.893 1.00 . A A . 7 GLU HB3 1 1 19 12639 1 1 7 GLU HE2 H 7.493 3.152 14.835 1.00 . A A . 7 GLU HE2 1 1 19 12640 1 1 7 GLU HG2 H 5.037 0.702 15.557 1.00 . A A . 7 GLU HG2 1 1 19 12641 1 1 7 GLU HG3 H 5.654 -0.482 14.424 1.00 . A A . 7 GLU HG3 1 1 19 12642 1 1 7 GLU N N 5.482 1.594 11.355 1.00 . A A . 7 GLU N 1 1 19 12643 1 1 7 GLU O O 2.609 1.355 10.951 1.00 . A A . 7 GLU O 1 1 19 12644 1 1 7 GLU OE1 O 7.883 0.817 14.298 1.00 . A A . 7 GLU OE1 1 1 19 12645 1 1 7 GLU OE2 O 6.653 2.686 14.838 1.00 . A A . 7 GLU OE2 1 1 19 12646 1 1 8 ASP C C 0.587 -0.910 12.306 1.00 . A A . 8 ASP C 1 1 19 12647 1 1 8 ASP CA C 1.434 -1.317 11.073 1.00 . A A . 8 ASP CA 1 1 19 12648 1 1 8 ASP CB C 1.278 -2.837 10.874 1.00 . A A . 8 ASP CB 1 1 19 12649 1 1 8 ASP CG C 2.073 -3.399 9.683 1.00 . A A . 8 ASP CG 1 1 19 12650 1 1 8 ASP H H 3.488 -1.547 11.803 1.00 . A A . 8 ASP H 1 1 19 12651 1 1 8 ASP HA H 1.091 -0.845 10.129 1.00 . A A . 8 ASP HA 1 1 19 12652 1 1 8 ASP HB2 H 1.496 -3.324 11.830 1.00 . A A . 8 ASP HB2 1 1 19 12653 1 1 8 ASP HB3 H 0.216 -3.064 10.684 1.00 . A A . 8 ASP HB3 1 1 19 12654 1 1 8 ASP HD2 H 2.691 -4.737 10.953 1.00 . A A . 8 ASP HD2 1 1 19 12655 1 1 8 ASP N N 2.813 -0.888 11.400 1.00 . A A . 8 ASP N 1 1 19 12656 1 1 8 ASP O O 0.920 -1.122 13.480 1.00 . A A . 8 ASP O 1 1 19 12657 1 1 8 ASP OD1 O 2.046 -2.912 8.552 1.00 . A A . 8 ASP OD1 1 1 19 12658 1 1 8 ASP OD2 O 2.803 -4.507 10.028 1.00 . A A . 8 ASP OD2 1 1 19 12659 1 1 9 TYR C C -0.706 1.607 13.667 1.00 . A A . 9 TYR C 1 1 19 12660 1 1 9 TYR CA C -1.453 0.459 12.862 1.00 . A A . 9 TYR CA 1 1 19 12661 1 1 9 TYR CB C -2.165 -0.586 13.797 1.00 . A A . 9 TYR CB 1 1 19 12662 1 1 9 TYR CD1 C -4.057 -1.419 12.279 1.00 . A A . 9 TYR CD1 1 1 19 12663 1 1 9 TYR CD2 C -2.335 -2.983 12.931 1.00 . A A . 9 TYR CD2 1 1 19 12664 1 1 9 TYR CE1 C -4.584 -2.369 11.405 1.00 . A A . 9 TYR CE1 1 1 19 12665 1 1 9 TYR CE2 C -2.863 -3.930 12.057 1.00 . A A . 9 TYR CE2 1 1 19 12666 1 1 9 TYR CG C -2.917 -1.713 13.037 1.00 . A A . 9 TYR CG 1 1 19 12667 1 1 9 TYR CZ C -3.984 -3.621 11.292 1.00 . A A . 9 TYR CZ 1 1 19 12668 1 1 9 TYR H H -0.630 -0.380 10.935 1.00 . A A . 9 TYR H 1 1 19 12669 1 1 9 TYR HA H -2.214 0.979 12.254 1.00 . A A . 9 TYR HA 1 1 19 12670 1 1 9 TYR HB2 H -1.445 -1.015 14.520 1.00 . A A . 9 TYR HB2 1 1 19 12671 1 1 9 TYR HB3 H -2.895 -0.053 14.435 1.00 . A A . 9 TYR HB3 1 1 19 12672 1 1 9 TYR HD1 H -4.499 -0.433 12.314 1.00 . A A . 9 TYR HD1 1 1 19 12673 1 1 9 TYR HD2 H -1.430 -3.220 13.474 1.00 . A A . 9 TYR HD2 1 1 19 12674 1 1 9 TYR HE1 H -5.436 -2.122 10.789 1.00 . A A . 9 TYR HE1 1 1 19 12675 1 1 9 TYR HE2 H -2.378 -4.891 11.947 1.00 . A A . 9 TYR HE2 1 1 19 12676 1 1 9 TYR HH H -5.239 -4.162 9.953 1.00 . A A . 9 TYR HH 1 1 19 12677 1 1 9 TYR N N -0.519 -0.284 11.947 1.00 . A A . 9 TYR N 1 1 19 12678 1 1 9 TYR O O -1.098 1.946 14.788 1.00 . A A . 9 TYR O 1 1 19 12679 1 1 9 TYR OH O -4.480 -4.540 10.403 1.00 . A A . 9 TYR OH 1 1 19 12680 1 1 10 GLY C C 0.210 4.708 13.014 1.00 . A A . 10 GLY C 1 1 19 12681 1 1 10 GLY CA C 0.959 3.490 13.536 1.00 . A A . 10 GLY CA 1 1 19 12682 1 1 10 GLY H H 0.538 1.880 12.114 1.00 . A A . 10 GLY H 1 1 19 12683 1 1 10 GLY HA2 H 1.083 3.491 14.620 1.00 . A A . 10 GLY HA2 1 1 19 12684 1 1 10 GLY HA3 H 1.996 3.617 13.214 1.00 . A A . 10 GLY HA3 1 1 19 12685 1 1 10 GLY N N 0.316 2.253 13.044 1.00 . A A . 10 GLY N 1 1 19 12686 1 1 10 GLY O O -0.387 4.717 11.936 1.00 . A A . 10 GLY O 1 1 19 12687 1 1 11 LYS C C 0.007 7.785 12.448 1.00 . A A . 11 LYS C 1 1 19 12688 1 1 11 LYS CA C -0.574 6.962 13.632 1.00 . A A . 11 LYS CA 1 1 19 12689 1 1 11 LYS CB C -0.641 7.854 14.907 1.00 . A A . 11 LYS CB 1 1 19 12690 1 1 11 LYS CD C 1.849 8.489 15.551 1.00 . A A . 11 LYS CD 1 1 19 12691 1 1 11 LYS CE C 1.861 9.980 15.149 1.00 . A A . 11 LYS CE 1 1 19 12692 1 1 11 LYS CG C 0.488 7.890 15.973 1.00 . A A . 11 LYS CG 1 1 19 12693 1 1 11 LYS H H 0.961 5.534 14.561 1.00 . A A . 11 LYS H 1 1 19 12694 1 1 11 LYS HA H -1.611 6.618 13.384 1.00 . A A . 11 LYS HA 1 1 19 12695 1 1 11 LYS HB2 H -0.897 8.896 14.631 1.00 . A A . 11 LYS HB2 1 1 19 12696 1 1 11 LYS HB3 H -1.566 7.525 15.406 1.00 . A A . 11 LYS HB3 1 1 19 12697 1 1 11 LYS HD2 H 2.574 8.332 16.372 1.00 . A A . 11 LYS HD2 1 1 19 12698 1 1 11 LYS HD3 H 2.257 7.892 14.716 1.00 . A A . 11 LYS HD3 1 1 19 12699 1 1 11 LYS HE2 H 2.851 10.234 14.730 1.00 . A A . 11 LYS HE2 1 1 19 12700 1 1 11 LYS HE3 H 1.138 10.172 14.336 1.00 . A A . 11 LYS HE3 1 1 19 12701 1 1 11 LYS HG2 H 0.116 8.444 16.855 1.00 . A A . 11 LYS HG2 1 1 19 12702 1 1 11 LYS HG3 H 0.656 6.864 16.351 1.00 . A A . 11 LYS HG3 1 1 19 12703 1 1 11 LYS HZ1 H 1.654 11.866 15.966 1.00 . A A . 11 LYS HZ1 1 1 19 12704 1 1 11 LYS HZ2 H 2.300 10.780 17.003 1.00 . A A . 11 LYS HZ2 1 1 19 12705 1 1 11 LYS N N 0.269 5.745 13.832 1.00 . A A . 11 LYS N 1 1 19 12706 1 1 11 LYS NZ N 1.584 10.891 16.277 1.00 . A A . 11 LYS NZ 1 1 19 12707 1 1 11 LYS O O 1.179 8.165 12.389 1.00 . A A . 11 LYS O 1 1 19 12708 1 1 12 CYS C C -1.720 9.479 9.674 1.00 . A A . 12 CYS C 1 1 19 12709 1 1 12 CYS CA C -0.589 8.523 10.148 1.00 . A A . 12 CYS CA 1 1 19 12710 1 1 12 CYS CB C -0.395 7.293 9.230 1.00 . A A . 12 CYS CB 1 1 19 12711 1 1 12 CYS H H -1.835 7.679 11.790 1.00 . A A . 12 CYS H 1 1 19 12712 1 1 12 CYS HA H 0.353 9.102 10.130 1.00 . A A . 12 CYS HA 1 1 19 12713 1 1 12 CYS HB2 H 0.192 7.587 8.349 1.00 . A A . 12 CYS HB2 1 1 19 12714 1 1 12 CYS HB3 H 0.203 6.504 9.708 1.00 . A A . 12 CYS HB3 1 1 19 12715 1 1 12 CYS N N -0.901 7.988 11.493 1.00 . A A . 12 CYS N 1 1 19 12716 1 1 12 CYS O O -2.573 9.951 10.436 1.00 . A A . 12 CYS O 1 1 19 12717 1 1 12 CYS SG S -1.911 6.510 8.706 1.00 . A A . 12 CYS SG 1 1 19 12718 1 1 13 THR C C -2.915 9.894 6.238 1.00 . A A . 13 THR C 1 1 19 12719 1 1 13 THR CA C -2.716 10.543 7.645 1.00 . A A . 13 THR CA 1 1 19 12720 1 1 13 THR CB C -2.315 12.058 7.472 1.00 . A A . 13 THR CB 1 1 19 12721 1 1 13 THR CG2 C -2.948 12.986 8.501 1.00 . A A . 13 THR CG2 1 1 19 12722 1 1 13 THR H H -0.825 9.378 7.929 1.00 . A A . 13 THR H 1 1 19 12723 1 1 13 THR HA H -3.677 10.470 8.209 1.00 . A A . 13 THR HA 1 1 19 12724 1 1 13 THR HB H -2.678 12.383 6.477 1.00 . A A . 13 THR HB 1 1 19 12725 1 1 13 THR HG1 H -0.771 13.215 7.492 1.00 . A A . 13 THR HG1 1 1 19 12726 1 1 13 THR HG21 H -4.048 12.946 8.449 1.00 . A A . 13 THR HG21 1 1 19 12727 1 1 13 THR HG22 H -2.615 12.743 9.524 1.00 . A A . 13 THR HG22 1 1 19 12728 1 1 13 THR HG23 H -2.646 14.030 8.288 1.00 . A A . 13 THR HG23 1 1 19 12729 1 1 13 THR N N -1.666 9.776 8.371 1.00 . A A . 13 THR N 1 1 19 12730 1 1 13 THR O O -1.975 9.445 5.570 1.00 . A A . 13 THR O 1 1 19 12731 1 1 13 THR OG1 O -0.910 12.275 7.624 1.00 . A A . 13 THR OG1 1 1 19 12732 1 1 14 TRP C C -4.527 10.928 3.632 1.00 . A A . 14 TRP C 1 1 19 12733 1 1 14 TRP CA C -4.580 9.573 4.396 1.00 . A A . 14 TRP CA 1 1 19 12734 1 1 14 TRP CB C -5.981 8.911 4.366 1.00 . A A . 14 TRP CB 1 1 19 12735 1 1 14 TRP CD1 C -5.884 6.969 2.622 1.00 . A A . 14 TRP CD1 1 1 19 12736 1 1 14 TRP CD2 C -7.039 8.752 1.959 1.00 . A A . 14 TRP CD2 1 1 19 12737 1 1 14 TRP CE2 C -7.037 7.775 0.930 1.00 . A A . 14 TRP CE2 1 1 19 12738 1 1 14 TRP CE3 C -7.692 9.996 1.766 1.00 . A A . 14 TRP CE3 1 1 19 12739 1 1 14 TRP CG C -6.316 8.249 3.025 1.00 . A A . 14 TRP CG 1 1 19 12740 1 1 14 TRP CH2 C -8.328 9.267 -0.470 1.00 . A A . 14 TRP CH2 1 1 19 12741 1 1 14 TRP CZ2 C -7.689 8.037 -0.299 1.00 . A A . 14 TRP CZ2 1 1 19 12742 1 1 14 TRP CZ3 C -8.329 10.231 0.547 1.00 . A A . 14 TRP CZ3 1 1 19 12743 1 1 14 TRP H H -4.783 10.475 6.417 1.00 . A A . 14 TRP H 1 1 19 12744 1 1 14 TRP HA H -3.851 8.850 3.970 1.00 . A A . 14 TRP HA 1 1 19 12745 1 1 14 TRP HB2 H -6.025 8.122 5.140 1.00 . A A . 14 TRP HB2 1 1 19 12746 1 1 14 TRP HB3 H -6.771 9.632 4.652 1.00 . A A . 14 TRP HB3 1 1 19 12747 1 1 14 TRP HD1 H -5.261 6.324 3.223 1.00 . A A . 14 TRP HD1 1 1 19 12748 1 1 14 TRP HE1 H -6.138 5.800 0.785 1.00 . A A . 14 TRP HE1 1 1 19 12749 1 1 14 TRP HE3 H -7.694 10.752 2.539 1.00 . A A . 14 TRP HE3 1 1 19 12750 1 1 14 TRP HH2 H -8.828 9.480 -1.403 1.00 . A A . 14 TRP HH2 1 1 19 12751 1 1 14 TRP HZ2 H -7.691 7.305 -1.093 1.00 . A A . 14 TRP HZ2 1 1 19 12752 1 1 14 TRP HZ3 H -8.829 11.175 0.383 1.00 . A A . 14 TRP HZ3 1 1 19 12753 1 1 14 TRP N N -4.187 9.917 5.796 1.00 . A A . 14 TRP N 1 1 19 12754 1 1 14 TRP NE1 N -6.325 6.652 1.325 1.00 . A A . 14 TRP NE1 1 1 19 12755 1 1 14 TRP O O -5.343 11.831 3.852 1.00 . A A . 14 TRP O 1 1 19 12756 1 1 15 GLY C C -2.186 12.972 3.308 1.00 . A A . 15 GLY C 1 1 19 12757 1 1 15 GLY CA C -3.089 12.369 2.197 1.00 . A A . 15 GLY CA 1 1 19 12758 1 1 15 GLY H H -2.881 10.240 2.726 1.00 . A A . 15 GLY H 1 1 19 12759 1 1 15 GLY HA2 H -2.539 12.218 1.249 1.00 . A A . 15 GLY HA2 1 1 19 12760 1 1 15 GLY HA3 H -3.955 13.020 1.976 1.00 . A A . 15 GLY HA3 1 1 19 12761 1 1 15 GLY N N -3.493 11.061 2.785 1.00 . A A . 15 GLY N 1 1 19 12762 1 1 15 GLY O O -2.608 13.859 4.056 1.00 . A A . 15 GLY O 1 1 19 12763 1 1 16 GLY C C 1.184 11.792 4.512 1.00 . A A . 16 GLY C 1 1 19 12764 1 1 16 GLY CA C -0.111 12.607 4.598 1.00 . A A . 16 GLY CA 1 1 19 12765 1 1 16 GLY H H -0.806 11.649 2.752 1.00 . A A . 16 GLY H 1 1 19 12766 1 1 16 GLY HA2 H -0.031 13.605 5.062 1.00 . A A . 16 GLY HA2 1 1 19 12767 1 1 16 GLY HA3 H -0.721 12.096 5.352 1.00 . A A . 16 GLY HA3 1 1 19 12768 1 1 16 GLY N N -0.978 12.398 3.431 1.00 . A A . 16 GLY N 1 1 19 12769 1 1 16 GLY O O 1.779 11.589 3.447 1.00 . A A . 16 GLY O 1 1 19 12770 1 1 17 THR C C 1.904 8.887 5.743 1.00 . A A . 17 THR C 1 1 19 12771 1 1 17 THR CA C 2.631 10.264 5.828 1.00 . A A . 17 THR CA 1 1 19 12772 1 1 17 THR CB C 3.417 10.283 7.193 1.00 . A A . 17 THR CB 1 1 19 12773 1 1 17 THR CG2 C 4.833 9.700 7.030 1.00 . A A . 17 THR CG2 1 1 19 12774 1 1 17 THR H H 1.003 11.700 6.457 1.00 . A A . 17 THR H 1 1 19 12775 1 1 17 THR HA H 3.360 10.409 5.003 1.00 . A A . 17 THR HA 1 1 19 12776 1 1 17 THR HB H 2.904 9.631 7.938 1.00 . A A . 17 THR HB 1 1 19 12777 1 1 17 THR HG1 H 4.047 12.091 6.994 1.00 . A A . 17 THR HG1 1 1 19 12778 1 1 17 THR HG21 H 5.433 10.213 6.258 1.00 . A A . 17 THR HG21 1 1 19 12779 1 1 17 THR HG22 H 5.402 9.749 7.977 1.00 . A A . 17 THR HG22 1 1 19 12780 1 1 17 THR HG23 H 4.808 8.630 6.755 1.00 . A A . 17 THR HG23 1 1 19 12781 1 1 17 THR N N 1.564 11.297 5.696 1.00 . A A . 17 THR N 1 1 19 12782 1 1 17 THR O O 0.851 8.658 6.352 1.00 . A A . 17 THR O 1 1 19 12783 1 1 17 THR OG1 O 3.563 11.616 7.674 1.00 . A A . 17 THR OG1 1 1 19 12784 1 1 18 LYS C C 3.437 5.802 5.478 1.00 . A A . 18 LYS C 1 1 19 12785 1 1 18 LYS CA C 2.167 6.543 4.986 1.00 . A A . 18 LYS CA 1 1 19 12786 1 1 18 LYS CB C 1.676 6.062 3.590 1.00 . A A . 18 LYS CB 1 1 19 12787 1 1 18 LYS CD C -0.072 6.270 1.678 1.00 . A A . 18 LYS CD 1 1 19 12788 1 1 18 LYS CE C -1.305 7.022 1.133 1.00 . A A . 18 LYS CE 1 1 19 12789 1 1 18 LYS CG C 0.594 6.932 2.902 1.00 . A A . 18 LYS CG 1 1 19 12790 1 1 18 LYS H H 3.457 8.305 4.683 1.00 . A A . 18 LYS H 1 1 19 12791 1 1 18 LYS HA H 1.352 6.298 5.691 1.00 . A A . 18 LYS HA 1 1 19 12792 1 1 18 LYS HB2 H 2.542 5.837 2.949 1.00 . A A . 18 LYS HB2 1 1 19 12793 1 1 18 LYS HB3 H 1.229 5.061 3.743 1.00 . A A . 18 LYS HB3 1 1 19 12794 1 1 18 LYS HD2 H 0.673 6.119 0.874 1.00 . A A . 18 LYS HD2 1 1 19 12795 1 1 18 LYS HD3 H -0.403 5.253 1.960 1.00 . A A . 18 LYS HD3 1 1 19 12796 1 1 18 LYS HE2 H -1.807 6.394 0.375 1.00 . A A . 18 LYS HE2 1 1 19 12797 1 1 18 LYS HE3 H -2.051 7.170 1.936 1.00 . A A . 18 LYS HE3 1 1 19 12798 1 1 18 LYS HG2 H -0.188 7.177 3.646 1.00 . A A . 18 LYS HG2 1 1 19 12799 1 1 18 LYS HG3 H 1.031 7.903 2.605 1.00 . A A . 18 LYS HG3 1 1 19 12800 1 1 18 LYS HZ1 H -0.579 8.954 1.224 1.00 . A A . 18 LYS HZ1 1 1 19 12801 1 1 18 LYS HZ2 H -1.839 8.785 0.198 1.00 . A A . 18 LYS HZ2 1 1 19 12802 1 1 18 LYS N N 2.535 7.983 4.995 1.00 . A A . 18 LYS N 1 1 19 12803 1 1 18 LYS NZ N -0.981 8.325 0.521 1.00 . A A . 18 LYS NZ 1 1 19 12804 1 1 18 LYS O O 4.500 6.353 5.828 1.00 . A A . 18 LYS O 1 1 19 12805 1 1 19 CYS C C 5.587 3.535 5.394 1.00 . A A . 19 CYS C 1 1 19 12806 1 1 19 CYS CA C 4.296 3.654 6.256 1.00 . A A . 19 CYS CA 1 1 19 12807 1 1 19 CYS CB C 3.713 2.269 6.639 1.00 . A A . 19 CYS CB 1 1 19 12808 1 1 19 CYS H H 2.379 4.228 5.129 1.00 . A A . 19 CYS H 1 1 19 12809 1 1 19 CYS HA H 4.449 4.241 7.197 1.00 . A A . 19 CYS HA 1 1 19 12810 1 1 19 CYS HB2 H 2.922 1.963 5.936 1.00 . A A . 19 CYS HB2 1 1 19 12811 1 1 19 CYS HB3 H 4.493 1.478 6.651 1.00 . A A . 19 CYS HB3 1 1 19 12812 1 1 19 CYS N N 3.273 4.485 5.574 1.00 . A A . 19 CYS N 1 1 19 12813 1 1 19 CYS O O 5.649 3.517 4.161 1.00 . A A . 19 CYS O 1 1 19 12814 1 1 19 CYS SG S 3.016 2.432 8.278 1.00 . A A . 19 CYS SG 1 1 19 12815 1 1 20 CYS C C 8.651 2.957 4.812 1.00 . A A . 20 CYS C 1 1 19 12816 1 1 20 CYS CA C 8.039 3.809 5.963 1.00 . A A . 20 CYS CA 1 1 19 12817 1 1 20 CYS CB C 8.822 3.529 7.268 1.00 . A A . 20 CYS CB 1 1 19 12818 1 1 20 CYS H H 6.304 3.569 7.233 1.00 . A A . 20 CYS H 1 1 19 12819 1 1 20 CYS HA H 8.020 4.884 5.801 1.00 . A A . 20 CYS HA 1 1 19 12820 1 1 20 CYS HB2 H 8.267 3.915 8.128 1.00 . A A . 20 CYS HB2 1 1 19 12821 1 1 20 CYS HB3 H 9.005 2.455 7.463 1.00 . A A . 20 CYS HB3 1 1 19 12822 1 1 20 CYS N N 6.616 3.573 6.256 1.00 . A A . 20 CYS N 1 1 19 12823 1 1 20 CYS O O 9.213 3.541 3.882 1.00 . A A . 20 CYS O 1 1 19 12824 1 1 20 CYS SG S 10.375 4.446 7.249 1.00 . A A . 20 CYS SG 1 1 19 12825 1 1 21 ARG C C 8.153 0.281 2.728 1.00 . A A . 21 ARG C 1 1 19 12826 1 1 21 ARG CA C 9.149 0.687 3.866 1.00 . A A . 21 ARG CA 1 1 19 12827 1 1 21 ARG CB C 9.679 -0.531 4.690 1.00 . A A . 21 ARG CB 1 1 19 12828 1 1 21 ARG CD C 12.023 -0.831 3.603 1.00 . A A . 21 ARG CD 1 1 19 12829 1 1 21 ARG CG C 10.677 -1.480 3.984 1.00 . A A . 21 ARG CG 1 1 19 12830 1 1 21 ARG CZ C 14.100 -1.704 2.470 1.00 . A A . 21 ARG CZ 1 1 19 12831 1 1 21 ARG H H 7.931 1.337 5.635 1.00 . A A . 21 ARG H 1 1 19 12832 1 1 21 ARG HA H 9.957 1.216 3.341 1.00 . A A . 21 ARG HA 1 1 19 12833 1 1 21 ARG HB2 H 10.185 -0.185 5.614 1.00 . A A . 21 ARG HB2 1 1 19 12834 1 1 21 ARG HB3 H 8.822 -1.131 5.054 1.00 . A A . 21 ARG HB3 1 1 19 12835 1 1 21 ARG HD2 H 11.861 0.004 2.896 1.00 . A A . 21 ARG HD2 1 1 19 12836 1 1 21 ARG HD3 H 12.505 -0.395 4.499 1.00 . A A . 21 ARG HD3 1 1 19 12837 1 1 21 ARG HG2 H 10.869 -2.333 4.663 1.00 . A A . 21 ARG HG2 1 1 19 12838 1 1 21 ARG HG3 H 10.210 -1.931 3.090 1.00 . A A . 21 ARG HG3 1 1 19 12839 1 1 21 ARG HH11 H 14.243 0.276 2.792 1.00 . A A . 21 ARG HH11 1 1 19 12840 1 1 21 ARG HH12 H 15.665 -0.544 1.971 1.00 . A A . 21 ARG HH12 1 1 19 12841 1 1 21 ARG HH21 H 14.185 -3.659 2.045 1.00 . A A . 21 ARG HH21 1 1 19 12842 1 1 21 ARG HH22 H 15.632 -2.633 1.576 1.00 . A A . 21 ARG HH22 1 1 19 12843 1 1 21 ARG N N 8.564 1.615 4.889 1.00 . A A . 21 ARG N 1 1 19 12844 1 1 21 ARG NE N 12.940 -1.838 2.981 1.00 . A A . 21 ARG NE 1 1 19 12845 1 1 21 ARG NH1 N 14.735 -0.537 2.404 1.00 . A A . 21 ARG NH1 1 1 19 12846 1 1 21 ARG NH2 N 14.700 -2.774 1.980 1.00 . A A . 21 ARG NH2 1 1 19 12847 1 1 21 ARG O O 8.167 -0.832 2.192 1.00 . A A . 21 ARG O 1 1 19 12848 1 1 22 GLY C C 5.099 0.339 1.529 1.00 . A A . 22 GLY C 1 1 19 12849 1 1 22 GLY CA C 6.367 1.142 1.222 1.00 . A A . 22 GLY CA 1 1 19 12850 1 1 22 GLY H H 7.415 2.015 3.030 1.00 . A A . 22 GLY H 1 1 19 12851 1 1 22 GLY HA2 H 6.093 2.162 0.894 1.00 . A A . 22 GLY HA2 1 1 19 12852 1 1 22 GLY HA3 H 6.859 0.698 0.352 1.00 . A A . 22 GLY HA3 1 1 19 12853 1 1 22 GLY N N 7.325 1.250 2.345 1.00 . A A . 22 GLY N 1 1 19 12854 1 1 22 GLY O O 4.837 -0.708 0.931 1.00 . A A . 22 GLY O 1 1 19 12855 1 1 23 ARG C C 1.976 1.299 3.082 1.00 . A A . 23 ARG C 1 1 19 12856 1 1 23 ARG CA C 3.131 0.241 3.036 1.00 . A A . 23 ARG CA 1 1 19 12857 1 1 23 ARG CB C 3.436 -0.292 4.463 1.00 . A A . 23 ARG CB 1 1 19 12858 1 1 23 ARG CD C 3.215 -2.836 4.091 1.00 . A A . 23 ARG CD 1 1 19 12859 1 1 23 ARG CG C 4.079 -1.676 4.622 1.00 . A A . 23 ARG CG 1 1 19 12860 1 1 23 ARG CZ C 3.302 -5.339 4.379 1.00 . A A . 23 ARG CZ 1 1 19 12861 1 1 23 ARG H H 4.851 1.654 2.936 1.00 . A A . 23 ARG H 1 1 19 12862 1 1 23 ARG HA H 2.827 -0.607 2.399 1.00 . A A . 23 ARG HA 1 1 19 12863 1 1 23 ARG HB2 H 4.145 0.395 4.939 1.00 . A A . 23 ARG HB2 1 1 19 12864 1 1 23 ARG HB3 H 2.535 -0.260 5.105 1.00 . A A . 23 ARG HB3 1 1 19 12865 1 1 23 ARG HD2 H 2.164 -2.702 4.406 1.00 . A A . 23 ARG HD2 1 1 19 12866 1 1 23 ARG HD3 H 3.209 -2.833 2.985 1.00 . A A . 23 ARG HD3 1 1 19 12867 1 1 23 ARG HG2 H 5.079 -1.668 4.150 1.00 . A A . 23 ARG HG2 1 1 19 12868 1 1 23 ARG HG3 H 4.269 -1.801 5.708 1.00 . A A . 23 ARG HG3 1 1 19 12869 1 1 23 ARG HH11 H 1.787 -4.815 3.164 1.00 . A A . 23 ARG HH11 1 1 19 12870 1 1 23 ARG HH12 H 2.006 -6.605 3.505 1.00 . A A . 23 ARG HH12 1 1 19 12871 1 1 23 ARG HH21 H 4.733 -6.097 5.556 1.00 . A A . 23 ARG HH21 1 1 19 12872 1 1 23 ARG HH22 H 3.571 -7.283 4.775 1.00 . A A . 23 ARG HH22 1 1 19 12873 1 1 23 ARG N N 4.345 0.884 2.479 1.00 . A A . 23 ARG N 1 1 19 12874 1 1 23 ARG NE N 3.721 -4.153 4.589 1.00 . A A . 23 ARG NE 1 1 19 12875 1 1 23 ARG NH1 N 2.259 -5.615 3.601 1.00 . A A . 23 ARG NH1 1 1 19 12876 1 1 23 ARG NH2 N 3.932 -6.341 4.963 1.00 . A A . 23 ARG NH2 1 1 19 12877 1 1 23 ARG O O 2.220 2.433 3.519 1.00 . A A . 23 ARG O 1 1 19 12878 1 1 24 PRO C C -0.983 2.308 4.064 1.00 . A A . 24 PRO C 1 1 19 12879 1 1 24 PRO CA C -0.398 1.982 2.658 1.00 . A A . 24 PRO CA 1 1 19 12880 1 1 24 PRO CB C -1.431 1.318 1.731 1.00 . A A . 24 PRO CB 1 1 19 12881 1 1 24 PRO CD C 0.301 -0.321 2.127 1.00 . A A . 24 PRO CD 1 1 19 12882 1 1 24 PRO CG C -1.204 -0.187 1.897 1.00 . A A . 24 PRO CG 1 1 19 12883 1 1 24 PRO HA H -0.047 2.934 2.212 1.00 . A A . 24 PRO HA 1 1 19 12884 1 1 24 PRO HB2 H -2.476 1.612 1.947 1.00 . A A . 24 PRO HB2 1 1 19 12885 1 1 24 PRO HB3 H -1.237 1.622 0.686 1.00 . A A . 24 PRO HB3 1 1 19 12886 1 1 24 PRO HD2 H 0.528 -1.155 2.818 1.00 . A A . 24 PRO HD2 1 1 19 12887 1 1 24 PRO HD3 H 0.826 -0.514 1.172 1.00 . A A . 24 PRO HD3 1 1 19 12888 1 1 24 PRO HG2 H -1.760 -0.559 2.779 1.00 . A A . 24 PRO HG2 1 1 19 12889 1 1 24 PRO HG3 H -1.552 -0.769 1.024 1.00 . A A . 24 PRO HG3 1 1 19 12890 1 1 24 PRO N N 0.706 0.989 2.682 1.00 . A A . 24 PRO N 1 1 19 12891 1 1 24 PRO O O -0.864 1.522 5.011 1.00 . A A . 24 PRO O 1 1 19 12892 1 1 25 CYS C C -3.974 3.815 4.946 1.00 . A A . 25 CYS C 1 1 19 12893 1 1 25 CYS CA C -2.462 3.843 5.338 1.00 . A A . 25 CYS CA 1 1 19 12894 1 1 25 CYS CB C -2.029 5.243 5.867 1.00 . A A . 25 CYS CB 1 1 19 12895 1 1 25 CYS H H -1.712 3.984 3.263 1.00 . A A . 25 CYS H 1 1 19 12896 1 1 25 CYS HA H -2.298 3.117 6.157 1.00 . A A . 25 CYS HA 1 1 19 12897 1 1 25 CYS HB2 H -1.263 5.716 5.230 1.00 . A A . 25 CYS HB2 1 1 19 12898 1 1 25 CYS HB3 H -2.893 5.920 5.930 1.00 . A A . 25 CYS HB3 1 1 19 12899 1 1 25 CYS N N -1.654 3.469 4.149 1.00 . A A . 25 CYS N 1 1 19 12900 1 1 25 CYS O O -4.380 4.018 3.796 1.00 . A A . 25 CYS O 1 1 19 12901 1 1 25 CYS SG S -1.353 5.027 7.503 1.00 . A A . 25 CYS SG 1 1 19 12902 1 1 26 ARG C C -6.743 4.095 7.277 1.00 . A A . 26 ARG C 1 1 19 12903 1 1 26 ARG CA C -6.281 3.580 5.887 1.00 . A A . 26 ARG CA 1 1 19 12904 1 1 26 ARG CB C -6.848 2.176 5.551 1.00 . A A . 26 ARG CB 1 1 19 12905 1 1 26 ARG CD C -8.935 0.780 4.833 1.00 . A A . 26 ARG CD 1 1 19 12906 1 1 26 ARG CG C -8.387 2.107 5.392 1.00 . A A . 26 ARG CG 1 1 19 12907 1 1 26 ARG CZ C -8.952 -1.665 5.385 1.00 . A A . 26 ARG CZ 1 1 19 12908 1 1 26 ARG H H -4.352 3.562 6.899 1.00 . A A . 26 ARG H 1 1 19 12909 1 1 26 ARG HA H -6.593 4.289 5.092 1.00 . A A . 26 ARG HA 1 1 19 12910 1 1 26 ARG HB2 H -6.384 1.821 4.610 1.00 . A A . 26 ARG HB2 1 1 19 12911 1 1 26 ARG HB3 H -6.533 1.452 6.323 1.00 . A A . 26 ARG HB3 1 1 19 12912 1 1 26 ARG HD2 H -10.031 0.870 4.713 1.00 . A A . 26 ARG HD2 1 1 19 12913 1 1 26 ARG HD3 H -8.538 0.618 3.814 1.00 . A A . 26 ARG HD3 1 1 19 12914 1 1 26 ARG HG2 H -8.872 2.325 6.362 1.00 . A A . 26 ARG HG2 1 1 19 12915 1 1 26 ARG HG3 H -8.714 2.920 4.717 1.00 . A A . 26 ARG HG3 1 1 19 12916 1 1 26 ARG HH11 H -9.873 -1.262 3.642 1.00 . A A . 26 ARG HH11 1 1 19 12917 1 1 26 ARG HH12 H -9.793 -3.021 4.159 1.00 . A A . 26 ARG HH12 1 1 19 12918 1 1 26 ARG HH21 H -8.094 -2.317 7.072 1.00 . A A . 26 ARG HH21 1 1 19 12919 1 1 26 ARG HH22 H -8.853 -3.576 5.973 1.00 . A A . 26 ARG HH22 1 1 19 12920 1 1 26 ARG N N -4.800 3.550 5.972 1.00 . A A . 26 ARG N 1 1 19 12921 1 1 26 ARG NE N -8.632 -0.394 5.691 1.00 . A A . 26 ARG NE 1 1 19 12922 1 1 26 ARG NH1 N -9.608 -2.019 4.282 1.00 . A A . 26 ARG NH1 1 1 19 12923 1 1 26 ARG NH2 N -8.596 -2.616 6.228 1.00 . A A . 26 ARG NH2 1 1 19 12924 1 1 26 ARG O O -6.278 3.631 8.332 1.00 . A A . 26 ARG O 1 1 19 12925 1 1 27 CYS C C -8.886 5.001 9.521 1.00 . A A . 27 CYS C 1 1 19 12926 1 1 27 CYS CA C -7.955 5.807 8.543 1.00 . A A . 27 CYS CA 1 1 19 12927 1 1 27 CYS CB C -8.652 7.139 8.192 1.00 . A A . 27 CYS CB 1 1 19 12928 1 1 27 CYS H H -7.964 5.416 6.367 1.00 . A A . 27 CYS H 1 1 19 12929 1 1 27 CYS HA H -6.965 6.016 8.968 1.00 . A A . 27 CYS HA 1 1 19 12930 1 1 27 CYS HB2 H -9.618 6.965 7.748 1.00 . A A . 27 CYS HB2 1 1 19 12931 1 1 27 CYS HB3 H -8.881 7.715 9.106 1.00 . A A . 27 CYS HB3 1 1 19 12932 1 1 27 CYS N N -7.652 5.087 7.287 1.00 . A A . 27 CYS N 1 1 19 12933 1 1 27 CYS O O -9.415 3.925 9.222 1.00 . A A . 27 CYS O 1 1 19 12934 1 1 27 CYS SG S -7.642 8.234 7.210 1.00 . A A . 27 CYS SG 1 1 19 12935 1 1 28 SER C C -11.536 5.072 11.237 1.00 . A A . 28 SER C 1 1 19 12936 1 1 28 SER CA C -10.065 5.218 11.757 1.00 . A A . 28 SER CA 1 1 19 12937 1 1 28 SER CB C -9.960 6.339 12.836 1.00 . A A . 28 SER CB 1 1 19 12938 1 1 28 SER H H -8.511 6.463 10.803 1.00 . A A . 28 SER H 1 1 19 12939 1 1 28 SER HA H -9.786 4.243 12.200 1.00 . A A . 28 SER HA 1 1 19 12940 1 1 28 SER HB2 H -10.086 7.348 12.395 1.00 . A A . 28 SER HB2 1 1 19 12941 1 1 28 SER HB3 H -10.754 6.270 13.602 1.00 . A A . 28 SER HB3 1 1 19 12942 1 1 28 SER HG H -8.040 6.387 12.855 1.00 . A A . 28 SER HG 1 1 19 12943 1 1 28 SER N N -9.076 5.612 10.710 1.00 . A A . 28 SER N 1 1 19 12944 1 1 28 SER O O -11.863 5.374 10.083 1.00 . A A . 28 SER O 1 1 19 12945 1 1 28 SER OG O -8.719 6.274 13.524 1.00 . A A . 28 SER OG 1 1 19 12946 1 1 29 MET C C -14.592 5.809 11.531 1.00 . A A . 29 MET C 1 1 19 12947 1 1 29 MET CA C -13.892 4.444 11.841 1.00 . A A . 29 MET CA 1 1 19 12948 1 1 29 MET CB C -14.568 3.781 13.075 1.00 . A A . 29 MET CB 1 1 19 12949 1 1 29 MET CE C -14.087 2.129 16.093 1.00 . A A . 29 MET CE 1 1 19 12950 1 1 29 MET CG C -14.226 2.295 13.294 1.00 . A A . 29 MET CG 1 1 19 12951 1 1 29 MET H H -12.061 4.542 13.084 1.00 . A A . 29 MET H 1 1 19 12952 1 1 29 MET HA H -14.024 3.797 10.955 1.00 . A A . 29 MET HA 1 1 19 12953 1 1 29 MET HB2 H -14.344 4.352 13.997 1.00 . A A . 29 MET HB2 1 1 19 12954 1 1 29 MET HB3 H -15.668 3.845 12.967 1.00 . A A . 29 MET HB3 1 1 19 12955 1 1 29 MET HE1 H -13.078 1.689 15.992 1.00 . A A . 29 MET HE1 1 1 19 12956 1 1 29 MET HE2 H -13.981 3.228 16.148 1.00 . A A . 29 MET HE2 1 1 19 12957 1 1 29 MET HE3 H -14.518 1.781 17.049 1.00 . A A . 29 MET HE3 1 1 19 12958 1 1 29 MET HG2 H -14.497 1.704 12.400 1.00 . A A . 29 MET HG2 1 1 19 12959 1 1 29 MET HG3 H -13.141 2.147 13.449 1.00 . A A . 29 MET HG3 1 1 19 12960 1 1 29 MET N N -12.428 4.595 12.129 1.00 . A A . 29 MET N 1 1 19 12961 1 1 29 MET O O -15.376 5.882 10.581 1.00 . A A . 29 MET O 1 1 19 12962 1 1 29 MET SD S -15.143 1.646 14.710 1.00 . A A . 29 MET SD 1 1 19 12963 1 1 30 ILE C C -13.847 8.880 10.785 1.00 . A A . 30 ILE C 1 1 19 12964 1 1 30 ILE CA C -14.704 8.277 11.963 1.00 . A A . 30 ILE CA 1 1 19 12965 1 1 30 ILE CB C -14.594 9.217 13.236 1.00 . A A . 30 ILE CB 1 1 19 12966 1 1 30 ILE CD1 C -12.998 10.201 15.075 1.00 . A A . 30 ILE CD1 1 1 19 12967 1 1 30 ILE CG1 C -13.224 9.130 13.995 1.00 . A A . 30 ILE CG1 1 1 19 12968 1 1 30 ILE CG2 C -15.745 8.833 14.207 1.00 . A A . 30 ILE CG2 1 1 19 12969 1 1 30 ILE H H -13.554 6.647 12.987 1.00 . A A . 30 ILE H 1 1 19 12970 1 1 30 ILE HA H -15.750 8.265 11.611 1.00 . A A . 30 ILE HA 1 1 19 12971 1 1 30 ILE HB H -14.726 10.273 12.929 1.00 . A A . 30 ILE HB 1 1 19 12972 1 1 30 ILE HD11 H -13.100 11.222 14.665 1.00 . A A . 30 ILE HD11 1 1 19 12973 1 1 30 ILE HD12 H -13.710 10.103 15.914 1.00 . A A . 30 ILE HD12 1 1 19 12974 1 1 30 ILE HD13 H -11.982 10.121 15.503 1.00 . A A . 30 ILE HD13 1 1 19 12975 1 1 30 ILE HG12 H -13.086 8.130 14.448 1.00 . A A . 30 ILE HG12 1 1 19 12976 1 1 30 ILE HG13 H -12.393 9.233 13.275 1.00 . A A . 30 ILE HG13 1 1 19 12977 1 1 30 ILE HG21 H -16.732 8.883 13.710 1.00 . A A . 30 ILE HG21 1 1 19 12978 1 1 30 ILE HG22 H -15.636 7.810 14.615 1.00 . A A . 30 ILE HG22 1 1 19 12979 1 1 30 ILE HG23 H -15.804 9.522 15.070 1.00 . A A . 30 ILE HG23 1 1 19 12980 1 1 30 ILE N N -14.283 6.873 12.298 1.00 . A A . 30 ILE N 1 1 19 12981 1 1 30 ILE O O -14.401 9.629 9.976 1.00 . A A . 30 ILE O 1 1 19 12982 1 1 31 GLY C C -10.998 10.438 9.971 1.00 . A A . 31 GLY C 1 1 19 12983 1 1 31 GLY CA C -11.639 9.082 9.628 1.00 . A A . 31 GLY CA 1 1 19 12984 1 1 31 GLY H H -12.197 7.996 11.459 1.00 . A A . 31 GLY H 1 1 19 12985 1 1 31 GLY HA2 H -10.851 8.329 9.491 1.00 . A A . 31 GLY HA2 1 1 19 12986 1 1 31 GLY HA3 H -12.133 9.119 8.643 1.00 . A A . 31 GLY HA3 1 1 19 12987 1 1 31 GLY N N -12.541 8.566 10.681 1.00 . A A . 31 GLY N 1 1 19 12988 1 1 31 GLY O O -11.241 11.439 9.292 1.00 . A A . 31 GLY O 1 1 19 12989 1 1 32 THR C C -8.297 11.509 12.438 1.00 . A A . 32 THR C 1 1 19 12990 1 1 32 THR CA C -9.661 11.696 11.694 1.00 . A A . 32 THR CA 1 1 19 12991 1 1 32 THR CB C -10.740 12.217 12.709 1.00 . A A . 32 THR CB 1 1 19 12992 1 1 32 THR CG2 C -10.421 13.606 13.298 1.00 . A A . 32 THR CG2 1 1 19 12993 1 1 32 THR H H -10.180 9.537 11.535 1.00 . A A . 32 THR H 1 1 19 12994 1 1 32 THR HA H -9.451 12.388 10.905 1.00 . A A . 32 THR HA 1 1 19 12995 1 1 32 THR HB H -10.803 11.457 13.514 1.00 . A A . 32 THR HB 1 1 19 12996 1 1 32 THR HG1 H -11.904 13.025 11.403 1.00 . A A . 32 THR HG1 1 1 19 12997 1 1 32 THR HG21 H -10.309 14.372 12.508 1.00 . A A . 32 THR HG21 1 1 19 12998 1 1 32 THR HG22 H -11.225 13.948 13.976 1.00 . A A . 32 THR HG22 1 1 19 12999 1 1 32 THR HG23 H -9.489 13.603 13.892 1.00 . A A . 32 THR HG23 1 1 19 13000 1 1 32 THR N N -10.206 10.445 11.056 1.00 . A A . 32 THR N 1 1 19 13001 1 1 32 THR O O -7.449 12.404 12.494 1.00 . A A . 32 THR O 1 1 19 13002 1 1 32 THR OG1 O -12.018 12.365 12.091 1.00 . A A . 32 THR OG1 1 1 19 13003 1 1 33 ASN C C -6.404 8.565 12.871 1.00 . A A . 33 ASN C 1 1 19 13004 1 1 33 ASN CA C -6.962 9.788 13.660 1.00 . A A . 33 ASN CA 1 1 19 13005 1 1 33 ASN CB C -7.380 9.429 15.122 1.00 . A A . 33 ASN CB 1 1 19 13006 1 1 33 ASN CG C -6.204 9.298 16.109 1.00 . A A . 33 ASN CG 1 1 19 13007 1 1 33 ASN H H -8.974 9.861 12.570 1.00 . A A . 33 ASN H 1 1 19 13008 1 1 33 ASN HA H -6.164 10.556 13.668 1.00 . A A . 33 ASN HA 1 1 19 13009 1 1 33 ASN HB2 H -8.117 10.151 15.527 1.00 . A A . 33 ASN HB2 1 1 19 13010 1 1 33 ASN HB3 H -7.950 8.479 15.129 1.00 . A A . 33 ASN HB3 1 1 19 13011 1 1 33 ASN HD21 H -6.272 11.266 16.496 1.00 . A A . 33 ASN HD21 1 1 19 13012 1 1 33 ASN HD22 H -4.997 10.281 17.375 1.00 . A A . 33 ASN HD22 1 1 19 13013 1 1 33 ASN N N -8.174 10.326 12.999 1.00 . A A . 33 ASN N 1 1 19 13014 1 1 33 ASN ND2 N -5.782 10.394 16.724 1.00 . A A . 33 ASN ND2 1 1 19 13015 1 1 33 ASN O O -6.197 7.483 13.429 1.00 . A A . 33 ASN O 1 1 19 13016 1 1 33 ASN OD1 O -5.668 8.212 16.327 1.00 . A A . 33 ASN OD1 1 1 19 13017 1 1 34 CYS C C -4.636 6.777 11.047 1.00 . A A . 34 CYS C 1 1 19 13018 1 1 34 CYS CA C -5.835 7.673 10.595 1.00 . A A . 34 CYS CA 1 1 19 13019 1 1 34 CYS CB C -5.424 8.270 9.230 1.00 . A A . 34 CYS CB 1 1 19 13020 1 1 34 CYS H H -6.575 9.677 11.302 1.00 . A A . 34 CYS H 1 1 19 13021 1 1 34 CYS HA H -6.758 7.091 10.485 1.00 . A A . 34 CYS HA 1 1 19 13022 1 1 34 CYS HB2 H -4.474 8.774 9.332 1.00 . A A . 34 CYS HB2 1 1 19 13023 1 1 34 CYS HB3 H -5.262 7.456 8.498 1.00 . A A . 34 CYS HB3 1 1 19 13024 1 1 34 CYS N N -6.163 8.768 11.559 1.00 . A A . 34 CYS N 1 1 19 13025 1 1 34 CYS O O -3.767 7.250 11.789 1.00 . A A . 34 CYS O 1 1 19 13026 1 1 34 CYS SG S -6.689 9.343 8.551 1.00 . A A . 34 CYS SG 1 1 19 13027 1 1 35 GLU C C -2.985 3.709 9.840 1.00 . A A . 35 GLU C 1 1 19 13028 1 1 35 GLU CA C -3.491 4.571 11.051 1.00 . A A . 35 GLU CA 1 1 19 13029 1 1 35 GLU CB C -3.954 3.602 12.195 1.00 . A A . 35 GLU CB 1 1 19 13030 1 1 35 GLU CD C -6.500 3.661 12.753 1.00 . A A . 35 GLU CD 1 1 19 13031 1 1 35 GLU CG C -5.069 4.013 13.189 1.00 . A A . 35 GLU CG 1 1 19 13032 1 1 35 GLU H H -5.332 5.248 9.929 1.00 . A A . 35 GLU H 1 1 19 13033 1 1 35 GLU HA H -2.641 5.174 11.433 1.00 . A A . 35 GLU HA 1 1 19 13034 1 1 35 GLU HB2 H -4.140 2.584 11.804 1.00 . A A . 35 GLU HB2 1 1 19 13035 1 1 35 GLU HB3 H -3.051 3.435 12.812 1.00 . A A . 35 GLU HB3 1 1 19 13036 1 1 35 GLU HE2 H -8.266 3.459 13.545 1.00 . A A . 35 GLU HE2 1 1 19 13037 1 1 35 GLU HG2 H -4.872 3.520 14.157 1.00 . A A . 35 GLU HG2 1 1 19 13038 1 1 35 GLU HG3 H -5.004 5.096 13.406 1.00 . A A . 35 GLU HG3 1 1 19 13039 1 1 35 GLU N N -4.596 5.495 10.615 1.00 . A A . 35 GLU N 1 1 19 13040 1 1 35 GLU O O -3.547 3.716 8.742 1.00 . A A . 35 GLU O 1 1 19 13041 1 1 35 GLU OE1 O -6.830 3.396 11.596 1.00 . A A . 35 GLU OE1 1 1 19 13042 1 1 35 GLU OE2 O -7.370 3.677 13.812 1.00 . A A . 35 GLU OE2 1 1 19 13043 1 1 36 CYS C C -1.870 0.741 8.913 1.00 . A A . 36 CYS C 1 1 19 13044 1 1 36 CYS CA C -1.201 2.144 9.010 1.00 . A A . 36 CYS CA 1 1 19 13045 1 1 36 CYS CB C 0.325 2.042 9.351 1.00 . A A . 36 CYS CB 1 1 19 13046 1 1 36 CYS H H -1.636 2.927 11.059 1.00 . A A . 36 CYS H 1 1 19 13047 1 1 36 CYS HA H -1.294 2.661 8.031 1.00 . A A . 36 CYS HA 1 1 19 13048 1 1 36 CYS HB2 H 0.532 2.111 10.433 1.00 . A A . 36 CYS HB2 1 1 19 13049 1 1 36 CYS HB3 H 0.792 1.065 9.124 1.00 . A A . 36 CYS HB3 1 1 19 13050 1 1 36 CYS N N -1.886 2.956 10.064 1.00 . A A . 36 CYS N 1 1 19 13051 1 1 36 CYS O O -2.541 0.256 9.832 1.00 . A A . 36 CYS O 1 1 19 13052 1 1 36 CYS SG S 1.211 3.230 8.361 1.00 . A A . 36 CYS SG 1 1 19 13053 1 1 37 THR C C -1.342 -2.046 6.582 1.00 . A A . 37 THR C 1 1 19 13054 1 1 37 THR CA C -2.347 -1.208 7.443 1.00 . A A . 37 THR CA 1 1 19 13055 1 1 37 THR CB C -3.692 -1.084 6.647 1.00 . A A . 37 THR CB 1 1 19 13056 1 1 37 THR CG2 C -4.836 -0.548 7.526 1.00 . A A . 37 THR CG2 1 1 19 13057 1 1 37 THR H H -1.163 0.619 7.040 1.00 . A A . 37 THR H 1 1 19 13058 1 1 37 THR HA H -2.561 -1.728 8.395 1.00 . A A . 37 THR HA 1 1 19 13059 1 1 37 THR HB H -3.968 -2.094 6.288 1.00 . A A . 37 THR HB 1 1 19 13060 1 1 37 THR HG1 H -3.328 0.662 5.915 1.00 . A A . 37 THR HG1 1 1 19 13061 1 1 37 THR HG21 H -4.960 -1.147 8.447 1.00 . A A . 37 THR HG21 1 1 19 13062 1 1 37 THR HG22 H -4.676 0.504 7.831 1.00 . A A . 37 THR HG22 1 1 19 13063 1 1 37 THR HG23 H -5.799 -0.593 6.987 1.00 . A A . 37 THR HG23 1 1 19 13064 1 1 37 THR N N -1.727 0.116 7.734 1.00 . A A . 37 THR N 1 1 19 13065 1 1 37 THR O O -0.854 -1.527 5.569 1.00 . A A . 37 THR O 1 1 19 13066 1 1 37 THR OG1 O -3.554 -0.192 5.540 1.00 . A A . 37 THR OG1 1 1 19 13067 1 1 38 PRO C C -1.116 -4.729 4.776 1.00 . A A . 38 PRO C 1 1 19 13068 1 1 38 PRO CA C -0.279 -4.255 6.010 1.00 . A A . 38 PRO CA 1 1 19 13069 1 1 38 PRO CB C 0.129 -5.392 6.971 1.00 . A A . 38 PRO CB 1 1 19 13070 1 1 38 PRO CD C -1.452 -3.997 8.159 1.00 . A A . 38 PRO CD 1 1 19 13071 1 1 38 PRO CG C -0.971 -5.442 8.036 1.00 . A A . 38 PRO CG 1 1 19 13072 1 1 38 PRO HA H 0.637 -3.768 5.627 1.00 . A A . 38 PRO HA 1 1 19 13073 1 1 38 PRO HB2 H 0.261 -6.369 6.475 1.00 . A A . 38 PRO HB2 1 1 19 13074 1 1 38 PRO HB3 H 1.100 -5.156 7.445 1.00 . A A . 38 PRO HB3 1 1 19 13075 1 1 38 PRO HD2 H -2.536 -3.936 8.343 1.00 . A A . 38 PRO HD2 1 1 19 13076 1 1 38 PRO HD3 H -0.968 -3.487 9.004 1.00 . A A . 38 PRO HD3 1 1 19 13077 1 1 38 PRO HG2 H -1.800 -6.090 7.694 1.00 . A A . 38 PRO HG2 1 1 19 13078 1 1 38 PRO HG3 H -0.612 -5.852 8.998 1.00 . A A . 38 PRO HG3 1 1 19 13079 1 1 38 PRO N N -1.048 -3.346 6.898 1.00 . A A . 38 PRO N 1 1 19 13080 1 1 38 PRO O O -1.778 -5.770 4.823 1.00 . A A . 38 PRO O 1 1 19 13081 1 1 39 ARG C C -3.477 -3.814 2.919 1.00 . A A . 39 ARG C 1 1 19 13082 1 1 39 ARG CA C -1.982 -4.010 2.490 1.00 . A A . 39 ARG CA 1 1 19 13083 1 1 39 ARG CB C -1.799 -5.382 1.767 1.00 . A A . 39 ARG CB 1 1 19 13084 1 1 39 ARG CD C -2.328 -6.769 -0.384 1.00 . A A . 39 ARG CD 1 1 19 13085 1 1 39 ARG CG C -2.423 -5.415 0.349 1.00 . A A . 39 ARG CG 1 1 19 13086 1 1 39 ARG CZ C -4.470 -8.035 0.015 1.00 . A A . 39 ARG CZ 1 1 19 13087 1 1 39 ARG H H -0.495 -3.089 3.823 1.00 . A A . 39 ARG H 1 1 19 13088 1 1 39 ARG HA H -1.692 -3.194 1.800 1.00 . A A . 39 ARG HA 1 1 19 13089 1 1 39 ARG HB2 H -0.720 -5.610 1.671 1.00 . A A . 39 ARG HB2 1 1 19 13090 1 1 39 ARG HB3 H -2.217 -6.208 2.373 1.00 . A A . 39 ARG HB3 1 1 19 13091 1 1 39 ARG HD2 H -2.603 -6.631 -1.447 1.00 . A A . 39 ARG HD2 1 1 19 13092 1 1 39 ARG HD3 H -1.273 -7.100 -0.411 1.00 . A A . 39 ARG HD3 1 1 19 13093 1 1 39 ARG HG2 H -3.483 -5.100 0.391 1.00 . A A . 39 ARG HG2 1 1 19 13094 1 1 39 ARG HG3 H -1.924 -4.648 -0.272 1.00 . A A . 39 ARG HG3 1 1 19 13095 1 1 39 ARG HH11 H -4.754 -6.437 -1.175 1.00 . A A . 39 ARG HH11 1 1 19 13096 1 1 39 ARG HH12 H -6.221 -7.476 -0.805 1.00 . A A . 39 ARG HH12 1 1 19 13097 1 1 39 ARG HH21 H -4.447 -9.671 1.168 1.00 . A A . 39 ARG HH21 1 1 19 13098 1 1 39 ARG HH22 H -6.056 -9.183 0.433 1.00 . A A . 39 ARG HH22 1 1 19 13099 1 1 39 ARG N N -1.104 -3.905 3.700 1.00 . A A . 39 ARG N 1 1 19 13100 1 1 39 ARG NE N -3.147 -7.857 0.214 1.00 . A A . 39 ARG NE 1 1 19 13101 1 1 39 ARG NH1 N -5.227 -7.233 -0.732 1.00 . A A . 39 ARG NH1 1 1 19 13102 1 1 39 ARG NH2 N -5.050 -9.067 0.599 1.00 . A A . 39 ARG NH2 1 1 19 13103 1 1 39 ARG O O -4.063 -4.663 3.602 1.00 . A A . 39 ARG O 1 1 19 13104 1 1 40 LEU C C -6.418 -3.282 1.782 1.00 . A A . 40 LEU C 1 1 19 13105 1 1 40 LEU CA C -5.535 -2.425 2.748 1.00 . A A . 40 LEU CA 1 1 19 13106 1 1 40 LEU CB C -5.797 -0.892 2.591 1.00 . A A . 40 LEU CB 1 1 19 13107 1 1 40 LEU CD1 C -6.314 1.293 1.391 1.00 . A A . 40 LEU CD1 1 1 19 13108 1 1 40 LEU CD2 C -4.742 -0.318 0.267 1.00 . A A . 40 LEU CD2 1 1 19 13109 1 1 40 LEU CG C -5.962 -0.198 1.202 1.00 . A A . 40 LEU CG 1 1 19 13110 1 1 40 LEU H H -3.518 -2.077 1.905 1.00 . A A . 40 LEU H 1 1 19 13111 1 1 40 LEU HA H -5.772 -2.705 3.796 1.00 . A A . 40 LEU HA 1 1 19 13112 1 1 40 LEU HB2 H -6.733 -0.702 3.149 1.00 . A A . 40 LEU HB2 1 1 19 13113 1 1 40 LEU HB3 H -5.038 -0.340 3.180 1.00 . A A . 40 LEU HB3 1 1 19 13114 1 1 40 LEU HD11 H -7.233 1.424 1.991 1.00 . A A . 40 LEU HD11 1 1 19 13115 1 1 40 LEU HD12 H -5.508 1.849 1.906 1.00 . A A . 40 LEU HD12 1 1 19 13116 1 1 40 LEU HD13 H -6.496 1.798 0.424 1.00 . A A . 40 LEU HD13 1 1 19 13117 1 1 40 LEU HD21 H -3.840 0.134 0.710 1.00 . A A . 40 LEU HD21 1 1 19 13118 1 1 40 LEU HD22 H -4.500 -1.370 0.032 1.00 . A A . 40 LEU HD22 1 1 19 13119 1 1 40 LEU HD23 H -4.918 0.184 -0.702 1.00 . A A . 40 LEU HD23 1 1 19 13120 1 1 40 LEU HG H -6.821 -0.667 0.687 1.00 . A A . 40 LEU HG 1 1 19 13121 1 1 40 LEU N N -4.098 -2.704 2.474 1.00 . A A . 40 LEU N 1 1 19 13122 1 1 40 LEU O O -6.204 -3.307 0.564 1.00 . A A . 40 LEU O 1 1 19 13123 1 1 41 ILE C C -9.360 -4.349 0.873 1.00 . A A . 41 ILE C 1 1 19 13124 1 1 41 ILE CA C -8.167 -5.052 1.600 1.00 . A A . 41 ILE CA 1 1 19 13125 1 1 41 ILE CB C -8.707 -6.195 2.555 1.00 . A A . 41 ILE CB 1 1 19 13126 1 1 41 ILE CD1 C -10.205 -6.747 4.639 1.00 . A A . 41 ILE CD1 1 1 19 13127 1 1 41 ILE CG1 C -9.450 -5.677 3.834 1.00 . A A . 41 ILE CG1 1 1 19 13128 1 1 41 ILE CG2 C -7.492 -7.063 2.985 1.00 . A A . 41 ILE CG2 1 1 19 13129 1 1 41 ILE H H -7.462 -3.921 3.372 1.00 . A A . 41 ILE H 1 1 19 13130 1 1 41 ILE HA H -7.510 -5.523 0.838 1.00 . A A . 41 ILE HA 1 1 19 13131 1 1 41 ILE HB H -9.422 -6.831 1.999 1.00 . A A . 41 ILE HB 1 1 19 13132 1 1 41 ILE HD11 H -10.932 -7.295 4.011 1.00 . A A . 41 ILE HD11 1 1 19 13133 1 1 41 ILE HD12 H -9.521 -7.492 5.085 1.00 . A A . 41 ILE HD12 1 1 19 13134 1 1 41 ILE HD13 H -10.771 -6.290 5.471 1.00 . A A . 41 ILE HD13 1 1 19 13135 1 1 41 ILE HG12 H -8.750 -5.148 4.508 1.00 . A A . 41 ILE HG12 1 1 19 13136 1 1 41 ILE HG13 H -10.198 -4.917 3.547 1.00 . A A . 41 ILE HG13 1 1 19 13137 1 1 41 ILE HG21 H -6.945 -7.455 2.108 1.00 . A A . 41 ILE HG21 1 1 19 13138 1 1 41 ILE HG22 H -6.763 -6.503 3.600 1.00 . A A . 41 ILE HG22 1 1 19 13139 1 1 41 ILE HG23 H -7.801 -7.947 3.571 1.00 . A A . 41 ILE HG23 1 1 19 13140 1 1 41 ILE N N -7.386 -4.021 2.353 1.00 . A A . 41 ILE N 1 1 19 13141 1 1 41 ILE O O -10.112 -3.559 1.456 1.00 . A A . 41 ILE O 1 1 19 13142 1 1 42 MET C C -11.854 -4.986 -1.146 1.00 . A A . 42 MET C 1 1 19 13143 1 1 42 MET CA C -10.583 -4.093 -1.285 1.00 . A A . 42 MET CA 1 1 19 13144 1 1 42 MET CB C -10.091 -4.011 -2.763 1.00 . A A . 42 MET CB 1 1 19 13145 1 1 42 MET CE C -7.787 -7.370 -3.776 1.00 . A A . 42 MET CE 1 1 19 13146 1 1 42 MET CG C -9.593 -5.269 -3.511 1.00 . A A . 42 MET CG 1 1 19 13147 1 1 42 MET H H -8.820 -5.329 -0.793 1.00 . A A . 42 MET H 1 1 19 13148 1 1 42 MET HA H -10.824 -3.058 -0.963 1.00 . A A . 42 MET HA 1 1 19 13149 1 1 42 MET HB2 H -10.910 -3.571 -3.364 1.00 . A A . 42 MET HB2 1 1 19 13150 1 1 42 MET HB3 H -9.288 -3.252 -2.820 1.00 . A A . 42 MET HB3 1 1 19 13151 1 1 42 MET HE1 H -7.744 -7.158 -4.860 1.00 . A A . 42 MET HE1 1 1 19 13152 1 1 42 MET HE2 H -6.842 -7.863 -3.486 1.00 . A A . 42 MET HE2 1 1 19 13153 1 1 42 MET HE3 H -8.614 -8.081 -3.594 1.00 . A A . 42 MET HE3 1 1 19 13154 1 1 42 MET HG2 H -10.343 -6.079 -3.487 1.00 . A A . 42 MET HG2 1 1 19 13155 1 1 42 MET HG3 H -9.440 -5.029 -4.579 1.00 . A A . 42 MET HG3 1 1 19 13156 1 1 42 MET N N -9.509 -4.662 -0.427 1.00 . A A . 42 MET N 1 1 19 13157 1 1 42 MET O O -11.841 -6.180 -1.468 1.00 . A A . 42 MET O 1 1 19 13158 1 1 42 MET SD S -8.023 -5.853 -2.831 1.00 . A A . 42 MET SD 1 1 19 13159 1 1 43 GLU C C -15.383 -4.473 -0.985 1.00 . A A . 43 GLU C 1 1 19 13160 1 1 43 GLU CA C -14.177 -5.120 -0.247 1.00 . A A . 43 GLU CA 1 1 19 13161 1 1 43 GLU CB C -14.412 -5.058 1.291 1.00 . A A . 43 GLU CB 1 1 19 13162 1 1 43 GLU CD C -13.171 -7.223 1.999 1.00 . A A . 43 GLU CD 1 1 19 13163 1 1 43 GLU CG C -13.344 -5.712 2.201 1.00 . A A . 43 GLU CG 1 1 19 13164 1 1 43 GLU H H -12.803 -3.396 -0.377 1.00 . A A . 43 GLU H 1 1 19 13165 1 1 43 GLU HA H -14.098 -6.190 -0.531 1.00 . A A . 43 GLU HA 1 1 19 13166 1 1 43 GLU HB2 H -14.537 -4.004 1.600 1.00 . A A . 43 GLU HB2 1 1 19 13167 1 1 43 GLU HB3 H -15.387 -5.528 1.525 1.00 . A A . 43 GLU HB3 1 1 19 13168 1 1 43 GLU HE2 H -11.925 -8.473 1.177 1.00 . A A . 43 GLU HE2 1 1 19 13169 1 1 43 GLU HG2 H -12.372 -5.198 2.074 1.00 . A A . 43 GLU HG2 1 1 19 13170 1 1 43 GLU HG3 H -13.617 -5.536 3.257 1.00 . A A . 43 GLU HG3 1 1 19 13171 1 1 43 GLU N N -12.933 -4.387 -0.610 1.00 . A A . 43 GLU N 1 1 19 13172 1 1 43 GLU O O -15.535 -3.247 -1.044 1.00 . A A . 43 GLU O 1 1 19 13173 1 1 43 GLU OE1 O -13.970 -8.059 2.420 1.00 . A A . 43 GLU OE1 1 1 19 13174 1 1 43 GLU OE2 O -12.030 -7.527 1.300 1.00 . A A . 43 GLU OE2 1 1 19 13175 1 1 44 GLY C C -18.190 -6.162 -2.780 1.00 . A A . 44 GLY C 1 1 19 13176 1 1 44 GLY CA C -17.441 -4.917 -2.286 1.00 . A A . 44 GLY CA 1 1 19 13177 1 1 44 GLY H H -16.030 -6.326 -1.339 1.00 . A A . 44 GLY H 1 1 19 13178 1 1 44 GLY HA2 H -18.109 -4.316 -1.639 1.00 . A A . 44 GLY HA2 1 1 19 13179 1 1 44 GLY HA3 H -17.153 -4.255 -3.127 1.00 . A A . 44 GLY HA3 1 1 19 13180 1 1 44 GLY N N -16.248 -5.341 -1.525 1.00 . A A . 44 GLY N 1 1 19 13181 1 1 44 GLY O O -19.031 -6.701 -2.055 1.00 . A A . 44 GLY O 1 1 19 13182 1 1 45 LEU C C -17.113 -8.980 -4.171 1.00 . A A . 45 LEU C 1 1 19 13183 1 1 45 LEU CA C -18.260 -7.971 -4.483 1.00 . A A . 45 LEU CA 1 1 19 13184 1 1 45 LEU CB C -18.577 -7.863 -6.007 1.00 . A A . 45 LEU CB 1 1 19 13185 1 1 45 LEU CD1 C -20.393 -9.706 -6.160 1.00 . A A . 45 LEU CD1 1 1 19 13186 1 1 45 LEU CD2 C -19.217 -8.901 -8.244 1.00 . A A . 45 LEU CD2 1 1 19 13187 1 1 45 LEU CG C -19.073 -9.151 -6.730 1.00 . A A . 45 LEU CG 1 1 19 13188 1 1 45 LEU H H -17.120 -6.083 -4.475 1.00 . A A . 45 LEU H 1 1 19 13189 1 1 45 LEU HA H -19.186 -8.305 -3.972 1.00 . A A . 45 LEU HA 1 1 19 13190 1 1 45 LEU HB2 H -19.336 -7.070 -6.157 1.00 . A A . 45 LEU HB2 1 1 19 13191 1 1 45 LEU HB3 H -17.676 -7.489 -6.534 1.00 . A A . 45 LEU HB3 1 1 19 13192 1 1 45 LEU HD11 H -21.202 -8.951 -6.166 1.00 . A A . 45 LEU HD11 1 1 19 13193 1 1 45 LEU HD12 H -20.755 -10.580 -6.732 1.00 . A A . 45 LEU HD12 1 1 19 13194 1 1 45 LEU HD13 H -20.267 -10.050 -5.118 1.00 . A A . 45 LEU HD13 1 1 19 13195 1 1 45 LEU HD21 H -18.264 -8.566 -8.694 1.00 . A A . 45 LEU HD21 1 1 19 13196 1 1 45 LEU HD22 H -19.516 -9.819 -8.783 1.00 . A A . 45 LEU HD22 1 1 19 13197 1 1 45 LEU HD23 H -19.976 -8.127 -8.468 1.00 . A A . 45 LEU HD23 1 1 19 13198 1 1 45 LEU HG H -18.305 -9.937 -6.609 1.00 . A A . 45 LEU HG 1 1 19 13199 1 1 45 LEU N N -17.838 -6.634 -3.991 1.00 . A A . 45 LEU N 1 1 19 13200 1 1 45 LEU O O -16.195 -9.180 -4.975 1.00 . A A . 45 LEU O 1 1 19 13201 1 1 46 SER C C -17.118 -11.879 -2.006 1.00 . A A . 46 SER C 1 1 19 13202 1 1 46 SER CA C -16.271 -10.698 -2.573 1.00 . A A . 46 SER CA 1 1 19 13203 1 1 46 SER CB C -15.267 -10.114 -1.546 1.00 . A A . 46 SER CB 1 1 19 13204 1 1 46 SER H H -17.998 -9.333 -2.407 1.00 . A A . 46 SER H 1 1 19 13205 1 1 46 SER HA H -15.693 -11.083 -3.437 1.00 . A A . 46 SER HA 1 1 19 13206 1 1 46 SER HB2 H -14.748 -9.229 -1.963 1.00 . A A . 46 SER HB2 1 1 19 13207 1 1 46 SER HB3 H -15.779 -9.763 -0.630 1.00 . A A . 46 SER HB3 1 1 19 13208 1 1 46 SER HG H -13.841 -11.316 -2.012 1.00 . A A . 46 SER HG 1 1 19 13209 1 1 46 SER N N -17.189 -9.599 -2.979 1.00 . A A . 46 SER N 1 1 19 13210 1 1 46 SER O O -17.107 -12.174 -0.805 1.00 . A A . 46 SER O 1 1 19 13211 1 1 46 SER OG O -14.284 -11.080 -1.194 1.00 . A A . 46 SER OG 1 1 19 13212 1 1 47 PHE C C -19.266 -14.394 -3.852 1.00 . A A . 47 PHE C 1 1 19 13213 1 1 47 PHE CA C -18.813 -13.650 -2.552 1.00 . A A . 47 PHE CA 1 1 19 13214 1 1 47 PHE CB C -20.056 -13.111 -1.754 1.00 . A A . 47 PHE CB 1 1 19 13215 1 1 47 PHE CD1 C -20.572 -10.611 -1.933 1.00 . A A . 47 PHE CD1 1 1 19 13216 1 1 47 PHE CD2 C -22.057 -12.160 -3.040 1.00 . A A . 47 PHE CD2 1 1 19 13217 1 1 47 PHE CE1 C -21.365 -9.548 -2.360 1.00 . A A . 47 PHE CE1 1 1 19 13218 1 1 47 PHE CE2 C -22.845 -11.096 -3.472 1.00 . A A . 47 PHE CE2 1 1 19 13219 1 1 47 PHE CG C -20.907 -11.927 -2.276 1.00 . A A . 47 PHE CG 1 1 19 13220 1 1 47 PHE CZ C -22.499 -9.791 -3.129 1.00 . A A . 47 PHE CZ 1 1 19 13221 1 1 47 PHE H H -17.794 -12.193 -3.867 1.00 . A A . 47 PHE H 1 1 19 13222 1 1 47 PHE HA H -18.278 -14.384 -1.930 1.00 . A A . 47 PHE HA 1 1 19 13223 1 1 47 PHE HB2 H -20.728 -13.969 -1.554 1.00 . A A . 47 PHE HB2 1 1 19 13224 1 1 47 PHE HB3 H -19.707 -12.853 -0.736 1.00 . A A . 47 PHE HB3 1 1 19 13225 1 1 47 PHE HD1 H -19.700 -10.405 -1.329 1.00 . A A . 47 PHE HD1 1 1 19 13226 1 1 47 PHE HD2 H -22.344 -13.169 -3.304 1.00 . A A . 47 PHE HD2 1 1 19 13227 1 1 47 PHE HE1 H -21.099 -8.535 -2.095 1.00 . A A . 47 PHE HE1 1 1 19 13228 1 1 47 PHE HE2 H -23.725 -11.283 -4.068 1.00 . A A . 47 PHE HE2 1 1 19 13229 1 1 47 PHE HZ H -23.111 -8.966 -3.464 1.00 . A A . 47 PHE HZ 1 1 19 13230 1 1 47 PHE N N -17.875 -12.541 -2.905 1.00 . A A . 47 PHE N 1 1 19 13231 1 1 47 PHE O O -19.215 -15.627 -3.865 1.00 . A A . 47 PHE O 1 1 19 13232 1 1 48 ALA C C -19.209 -13.768 -7.317 1.00 . A A . 48 ALA C 1 1 19 13233 1 1 48 ALA CA C -20.132 -14.285 -6.196 1.00 . A A . 48 ALA CA 1 1 19 13234 1 1 48 ALA CB C -21.602 -13.907 -6.463 1.00 . A A . 48 ALA CB 1 1 19 13235 1 1 48 ALA H H -19.659 -12.671 -4.754 1.00 . A A . 48 ALA H 1 1 19 13236 1 1 48 ALA HXT H -17.770 -14.416 -8.457 1.00 . A A . 48 ALA HXT 1 1 19 13237 1 1 48 ALA HA H -20.075 -15.391 -6.165 1.00 . A A . 48 ALA HA 1 1 19 13238 1 1 48 ALA HB1 H -21.761 -12.813 -6.503 1.00 . A A . 48 ALA HB1 1 1 19 13239 1 1 48 ALA HB2 H -21.959 -14.324 -7.422 1.00 . A A . 48 ALA HB2 1 1 19 13240 1 1 48 ALA HB3 H -22.271 -14.304 -5.677 1.00 . A A . 48 ALA HB3 1 1 19 13241 1 1 48 ALA N N -19.701 -13.682 -4.913 1.00 . A A . 48 ALA N 1 1 19 13242 1 1 48 ALA O O -19.231 -12.616 -7.757 1.00 . A A . 48 ALA O 1 1 19 13243 1 1 48 ALA OXT O -18.349 -14.739 -7.763 1.00 . A A . 48 ALA OXT 1 1 20 13244 1 1 1 GLU C C 8.938 9.909 14.069 1.00 . A A . 1 GLU C 1 1 20 13245 1 1 1 GLU CA C 8.140 8.592 14.251 1.00 . A A . 1 GLU CA 1 1 20 13246 1 1 1 GLU CB C 6.784 8.869 14.966 1.00 . A A . 1 GLU CB 1 1 20 13247 1 1 1 GLU CD C 5.173 7.370 13.616 1.00 . A A . 1 GLU CD 1 1 20 13248 1 1 1 GLU CG C 5.769 7.703 14.987 1.00 . A A . 1 GLU CG 1 1 20 13249 1 1 1 GLU H1 H 9.861 7.458 14.596 1.00 . A A . 1 GLU H1 1 1 20 13250 1 1 1 GLU H2 H 8.488 6.762 15.196 1.00 . A A . 1 GLU H2 1 1 20 13251 1 1 1 GLU HA H 7.947 8.130 13.263 1.00 . A A . 1 GLU HA 1 1 20 13252 1 1 1 GLU HB2 H 6.968 9.195 16.008 1.00 . A A . 1 GLU HB2 1 1 20 13253 1 1 1 GLU HB3 H 6.288 9.740 14.494 1.00 . A A . 1 GLU HB3 1 1 20 13254 1 1 1 GLU HE2 H 5.561 6.250 12.075 1.00 . A A . 1 GLU HE2 1 1 20 13255 1 1 1 GLU HG2 H 6.228 6.798 15.429 1.00 . A A . 1 GLU HG2 1 1 20 13256 1 1 1 GLU HG3 H 4.940 7.959 15.672 1.00 . A A . 1 GLU HG3 1 1 20 13257 1 1 1 GLU N N 8.964 7.659 15.053 1.00 . A A . 1 GLU N 1 1 20 13258 1 1 1 GLU O O 9.174 10.653 15.029 1.00 . A A . 1 GLU O 1 1 20 13259 1 1 1 GLU OE1 O 4.130 7.863 13.189 1.00 . A A . 1 GLU OE1 1 1 20 13260 1 1 1 GLU OE2 O 5.936 6.460 12.933 1.00 . A A . 1 GLU OE2 1 1 20 13261 1 1 2 ASP C C 9.668 11.859 10.996 1.00 . A A . 2 ASP C 1 1 20 13262 1 1 2 ASP CA C 10.065 11.435 12.445 1.00 . A A . 2 ASP CA 1 1 20 13263 1 1 2 ASP CB C 11.609 11.223 12.609 1.00 . A A . 2 ASP CB 1 1 20 13264 1 1 2 ASP CG C 12.320 10.065 11.876 1.00 . A A . 2 ASP CG 1 1 20 13265 1 1 2 ASP H H 9.080 9.480 12.115 1.00 . A A . 2 ASP H 1 1 20 13266 1 1 2 ASP HA H 9.756 12.260 13.106 1.00 . A A . 2 ASP HA 1 1 20 13267 1 1 2 ASP HB2 H 12.119 12.171 12.352 1.00 . A A . 2 ASP HB2 1 1 20 13268 1 1 2 ASP HB3 H 11.826 11.102 13.687 1.00 . A A . 2 ASP HB3 1 1 20 13269 1 1 2 ASP HD2 H 12.890 11.434 10.615 1.00 . A A . 2 ASP HD2 1 1 20 13270 1 1 2 ASP N N 9.341 10.183 12.816 1.00 . A A . 2 ASP N 1 1 20 13271 1 1 2 ASP O O 9.178 12.978 10.822 1.00 . A A . 2 ASP O 1 1 20 13272 1 1 2 ASP OD1 O 12.291 8.899 12.266 1.00 . A A . 2 ASP OD1 1 1 20 13273 1 1 2 ASP OD2 O 12.983 10.489 10.752 1.00 . A A . 2 ASP OD2 1 1 20 13274 1 1 3 ASN C C 8.840 10.096 7.769 1.00 . A A . 3 ASN C 1 1 20 13275 1 1 3 ASN CA C 9.496 11.286 8.548 1.00 . A A . 3 ASN CA 1 1 20 13276 1 1 3 ASN CB C 10.802 11.711 7.814 1.00 . A A . 3 ASN CB 1 1 20 13277 1 1 3 ASN CG C 11.452 13.046 8.242 1.00 . A A . 3 ASN CG 1 1 20 13278 1 1 3 ASN H H 10.276 10.112 10.286 1.00 . A A . 3 ASN H 1 1 20 13279 1 1 3 ASN HA H 8.735 12.071 8.537 1.00 . A A . 3 ASN HA 1 1 20 13280 1 1 3 ASN HB2 H 11.529 10.885 7.938 1.00 . A A . 3 ASN HB2 1 1 20 13281 1 1 3 ASN HB3 H 10.632 11.758 6.720 1.00 . A A . 3 ASN HB3 1 1 20 13282 1 1 3 ASN HD21 H 10.200 14.071 7.055 1.00 . A A . 3 ASN HD21 1 1 20 13283 1 1 3 ASN HD22 H 11.422 15.040 8.023 1.00 . A A . 3 ASN HD22 1 1 20 13284 1 1 3 ASN N N 9.874 11.002 9.976 1.00 . A A . 3 ASN N 1 1 20 13285 1 1 3 ASN ND2 N 10.977 14.167 7.719 1.00 . A A . 3 ASN ND2 1 1 20 13286 1 1 3 ASN O O 8.601 10.198 6.561 1.00 . A A . 3 ASN O 1 1 20 13287 1 1 3 ASN OD1 O 12.379 13.074 9.051 1.00 . A A . 3 ASN OD1 1 1 20 13288 1 1 4 CYS C C 6.820 7.234 9.040 1.00 . A A . 4 CYS C 1 1 20 13289 1 1 4 CYS CA C 7.730 7.870 7.930 1.00 . A A . 4 CYS CA 1 1 20 13290 1 1 4 CYS CB C 8.692 6.836 7.352 1.00 . A A . 4 CYS CB 1 1 20 13291 1 1 4 CYS H H 8.682 9.251 9.452 1.00 . A A . 4 CYS H 1 1 20 13292 1 1 4 CYS HA H 7.084 8.179 7.092 1.00 . A A . 4 CYS HA 1 1 20 13293 1 1 4 CYS HB2 H 7.961 6.093 7.107 1.00 . A A . 4 CYS HB2 1 1 20 13294 1 1 4 CYS HB3 H 9.111 7.082 6.365 1.00 . A A . 4 CYS HB3 1 1 20 13295 1 1 4 CYS N N 8.503 9.016 8.472 1.00 . A A . 4 CYS N 1 1 20 13296 1 1 4 CYS O O 6.956 7.550 10.230 1.00 . A A . 4 CYS O 1 1 20 13297 1 1 4 CYS SG S 9.834 5.940 8.416 1.00 . A A . 4 CYS SG 1 1 20 13298 1 1 5 ILE C C 5.678 4.125 9.670 1.00 . A A . 5 ILE C 1 1 20 13299 1 1 5 ILE CA C 5.078 5.544 9.665 1.00 . A A . 5 ILE CA 1 1 20 13300 1 1 5 ILE CB C 3.520 5.403 9.395 1.00 . A A . 5 ILE CB 1 1 20 13301 1 1 5 ILE CD1 C 3.041 7.924 9.638 1.00 . A A . 5 ILE CD1 1 1 20 13302 1 1 5 ILE CG1 C 2.881 6.677 8.809 1.00 . A A . 5 ILE CG1 1 1 20 13303 1 1 5 ILE CG2 C 2.810 5.038 10.733 1.00 . A A . 5 ILE CG2 1 1 20 13304 1 1 5 ILE H H 6.019 6.039 7.631 1.00 . A A . 5 ILE H 1 1 20 13305 1 1 5 ILE HA H 5.185 6.031 10.645 1.00 . A A . 5 ILE HA 1 1 20 13306 1 1 5 ILE HB H 3.236 4.580 8.733 1.00 . A A . 5 ILE HB 1 1 20 13307 1 1 5 ILE HD11 H 3.064 7.702 10.706 1.00 . A A . 5 ILE HD11 1 1 20 13308 1 1 5 ILE HD12 H 3.989 8.408 9.373 1.00 . A A . 5 ILE HD12 1 1 20 13309 1 1 5 ILE HD13 H 2.198 8.589 9.421 1.00 . A A . 5 ILE HD13 1 1 20 13310 1 1 5 ILE HG12 H 3.263 6.916 7.814 1.00 . A A . 5 ILE HG12 1 1 20 13311 1 1 5 ILE HG13 H 1.826 6.500 8.597 1.00 . A A . 5 ILE HG13 1 1 20 13312 1 1 5 ILE HG21 H 3.053 5.721 11.568 1.00 . A A . 5 ILE HG21 1 1 20 13313 1 1 5 ILE HG22 H 1.708 5.042 10.628 1.00 . A A . 5 ILE HG22 1 1 20 13314 1 1 5 ILE HG23 H 3.088 4.023 11.066 1.00 . A A . 5 ILE HG23 1 1 20 13315 1 1 5 ILE N N 5.889 6.313 8.636 1.00 . A A . 5 ILE N 1 1 20 13316 1 1 5 ILE O O 5.301 3.253 8.880 1.00 . A A . 5 ILE O 1 1 20 13317 1 1 6 ALA C C 6.540 1.404 11.321 1.00 . A A . 6 ALA C 1 1 20 13318 1 1 6 ALA CA C 7.339 2.562 10.607 1.00 . A A . 6 ALA CA 1 1 20 13319 1 1 6 ALA CB C 8.672 2.825 11.333 1.00 . A A . 6 ALA CB 1 1 20 13320 1 1 6 ALA H H 6.726 4.609 11.282 1.00 . A A . 6 ALA H 1 1 20 13321 1 1 6 ALA HA H 7.514 2.253 9.549 1.00 . A A . 6 ALA HA 1 1 20 13322 1 1 6 ALA HB1 H 9.262 3.616 10.833 1.00 . A A . 6 ALA HB1 1 1 20 13323 1 1 6 ALA HB2 H 8.522 3.135 12.385 1.00 . A A . 6 ALA HB2 1 1 20 13324 1 1 6 ALA HB3 H 9.305 1.920 11.345 1.00 . A A . 6 ALA HB3 1 1 20 13325 1 1 6 ALA N N 6.624 3.874 10.582 1.00 . A A . 6 ALA N 1 1 20 13326 1 1 6 ALA O O 7.113 0.391 11.730 1.00 . A A . 6 ALA O 1 1 20 13327 1 1 7 GLU C C 3.238 0.024 11.393 1.00 . A A . 7 GLU C 1 1 20 13328 1 1 7 GLU CA C 4.316 0.722 12.252 1.00 . A A . 7 GLU CA 1 1 20 13329 1 1 7 GLU CB C 3.656 1.623 13.339 1.00 . A A . 7 GLU CB 1 1 20 13330 1 1 7 GLU CD C 5.155 3.487 14.308 1.00 . A A . 7 GLU CD 1 1 20 13331 1 1 7 GLU CG C 4.550 2.097 14.510 1.00 . A A . 7 GLU CG 1 1 20 13332 1 1 7 GLU H H 5.014 2.558 11.188 1.00 . A A . 7 GLU H 1 1 20 13333 1 1 7 GLU HA H 4.854 -0.067 12.745 1.00 . A A . 7 GLU HA 1 1 20 13334 1 1 7 GLU HB2 H 3.154 2.481 12.861 1.00 . A A . 7 GLU HB2 1 1 20 13335 1 1 7 GLU HB3 H 2.828 1.061 13.810 1.00 . A A . 7 GLU HB3 1 1 20 13336 1 1 7 GLU HE2 H 4.605 5.354 14.366 1.00 . A A . 7 GLU HE2 1 1 20 13337 1 1 7 GLU HG2 H 3.946 2.124 15.437 1.00 . A A . 7 GLU HG2 1 1 20 13338 1 1 7 GLU HG3 H 5.349 1.361 14.717 1.00 . A A . 7 GLU HG3 1 1 20 13339 1 1 7 GLU N N 5.216 1.580 11.449 1.00 . A A . 7 GLU N 1 1 20 13340 1 1 7 GLU O O 2.953 0.388 10.252 1.00 . A A . 7 GLU O 1 1 20 13341 1 1 7 GLU OE1 O 6.335 3.681 14.021 1.00 . A A . 7 GLU OE1 1 1 20 13342 1 1 7 GLU OE2 O 4.226 4.481 14.490 1.00 . A A . 7 GLU OE2 1 1 20 13343 1 1 8 ASP C C 0.398 -1.224 12.655 1.00 . A A . 8 ASP C 1 1 20 13344 1 1 8 ASP CA C 1.396 -1.661 11.549 1.00 . A A . 8 ASP CA 1 1 20 13345 1 1 8 ASP CB C 1.444 -3.200 11.445 1.00 . A A . 8 ASP CB 1 1 20 13346 1 1 8 ASP CG C 2.682 -3.761 10.719 1.00 . A A . 8 ASP CG 1 1 20 13347 1 1 8 ASP H H 2.999 -1.176 12.973 1.00 . A A . 8 ASP H 1 1 20 13348 1 1 8 ASP HA H 1.129 -1.275 10.540 1.00 . A A . 8 ASP HA 1 1 20 13349 1 1 8 ASP HB2 H 1.301 -3.602 12.454 1.00 . A A . 8 ASP HB2 1 1 20 13350 1 1 8 ASP HB3 H 0.563 -3.541 10.872 1.00 . A A . 8 ASP HB3 1 1 20 13351 1 1 8 ASP HD2 H 2.761 -5.015 12.205 1.00 . A A . 8 ASP HD2 1 1 20 13352 1 1 8 ASP N N 2.631 -0.993 12.033 1.00 . A A . 8 ASP N 1 1 20 13353 1 1 8 ASP O O 0.556 -1.442 13.863 1.00 . A A . 8 ASP O 1 1 20 13354 1 1 8 ASP OD1 O 3.114 -3.315 9.655 1.00 . A A . 8 ASP OD1 1 1 20 13355 1 1 8 ASP OD2 O 3.239 -4.815 11.396 1.00 . A A . 8 ASP OD2 1 1 20 13356 1 1 9 TYR C C -0.915 1.386 13.764 1.00 . A A . 9 TYR C 1 1 20 13357 1 1 9 TYR CA C -1.633 0.252 12.921 1.00 . A A . 9 TYR CA 1 1 20 13358 1 1 9 TYR CB C -2.507 -0.723 13.783 1.00 . A A . 9 TYR CB 1 1 20 13359 1 1 9 TYR CD1 C -4.395 -1.271 12.143 1.00 . A A . 9 TYR CD1 1 1 20 13360 1 1 9 TYR CD2 C -2.871 -3.039 12.769 1.00 . A A . 9 TYR CD2 1 1 20 13361 1 1 9 TYR CE1 C -4.987 -2.115 11.207 1.00 . A A . 9 TYR CE1 1 1 20 13362 1 1 9 TYR CE2 C -3.467 -3.882 11.834 1.00 . A A . 9 TYR CE2 1 1 20 13363 1 1 9 TYR CG C -3.320 -1.721 12.921 1.00 . A A . 9 TYR CG 1 1 20 13364 1 1 9 TYR CZ C -4.519 -3.418 11.049 1.00 . A A . 9 TYR CZ 1 1 20 13365 1 1 9 TYR H H -0.583 -0.636 11.130 1.00 . A A . 9 TYR H 1 1 20 13366 1 1 9 TYR HA H -2.291 0.790 12.219 1.00 . A A . 9 TYR HA 1 1 20 13367 1 1 9 TYR HB2 H -1.894 -1.253 14.538 1.00 . A A . 9 TYR HB2 1 1 20 13368 1 1 9 TYR HB3 H -3.218 -0.128 14.387 1.00 . A A . 9 TYR HB3 1 1 20 13369 1 1 9 TYR HD1 H -4.736 -0.248 12.220 1.00 . A A . 9 TYR HD1 1 1 20 13370 1 1 9 TYR HD2 H -2.022 -3.398 13.334 1.00 . A A . 9 TYR HD2 1 1 20 13371 1 1 9 TYR HE1 H -5.789 -1.749 10.583 1.00 . A A . 9 TYR HE1 1 1 20 13372 1 1 9 TYR HE2 H -3.088 -4.886 11.699 1.00 . A A . 9 TYR HE2 1 1 20 13373 1 1 9 TYR HH H -5.779 -3.758 9.650 1.00 . A A . 9 TYR HH 1 1 20 13374 1 1 9 TYR N N -0.621 -0.547 12.148 1.00 . A A . 9 TYR N 1 1 20 13375 1 1 9 TYR O O -1.210 1.609 14.942 1.00 . A A . 9 TYR O 1 1 20 13376 1 1 9 TYR OH O -5.078 -4.236 10.101 1.00 . A A . 9 TYR OH 1 1 20 13377 1 1 10 GLY C C -0.345 4.609 13.566 1.00 . A A . 10 GLY C 1 1 20 13378 1 1 10 GLY CA C 0.597 3.403 13.590 1.00 . A A . 10 GLY CA 1 1 20 13379 1 1 10 GLY H H 0.196 1.780 12.148 1.00 . A A . 10 GLY H 1 1 20 13380 1 1 10 GLY HA2 H 1.155 3.300 14.527 1.00 . A A . 10 GLY HA2 1 1 20 13381 1 1 10 GLY HA3 H 1.393 3.677 12.879 1.00 . A A . 10 GLY HA3 1 1 20 13382 1 1 10 GLY N N -0.019 2.148 13.085 1.00 . A A . 10 GLY N 1 1 20 13383 1 1 10 GLY O O -1.533 4.469 13.301 1.00 . A A . 10 GLY O 1 1 20 13384 1 1 11 LYS C C -0.071 7.605 12.196 1.00 . A A . 11 LYS C 1 1 20 13385 1 1 11 LYS CA C -0.558 7.074 13.565 1.00 . A A . 11 LYS CA 1 1 20 13386 1 1 11 LYS CB C -0.348 8.156 14.650 1.00 . A A . 11 LYS CB 1 1 20 13387 1 1 11 LYS CD C 1.097 9.518 16.298 1.00 . A A . 11 LYS CD 1 1 20 13388 1 1 11 LYS CE C 2.493 9.814 16.883 1.00 . A A . 11 LYS CE 1 1 20 13389 1 1 11 LYS CG C 1.060 8.376 15.259 1.00 . A A . 11 LYS CG 1 1 20 13390 1 1 11 LYS H H 1.211 5.750 13.914 1.00 . A A . 11 LYS H 1 1 20 13391 1 1 11 LYS HA H -1.654 6.857 13.507 1.00 . A A . 11 LYS HA 1 1 20 13392 1 1 11 LYS HB2 H -0.710 9.127 14.256 1.00 . A A . 11 LYS HB2 1 1 20 13393 1 1 11 LYS HB3 H -1.095 7.926 15.418 1.00 . A A . 11 LYS HB3 1 1 20 13394 1 1 11 LYS HD2 H 0.671 10.444 15.865 1.00 . A A . 11 LYS HD2 1 1 20 13395 1 1 11 LYS HD3 H 0.421 9.254 17.133 1.00 . A A . 11 LYS HD3 1 1 20 13396 1 1 11 LYS HE2 H 2.385 10.462 17.771 1.00 . A A . 11 LYS HE2 1 1 20 13397 1 1 11 LYS HE3 H 2.968 8.884 17.248 1.00 . A A . 11 LYS HE3 1 1 20 13398 1 1 11 LYS HG2 H 1.417 7.441 15.730 1.00 . A A . 11 LYS HG2 1 1 20 13399 1 1 11 LYS HG3 H 1.775 8.594 14.445 1.00 . A A . 11 LYS HG3 1 1 20 13400 1 1 11 LYS HZ1 H 2.967 11.358 15.593 1.00 . A A . 11 LYS HZ1 1 1 20 13401 1 1 11 LYS HZ2 H 3.518 9.903 15.090 1.00 . A A . 11 LYS HZ2 1 1 20 13402 1 1 11 LYS N N 0.190 5.803 13.827 1.00 . A A . 11 LYS N 1 1 20 13403 1 1 11 LYS NZ N 3.394 10.486 15.925 1.00 . A A . 11 LYS NZ 1 1 20 13404 1 1 11 LYS O O 1.131 7.727 11.964 1.00 . A A . 11 LYS O 1 1 20 13405 1 1 12 CYS C C -1.791 9.519 9.522 1.00 . A A . 12 CYS C 1 1 20 13406 1 1 12 CYS CA C -0.717 8.490 9.965 1.00 . A A . 12 CYS CA 1 1 20 13407 1 1 12 CYS CB C -0.647 7.299 8.977 1.00 . A A . 12 CYS CB 1 1 20 13408 1 1 12 CYS H H -1.940 7.935 11.794 1.00 . A A . 12 CYS H 1 1 20 13409 1 1 12 CYS HA H 0.255 9.011 9.934 1.00 . A A . 12 CYS HA 1 1 20 13410 1 1 12 CYS HB2 H -0.046 7.602 8.100 1.00 . A A . 12 CYS HB2 1 1 20 13411 1 1 12 CYS HB3 H -0.068 6.474 9.422 1.00 . A A . 12 CYS HB3 1 1 20 13412 1 1 12 CYS N N -1.019 7.966 11.333 1.00 . A A . 12 CYS N 1 1 20 13413 1 1 12 CYS O O -2.671 9.944 10.280 1.00 . A A . 12 CYS O 1 1 20 13414 1 1 12 CYS SG S -2.292 6.732 8.468 1.00 . A A . 12 CYS SG 1 1 20 13415 1 1 13 THR C C -2.771 10.500 6.101 1.00 . A A . 13 THR C 1 1 20 13416 1 1 13 THR CA C -2.611 10.879 7.603 1.00 . A A . 13 THR CA 1 1 20 13417 1 1 13 THR CB C -2.096 12.371 7.693 1.00 . A A . 13 THR CB 1 1 20 13418 1 1 13 THR CG2 C -2.665 13.150 8.872 1.00 . A A . 13 THR CG2 1 1 20 13419 1 1 13 THR H H -0.834 9.521 7.769 1.00 . A A . 13 THR H 1 1 20 13420 1 1 13 THR HA H -3.608 10.776 8.107 1.00 . A A . 13 THR HA 1 1 20 13421 1 1 13 THR HB H -2.417 12.893 6.770 1.00 . A A . 13 THR HB 1 1 20 13422 1 1 13 THR HG1 H -0.494 12.013 8.706 1.00 . A A . 13 THR HG1 1 1 20 13423 1 1 13 THR HG21 H -3.765 13.200 8.822 1.00 . A A . 13 THR HG21 1 1 20 13424 1 1 13 THR HG22 H -2.354 12.714 9.836 1.00 . A A . 13 THR HG22 1 1 20 13425 1 1 13 THR HG23 H -2.286 14.191 8.837 1.00 . A A . 13 THR HG23 1 1 20 13426 1 1 13 THR N N -1.659 9.934 8.249 1.00 . A A . 13 THR N 1 1 20 13427 1 1 13 THR O O -1.824 10.106 5.412 1.00 . A A . 13 THR O 1 1 20 13428 1 1 13 THR OG1 O -0.679 12.446 7.869 1.00 . A A . 13 THR OG1 1 1 20 13429 1 1 14 TRP C C -4.156 12.117 3.667 1.00 . A A . 14 TRP C 1 1 20 13430 1 1 14 TRP CA C -4.342 10.655 4.154 1.00 . A A . 14 TRP CA 1 1 20 13431 1 1 14 TRP CB C -5.780 10.161 3.901 1.00 . A A . 14 TRP CB 1 1 20 13432 1 1 14 TRP CD1 C -5.241 7.620 4.616 1.00 . A A . 14 TRP CD1 1 1 20 13433 1 1 14 TRP CD2 C -7.303 8.077 3.860 1.00 . A A . 14 TRP CD2 1 1 20 13434 1 1 14 TRP CE2 C -7.220 6.714 4.221 1.00 . A A . 14 TRP CE2 1 1 20 13435 1 1 14 TRP CE3 C -8.532 8.623 3.399 1.00 . A A . 14 TRP CE3 1 1 20 13436 1 1 14 TRP CG C -6.071 8.667 4.110 1.00 . A A . 14 TRP CG 1 1 20 13437 1 1 14 TRP CH2 C -9.567 6.440 3.696 1.00 . A A . 14 TRP CH2 1 1 20 13438 1 1 14 TRP CZ2 C -8.371 5.889 4.155 1.00 . A A . 14 TRP CZ2 1 1 20 13439 1 1 14 TRP CZ3 C -9.646 7.786 3.320 1.00 . A A . 14 TRP CZ3 1 1 20 13440 1 1 14 TRP H H -4.606 11.184 6.294 1.00 . A A . 14 TRP H 1 1 20 13441 1 1 14 TRP HA H -3.652 9.963 3.627 1.00 . A A . 14 TRP HA 1 1 20 13442 1 1 14 TRP HB2 H -6.495 10.754 4.506 1.00 . A A . 14 TRP HB2 1 1 20 13443 1 1 14 TRP HB3 H -6.047 10.394 2.852 1.00 . A A . 14 TRP HB3 1 1 20 13444 1 1 14 TRP HD1 H -4.196 7.676 4.932 1.00 . A A . 14 TRP HD1 1 1 20 13445 1 1 14 TRP HE1 H -5.619 5.517 5.048 1.00 . A A . 14 TRP HE1 1 1 20 13446 1 1 14 TRP HE3 H -8.614 9.666 3.128 1.00 . A A . 14 TRP HE3 1 1 20 13447 1 1 14 TRP HH2 H -10.451 5.821 3.644 1.00 . A A . 14 TRP HH2 1 1 20 13448 1 1 14 TRP HZ2 H -8.342 4.863 4.484 1.00 . A A . 14 TRP HZ2 1 1 20 13449 1 1 14 TRP HZ3 H -10.588 8.188 2.977 1.00 . A A . 14 TRP HZ3 1 1 20 13450 1 1 14 TRP N N -4.009 10.704 5.612 1.00 . A A . 14 TRP N 1 1 20 13451 1 1 14 TRP NE1 N -5.956 6.420 4.695 1.00 . A A . 14 TRP NE1 1 1 20 13452 1 1 14 TRP O O -4.836 13.046 4.121 1.00 . A A . 14 TRP O 1 1 20 13453 1 1 15 GLY C C -1.706 13.975 3.669 1.00 . A A . 15 GLY C 1 1 20 13454 1 1 15 GLY CA C -2.624 13.657 2.453 1.00 . A A . 15 GLY CA 1 1 20 13455 1 1 15 GLY H H -2.668 11.447 2.506 1.00 . A A . 15 GLY H 1 1 20 13456 1 1 15 GLY HA2 H -2.058 13.629 1.503 1.00 . A A . 15 GLY HA2 1 1 20 13457 1 1 15 GLY HA3 H -3.427 14.407 2.338 1.00 . A A . 15 GLY HA3 1 1 20 13458 1 1 15 GLY N N -3.156 12.303 2.789 1.00 . A A . 15 GLY N 1 1 20 13459 1 1 15 GLY O O -2.044 14.799 4.525 1.00 . A A . 15 GLY O 1 1 20 13460 1 1 16 GLY C C 1.469 12.256 4.738 1.00 . A A . 16 GLY C 1 1 20 13461 1 1 16 GLY CA C 0.231 13.133 4.948 1.00 . A A . 16 GLY CA 1 1 20 13462 1 1 16 GLY H H -0.484 12.573 2.958 1.00 . A A . 16 GLY H 1 1 20 13463 1 1 16 GLY HA2 H 0.365 14.024 5.588 1.00 . A A . 16 GLY HA2 1 1 20 13464 1 1 16 GLY HA3 H -0.444 12.539 5.579 1.00 . A A . 16 GLY HA3 1 1 20 13465 1 1 16 GLY N N -0.598 13.223 3.743 1.00 . A A . 16 GLY N 1 1 20 13466 1 1 16 GLY O O 2.066 12.176 3.659 1.00 . A A . 16 GLY O 1 1 20 13467 1 1 17 THR C C 2.063 9.117 5.561 1.00 . A A . 17 THR C 1 1 20 13468 1 1 17 THR CA C 2.806 10.472 5.828 1.00 . A A . 17 THR CA 1 1 20 13469 1 1 17 THR CB C 3.561 10.341 7.195 1.00 . A A . 17 THR CB 1 1 20 13470 1 1 17 THR CG2 C 4.958 9.724 7.026 1.00 . A A . 17 THR CG2 1 1 20 13471 1 1 17 THR H H 1.259 11.883 6.648 1.00 . A A . 17 THR H 1 1 20 13472 1 1 17 THR HA H 3.553 10.683 5.032 1.00 . A A . 17 THR HA 1 1 20 13473 1 1 17 THR HB H 2.979 9.662 7.852 1.00 . A A . 17 THR HB 1 1 20 13474 1 1 17 THR HG1 H 4.272 12.131 7.186 1.00 . A A . 17 THR HG1 1 1 20 13475 1 1 17 THR HG21 H 5.609 10.275 6.324 1.00 . A A . 17 THR HG21 1 1 20 13476 1 1 17 THR HG22 H 5.491 9.671 7.994 1.00 . A A . 17 THR HG22 1 1 20 13477 1 1 17 THR HG23 H 4.902 8.685 6.664 1.00 . A A . 17 THR HG23 1 1 20 13478 1 1 17 THR N N 1.798 11.567 5.834 1.00 . A A . 17 THR N 1 1 20 13479 1 1 17 THR O O 1.003 8.826 6.142 1.00 . A A . 17 THR O 1 1 20 13480 1 1 17 THR OG1 O 3.760 11.612 7.811 1.00 . A A . 17 THR OG1 1 1 20 13481 1 1 18 LYS C C 3.462 6.048 5.202 1.00 . A A . 18 LYS C 1 1 20 13482 1 1 18 LYS CA C 2.374 6.884 4.465 1.00 . A A . 18 LYS CA 1 1 20 13483 1 1 18 LYS CB C 2.332 6.503 2.951 1.00 . A A . 18 LYS CB 1 1 20 13484 1 1 18 LYS CD C 0.121 7.425 1.867 1.00 . A A . 18 LYS CD 1 1 20 13485 1 1 18 LYS CE C -0.609 8.309 2.897 1.00 . A A . 18 LYS CE 1 1 20 13486 1 1 18 LYS CG C 1.669 7.429 1.903 1.00 . A A . 18 LYS CG 1 1 20 13487 1 1 18 LYS H H 3.641 8.690 4.469 1.00 . A A . 18 LYS H 1 1 20 13488 1 1 18 LYS HA H 1.386 6.611 4.876 1.00 . A A . 18 LYS HA 1 1 20 13489 1 1 18 LYS HB2 H 3.353 6.234 2.639 1.00 . A A . 18 LYS HB2 1 1 20 13490 1 1 18 LYS HB3 H 1.824 5.522 2.874 1.00 . A A . 18 LYS HB3 1 1 20 13491 1 1 18 LYS HD2 H -0.208 7.726 0.853 1.00 . A A . 18 LYS HD2 1 1 20 13492 1 1 18 LYS HD3 H -0.242 6.385 1.969 1.00 . A A . 18 LYS HD3 1 1 20 13493 1 1 18 LYS HE2 H -1.694 8.096 2.860 1.00 . A A . 18 LYS HE2 1 1 20 13494 1 1 18 LYS HE3 H -0.297 8.056 3.925 1.00 . A A . 18 LYS HE3 1 1 20 13495 1 1 18 LYS HG2 H 2.064 8.459 1.978 1.00 . A A . 18 LYS HG2 1 1 20 13496 1 1 18 LYS HG3 H 2.013 7.081 0.911 1.00 . A A . 18 LYS HG3 1 1 20 13497 1 1 18 LYS HZ1 H -0.727 9.996 1.711 1.00 . A A . 18 LYS HZ1 1 1 20 13498 1 1 18 LYS HZ2 H 0.592 9.975 2.676 1.00 . A A . 18 LYS HZ2 1 1 20 13499 1 1 18 LYS N N 2.714 8.318 4.697 1.00 . A A . 18 LYS N 1 1 20 13500 1 1 18 LYS NZ N -0.409 9.750 2.655 1.00 . A A . 18 LYS NZ 1 1 20 13501 1 1 18 LYS O O 4.464 6.519 5.765 1.00 . A A . 18 LYS O 1 1 20 13502 1 1 19 CYS C C 5.412 3.564 5.374 1.00 . A A . 19 CYS C 1 1 20 13503 1 1 19 CYS CA C 4.017 3.812 6.043 1.00 . A A . 19 CYS CA 1 1 20 13504 1 1 19 CYS CB C 3.197 2.535 6.250 1.00 . A A . 19 CYS CB 1 1 20 13505 1 1 19 CYS H H 2.452 4.521 4.543 1.00 . A A . 19 CYS H 1 1 20 13506 1 1 19 CYS HA H 4.114 4.328 7.033 1.00 . A A . 19 CYS HA 1 1 20 13507 1 1 19 CYS HB2 H 2.800 2.168 5.311 1.00 . A A . 19 CYS HB2 1 1 20 13508 1 1 19 CYS HB3 H 3.812 1.755 6.749 1.00 . A A . 19 CYS HB3 1 1 20 13509 1 1 19 CYS N N 3.225 4.738 5.194 1.00 . A A . 19 CYS N 1 1 20 13510 1 1 19 CYS O O 5.595 3.477 4.154 1.00 . A A . 19 CYS O 1 1 20 13511 1 1 19 CYS SG S 1.772 2.931 7.239 1.00 . A A . 19 CYS SG 1 1 20 13512 1 1 20 CYS C C 8.468 2.750 5.001 1.00 . A A . 20 CYS C 1 1 20 13513 1 1 20 CYS CA C 7.837 3.681 6.077 1.00 . A A . 20 CYS CA 1 1 20 13514 1 1 20 CYS CB C 8.543 3.383 7.419 1.00 . A A . 20 CYS CB 1 1 20 13515 1 1 20 CYS H H 6.009 3.634 7.257 1.00 . A A . 20 CYS H 1 1 20 13516 1 1 20 CYS HA H 7.920 4.741 5.869 1.00 . A A . 20 CYS HA 1 1 20 13517 1 1 20 CYS HB2 H 7.976 3.824 8.240 1.00 . A A . 20 CYS HB2 1 1 20 13518 1 1 20 CYS HB3 H 8.647 2.304 7.642 1.00 . A A . 20 CYS HB3 1 1 20 13519 1 1 20 CYS N N 6.378 3.563 6.303 1.00 . A A . 20 CYS N 1 1 20 13520 1 1 20 CYS O O 9.170 3.261 4.124 1.00 . A A . 20 CYS O 1 1 20 13521 1 1 20 CYS SG S 10.153 4.191 7.462 1.00 . A A . 20 CYS SG 1 1 20 13522 1 1 21 ARG C C 8.263 0.033 2.917 1.00 . A A . 21 ARG C 1 1 20 13523 1 1 21 ARG CA C 8.995 0.418 4.245 1.00 . A A . 21 ARG CA 1 1 20 13524 1 1 21 ARG CB C 9.238 -0.816 5.173 1.00 . A A . 21 ARG CB 1 1 20 13525 1 1 21 ARG CD C 8.300 -2.786 6.629 1.00 . A A . 21 ARG CD 1 1 20 13526 1 1 21 ARG CG C 8.003 -1.623 5.661 1.00 . A A . 21 ARG CG 1 1 20 13527 1 1 21 ARG CZ C 8.177 -1.920 9.009 1.00 . A A . 21 ARG CZ 1 1 20 13528 1 1 21 ARG H H 7.563 1.205 5.788 1.00 . A A . 21 ARG H 1 1 20 13529 1 1 21 ARG HA H 9.945 0.855 3.907 1.00 . A A . 21 ARG HA 1 1 20 13530 1 1 21 ARG HB2 H 9.918 -1.513 4.648 1.00 . A A . 21 ARG HB2 1 1 20 13531 1 1 21 ARG HB3 H 9.827 -0.488 6.051 1.00 . A A . 21 ARG HB3 1 1 20 13532 1 1 21 ARG HD2 H 7.389 -3.400 6.760 1.00 . A A . 21 ARG HD2 1 1 20 13533 1 1 21 ARG HD3 H 9.047 -3.468 6.183 1.00 . A A . 21 ARG HD3 1 1 20 13534 1 1 21 ARG HG2 H 7.260 -0.946 6.121 1.00 . A A . 21 ARG HG2 1 1 20 13535 1 1 21 ARG HG3 H 7.496 -2.052 4.779 1.00 . A A . 21 ARG HG3 1 1 20 13536 1 1 21 ARG HH11 H 6.327 -2.093 8.239 1.00 . A A . 21 ARG HH11 1 1 20 13537 1 1 21 ARG HH12 H 6.461 -1.486 9.965 1.00 . A A . 21 ARG HH12 1 1 20 13538 1 1 21 ARG HH21 H 9.909 -1.669 9.981 1.00 . A A . 21 ARG HH21 1 1 20 13539 1 1 21 ARG HH22 H 8.368 -1.262 10.890 1.00 . A A . 21 ARG HH22 1 1 20 13540 1 1 21 ARG N N 8.271 1.424 5.094 1.00 . A A . 21 ARG N 1 1 20 13541 1 1 21 ARG NE N 8.794 -2.323 7.969 1.00 . A A . 21 ARG NE 1 1 20 13542 1 1 21 ARG NH1 N 6.851 -1.824 9.078 1.00 . A A . 21 ARG NH1 1 1 20 13543 1 1 21 ARG NH2 N 8.890 -1.582 10.067 1.00 . A A . 21 ARG NH2 1 1 20 13544 1 1 21 ARG O O 8.354 -1.089 2.409 1.00 . A A . 21 ARG O 1 1 20 13545 1 1 22 GLY C C 5.375 0.165 1.486 1.00 . A A . 22 GLY C 1 1 20 13546 1 1 22 GLY CA C 6.694 0.886 1.184 1.00 . A A . 22 GLY CA 1 1 20 13547 1 1 22 GLY H H 7.559 1.774 3.084 1.00 . A A . 22 GLY H 1 1 20 13548 1 1 22 GLY HA2 H 6.493 1.891 0.765 1.00 . A A . 22 GLY HA2 1 1 20 13549 1 1 22 GLY HA3 H 7.216 0.352 0.386 1.00 . A A . 22 GLY HA3 1 1 20 13550 1 1 22 GLY N N 7.573 1.029 2.368 1.00 . A A . 22 GLY N 1 1 20 13551 1 1 22 GLY O O 5.140 -0.961 1.040 1.00 . A A . 22 GLY O 1 1 20 13552 1 1 23 ARG C C 2.163 1.322 2.829 1.00 . A A . 23 ARG C 1 1 20 13553 1 1 23 ARG CA C 3.339 0.278 2.892 1.00 . A A . 23 ARG CA 1 1 20 13554 1 1 23 ARG CB C 3.632 -0.097 4.372 1.00 . A A . 23 ARG CB 1 1 20 13555 1 1 23 ARG CD C 3.826 -2.679 4.338 1.00 . A A . 23 ARG CD 1 1 20 13556 1 1 23 ARG CG C 4.464 -1.334 4.717 1.00 . A A . 23 ARG CG 1 1 20 13557 1 1 23 ARG CZ C 4.377 -5.041 5.045 1.00 . A A . 23 ARG CZ 1 1 20 13558 1 1 23 ARG H H 5.048 1.688 2.645 1.00 . A A . 23 ARG H 1 1 20 13559 1 1 23 ARG HA H 3.043 -0.639 2.359 1.00 . A A . 23 ARG HA 1 1 20 13560 1 1 23 ARG HB2 H 4.215 0.722 4.817 1.00 . A A . 23 ARG HB2 1 1 20 13561 1 1 23 ARG HB3 H 2.688 -0.160 4.948 1.00 . A A . 23 ARG HB3 1 1 20 13562 1 1 23 ARG HD2 H 2.796 -2.741 4.739 1.00 . A A . 23 ARG HD2 1 1 20 13563 1 1 23 ARG HD3 H 3.747 -2.767 3.239 1.00 . A A . 23 ARG HD3 1 1 20 13564 1 1 23 ARG HG2 H 5.459 -1.214 4.259 1.00 . A A . 23 ARG HG2 1 1 20 13565 1 1 23 ARG HG3 H 4.634 -1.292 5.814 1.00 . A A . 23 ARG HG3 1 1 20 13566 1 1 23 ARG HH11 H 2.490 -4.936 4.363 1.00 . A A . 23 ARG HH11 1 1 20 13567 1 1 23 ARG HH12 H 3.084 -6.576 4.935 1.00 . A A . 23 ARG HH12 1 1 20 13568 1 1 23 ARG HH21 H 6.214 -5.387 5.763 1.00 . A A . 23 ARG HH21 1 1 20 13569 1 1 23 ARG HH22 H 5.062 -6.813 5.677 1.00 . A A . 23 ARG HH22 1 1 20 13570 1 1 23 ARG N N 4.562 0.856 2.284 1.00 . A A . 23 ARG N 1 1 20 13571 1 1 23 ARG NE N 4.651 -3.809 4.869 1.00 . A A . 23 ARG NE 1 1 20 13572 1 1 23 ARG NH1 N 3.195 -5.572 4.751 1.00 . A A . 23 ARG NH1 1 1 20 13573 1 1 23 ARG NH2 N 5.312 -5.827 5.546 1.00 . A A . 23 ARG NH2 1 1 20 13574 1 1 23 ARG O O 2.399 2.529 3.020 1.00 . A A . 23 ARG O 1 1 20 13575 1 1 24 PRO C C -0.716 2.206 4.153 1.00 . A A . 24 PRO C 1 1 20 13576 1 1 24 PRO CA C -0.292 1.827 2.696 1.00 . A A . 24 PRO CA 1 1 20 13577 1 1 24 PRO CB C -1.383 1.042 1.942 1.00 . A A . 24 PRO CB 1 1 20 13578 1 1 24 PRO CD C 0.492 -0.468 2.248 1.00 . A A . 24 PRO CD 1 1 20 13579 1 1 24 PRO CG C -1.031 -0.435 2.122 1.00 . A A . 24 PRO CG 1 1 20 13580 1 1 24 PRO HA H -0.070 2.771 2.156 1.00 . A A . 24 PRO HA 1 1 20 13581 1 1 24 PRO HB2 H -2.412 1.270 2.279 1.00 . A A . 24 PRO HB2 1 1 20 13582 1 1 24 PRO HB3 H -1.349 1.306 0.868 1.00 . A A . 24 PRO HB3 1 1 20 13583 1 1 24 PRO HD2 H 0.815 -1.213 3.000 1.00 . A A . 24 PRO HD2 1 1 20 13584 1 1 24 PRO HD3 H 0.954 -0.742 1.279 1.00 . A A . 24 PRO HD3 1 1 20 13585 1 1 24 PRO HG2 H -1.488 -0.827 3.047 1.00 . A A . 24 PRO HG2 1 1 20 13586 1 1 24 PRO HG3 H -1.401 -1.062 1.291 1.00 . A A . 24 PRO HG3 1 1 20 13587 1 1 24 PRO N N 0.873 0.909 2.630 1.00 . A A . 24 PRO N 1 1 20 13588 1 1 24 PRO O O -0.437 1.498 5.127 1.00 . A A . 24 PRO O 1 1 20 13589 1 1 25 CYS C C -3.612 3.846 5.194 1.00 . A A . 25 CYS C 1 1 20 13590 1 1 25 CYS CA C -2.082 3.825 5.493 1.00 . A A . 25 CYS CA 1 1 20 13591 1 1 25 CYS CB C -1.431 5.191 5.894 1.00 . A A . 25 CYS CB 1 1 20 13592 1 1 25 CYS H H -1.597 3.794 3.340 1.00 . A A . 25 CYS H 1 1 20 13593 1 1 25 CYS HA H -1.880 3.129 6.330 1.00 . A A . 25 CYS HA 1 1 20 13594 1 1 25 CYS HB2 H -0.695 4.996 6.671 1.00 . A A . 25 CYS HB2 1 1 20 13595 1 1 25 CYS HB3 H -0.934 5.636 5.027 1.00 . A A . 25 CYS HB3 1 1 20 13596 1 1 25 CYS N N -1.427 3.340 4.244 1.00 . A A . 25 CYS N 1 1 20 13597 1 1 25 CYS O O -4.071 4.217 4.107 1.00 . A A . 25 CYS O 1 1 20 13598 1 1 25 CYS SG S -2.545 6.477 6.486 1.00 . A A . 25 CYS SG 1 1 20 13599 1 1 26 ARG C C -6.350 3.823 7.508 1.00 . A A . 26 ARG C 1 1 20 13600 1 1 26 ARG CA C -5.871 3.283 6.144 1.00 . A A . 26 ARG CA 1 1 20 13601 1 1 26 ARG CB C -6.355 1.822 5.924 1.00 . A A . 26 ARG CB 1 1 20 13602 1 1 26 ARG CD C -7.578 2.012 3.649 1.00 . A A . 26 ARG CD 1 1 20 13603 1 1 26 ARG CG C -6.440 1.349 4.451 1.00 . A A . 26 ARG CG 1 1 20 13604 1 1 26 ARG CZ C -8.674 1.830 1.409 1.00 . A A . 26 ARG CZ 1 1 20 13605 1 1 26 ARG H H -3.909 3.252 7.095 1.00 . A A . 26 ARG H 1 1 20 13606 1 1 26 ARG HA H -6.268 3.902 5.322 1.00 . A A . 26 ARG HA 1 1 20 13607 1 1 26 ARG HB2 H -5.725 1.120 6.501 1.00 . A A . 26 ARG HB2 1 1 20 13608 1 1 26 ARG HB3 H -7.361 1.698 6.367 1.00 . A A . 26 ARG HB3 1 1 20 13609 1 1 26 ARG HD2 H -8.536 1.895 4.190 1.00 . A A . 26 ARG HD2 1 1 20 13610 1 1 26 ARG HD3 H -7.392 3.097 3.572 1.00 . A A . 26 ARG HD3 1 1 20 13611 1 1 26 ARG HG2 H -5.469 1.511 3.946 1.00 . A A . 26 ARG HG2 1 1 20 13612 1 1 26 ARG HG3 H -6.595 0.254 4.451 1.00 . A A . 26 ARG HG3 1 1 20 13613 1 1 26 ARG HH11 H -9.637 3.105 2.635 1.00 . A A . 26 ARG HH11 1 1 20 13614 1 1 26 ARG HH12 H -10.319 2.894 0.945 1.00 . A A . 26 ARG HH12 1 1 20 13615 1 1 26 ARG HH21 H -7.906 0.628 0.005 1.00 . A A . 26 ARG HH21 1 1 20 13616 1 1 26 ARG HH22 H -9.405 1.589 -0.438 1.00 . A A . 26 ARG HH22 1 1 20 13617 1 1 26 ARG N N -4.389 3.393 6.195 1.00 . A A . 26 ARG N 1 1 20 13618 1 1 26 ARG NE N -7.709 1.468 2.278 1.00 . A A . 26 ARG NE 1 1 20 13619 1 1 26 ARG NH1 N -9.643 2.701 1.692 1.00 . A A . 26 ARG NH1 1 1 20 13620 1 1 26 ARG NH2 N -8.660 1.295 0.203 1.00 . A A . 26 ARG NH2 1 1 20 13621 1 1 26 ARG O O -5.817 3.463 8.569 1.00 . A A . 26 ARG O 1 1 20 13622 1 1 27 CYS C C -8.471 4.633 9.762 1.00 . A A . 27 CYS C 1 1 20 13623 1 1 27 CYS CA C -7.704 5.483 8.699 1.00 . A A . 27 CYS CA 1 1 20 13624 1 1 27 CYS CB C -8.597 6.686 8.314 1.00 . A A . 27 CYS CB 1 1 20 13625 1 1 27 CYS H H -7.709 4.965 6.552 1.00 . A A . 27 CYS H 1 1 20 13626 1 1 27 CYS HA H -6.735 5.850 9.062 1.00 . A A . 27 CYS HA 1 1 20 13627 1 1 27 CYS HB2 H -9.575 6.366 7.966 1.00 . A A . 27 CYS HB2 1 1 20 13628 1 1 27 CYS HB3 H -8.803 7.305 9.207 1.00 . A A . 27 CYS HB3 1 1 20 13629 1 1 27 CYS N N -7.353 4.721 7.483 1.00 . A A . 27 CYS N 1 1 20 13630 1 1 27 CYS O O -9.016 3.554 9.501 1.00 . A A . 27 CYS O 1 1 20 13631 1 1 27 CYS SG S -7.820 7.771 7.119 1.00 . A A . 27 CYS SG 1 1 20 13632 1 1 28 SER C C -10.900 4.858 11.812 1.00 . A A . 28 SER C 1 1 20 13633 1 1 28 SER CA C -9.363 4.729 12.104 1.00 . A A . 28 SER CA 1 1 20 13634 1 1 28 SER CB C -8.882 5.571 13.329 1.00 . A A . 28 SER CB 1 1 20 13635 1 1 28 SER H H -8.027 6.106 11.036 1.00 . A A . 28 SER H 1 1 20 13636 1 1 28 SER HA H -9.187 3.663 12.323 1.00 . A A . 28 SER HA 1 1 20 13637 1 1 28 SER HB2 H -7.793 5.771 13.321 1.00 . A A . 28 SER HB2 1 1 20 13638 1 1 28 SER HB3 H -9.377 6.560 13.346 1.00 . A A . 28 SER HB3 1 1 20 13639 1 1 28 SER HG H -8.690 4.068 14.514 1.00 . A A . 28 SER HG 1 1 20 13640 1 1 28 SER N N -8.524 5.211 10.978 1.00 . A A . 28 SER N 1 1 20 13641 1 1 28 SER O O -11.364 5.084 10.688 1.00 . A A . 28 SER O 1 1 20 13642 1 1 28 SER OG O -9.175 4.896 14.547 1.00 . A A . 28 SER OG 1 1 20 13643 1 1 29 MET C C -13.671 6.272 12.542 1.00 . A A . 29 MET C 1 1 20 13644 1 1 29 MET CA C -13.161 4.832 12.898 1.00 . A A . 29 MET CA 1 1 20 13645 1 1 29 MET CB C -13.650 4.465 14.329 1.00 . A A . 29 MET CB 1 1 20 13646 1 1 29 MET CE C -12.447 0.524 15.108 1.00 . A A . 29 MET CE 1 1 20 13647 1 1 29 MET CG C -13.714 2.960 14.650 1.00 . A A . 29 MET CG 1 1 20 13648 1 1 29 MET H H -11.083 4.669 13.723 1.00 . A A . 29 MET H 1 1 20 13649 1 1 29 MET HA H -13.606 4.139 12.158 1.00 . A A . 29 MET HA 1 1 20 13650 1 1 29 MET HB2 H -13.051 4.984 15.103 1.00 . A A . 29 MET HB2 1 1 20 13651 1 1 29 MET HB3 H -14.667 4.871 14.470 1.00 . A A . 29 MET HB3 1 1 20 13652 1 1 29 MET HE1 H -13.031 0.095 14.273 1.00 . A A . 29 MET HE1 1 1 20 13653 1 1 29 MET HE2 H -11.521 -0.068 15.217 1.00 . A A . 29 MET HE2 1 1 20 13654 1 1 29 MET HE3 H -13.036 0.415 16.037 1.00 . A A . 29 MET HE3 1 1 20 13655 1 1 29 MET HG2 H -14.249 2.802 15.605 1.00 . A A . 29 MET HG2 1 1 20 13656 1 1 29 MET HG3 H -14.289 2.417 13.877 1.00 . A A . 29 MET HG3 1 1 20 13657 1 1 29 MET N N -11.673 4.684 12.885 1.00 . A A . 29 MET N 1 1 20 13658 1 1 29 MET O O -14.729 6.398 11.919 1.00 . A A . 29 MET O 1 1 20 13659 1 1 29 MET SD S -12.055 2.257 14.795 1.00 . A A . 29 MET SD 1 1 20 13660 1 1 30 ILE C C -13.029 9.103 11.155 1.00 . A A . 30 ILE C 1 1 20 13661 1 1 30 ILE CA C -13.301 8.754 12.666 1.00 . A A . 30 ILE CA 1 1 20 13662 1 1 30 ILE CB C -12.475 9.692 13.641 1.00 . A A . 30 ILE CB 1 1 20 13663 1 1 30 ILE CD1 C -11.780 10.015 16.149 1.00 . A A . 30 ILE CD1 1 1 20 13664 1 1 30 ILE CG1 C -12.765 9.384 15.150 1.00 . A A . 30 ILE CG1 1 1 20 13665 1 1 30 ILE CG2 C -12.840 11.183 13.389 1.00 . A A . 30 ILE CG2 1 1 20 13666 1 1 30 ILE H H -12.051 7.040 13.372 1.00 . A A . 30 ILE H 1 1 20 13667 1 1 30 ILE HA H -14.380 8.894 12.851 1.00 . A A . 30 ILE HA 1 1 20 13668 1 1 30 ILE HB H -11.391 9.552 13.455 1.00 . A A . 30 ILE HB 1 1 20 13669 1 1 30 ILE HD11 H -10.736 9.724 15.931 1.00 . A A . 30 ILE HD11 1 1 20 13670 1 1 30 ILE HD12 H -11.827 11.119 16.145 1.00 . A A . 30 ILE HD12 1 1 20 13671 1 1 30 ILE HD13 H -12.001 9.689 17.182 1.00 . A A . 30 ILE HD13 1 1 20 13672 1 1 30 ILE HG12 H -13.800 9.673 15.415 1.00 . A A . 30 ILE HG12 1 1 20 13673 1 1 30 ILE HG13 H -12.726 8.295 15.335 1.00 . A A . 30 ILE HG13 1 1 20 13674 1 1 30 ILE HG21 H -12.620 11.496 12.353 1.00 . A A . 30 ILE HG21 1 1 20 13675 1 1 30 ILE HG22 H -13.913 11.388 13.567 1.00 . A A . 30 ILE HG22 1 1 20 13676 1 1 30 ILE HG23 H -12.262 11.871 14.032 1.00 . A A . 30 ILE HG23 1 1 20 13677 1 1 30 ILE N N -12.935 7.328 12.937 1.00 . A A . 30 ILE N 1 1 20 13678 1 1 30 ILE O O -13.914 9.662 10.501 1.00 . A A . 30 ILE O 1 1 20 13679 1 1 31 GLY C C -10.682 10.685 9.280 1.00 . A A . 31 GLY C 1 1 20 13680 1 1 31 GLY CA C -11.366 9.294 9.304 1.00 . A A . 31 GLY CA 1 1 20 13681 1 1 31 GLY H H -11.225 8.311 11.305 1.00 . A A . 31 GLY H 1 1 20 13682 1 1 31 GLY HA2 H -10.665 8.552 8.890 1.00 . A A . 31 GLY HA2 1 1 20 13683 1 1 31 GLY HA3 H -12.210 9.293 8.592 1.00 . A A . 31 GLY HA3 1 1 20 13684 1 1 31 GLY N N -11.819 8.820 10.640 1.00 . A A . 31 GLY N 1 1 20 13685 1 1 31 GLY O O -10.994 11.515 8.422 1.00 . A A . 31 GLY O 1 1 20 13686 1 1 32 THR C C -7.758 12.146 11.291 1.00 . A A . 32 THR C 1 1 20 13687 1 1 32 THR CA C -9.117 12.256 10.509 1.00 . A A . 32 THR CA 1 1 20 13688 1 1 32 THR CB C -10.116 13.140 11.341 1.00 . A A . 32 THR CB 1 1 20 13689 1 1 32 THR CG2 C -9.635 14.591 11.555 1.00 . A A . 32 THR CG2 1 1 20 13690 1 1 32 THR H H -9.633 10.123 10.863 1.00 . A A . 32 THR H 1 1 20 13691 1 1 32 THR HA H -8.867 12.680 9.558 1.00 . A A . 32 THR HA 1 1 20 13692 1 1 32 THR HB H -10.254 12.630 12.315 1.00 . A A . 32 THR HB 1 1 20 13693 1 1 32 THR HG1 H -11.923 13.800 11.265 1.00 . A A . 32 THR HG1 1 1 20 13694 1 1 32 THR HG21 H -9.445 15.107 10.596 1.00 . A A . 32 THR HG21 1 1 20 13695 1 1 32 THR HG22 H -10.387 15.185 12.105 1.00 . A A . 32 THR HG22 1 1 20 13696 1 1 32 THR HG23 H -8.703 14.638 12.148 1.00 . A A . 32 THR HG23 1 1 20 13697 1 1 32 THR N N -9.767 10.921 10.233 1.00 . A A . 32 THR N 1 1 20 13698 1 1 32 THR O O -6.815 12.919 11.101 1.00 . A A . 32 THR O 1 1 20 13699 1 1 32 THR OG1 O -11.375 13.266 10.685 1.00 . A A . 32 THR OG1 1 1 20 13700 1 1 33 ASN C C -6.270 9.195 12.389 1.00 . A A . 33 ASN C 1 1 20 13701 1 1 33 ASN CA C -6.585 10.634 12.907 1.00 . A A . 33 ASN CA 1 1 20 13702 1 1 33 ASN CB C -6.919 10.653 14.430 1.00 . A A . 33 ASN CB 1 1 20 13703 1 1 33 ASN CG C -7.022 12.054 15.071 1.00 . A A . 33 ASN CG 1 1 20 13704 1 1 33 ASN H H -8.605 10.689 11.854 1.00 . A A . 33 ASN H 1 1 20 13705 1 1 33 ASN HA H -5.689 11.264 12.738 1.00 . A A . 33 ASN HA 1 1 20 13706 1 1 33 ASN HB2 H -7.865 10.110 14.620 1.00 . A A . 33 ASN HB2 1 1 20 13707 1 1 33 ASN HB3 H -6.164 10.059 14.981 1.00 . A A . 33 ASN HB3 1 1 20 13708 1 1 33 ASN HD21 H -5.060 12.047 15.486 1.00 . A A . 33 ASN HD21 1 1 20 13709 1 1 33 ASN HD22 H -6.017 13.533 15.981 1.00 . A A . 33 ASN HD22 1 1 20 13710 1 1 33 ASN N N -7.752 11.156 12.158 1.00 . A A . 33 ASN N 1 1 20 13711 1 1 33 ASN ND2 N -5.920 12.601 15.563 1.00 . A A . 33 ASN ND2 1 1 20 13712 1 1 33 ASN O O -6.275 8.208 13.133 1.00 . A A . 33 ASN O 1 1 20 13713 1 1 33 ASN OD1 O -8.097 12.653 15.122 1.00 . A A . 33 ASN OD1 1 1 20 13714 1 1 34 CYS C C -4.588 6.982 10.915 1.00 . A A . 34 CYS C 1 1 20 13715 1 1 34 CYS CA C -5.746 7.853 10.321 1.00 . A A . 34 CYS CA 1 1 20 13716 1 1 34 CYS CB C -5.402 8.230 8.863 1.00 . A A . 34 CYS CB 1 1 20 13717 1 1 34 CYS H H -6.213 10.025 10.639 1.00 . A A . 34 CYS H 1 1 20 13718 1 1 34 CYS HA H -6.682 7.290 10.323 1.00 . A A . 34 CYS HA 1 1 20 13719 1 1 34 CYS HB2 H -4.474 8.790 8.827 1.00 . A A . 34 CYS HB2 1 1 20 13720 1 1 34 CYS HB3 H -5.221 7.321 8.259 1.00 . A A . 34 CYS HB3 1 1 20 13721 1 1 34 CYS N N -5.982 9.120 11.073 1.00 . A A . 34 CYS N 1 1 20 13722 1 1 34 CYS O O -3.838 7.438 11.783 1.00 . A A . 34 CYS O 1 1 20 13723 1 1 34 CYS SG S -6.773 9.125 8.127 1.00 . A A . 34 CYS SG 1 1 20 13724 1 1 35 GLU C C -2.666 4.039 9.838 1.00 . A A . 35 GLU C 1 1 20 13725 1 1 35 GLU CA C -3.424 4.775 10.993 1.00 . A A . 35 GLU CA 1 1 20 13726 1 1 35 GLU CB C -4.062 3.684 11.913 1.00 . A A . 35 GLU CB 1 1 20 13727 1 1 35 GLU CD C -5.602 2.960 13.820 1.00 . A A . 35 GLU CD 1 1 20 13728 1 1 35 GLU CG C -5.007 4.137 13.046 1.00 . A A . 35 GLU CG 1 1 20 13729 1 1 35 GLU H H -5.165 5.458 9.740 1.00 . A A . 35 GLU H 1 1 20 13730 1 1 35 GLU HA H -2.680 5.375 11.559 1.00 . A A . 35 GLU HA 1 1 20 13731 1 1 35 GLU HB2 H -4.480 2.893 11.277 1.00 . A A . 35 GLU HB2 1 1 20 13732 1 1 35 GLU HB3 H -3.249 3.120 12.404 1.00 . A A . 35 GLU HB3 1 1 20 13733 1 1 35 GLU HE2 H -5.085 1.675 15.189 1.00 . A A . 35 GLU HE2 1 1 20 13734 1 1 35 GLU HG2 H -4.462 4.807 13.739 1.00 . A A . 35 GLU HG2 1 1 20 13735 1 1 35 GLU HG3 H -5.830 4.746 12.634 1.00 . A A . 35 GLU HG3 1 1 20 13736 1 1 35 GLU N N -4.479 5.706 10.472 1.00 . A A . 35 GLU N 1 1 20 13737 1 1 35 GLU O O -2.974 4.183 8.654 1.00 . A A . 35 GLU O 1 1 20 13738 1 1 35 GLU OE1 O -6.753 2.555 13.656 1.00 . A A . 35 GLU OE1 1 1 20 13739 1 1 35 GLU OE2 O -4.707 2.414 14.706 1.00 . A A . 35 GLU OE2 1 1 20 13740 1 1 36 CYS C C -1.815 1.032 9.035 1.00 . A A . 36 CYS C 1 1 20 13741 1 1 36 CYS CA C -0.955 2.329 9.238 1.00 . A A . 36 CYS CA 1 1 20 13742 1 1 36 CYS CB C 0.479 1.894 9.713 1.00 . A A . 36 CYS CB 1 1 20 13743 1 1 36 CYS H H -1.697 3.109 11.230 1.00 . A A . 36 CYS H 1 1 20 13744 1 1 36 CYS HA H -0.838 2.876 8.267 1.00 . A A . 36 CYS HA 1 1 20 13745 1 1 36 CYS HB2 H 1.121 2.694 10.132 1.00 . A A . 36 CYS HB2 1 1 20 13746 1 1 36 CYS HB3 H 0.419 1.108 10.483 1.00 . A A . 36 CYS HB3 1 1 20 13747 1 1 36 CYS N N -1.659 3.224 10.209 1.00 . A A . 36 CYS N 1 1 20 13748 1 1 36 CYS O O -2.683 0.676 9.842 1.00 . A A . 36 CYS O 1 1 20 13749 1 1 36 CYS SG S 1.255 1.299 8.220 1.00 . A A . 36 CYS SG 1 1 20 13750 1 1 37 THR C C -1.015 -1.927 6.992 1.00 . A A . 37 THR C 1 1 20 13751 1 1 37 THR CA C -2.103 -1.061 7.733 1.00 . A A . 37 THR CA 1 1 20 13752 1 1 37 THR CB C -3.444 -0.998 6.942 1.00 . A A . 37 THR CB 1 1 20 13753 1 1 37 THR CG2 C -3.362 -0.399 5.523 1.00 . A A . 37 THR CG2 1 1 20 13754 1 1 37 THR H H -0.841 0.716 7.317 1.00 . A A . 37 THR H 1 1 20 13755 1 1 37 THR HA H -2.317 -1.517 8.716 1.00 . A A . 37 THR HA 1 1 20 13756 1 1 37 THR HB H -4.147 -0.447 7.585 1.00 . A A . 37 THR HB 1 1 20 13757 1 1 37 THR HG1 H -3.307 -2.787 6.254 1.00 . A A . 37 THR HG1 1 1 20 13758 1 1 37 THR HG21 H -2.677 -0.971 4.876 1.00 . A A . 37 THR HG21 1 1 20 13759 1 1 37 THR HG22 H -4.346 -0.414 5.027 1.00 . A A . 37 THR HG22 1 1 20 13760 1 1 37 THR HG23 H -3.021 0.652 5.534 1.00 . A A . 37 THR HG23 1 1 20 13761 1 1 37 THR N N -1.547 0.305 7.938 1.00 . A A . 37 THR N 1 1 20 13762 1 1 37 THR O O -0.353 -1.420 6.076 1.00 . A A . 37 THR O 1 1 20 13763 1 1 37 THR OG1 O -3.953 -2.316 6.785 1.00 . A A . 37 THR OG1 1 1 20 13764 1 1 38 PRO C C -0.274 -4.747 5.347 1.00 . A A . 38 PRO C 1 1 20 13765 1 1 38 PRO CA C 0.200 -4.109 6.694 1.00 . A A . 38 PRO CA 1 1 20 13766 1 1 38 PRO CB C 0.477 -5.130 7.819 1.00 . A A . 38 PRO CB 1 1 20 13767 1 1 38 PRO CD C -1.475 -3.874 8.495 1.00 . A A . 38 PRO CD 1 1 20 13768 1 1 38 PRO CG C -0.836 -5.259 8.596 1.00 . A A . 38 PRO CG 1 1 20 13769 1 1 38 PRO HA H 1.136 -3.557 6.473 1.00 . A A . 38 PRO HA 1 1 20 13770 1 1 38 PRO HB2 H 0.844 -6.107 7.456 1.00 . A A . 38 PRO HB2 1 1 20 13771 1 1 38 PRO HB3 H 1.265 -4.741 8.487 1.00 . A A . 38 PRO HB3 1 1 20 13772 1 1 38 PRO HD2 H -2.569 -3.928 8.365 1.00 . A A . 38 PRO HD2 1 1 20 13773 1 1 38 PRO HD3 H -1.313 -3.268 9.405 1.00 . A A . 38 PRO HD3 1 1 20 13774 1 1 38 PRO HG2 H -1.488 -6.014 8.116 1.00 . A A . 38 PRO HG2 1 1 20 13775 1 1 38 PRO HG3 H -0.682 -5.579 9.642 1.00 . A A . 38 PRO HG3 1 1 20 13776 1 1 38 PRO N N -0.823 -3.238 7.333 1.00 . A A . 38 PRO N 1 1 20 13777 1 1 38 PRO O O -0.572 -5.944 5.278 1.00 . A A . 38 PRO O 1 1 20 13778 1 1 39 ARG C C -2.305 -4.991 3.049 1.00 . A A . 39 ARG C 1 1 20 13779 1 1 39 ARG CA C -0.918 -4.266 2.928 1.00 . A A . 39 ARG CA 1 1 20 13780 1 1 39 ARG CB C 0.128 -5.137 2.161 1.00 . A A . 39 ARG CB 1 1 20 13781 1 1 39 ARG CD C 2.468 -5.194 1.001 1.00 . A A . 39 ARG CD 1 1 20 13782 1 1 39 ARG CG C 1.357 -4.345 1.652 1.00 . A A . 39 ARG CG 1 1 20 13783 1 1 39 ARG CZ C 1.745 -7.045 -0.550 1.00 . A A . 39 ARG CZ 1 1 20 13784 1 1 39 ARG H H -0.063 -2.955 4.487 1.00 . A A . 39 ARG H 1 1 20 13785 1 1 39 ARG HA H -1.098 -3.335 2.358 1.00 . A A . 39 ARG HA 1 1 20 13786 1 1 39 ARG HB2 H 0.456 -5.998 2.776 1.00 . A A . 39 ARG HB2 1 1 20 13787 1 1 39 ARG HB3 H -0.359 -5.592 1.277 1.00 . A A . 39 ARG HB3 1 1 20 13788 1 1 39 ARG HD2 H 3.349 -4.546 0.842 1.00 . A A . 39 ARG HD2 1 1 20 13789 1 1 39 ARG HD3 H 2.823 -5.970 1.706 1.00 . A A . 39 ARG HD3 1 1 20 13790 1 1 39 ARG HG2 H 1.029 -3.553 0.952 1.00 . A A . 39 ARG HG2 1 1 20 13791 1 1 39 ARG HG3 H 1.806 -3.803 2.502 1.00 . A A . 39 ARG HG3 1 1 20 13792 1 1 39 ARG HH11 H 1.938 -7.693 1.345 1.00 . A A . 39 ARG HH11 1 1 20 13793 1 1 39 ARG HH12 H 1.417 -8.925 0.089 1.00 . A A . 39 ARG HH12 1 1 20 13794 1 1 39 ARG HH21 H 1.479 -6.652 -2.495 1.00 . A A . 39 ARG HH21 1 1 20 13795 1 1 39 ARG HH22 H 1.176 -8.373 -1.936 1.00 . A A . 39 ARG HH22 1 1 20 13796 1 1 39 ARG N N -0.351 -3.917 4.278 1.00 . A A . 39 ARG N 1 1 20 13797 1 1 39 ARG NE N 2.089 -5.762 -0.321 1.00 . A A . 39 ARG NE 1 1 20 13798 1 1 39 ARG NH1 N 1.695 -7.985 0.392 1.00 . A A . 39 ARG NH1 1 1 20 13799 1 1 39 ARG NH2 N 1.435 -7.392 -1.786 1.00 . A A . 39 ARG NH2 1 1 20 13800 1 1 39 ARG O O -2.434 -6.200 2.819 1.00 . A A . 39 ARG O 1 1 20 13801 1 1 40 LEU C C -5.664 -3.535 3.583 1.00 . A A . 40 LEU C 1 1 20 13802 1 1 40 LEU CA C -4.696 -4.742 3.714 1.00 . A A . 40 LEU CA 1 1 20 13803 1 1 40 LEU CB C -4.770 -5.395 5.132 1.00 . A A . 40 LEU CB 1 1 20 13804 1 1 40 LEU CD1 C -6.527 -7.241 4.705 1.00 . A A . 40 LEU CD1 1 1 20 13805 1 1 40 LEU CD2 C -6.106 -6.401 7.052 1.00 . A A . 40 LEU CD2 1 1 20 13806 1 1 40 LEU CG C -6.130 -6.019 5.559 1.00 . A A . 40 LEU CG 1 1 20 13807 1 1 40 LEU H H -3.089 -3.236 3.623 1.00 . A A . 40 LEU H 1 1 20 13808 1 1 40 LEU HA H -4.944 -5.510 2.953 1.00 . A A . 40 LEU HA 1 1 20 13809 1 1 40 LEU HB2 H -3.990 -6.177 5.210 1.00 . A A . 40 LEU HB2 1 1 20 13810 1 1 40 LEU HB3 H -4.472 -4.641 5.885 1.00 . A A . 40 LEU HB3 1 1 20 13811 1 1 40 LEU HD11 H -5.774 -8.049 4.759 1.00 . A A . 40 LEU HD11 1 1 20 13812 1 1 40 LEU HD12 H -7.494 -7.669 5.030 1.00 . A A . 40 LEU HD12 1 1 20 13813 1 1 40 LEU HD13 H -6.647 -6.973 3.639 1.00 . A A . 40 LEU HD13 1 1 20 13814 1 1 40 LEU HD21 H -5.887 -5.525 7.692 1.00 . A A . 40 LEU HD21 1 1 20 13815 1 1 40 LEU HD22 H -7.081 -6.800 7.388 1.00 . A A . 40 LEU HD22 1 1 20 13816 1 1 40 LEU HD23 H -5.341 -7.168 7.275 1.00 . A A . 40 LEU HD23 1 1 20 13817 1 1 40 LEU HG H -6.919 -5.254 5.439 1.00 . A A . 40 LEU HG 1 1 20 13818 1 1 40 LEU N N -3.331 -4.218 3.455 1.00 . A A . 40 LEU N 1 1 20 13819 1 1 40 LEU O O -5.692 -2.645 4.441 1.00 . A A . 40 LEU O 1 1 20 13820 1 1 41 ILE C C -8.754 -2.677 2.907 1.00 . A A . 41 ILE C 1 1 20 13821 1 1 41 ILE CA C -7.391 -2.392 2.197 1.00 . A A . 41 ILE CA 1 1 20 13822 1 1 41 ILE CB C -7.615 -2.205 0.641 1.00 . A A . 41 ILE CB 1 1 20 13823 1 1 41 ILE CD1 C -8.452 -3.330 -1.570 1.00 . A A . 41 ILE CD1 1 1 20 13824 1 1 41 ILE CG1 C -7.910 -3.529 -0.145 1.00 . A A . 41 ILE CG1 1 1 20 13825 1 1 41 ILE CG2 C -6.335 -1.544 0.059 1.00 . A A . 41 ILE CG2 1 1 20 13826 1 1 41 ILE H H -6.345 -4.317 1.864 1.00 . A A . 41 ILE H 1 1 20 13827 1 1 41 ILE HA H -6.967 -1.446 2.595 1.00 . A A . 41 ILE HA 1 1 20 13828 1 1 41 ILE HB H -8.477 -1.532 0.474 1.00 . A A . 41 ILE HB 1 1 20 13829 1 1 41 ILE HD11 H -9.382 -2.731 -1.573 1.00 . A A . 41 ILE HD11 1 1 20 13830 1 1 41 ILE HD12 H -7.724 -2.819 -2.226 1.00 . A A . 41 ILE HD12 1 1 20 13831 1 1 41 ILE HD13 H -8.687 -4.301 -2.043 1.00 . A A . 41 ILE HD13 1 1 20 13832 1 1 41 ILE HG12 H -7.009 -4.171 -0.186 1.00 . A A . 41 ILE HG12 1 1 20 13833 1 1 41 ILE HG13 H -8.659 -4.131 0.395 1.00 . A A . 41 ILE HG13 1 1 20 13834 1 1 41 ILE HG21 H -6.097 -0.593 0.572 1.00 . A A . 41 ILE HG21 1 1 20 13835 1 1 41 ILE HG22 H -5.443 -2.192 0.146 1.00 . A A . 41 ILE HG22 1 1 20 13836 1 1 41 ILE HG23 H -6.451 -1.290 -1.010 1.00 . A A . 41 ILE HG23 1 1 20 13837 1 1 41 ILE N N -6.461 -3.521 2.500 1.00 . A A . 41 ILE N 1 1 20 13838 1 1 41 ILE O O -9.388 -3.719 2.706 1.00 . A A . 41 ILE O 1 1 20 13839 1 1 42 MET C C -11.431 -0.734 3.604 1.00 . A A . 42 MET C 1 1 20 13840 1 1 42 MET CA C -10.531 -1.738 4.383 1.00 . A A . 42 MET CA 1 1 20 13841 1 1 42 MET CB C -10.415 -1.387 5.899 1.00 . A A . 42 MET CB 1 1 20 13842 1 1 42 MET CE C -11.093 0.997 8.457 1.00 . A A . 42 MET CE 1 1 20 13843 1 1 42 MET CG C -9.636 -0.130 6.344 1.00 . A A . 42 MET CG 1 1 20 13844 1 1 42 MET H H -8.571 -0.896 3.811 1.00 . A A . 42 MET H 1 1 20 13845 1 1 42 MET HA H -10.985 -2.749 4.333 1.00 . A A . 42 MET HA 1 1 20 13846 1 1 42 MET HB2 H -11.433 -1.334 6.328 1.00 . A A . 42 MET HB2 1 1 20 13847 1 1 42 MET HB3 H -9.954 -2.252 6.411 1.00 . A A . 42 MET HB3 1 1 20 13848 1 1 42 MET HE1 H -11.999 0.505 8.059 1.00 . A A . 42 MET HE1 1 1 20 13849 1 1 42 MET HE2 H -11.234 1.150 9.542 1.00 . A A . 42 MET HE2 1 1 20 13850 1 1 42 MET HE3 H -11.000 1.991 7.982 1.00 . A A . 42 MET HE3 1 1 20 13851 1 1 42 MET HG2 H -8.590 -0.200 5.999 1.00 . A A . 42 MET HG2 1 1 20 13852 1 1 42 MET HG3 H -10.050 0.795 5.905 1.00 . A A . 42 MET HG3 1 1 20 13853 1 1 42 MET N N -9.189 -1.712 3.739 1.00 . A A . 42 MET N 1 1 20 13854 1 1 42 MET O O -11.344 0.488 3.768 1.00 . A A . 42 MET O 1 1 20 13855 1 1 42 MET SD S -9.623 -0.004 8.147 1.00 . A A . 42 MET SD 1 1 20 13856 1 1 43 GLU C C -14.390 -1.349 1.455 1.00 . A A . 43 GLU C 1 1 20 13857 1 1 43 GLU CA C -13.139 -0.495 1.801 1.00 . A A . 43 GLU CA 1 1 20 13858 1 1 43 GLU CB C -12.353 -0.112 0.518 1.00 . A A . 43 GLU CB 1 1 20 13859 1 1 43 GLU CD C -12.179 1.264 -1.624 1.00 . A A . 43 GLU CD 1 1 20 13860 1 1 43 GLU CG C -13.057 0.882 -0.431 1.00 . A A . 43 GLU CG 1 1 20 13861 1 1 43 GLU H H -12.227 -2.313 2.656 1.00 . A A . 43 GLU H 1 1 20 13862 1 1 43 GLU HA H -13.454 0.435 2.322 1.00 . A A . 43 GLU HA 1 1 20 13863 1 1 43 GLU HB2 H -11.416 0.370 0.842 1.00 . A A . 43 GLU HB2 1 1 20 13864 1 1 43 GLU HB3 H -12.047 -1.020 -0.038 1.00 . A A . 43 GLU HB3 1 1 20 13865 1 1 43 GLU HE2 H -10.892 2.634 -2.134 1.00 . A A . 43 GLU HE2 1 1 20 13866 1 1 43 GLU HG2 H -14.002 0.450 -0.809 1.00 . A A . 43 GLU HG2 1 1 20 13867 1 1 43 GLU HG3 H -13.352 1.792 0.124 1.00 . A A . 43 GLU HG3 1 1 20 13868 1 1 43 GLU N N -12.267 -1.289 2.705 1.00 . A A . 43 GLU N 1 1 20 13869 1 1 43 GLU O O -14.307 -2.545 1.148 1.00 . A A . 43 GLU O 1 1 20 13870 1 1 43 GLU OE1 O -12.139 0.618 -2.671 1.00 . A A . 43 GLU OE1 1 1 20 13871 1 1 43 GLU OE2 O -11.445 2.399 -1.386 1.00 . A A . 43 GLU OE2 1 1 20 13872 1 1 44 GLY C C -17.274 -1.202 -0.259 1.00 . A A . 44 GLY C 1 1 20 13873 1 1 44 GLY CA C -16.857 -1.315 1.218 1.00 . A A . 44 GLY CA 1 1 20 13874 1 1 44 GLY H H -15.423 0.328 1.647 1.00 . A A . 44 GLY H 1 1 20 13875 1 1 44 GLY HA2 H -16.875 -2.365 1.572 1.00 . A A . 44 GLY HA2 1 1 20 13876 1 1 44 GLY HA3 H -17.619 -0.805 1.836 1.00 . A A . 44 GLY HA3 1 1 20 13877 1 1 44 GLY N N -15.549 -0.678 1.488 1.00 . A A . 44 GLY N 1 1 20 13878 1 1 44 GLY O O -17.780 -0.158 -0.679 1.00 . A A . 44 GLY O 1 1 20 13879 1 1 45 LEU C C -17.745 -3.840 -2.811 1.00 . A A . 45 LEU C 1 1 20 13880 1 1 45 LEU CA C -17.452 -2.351 -2.459 1.00 . A A . 45 LEU CA 1 1 20 13881 1 1 45 LEU CB C -16.327 -1.758 -3.373 1.00 . A A . 45 LEU CB 1 1 20 13882 1 1 45 LEU CD1 C -14.152 -1.733 -4.694 1.00 . A A . 45 LEU CD1 1 1 20 13883 1 1 45 LEU CD2 C -14.088 -2.622 -2.340 1.00 . A A . 45 LEU CD2 1 1 20 13884 1 1 45 LEU CG C -14.957 -2.472 -3.605 1.00 . A A . 45 LEU CG 1 1 20 13885 1 1 45 LEU H H -16.636 -3.084 -0.541 1.00 . A A . 45 LEU H 1 1 20 13886 1 1 45 LEU HA H -18.374 -1.753 -2.615 1.00 . A A . 45 LEU HA 1 1 20 13887 1 1 45 LEU HB2 H -16.796 -1.631 -4.367 1.00 . A A . 45 LEU HB2 1 1 20 13888 1 1 45 LEU HB3 H -16.132 -0.717 -3.050 1.00 . A A . 45 LEU HB3 1 1 20 13889 1 1 45 LEU HD11 H -14.707 -1.687 -5.649 1.00 . A A . 45 LEU HD11 1 1 20 13890 1 1 45 LEU HD12 H -13.916 -0.692 -4.403 1.00 . A A . 45 LEU HD12 1 1 20 13891 1 1 45 LEU HD13 H -13.193 -2.238 -4.912 1.00 . A A . 45 LEU HD13 1 1 20 13892 1 1 45 LEU HD21 H -13.891 -1.649 -1.855 1.00 . A A . 45 LEU HD21 1 1 20 13893 1 1 45 LEU HD22 H -14.567 -3.274 -1.588 1.00 . A A . 45 LEU HD22 1 1 20 13894 1 1 45 LEU HD23 H -13.107 -3.081 -2.564 1.00 . A A . 45 LEU HD23 1 1 20 13895 1 1 45 LEU HG H -15.154 -3.487 -3.996 1.00 . A A . 45 LEU HG 1 1 20 13896 1 1 45 LEU N N -17.059 -2.286 -1.026 1.00 . A A . 45 LEU N 1 1 20 13897 1 1 45 LEU O O -16.925 -4.735 -2.573 1.00 . A A . 45 LEU O 1 1 20 13898 1 1 46 SER C C -18.993 -5.588 -5.385 1.00 . A A . 46 SER C 1 1 20 13899 1 1 46 SER CA C -19.342 -5.434 -3.872 1.00 . A A . 46 SER CA 1 1 20 13900 1 1 46 SER CB C -20.854 -5.596 -3.564 1.00 . A A . 46 SER CB 1 1 20 13901 1 1 46 SER H H -19.522 -3.257 -3.539 1.00 . A A . 46 SER H 1 1 20 13902 1 1 46 SER HA H -18.803 -6.230 -3.332 1.00 . A A . 46 SER HA 1 1 20 13903 1 1 46 SER HB2 H -21.048 -5.461 -2.483 1.00 . A A . 46 SER HB2 1 1 20 13904 1 1 46 SER HB3 H -21.465 -4.830 -4.080 1.00 . A A . 46 SER HB3 1 1 20 13905 1 1 46 SER HG H -22.244 -6.916 -3.727 1.00 . A A . 46 SER HG 1 1 20 13906 1 1 46 SER N N -18.932 -4.084 -3.398 1.00 . A A . 46 SER N 1 1 20 13907 1 1 46 SER O O -18.071 -6.343 -5.710 1.00 . A A . 46 SER O 1 1 20 13908 1 1 46 SER OG O -21.309 -6.890 -3.943 1.00 . A A . 46 SER OG 1 1 20 13909 1 1 47 PHE C C -18.497 -3.706 -8.136 1.00 . A A . 47 PHE C 1 1 20 13910 1 1 47 PHE CA C -19.426 -4.899 -7.747 1.00 . A A . 47 PHE CA 1 1 20 13911 1 1 47 PHE CB C -20.810 -4.880 -8.474 1.00 . A A . 47 PHE CB 1 1 20 13912 1 1 47 PHE CD1 C -20.616 -6.287 -10.595 1.00 . A A . 47 PHE CD1 1 1 20 13913 1 1 47 PHE CD2 C -20.800 -3.889 -10.826 1.00 . A A . 47 PHE CD2 1 1 20 13914 1 1 47 PHE CE1 C -20.538 -6.412 -11.981 1.00 . A A . 47 PHE CE1 1 1 20 13915 1 1 47 PHE CE2 C -20.716 -4.017 -12.210 1.00 . A A . 47 PHE CE2 1 1 20 13916 1 1 47 PHE CG C -20.744 -5.024 -10.007 1.00 . A A . 47 PHE CG 1 1 20 13917 1 1 47 PHE CZ C -20.587 -5.278 -12.787 1.00 . A A . 47 PHE CZ 1 1 20 13918 1 1 47 PHE H H -20.428 -4.299 -5.857 1.00 . A A . 47 PHE H 1 1 20 13919 1 1 47 PHE HA H -18.901 -5.826 -8.034 1.00 . A A . 47 PHE HA 1 1 20 13920 1 1 47 PHE HB2 H -21.441 -5.701 -8.080 1.00 . A A . 47 PHE HB2 1 1 20 13921 1 1 47 PHE HB3 H -21.374 -3.964 -8.204 1.00 . A A . 47 PHE HB3 1 1 20 13922 1 1 47 PHE HD1 H -20.570 -7.176 -9.982 1.00 . A A . 47 PHE HD1 1 1 20 13923 1 1 47 PHE HD2 H -20.896 -2.903 -10.394 1.00 . A A . 47 PHE HD2 1 1 20 13924 1 1 47 PHE HE1 H -20.439 -7.390 -12.430 1.00 . A A . 47 PHE HE1 1 1 20 13925 1 1 47 PHE HE2 H -20.751 -3.137 -12.836 1.00 . A A . 47 PHE HE2 1 1 20 13926 1 1 47 PHE HZ H -20.523 -5.375 -13.860 1.00 . A A . 47 PHE HZ 1 1 20 13927 1 1 47 PHE N N -19.696 -4.874 -6.284 1.00 . A A . 47 PHE N 1 1 20 13928 1 1 47 PHE O O -17.363 -3.953 -8.555 1.00 . A A . 47 PHE O 1 1 20 13929 1 1 48 ALA C C -18.049 -1.242 -10.013 1.00 . A A . 48 ALA C 1 1 20 13930 1 1 48 ALA CA C -18.310 -1.189 -8.483 1.00 . A A . 48 ALA CA 1 1 20 13931 1 1 48 ALA CB C -16.985 -0.976 -7.709 1.00 . A A . 48 ALA CB 1 1 20 13932 1 1 48 ALA H H -19.946 -2.438 -7.676 1.00 . A A . 48 ALA H 1 1 20 13933 1 1 48 ALA HXT H -18.914 -0.693 -11.670 1.00 . A A . 48 ALA HXT 1 1 20 13934 1 1 48 ALA HA H -18.982 -0.335 -8.282 1.00 . A A . 48 ALA HA 1 1 20 13935 1 1 48 ALA HB1 H -17.158 -0.929 -6.618 1.00 . A A . 48 ALA HB1 1 1 20 13936 1 1 48 ALA HB2 H -16.237 -1.771 -7.888 1.00 . A A . 48 ALA HB2 1 1 20 13937 1 1 48 ALA HB3 H -16.508 -0.020 -7.991 1.00 . A A . 48 ALA HB3 1 1 20 13938 1 1 48 ALA N N -18.984 -2.444 -8.027 1.00 . A A . 48 ALA N 1 1 20 13939 1 1 48 ALA O O -17.060 -1.758 -10.537 1.00 . A A . 48 ALA O 1 1 20 13940 1 1 48 ALA OXT O -19.068 -0.657 -10.723 1.00 . A A . 48 ALA OXT 1 1 21 13941 1 1 1 GLU C C 7.695 9.238 13.511 1.00 . A A . 1 GLU C 1 1 21 13942 1 1 1 GLU CA C 6.729 8.036 13.263 1.00 . A A . 1 GLU CA 1 1 21 13943 1 1 1 GLU CB C 5.399 8.126 14.076 1.00 . A A . 1 GLU CB 1 1 21 13944 1 1 1 GLU CD C 4.027 8.065 16.241 1.00 . A A . 1 GLU CD 1 1 21 13945 1 1 1 GLU CG C 5.426 8.011 15.624 1.00 . A A . 1 GLU CG 1 1 21 13946 1 1 1 GLU H1 H 8.292 6.657 13.095 1.00 . A A . 1 GLU H1 1 1 21 13947 1 1 1 GLU H2 H 7.679 6.762 14.625 1.00 . A A . 1 GLU H2 1 1 21 13948 1 1 1 GLU HA H 6.472 8.022 12.187 1.00 . A A . 1 GLU HA 1 1 21 13949 1 1 1 GLU HB2 H 4.895 9.073 13.802 1.00 . A A . 1 GLU HB2 1 1 21 13950 1 1 1 GLU HB3 H 4.720 7.343 13.686 1.00 . A A . 1 GLU HB3 1 1 21 13951 1 1 1 GLU HE2 H 2.629 6.853 16.848 1.00 . A A . 1 GLU HE2 1 1 21 13952 1 1 1 GLU HG2 H 5.926 7.074 15.932 1.00 . A A . 1 GLU HG2 1 1 21 13953 1 1 1 GLU HG3 H 6.031 8.823 16.066 1.00 . A A . 1 GLU HG3 1 1 21 13954 1 1 1 GLU N N 7.426 6.778 13.630 1.00 . A A . 1 GLU N 1 1 21 13955 1 1 1 GLU O O 7.629 9.936 14.528 1.00 . A A . 1 GLU O 1 1 21 13956 1 1 1 GLU OE1 O 3.445 9.116 16.508 1.00 . A A . 1 GLU OE1 1 1 21 13957 1 1 1 GLU OE2 O 3.507 6.815 16.460 1.00 . A A . 1 GLU OE2 1 1 21 13958 1 1 2 ASP C C 9.596 11.139 11.067 1.00 . A A . 2 ASP C 1 1 21 13959 1 1 2 ASP CA C 9.533 10.642 12.544 1.00 . A A . 2 ASP CA 1 1 21 13960 1 1 2 ASP CB C 10.916 10.228 13.145 1.00 . A A . 2 ASP CB 1 1 21 13961 1 1 2 ASP CG C 10.934 10.018 14.666 1.00 . A A . 2 ASP CG 1 1 21 13962 1 1 2 ASP H H 8.554 8.830 11.744 1.00 . A A . 2 ASP H 1 1 21 13963 1 1 2 ASP HA H 9.124 11.469 13.153 1.00 . A A . 2 ASP HA 1 1 21 13964 1 1 2 ASP HB2 H 11.314 9.327 12.639 1.00 . A A . 2 ASP HB2 1 1 21 13965 1 1 2 ASP HB3 H 11.656 11.020 12.922 1.00 . A A . 2 ASP HB3 1 1 21 13966 1 1 2 ASP HD2 H 10.708 8.132 14.239 1.00 . A A . 2 ASP HD2 1 1 21 13967 1 1 2 ASP N N 8.601 9.477 12.538 1.00 . A A . 2 ASP N 1 1 21 13968 1 1 2 ASP O O 8.745 11.950 10.690 1.00 . A A . 2 ASP O 1 1 21 13969 1 1 2 ASP OD1 O 11.055 10.937 15.475 1.00 . A A . 2 ASP OD1 1 1 21 13970 1 1 2 ASP OD2 O 10.791 8.698 15.010 1.00 . A A . 2 ASP OD2 1 1 21 13971 1 1 3 ASN C C 9.867 9.770 7.875 1.00 . A A . 3 ASN C 1 1 21 13972 1 1 3 ASN CA C 10.531 10.899 8.745 1.00 . A A . 3 ASN CA 1 1 21 13973 1 1 3 ASN CB C 12.015 11.087 8.319 1.00 . A A . 3 ASN CB 1 1 21 13974 1 1 3 ASN CG C 12.688 12.393 8.795 1.00 . A A . 3 ASN CG 1 1 21 13975 1 1 3 ASN H H 11.186 9.995 10.679 1.00 . A A . 3 ASN H 1 1 21 13976 1 1 3 ASN HA H 9.932 11.788 8.536 1.00 . A A . 3 ASN HA 1 1 21 13977 1 1 3 ASN HB2 H 12.597 10.190 8.615 1.00 . A A . 3 ASN HB2 1 1 21 13978 1 1 3 ASN HB3 H 12.084 11.098 7.214 1.00 . A A . 3 ASN HB3 1 1 21 13979 1 1 3 ASN HD21 H 13.868 11.367 10.051 1.00 . A A . 3 ASN HD21 1 1 21 13980 1 1 3 ASN HD22 H 14.069 13.190 10.011 1.00 . A A . 3 ASN HD22 1 1 21 13981 1 1 3 ASN N N 10.540 10.653 10.232 1.00 . A A . 3 ASN N 1 1 21 13982 1 1 3 ASN ND2 N 13.640 12.307 9.712 1.00 . A A . 3 ASN ND2 1 1 21 13983 1 1 3 ASN O O 9.821 9.864 6.645 1.00 . A A . 3 ASN O 1 1 21 13984 1 1 3 ASN OD1 O 12.355 13.486 8.337 1.00 . A A . 3 ASN OD1 1 1 21 13985 1 1 4 CYS C C 7.654 7.023 9.112 1.00 . A A . 4 CYS C 1 1 21 13986 1 1 4 CYS CA C 8.475 7.692 7.959 1.00 . A A . 4 CYS CA 1 1 21 13987 1 1 4 CYS CB C 9.280 6.636 7.206 1.00 . A A . 4 CYS CB 1 1 21 13988 1 1 4 CYS H H 9.371 9.023 9.524 1.00 . A A . 4 CYS H 1 1 21 13989 1 1 4 CYS HA H 7.772 8.112 7.219 1.00 . A A . 4 CYS HA 1 1 21 13990 1 1 4 CYS HB2 H 8.450 6.009 6.960 1.00 . A A . 4 CYS HB2 1 1 21 13991 1 1 4 CYS HB3 H 9.619 6.915 6.200 1.00 . A A . 4 CYS HB3 1 1 21 13992 1 1 4 CYS N N 9.337 8.747 8.538 1.00 . A A . 4 CYS N 1 1 21 13993 1 1 4 CYS O O 7.960 7.186 10.300 1.00 . A A . 4 CYS O 1 1 21 13994 1 1 4 CYS SG S 10.386 5.533 8.109 1.00 . A A . 4 CYS SG 1 1 21 13995 1 1 5 ILE C C 6.159 4.076 9.688 1.00 . A A . 5 ILE C 1 1 21 13996 1 1 5 ILE CA C 5.748 5.559 9.788 1.00 . A A . 5 ILE CA 1 1 21 13997 1 1 5 ILE CB C 4.191 5.750 9.582 1.00 . A A . 5 ILE CB 1 1 21 13998 1 1 5 ILE CD1 C 2.440 7.575 9.135 1.00 . A A . 5 ILE CD1 1 1 21 13999 1 1 5 ILE CG1 C 3.869 7.246 9.476 1.00 . A A . 5 ILE CG1 1 1 21 14000 1 1 5 ILE CG2 C 3.387 5.097 10.754 1.00 . A A . 5 ILE CG2 1 1 21 14001 1 1 5 ILE H H 6.567 6.061 7.713 1.00 . A A . 5 ILE H 1 1 21 14002 1 1 5 ILE HA H 5.972 5.957 10.791 1.00 . A A . 5 ILE HA 1 1 21 14003 1 1 5 ILE HB H 3.816 5.285 8.677 1.00 . A A . 5 ILE HB 1 1 21 14004 1 1 5 ILE HD11 H 1.750 7.144 9.876 1.00 . A A . 5 ILE HD11 1 1 21 14005 1 1 5 ILE HD12 H 2.270 8.663 9.141 1.00 . A A . 5 ILE HD12 1 1 21 14006 1 1 5 ILE HD13 H 2.182 7.187 8.135 1.00 . A A . 5 ILE HD13 1 1 21 14007 1 1 5 ILE HG12 H 4.133 7.748 10.397 1.00 . A A . 5 ILE HG12 1 1 21 14008 1 1 5 ILE HG13 H 4.485 7.687 8.676 1.00 . A A . 5 ILE HG13 1 1 21 14009 1 1 5 ILE HG21 H 3.574 4.011 10.826 1.00 . A A . 5 ILE HG21 1 1 21 14010 1 1 5 ILE HG22 H 3.585 5.538 11.748 1.00 . A A . 5 ILE HG22 1 1 21 14011 1 1 5 ILE HG23 H 2.290 5.154 10.599 1.00 . A A . 5 ILE HG23 1 1 21 14012 1 1 5 ILE N N 6.601 6.244 8.744 1.00 . A A . 5 ILE N 1 1 21 14013 1 1 5 ILE O O 5.641 3.308 8.884 1.00 . A A . 5 ILE O 1 1 21 14014 1 1 6 ALA C C 6.636 1.149 11.096 1.00 . A A . 6 ALA C 1 1 21 14015 1 1 6 ALA CA C 7.594 2.211 10.412 1.00 . A A . 6 ALA CA 1 1 21 14016 1 1 6 ALA CB C 8.975 2.203 11.091 1.00 . A A . 6 ALA CB 1 1 21 14017 1 1 6 ALA H H 7.342 4.284 11.252 1.00 . A A . 6 ALA H 1 1 21 14018 1 1 6 ALA HA H 7.683 1.963 9.322 1.00 . A A . 6 ALA HA 1 1 21 14019 1 1 6 ALA HB1 H 9.679 2.896 10.596 1.00 . A A . 6 ALA HB1 1 1 21 14020 1 1 6 ALA HB2 H 8.915 2.490 12.159 1.00 . A A . 6 ALA HB2 1 1 21 14021 1 1 6 ALA HB3 H 9.435 1.200 11.054 1.00 . A A . 6 ALA HB3 1 1 21 14022 1 1 6 ALA N N 7.102 3.623 10.514 1.00 . A A . 6 ALA N 1 1 21 14023 1 1 6 ALA O O 7.057 0.045 11.456 1.00 . A A . 6 ALA O 1 1 21 14024 1 1 7 GLU C C 3.183 0.146 11.328 1.00 . A A . 7 GLU C 1 1 21 14025 1 1 7 GLU CA C 4.357 0.795 12.094 1.00 . A A . 7 GLU CA 1 1 21 14026 1 1 7 GLU CB C 3.843 1.859 13.117 1.00 . A A . 7 GLU CB 1 1 21 14027 1 1 7 GLU CD C 4.305 3.536 14.982 1.00 . A A . 7 GLU CD 1 1 21 14028 1 1 7 GLU CG C 4.842 2.337 14.196 1.00 . A A . 7 GLU CG 1 1 21 14029 1 1 7 GLU H H 5.311 2.531 11.054 1.00 . A A . 7 GLU H 1 1 21 14030 1 1 7 GLU HA H 4.800 -0.026 12.620 1.00 . A A . 7 GLU HA 1 1 21 14031 1 1 7 GLU HB2 H 3.455 2.726 12.560 1.00 . A A . 7 GLU HB2 1 1 21 14032 1 1 7 GLU HB3 H 2.960 1.464 13.657 1.00 . A A . 7 GLU HB3 1 1 21 14033 1 1 7 GLU HE2 H 3.244 3.914 16.570 1.00 . A A . 7 GLU HE2 1 1 21 14034 1 1 7 GLU HG2 H 5.088 1.506 14.883 1.00 . A A . 7 GLU HG2 1 1 21 14035 1 1 7 GLU HG3 H 5.803 2.632 13.735 1.00 . A A . 7 GLU HG3 1 1 21 14036 1 1 7 GLU N N 5.355 1.522 11.271 1.00 . A A . 7 GLU N 1 1 21 14037 1 1 7 GLU O O 2.879 0.423 10.169 1.00 . A A . 7 GLU O 1 1 21 14038 1 1 7 GLU OE1 O 4.498 4.703 14.643 1.00 . A A . 7 GLU OE1 1 1 21 14039 1 1 7 GLU OE2 O 3.582 3.158 16.084 1.00 . A A . 7 GLU OE2 1 1 21 14040 1 1 8 ASP C C 0.355 -0.716 12.929 1.00 . A A . 8 ASP C 1 1 21 14041 1 1 8 ASP CA C 1.241 -1.383 11.840 1.00 . A A . 8 ASP CA 1 1 21 14042 1 1 8 ASP CB C 1.212 -2.920 11.999 1.00 . A A . 8 ASP CB 1 1 21 14043 1 1 8 ASP CG C 2.410 -3.674 11.384 1.00 . A A . 8 ASP CG 1 1 21 14044 1 1 8 ASP H H 2.975 -0.836 13.042 1.00 . A A . 8 ASP H 1 1 21 14045 1 1 8 ASP HA H 0.900 -1.171 10.798 1.00 . A A . 8 ASP HA 1 1 21 14046 1 1 8 ASP HB2 H 1.057 -3.145 13.063 1.00 . A A . 8 ASP HB2 1 1 21 14047 1 1 8 ASP HB3 H 0.311 -3.293 11.490 1.00 . A A . 8 ASP HB3 1 1 21 14048 1 1 8 ASP HD2 H 2.441 -4.638 13.073 1.00 . A A . 8 ASP HD2 1 1 21 14049 1 1 8 ASP N N 2.544 -0.739 12.116 1.00 . A A . 8 ASP N 1 1 21 14050 1 1 8 ASP O O 0.632 -0.726 14.137 1.00 . A A . 8 ASP O 1 1 21 14051 1 1 8 ASP OD1 O 2.850 -3.455 10.254 1.00 . A A . 8 ASP OD1 1 1 21 14052 1 1 8 ASP OD2 O 2.918 -4.615 12.240 1.00 . A A . 8 ASP OD2 1 1 21 14053 1 1 9 TYR C C -0.851 2.103 13.737 1.00 . A A . 9 TYR C 1 1 21 14054 1 1 9 TYR CA C -1.621 0.836 13.161 1.00 . A A . 9 TYR CA 1 1 21 14055 1 1 9 TYR CB C -2.372 0.062 14.300 1.00 . A A . 9 TYR CB 1 1 21 14056 1 1 9 TYR CD1 C -4.534 -0.634 13.131 1.00 . A A . 9 TYR CD1 1 1 21 14057 1 1 9 TYR CD2 C -3.085 -2.367 13.990 1.00 . A A . 9 TYR CD2 1 1 21 14058 1 1 9 TYR CE1 C -5.408 -1.604 12.650 1.00 . A A . 9 TYR CE1 1 1 21 14059 1 1 9 TYR CE2 C -3.968 -3.335 13.518 1.00 . A A . 9 TYR CE2 1 1 21 14060 1 1 9 TYR CG C -3.362 -1.009 13.801 1.00 . A A . 9 TYR CG 1 1 21 14061 1 1 9 TYR CZ C -5.125 -2.955 12.842 1.00 . A A . 9 TYR CZ 1 1 21 14062 1 1 9 TYR H H -0.800 -0.361 11.441 1.00 . A A . 9 TYR H 1 1 21 14063 1 1 9 TYR HA H -2.355 1.235 12.442 1.00 . A A . 9 TYR HA 1 1 21 14064 1 1 9 TYR HB2 H -1.663 -0.358 15.038 1.00 . A A . 9 TYR HB2 1 1 21 14065 1 1 9 TYR HB3 H -2.961 0.785 14.896 1.00 . A A . 9 TYR HB3 1 1 21 14066 1 1 9 TYR HD1 H -4.762 0.409 12.964 1.00 . A A . 9 TYR HD1 1 1 21 14067 1 1 9 TYR HD2 H -2.180 -2.679 14.491 1.00 . A A . 9 TYR HD2 1 1 21 14068 1 1 9 TYR HE1 H -6.304 -1.306 12.124 1.00 . A A . 9 TYR HE1 1 1 21 14069 1 1 9 TYR HE2 H -3.743 -4.382 13.665 1.00 . A A . 9 TYR HE2 1 1 21 14070 1 1 9 TYR HH H -6.715 -3.477 11.918 1.00 . A A . 9 TYR HH 1 1 21 14071 1 1 9 TYR N N -0.708 -0.106 12.427 1.00 . A A . 9 TYR N 1 1 21 14072 1 1 9 TYR O O -1.271 2.676 14.748 1.00 . A A . 9 TYR O 1 1 21 14073 1 1 9 TYR OH O -5.979 -3.910 12.356 1.00 . A A . 9 TYR OH 1 1 21 14074 1 1 10 GLY C C 0.074 5.030 12.670 1.00 . A A . 10 GLY C 1 1 21 14075 1 1 10 GLY CA C 0.844 3.909 13.346 1.00 . A A . 10 GLY CA 1 1 21 14076 1 1 10 GLY H H 0.491 2.031 12.239 1.00 . A A . 10 GLY H 1 1 21 14077 1 1 10 GLY HA2 H 1.008 4.056 14.421 1.00 . A A . 10 GLY HA2 1 1 21 14078 1 1 10 GLY HA3 H 1.855 4.041 12.971 1.00 . A A . 10 GLY HA3 1 1 21 14079 1 1 10 GLY N N 0.212 2.598 13.050 1.00 . A A . 10 GLY N 1 1 21 14080 1 1 10 GLY O O -0.483 4.893 11.579 1.00 . A A . 10 GLY O 1 1 21 14081 1 1 11 LYS C C -0.205 8.035 11.791 1.00 . A A . 11 LYS C 1 1 21 14082 1 1 11 LYS CA C -0.804 7.301 13.026 1.00 . A A . 11 LYS CA 1 1 21 14083 1 1 11 LYS CB C -0.962 8.323 14.189 1.00 . A A . 11 LYS CB 1 1 21 14084 1 1 11 LYS CD C 0.176 7.541 16.439 1.00 . A A . 11 LYS CD 1 1 21 14085 1 1 11 LYS CE C -1.048 7.584 17.375 1.00 . A A . 11 LYS CE 1 1 21 14086 1 1 11 LYS CG C 0.137 8.545 15.263 1.00 . A A . 11 LYS CG 1 1 21 14087 1 1 11 LYS H H 0.746 6.038 14.141 1.00 . A A . 11 LYS H 1 1 21 14088 1 1 11 LYS HA H -1.821 6.905 12.792 1.00 . A A . 11 LYS HA 1 1 21 14089 1 1 11 LYS HB2 H -1.203 9.319 13.768 1.00 . A A . 11 LYS HB2 1 1 21 14090 1 1 11 LYS HB3 H -1.920 8.059 14.661 1.00 . A A . 11 LYS HB3 1 1 21 14091 1 1 11 LYS HD2 H 0.327 6.514 16.057 1.00 . A A . 11 LYS HD2 1 1 21 14092 1 1 11 LYS HD3 H 1.081 7.760 17.036 1.00 . A A . 11 LYS HD3 1 1 21 14093 1 1 11 LYS HE2 H -1.193 8.605 17.773 1.00 . A A . 11 LYS HE2 1 1 21 14094 1 1 11 LYS HE3 H -1.972 7.329 16.826 1.00 . A A . 11 LYS HE3 1 1 21 14095 1 1 11 LYS HG2 H 1.126 8.566 14.767 1.00 . A A . 11 LYS HG2 1 1 21 14096 1 1 11 LYS HG3 H 0.019 9.561 15.685 1.00 . A A . 11 LYS HG3 1 1 21 14097 1 1 11 LYS HZ1 H -1.704 6.714 19.129 1.00 . A A . 11 LYS HZ1 1 1 21 14098 1 1 11 LYS HZ2 H -0.083 6.912 19.072 1.00 . A A . 11 LYS HZ2 1 1 21 14099 1 1 11 LYS N N 0.073 6.148 13.375 1.00 . A A . 11 LYS N 1 1 21 14100 1 1 11 LYS NZ N -0.895 6.647 18.503 1.00 . A A . 11 LYS NZ 1 1 21 14101 1 1 11 LYS O O 0.884 8.618 11.798 1.00 . A A . 11 LYS O 1 1 21 14102 1 1 12 CYS C C -1.906 9.484 9.013 1.00 . A A . 12 CYS C 1 1 21 14103 1 1 12 CYS CA C -0.777 8.499 9.397 1.00 . A A . 12 CYS CA 1 1 21 14104 1 1 12 CYS CB C -0.729 7.329 8.375 1.00 . A A . 12 CYS CB 1 1 21 14105 1 1 12 CYS H H -1.930 7.552 11.044 1.00 . A A . 12 CYS H 1 1 21 14106 1 1 12 CYS HA H 0.190 9.043 9.377 1.00 . A A . 12 CYS HA 1 1 21 14107 1 1 12 CYS HB2 H -0.615 7.684 7.334 1.00 . A A . 12 CYS HB2 1 1 21 14108 1 1 12 CYS HB3 H 0.129 6.672 8.547 1.00 . A A . 12 CYS HB3 1 1 21 14109 1 1 12 CYS N N -1.026 7.939 10.745 1.00 . A A . 12 CYS N 1 1 21 14110 1 1 12 CYS O O -2.888 9.684 9.739 1.00 . A A . 12 CYS O 1 1 21 14111 1 1 12 CYS SG S -2.130 6.235 8.465 1.00 . A A . 12 CYS SG 1 1 21 14112 1 1 13 THR C C -2.814 10.614 5.690 1.00 . A A . 13 THR C 1 1 21 14113 1 1 13 THR CA C -2.869 10.888 7.223 1.00 . A A . 13 THR CA 1 1 21 14114 1 1 13 THR CB C -2.793 12.451 7.528 1.00 . A A . 13 THR CB 1 1 21 14115 1 1 13 THR CG2 C -1.908 12.896 8.715 1.00 . A A . 13 THR CG2 1 1 21 14116 1 1 13 THR H H -0.875 9.841 7.344 1.00 . A A . 13 THR H 1 1 21 14117 1 1 13 THR HA H -3.845 10.506 7.611 1.00 . A A . 13 THR HA 1 1 21 14118 1 1 13 THR HB H -3.844 12.762 7.674 1.00 . A A . 13 THR HB 1 1 21 14119 1 1 13 THR HG1 H -2.802 12.996 5.685 1.00 . A A . 13 THR HG1 1 1 21 14120 1 1 13 THR HG21 H -2.220 12.428 9.664 1.00 . A A . 13 THR HG21 1 1 21 14121 1 1 13 THR HG22 H -0.842 12.646 8.546 1.00 . A A . 13 THR HG22 1 1 21 14122 1 1 13 THR HG23 H -1.953 13.992 8.855 1.00 . A A . 13 THR HG23 1 1 21 14123 1 1 13 THR N N -1.754 10.099 7.830 1.00 . A A . 13 THR N 1 1 21 14124 1 1 13 THR O O -1.759 10.392 5.080 1.00 . A A . 13 THR O 1 1 21 14125 1 1 13 THR OG1 O -2.246 13.189 6.443 1.00 . A A . 13 THR OG1 1 1 21 14126 1 1 14 TRP C C -3.872 12.222 3.157 1.00 . A A . 14 TRP C 1 1 21 14127 1 1 14 TRP CA C -4.145 10.747 3.592 1.00 . A A . 14 TRP CA 1 1 21 14128 1 1 14 TRP CB C -5.552 10.222 3.187 1.00 . A A . 14 TRP CB 1 1 21 14129 1 1 14 TRP CD1 C -4.835 7.681 3.577 1.00 . A A . 14 TRP CD1 1 1 21 14130 1 1 14 TRP CD2 C -7.025 8.048 3.433 1.00 . A A . 14 TRP CD2 1 1 21 14131 1 1 14 TRP CE2 C -6.779 6.663 3.630 1.00 . A A . 14 TRP CE2 1 1 21 14132 1 1 14 TRP CE3 C -8.354 8.526 3.302 1.00 . A A . 14 TRP CE3 1 1 21 14133 1 1 14 TRP CG C -5.803 8.706 3.400 1.00 . A A . 14 TRP CG 1 1 21 14134 1 1 14 TRP CH2 C -9.159 6.240 3.565 1.00 . A A . 14 TRP CH2 1 1 21 14135 1 1 14 TRP CZ2 C -7.859 5.750 3.696 1.00 . A A . 14 TRP CZ2 1 1 21 14136 1 1 14 TRP CZ3 C -9.403 7.606 3.372 1.00 . A A . 14 TRP CZ3 1 1 21 14137 1 1 14 TRP H H -4.757 10.983 5.731 1.00 . A A . 14 TRP H 1 1 21 14138 1 1 14 TRP HA H -3.399 10.079 3.118 1.00 . A A . 14 TRP HA 1 1 21 14139 1 1 14 TRP HB2 H -6.338 10.804 3.705 1.00 . A A . 14 TRP HB2 1 1 21 14140 1 1 14 TRP HB3 H -5.712 10.431 2.113 1.00 . A A . 14 TRP HB3 1 1 21 14141 1 1 14 TRP HD1 H -3.767 7.839 3.598 1.00 . A A . 14 TRP HD1 1 1 21 14142 1 1 14 TRP HE1 H -4.953 5.515 3.872 1.00 . A A . 14 TRP HE1 1 1 21 14143 1 1 14 TRP HE3 H -8.558 9.576 3.151 1.00 . A A . 14 TRP HE3 1 1 21 14144 1 1 14 TRP HH2 H -9.992 5.554 3.616 1.00 . A A . 14 TRP HH2 1 1 21 14145 1 1 14 TRP HZ2 H -7.686 4.694 3.847 1.00 . A A . 14 TRP HZ2 1 1 21 14146 1 1 14 TRP HZ3 H -10.421 7.955 3.275 1.00 . A A . 14 TRP HZ3 1 1 21 14147 1 1 14 TRP N N -4.003 10.733 5.078 1.00 . A A . 14 TRP N 1 1 21 14148 1 1 14 TRP NE1 N -5.423 6.416 3.732 1.00 . A A . 14 TRP NE1 1 1 21 14149 1 1 14 TRP O O -4.718 13.116 3.263 1.00 . A A . 14 TRP O 1 1 21 14150 1 1 15 GLY C C -1.085 14.081 3.731 1.00 . A A . 15 GLY C 1 1 21 14151 1 1 15 GLY CA C -1.999 13.760 2.514 1.00 . A A . 15 GLY CA 1 1 21 14152 1 1 15 GLY H H -2.041 11.575 2.707 1.00 . A A . 15 GLY H 1 1 21 14153 1 1 15 GLY HA2 H -1.407 13.748 1.580 1.00 . A A . 15 GLY HA2 1 1 21 14154 1 1 15 GLY HA3 H -2.758 14.551 2.383 1.00 . A A . 15 GLY HA3 1 1 21 14155 1 1 15 GLY N N -2.613 12.426 2.732 1.00 . A A . 15 GLY N 1 1 21 14156 1 1 15 GLY O O -1.341 15.029 4.478 1.00 . A A . 15 GLY O 1 1 21 14157 1 1 16 GLY C C 1.949 12.215 4.955 1.00 . A A . 16 GLY C 1 1 21 14158 1 1 16 GLY CA C 0.799 13.217 5.131 1.00 . A A . 16 GLY CA 1 1 21 14159 1 1 16 GLY H H 0.018 12.521 3.197 1.00 . A A . 16 GLY H 1 1 21 14160 1 1 16 GLY HA2 H 1.187 14.183 5.484 1.00 . A A . 16 GLY HA2 1 1 21 14161 1 1 16 GLY HA3 H 0.157 12.875 5.964 1.00 . A A . 16 GLY HA3 1 1 21 14162 1 1 16 GLY N N -0.046 13.250 3.915 1.00 . A A . 16 GLY N 1 1 21 14163 1 1 16 GLY O O 2.374 11.873 3.843 1.00 . A A . 16 GLY O 1 1 21 14164 1 1 17 THR C C 2.494 9.282 5.977 1.00 . A A . 17 THR C 1 1 21 14165 1 1 17 THR CA C 3.383 10.568 6.123 1.00 . A A . 17 THR CA 1 1 21 14166 1 1 17 THR CB C 4.251 10.444 7.441 1.00 . A A . 17 THR CB 1 1 21 14167 1 1 17 THR CG2 C 5.611 9.764 7.158 1.00 . A A . 17 THR CG2 1 1 21 14168 1 1 17 THR H H 2.058 12.231 6.916 1.00 . A A . 17 THR H 1 1 21 14169 1 1 17 THR HA H 4.076 10.683 5.261 1.00 . A A . 17 THR HA 1 1 21 14170 1 1 17 THR HB H 3.735 9.802 8.189 1.00 . A A . 17 THR HB 1 1 21 14171 1 1 17 THR HG1 H 5.056 11.578 8.772 1.00 . A A . 17 THR HG1 1 1 21 14172 1 1 17 THR HG21 H 5.496 8.748 6.742 1.00 . A A . 17 THR HG21 1 1 21 14173 1 1 17 THR HG22 H 6.249 10.321 6.449 1.00 . A A . 17 THR HG22 1 1 21 14174 1 1 17 THR HG23 H 6.197 9.633 8.088 1.00 . A A . 17 THR HG23 1 1 21 14175 1 1 17 THR N N 2.432 11.724 6.106 1.00 . A A . 17 THR N 1 1 21 14176 1 1 17 THR O O 1.411 9.131 6.568 1.00 . A A . 17 THR O 1 1 21 14177 1 1 17 THR OG1 O 4.535 11.731 7.981 1.00 . A A . 17 THR OG1 1 1 21 14178 1 1 18 LYS C C 3.679 6.085 5.618 1.00 . A A . 18 LYS C 1 1 21 14179 1 1 18 LYS CA C 2.571 6.979 5.005 1.00 . A A . 18 LYS CA 1 1 21 14180 1 1 18 LYS CB C 2.291 6.619 3.508 1.00 . A A . 18 LYS CB 1 1 21 14181 1 1 18 LYS CD C 0.230 8.126 2.975 1.00 . A A . 18 LYS CD 1 1 21 14182 1 1 18 LYS CE C -0.350 9.254 2.101 1.00 . A A . 18 LYS CE 1 1 21 14183 1 1 18 LYS CG C 1.647 7.663 2.563 1.00 . A A . 18 LYS CG 1 1 21 14184 1 1 18 LYS H H 3.980 8.657 4.844 1.00 . A A . 18 LYS H 1 1 21 14185 1 1 18 LYS HA H 1.633 6.770 5.546 1.00 . A A . 18 LYS HA 1 1 21 14186 1 1 18 LYS HB2 H 3.222 6.232 3.058 1.00 . A A . 18 LYS HB2 1 1 21 14187 1 1 18 LYS HB3 H 1.640 5.724 3.498 1.00 . A A . 18 LYS HB3 1 1 21 14188 1 1 18 LYS HD2 H -0.463 7.263 2.997 1.00 . A A . 18 LYS HD2 1 1 21 14189 1 1 18 LYS HD3 H 0.260 8.494 4.017 1.00 . A A . 18 LYS HD3 1 1 21 14190 1 1 18 LYS HE2 H -1.251 9.662 2.588 1.00 . A A . 18 LYS HE2 1 1 21 14191 1 1 18 LYS HE3 H 0.358 10.101 2.038 1.00 . A A . 18 LYS HE3 1 1 21 14192 1 1 18 LYS HG2 H 2.317 8.539 2.477 1.00 . A A . 18 LYS HG2 1 1 21 14193 1 1 18 LYS HG3 H 1.605 7.233 1.545 1.00 . A A . 18 LYS HG3 1 1 21 14194 1 1 18 LYS HZ1 H 0.115 8.499 0.235 1.00 . A A . 18 LYS HZ1 1 1 21 14195 1 1 18 LYS HZ2 H -1.085 9.609 0.203 1.00 . A A . 18 LYS HZ2 1 1 21 14196 1 1 18 LYS N N 3.046 8.379 5.161 1.00 . A A . 18 LYS N 1 1 21 14197 1 1 18 LYS NZ N -0.720 8.815 0.741 1.00 . A A . 18 LYS NZ 1 1 21 14198 1 1 18 LYS O O 4.736 6.519 6.116 1.00 . A A . 18 LYS O 1 1 21 14199 1 1 19 CYS C C 5.569 3.584 5.376 1.00 . A A . 19 CYS C 1 1 21 14200 1 1 19 CYS CA C 4.323 3.829 6.283 1.00 . A A . 19 CYS CA 1 1 21 14201 1 1 19 CYS CB C 3.560 2.559 6.713 1.00 . A A . 19 CYS CB 1 1 21 14202 1 1 19 CYS H H 2.558 4.596 5.040 1.00 . A A . 19 CYS H 1 1 21 14203 1 1 19 CYS HA H 4.605 4.350 7.223 1.00 . A A . 19 CYS HA 1 1 21 14204 1 1 19 CYS HB2 H 2.741 2.304 6.017 1.00 . A A . 19 CYS HB2 1 1 21 14205 1 1 19 CYS HB3 H 4.228 1.674 6.753 1.00 . A A . 19 CYS HB3 1 1 21 14206 1 1 19 CYS N N 3.400 4.779 5.611 1.00 . A A . 19 CYS N 1 1 21 14207 1 1 19 CYS O O 5.593 3.609 4.143 1.00 . A A . 19 CYS O 1 1 21 14208 1 1 19 CYS SG S 2.916 2.951 8.351 1.00 . A A . 19 CYS SG 1 1 21 14209 1 1 20 CYS C C 8.544 2.783 4.606 1.00 . A A . 20 CYS C 1 1 21 14210 1 1 20 CYS CA C 8.061 3.575 5.853 1.00 . A A . 20 CYS CA 1 1 21 14211 1 1 20 CYS CB C 8.854 3.076 7.080 1.00 . A A . 20 CYS CB 1 1 21 14212 1 1 20 CYS H H 6.354 3.476 7.184 1.00 . A A . 20 CYS H 1 1 21 14213 1 1 20 CYS HA H 8.172 4.652 5.784 1.00 . A A . 20 CYS HA 1 1 21 14214 1 1 20 CYS HB2 H 8.377 3.416 7.999 1.00 . A A . 20 CYS HB2 1 1 21 14215 1 1 20 CYS HB3 H 8.918 1.975 7.155 1.00 . A A . 20 CYS HB3 1 1 21 14216 1 1 20 CYS N N 6.628 3.480 6.196 1.00 . A A . 20 CYS N 1 1 21 14217 1 1 20 CYS O O 9.212 3.385 3.761 1.00 . A A . 20 CYS O 1 1 21 14218 1 1 20 CYS SG S 10.498 3.821 7.041 1.00 . A A . 20 CYS SG 1 1 21 14219 1 1 21 ARG C C 7.601 0.606 2.162 1.00 . A A . 21 ARG C 1 1 21 14220 1 1 21 ARG CA C 8.658 0.639 3.320 1.00 . A A . 21 ARG CA 1 1 21 14221 1 1 21 ARG CB C 8.955 -0.791 3.872 1.00 . A A . 21 ARG CB 1 1 21 14222 1 1 21 ARG CD C 10.588 -0.395 5.933 1.00 . A A . 21 ARG CD 1 1 21 14223 1 1 21 ARG CG C 10.335 -1.016 4.544 1.00 . A A . 21 ARG CG 1 1 21 14224 1 1 21 ARG CZ C 9.674 -0.869 8.240 1.00 . A A . 21 ARG CZ 1 1 21 14225 1 1 21 ARG H H 7.554 1.217 5.202 1.00 . A A . 21 ARG H 1 1 21 14226 1 1 21 ARG HA H 9.555 1.079 2.859 1.00 . A A . 21 ARG HA 1 1 21 14227 1 1 21 ARG HB2 H 8.138 -1.148 4.529 1.00 . A A . 21 ARG HB2 1 1 21 14228 1 1 21 ARG HB3 H 8.942 -1.510 3.031 1.00 . A A . 21 ARG HB3 1 1 21 14229 1 1 21 ARG HD2 H 11.632 -0.607 6.233 1.00 . A A . 21 ARG HD2 1 1 21 14230 1 1 21 ARG HD3 H 10.511 0.706 5.892 1.00 . A A . 21 ARG HD3 1 1 21 14231 1 1 21 ARG HG2 H 10.509 -2.106 4.618 1.00 . A A . 21 ARG HG2 1 1 21 14232 1 1 21 ARG HG3 H 11.123 -0.661 3.855 1.00 . A A . 21 ARG HG3 1 1 21 14233 1 1 21 ARG HH11 H 11.379 0.191 8.355 1.00 . A A . 21 ARG HH11 1 1 21 14234 1 1 21 ARG HH12 H 10.559 -0.252 9.935 1.00 . A A . 21 ARG HH12 1 1 21 14235 1 1 21 ARG HH21 H 7.975 -1.919 8.368 1.00 . A A . 21 ARG HH21 1 1 21 14236 1 1 21 ARG HH22 H 8.748 -1.375 9.941 1.00 . A A . 21 ARG HH22 1 1 21 14237 1 1 21 ARG N N 8.239 1.478 4.495 1.00 . A A . 21 ARG N 1 1 21 14238 1 1 21 ARG NE N 9.649 -0.937 6.968 1.00 . A A . 21 ARG NE 1 1 21 14239 1 1 21 ARG NH1 N 10.637 -0.246 8.912 1.00 . A A . 21 ARG NH1 1 1 21 14240 1 1 21 ARG NH2 N 8.699 -1.444 8.919 1.00 . A A . 21 ARG NH2 1 1 21 14241 1 1 21 ARG O O 7.399 -0.396 1.468 1.00 . A A . 21 ARG O 1 1 21 14242 1 1 22 GLY C C 4.593 1.177 1.237 1.00 . A A . 22 GLY C 1 1 21 14243 1 1 22 GLY CA C 5.882 1.966 0.969 1.00 . A A . 22 GLY CA 1 1 21 14244 1 1 22 GLY H H 7.209 2.369 2.754 1.00 . A A . 22 GLY H 1 1 21 14245 1 1 22 GLY HA2 H 5.649 3.046 0.915 1.00 . A A . 22 GLY HA2 1 1 21 14246 1 1 22 GLY HA3 H 6.245 1.706 -0.027 1.00 . A A . 22 GLY HA3 1 1 21 14247 1 1 22 GLY N N 6.969 1.761 1.957 1.00 . A A . 22 GLY N 1 1 21 14248 1 1 22 GLY O O 4.148 0.374 0.412 1.00 . A A . 22 GLY O 1 1 21 14249 1 1 23 ARG C C 1.674 1.553 3.147 1.00 . A A . 23 ARG C 1 1 21 14250 1 1 23 ARG CA C 2.936 0.638 2.993 1.00 . A A . 23 ARG CA 1 1 21 14251 1 1 23 ARG CB C 3.383 0.064 4.363 1.00 . A A . 23 ARG CB 1 1 21 14252 1 1 23 ARG CD C 3.738 -2.440 3.626 1.00 . A A . 23 ARG CD 1 1 21 14253 1 1 23 ARG CG C 4.274 -1.196 4.363 1.00 . A A . 23 ARG CG 1 1 21 14254 1 1 23 ARG CZ C 1.554 -3.704 3.691 1.00 . A A . 23 ARG CZ 1 1 21 14255 1 1 23 ARG H H 4.661 2.034 2.985 1.00 . A A . 23 ARG H 1 1 21 14256 1 1 23 ARG HA H 2.694 -0.209 2.335 1.00 . A A . 23 ARG HA 1 1 21 14257 1 1 23 ARG HB2 H 3.967 0.828 4.886 1.00 . A A . 23 ARG HB2 1 1 21 14258 1 1 23 ARG HB3 H 2.510 -0.127 5.016 1.00 . A A . 23 ARG HB3 1 1 21 14259 1 1 23 ARG HD2 H 3.641 -2.228 2.544 1.00 . A A . 23 ARG HD2 1 1 21 14260 1 1 23 ARG HD3 H 4.481 -3.252 3.696 1.00 . A A . 23 ARG HD3 1 1 21 14261 1 1 23 ARG HG2 H 5.257 -0.923 3.936 1.00 . A A . 23 ARG HG2 1 1 21 14262 1 1 23 ARG HG3 H 4.494 -1.457 5.417 1.00 . A A . 23 ARG HG3 1 1 21 14263 1 1 23 ARG HH11 H 2.564 -4.111 2.001 1.00 . A A . 23 ARG HH11 1 1 21 14264 1 1 23 ARG HH12 H 0.935 -4.926 2.219 1.00 . A A . 23 ARG HH12 1 1 21 14265 1 1 23 ARG HH21 H 0.368 -3.453 5.283 1.00 . A A . 23 ARG HH21 1 1 21 14266 1 1 23 ARG HH22 H -0.228 -4.575 3.959 1.00 . A A . 23 ARG HH22 1 1 21 14267 1 1 23 ARG N N 4.046 1.431 2.424 1.00 . A A . 23 ARG N 1 1 21 14268 1 1 23 ARG NE N 2.425 -2.913 4.179 1.00 . A A . 23 ARG NE 1 1 21 14269 1 1 23 ARG NH1 N 1.699 -4.309 2.516 1.00 . A A . 23 ARG NH1 1 1 21 14270 1 1 23 ARG NH2 N 0.453 -3.933 4.381 1.00 . A A . 23 ARG NH2 1 1 21 14271 1 1 23 ARG O O 1.802 2.670 3.677 1.00 . A A . 23 ARG O 1 1 21 14272 1 1 24 PRO C C -1.392 2.128 4.175 1.00 . A A . 24 PRO C 1 1 21 14273 1 1 24 PRO CA C -0.769 1.974 2.752 1.00 . A A . 24 PRO CA 1 1 21 14274 1 1 24 PRO CB C -1.690 1.255 1.739 1.00 . A A . 24 PRO CB 1 1 21 14275 1 1 24 PRO CD C 0.194 -0.188 2.077 1.00 . A A . 24 PRO CD 1 1 21 14276 1 1 24 PRO CG C -1.312 -0.221 1.828 1.00 . A A . 24 PRO CG 1 1 21 14277 1 1 24 PRO HA H -0.539 2.998 2.393 1.00 . A A . 24 PRO HA 1 1 21 14278 1 1 24 PRO HB2 H -2.770 1.420 1.916 1.00 . A A . 24 PRO HB2 1 1 21 14279 1 1 24 PRO HB3 H -1.487 1.630 0.717 1.00 . A A . 24 PRO HB3 1 1 21 14280 1 1 24 PRO HD2 H 0.509 -1.032 2.718 1.00 . A A . 24 PRO HD2 1 1 21 14281 1 1 24 PRO HD3 H 0.745 -0.262 1.119 1.00 . A A . 24 PRO HD3 1 1 21 14282 1 1 24 PRO HG2 H -1.835 -0.699 2.679 1.00 . A A . 24 PRO HG2 1 1 21 14283 1 1 24 PRO HG3 H -1.582 -0.787 0.918 1.00 . A A . 24 PRO HG3 1 1 21 14284 1 1 24 PRO N N 0.445 1.123 2.719 1.00 . A A . 24 PRO N 1 1 21 14285 1 1 24 PRO O O -0.938 1.543 5.166 1.00 . A A . 24 PRO O 1 1 21 14286 1 1 25 CYS C C -4.700 3.013 5.254 1.00 . A A . 25 CYS C 1 1 21 14287 1 1 25 CYS CA C -3.178 3.257 5.483 1.00 . A A . 25 CYS CA 1 1 21 14288 1 1 25 CYS CB C -2.897 4.723 5.905 1.00 . A A . 25 CYS CB 1 1 21 14289 1 1 25 CYS H H -2.707 3.383 3.336 1.00 . A A . 25 CYS H 1 1 21 14290 1 1 25 CYS HA H -2.828 2.595 6.300 1.00 . A A . 25 CYS HA 1 1 21 14291 1 1 25 CYS HB2 H -2.481 5.306 5.074 1.00 . A A . 25 CYS HB2 1 1 21 14292 1 1 25 CYS HB3 H -3.819 5.216 6.261 1.00 . A A . 25 CYS HB3 1 1 21 14293 1 1 25 CYS N N -2.443 2.959 4.233 1.00 . A A . 25 CYS N 1 1 21 14294 1 1 25 CYS O O -5.264 3.227 4.175 1.00 . A A . 25 CYS O 1 1 21 14295 1 1 25 CYS SG S -1.716 4.724 7.241 1.00 . A A . 25 CYS SG 1 1 21 14296 1 1 26 ARG C C -7.132 3.248 7.755 1.00 . A A . 26 ARG C 1 1 21 14297 1 1 26 ARG CA C -6.810 2.450 6.468 1.00 . A A . 26 ARG CA 1 1 21 14298 1 1 26 ARG CB C -7.261 0.965 6.548 1.00 . A A . 26 ARG CB 1 1 21 14299 1 1 26 ARG CD C -9.541 1.176 5.316 1.00 . A A . 26 ARG CD 1 1 21 14300 1 1 26 ARG CG C -8.787 0.714 6.580 1.00 . A A . 26 ARG CG 1 1 21 14301 1 1 26 ARG CZ C -11.906 1.215 4.493 1.00 . A A . 26 ARG CZ 1 1 21 14302 1 1 26 ARG H H -4.768 2.590 7.198 1.00 . A A . 26 ARG H 1 1 21 14303 1 1 26 ARG HA H -7.295 2.918 5.588 1.00 . A A . 26 ARG HA 1 1 21 14304 1 1 26 ARG HB2 H -6.842 0.411 5.685 1.00 . A A . 26 ARG HB2 1 1 21 14305 1 1 26 ARG HB3 H -6.807 0.483 7.435 1.00 . A A . 26 ARG HB3 1 1 21 14306 1 1 26 ARG HD2 H -9.437 2.272 5.196 1.00 . A A . 26 ARG HD2 1 1 21 14307 1 1 26 ARG HD3 H -9.089 0.718 4.416 1.00 . A A . 26 ARG HD3 1 1 21 14308 1 1 26 ARG HG2 H -8.950 -0.371 6.727 1.00 . A A . 26 ARG HG2 1 1 21 14309 1 1 26 ARG HG3 H -9.221 1.196 7.477 1.00 . A A . 26 ARG HG3 1 1 21 14310 1 1 26 ARG HH11 H -10.671 2.286 3.319 1.00 . A A . 26 ARG HH11 1 1 21 14311 1 1 26 ARG HH12 H -12.438 2.220 2.831 1.00 . A A . 26 ARG HH12 1 1 21 14312 1 1 26 ARG HH21 H -13.328 0.220 5.491 1.00 . A A . 26 ARG HH21 1 1 21 14313 1 1 26 ARG HH22 H -13.840 1.127 3.980 1.00 . A A . 26 ARG HH22 1 1 21 14314 1 1 26 ARG N N -5.339 2.556 6.342 1.00 . A A . 26 ARG N 1 1 21 14315 1 1 26 ARG NE N -10.978 0.819 5.385 1.00 . A A . 26 ARG NE 1 1 21 14316 1 1 26 ARG NH1 N -11.645 1.986 3.438 1.00 . A A . 26 ARG NH1 1 1 21 14317 1 1 26 ARG NH2 N -13.151 0.814 4.674 1.00 . A A . 26 ARG NH2 1 1 21 14318 1 1 26 ARG O O -6.551 3.010 8.826 1.00 . A A . 26 ARG O 1 1 21 14319 1 1 27 CYS C C -9.059 4.640 9.935 1.00 . A A . 27 CYS C 1 1 21 14320 1 1 27 CYS CA C -8.220 5.207 8.743 1.00 . A A . 27 CYS CA 1 1 21 14321 1 1 27 CYS CB C -8.923 6.458 8.183 1.00 . A A . 27 CYS CB 1 1 21 14322 1 1 27 CYS H H -8.448 4.363 6.713 1.00 . A A . 27 CYS H 1 1 21 14323 1 1 27 CYS HA H -7.192 5.477 9.040 1.00 . A A . 27 CYS HA 1 1 21 14324 1 1 27 CYS HB2 H -9.974 6.283 7.969 1.00 . A A . 27 CYS HB2 1 1 21 14325 1 1 27 CYS HB3 H -8.929 7.241 8.957 1.00 . A A . 27 CYS HB3 1 1 21 14326 1 1 27 CYS N N -8.042 4.232 7.646 1.00 . A A . 27 CYS N 1 1 21 14327 1 1 27 CYS O O -9.746 3.617 9.846 1.00 . A A . 27 CYS O 1 1 21 14328 1 1 27 CYS SG S -8.068 7.120 6.747 1.00 . A A . 27 CYS SG 1 1 21 14329 1 1 28 SER C C -11.104 5.214 12.438 1.00 . A A . 28 SER C 1 1 21 14330 1 1 28 SER CA C -9.558 4.949 12.367 1.00 . A A . 28 SER CA 1 1 21 14331 1 1 28 SER CB C -8.746 5.745 13.441 1.00 . A A . 28 SER CB 1 1 21 14332 1 1 28 SER H H -8.360 6.187 10.997 1.00 . A A . 28 SER H 1 1 21 14333 1 1 28 SER HA H -9.420 3.867 12.544 1.00 . A A . 28 SER HA 1 1 21 14334 1 1 28 SER HB2 H -7.681 5.881 13.172 1.00 . A A . 28 SER HB2 1 1 21 14335 1 1 28 SER HB3 H -9.147 6.766 13.583 1.00 . A A . 28 SER HB3 1 1 21 14336 1 1 28 SER HG H -8.260 5.602 15.297 1.00 . A A . 28 SER HG 1 1 21 14337 1 1 28 SER N N -8.961 5.359 11.070 1.00 . A A . 28 SER N 1 1 21 14338 1 1 28 SER O O -11.784 5.567 11.468 1.00 . A A . 28 SER O 1 1 21 14339 1 1 28 SER OG O -8.780 5.068 14.692 1.00 . A A . 28 SER OG 1 1 21 14340 1 1 29 MET C C -13.378 6.944 14.056 1.00 . A A . 29 MET C 1 1 21 14341 1 1 29 MET CA C -13.019 5.403 14.080 1.00 . A A . 29 MET CA 1 1 21 14342 1 1 29 MET CB C -13.157 4.898 15.542 1.00 . A A . 29 MET CB 1 1 21 14343 1 1 29 MET CE C -11.254 2.131 16.178 1.00 . A A . 29 MET CE 1 1 21 14344 1 1 29 MET CG C -13.690 3.461 15.697 1.00 . A A . 29 MET CG 1 1 21 14345 1 1 29 MET H H -10.846 4.903 14.318 1.00 . A A . 29 MET H 1 1 21 14346 1 1 29 MET HA H -13.756 4.902 13.423 1.00 . A A . 29 MET HA 1 1 21 14347 1 1 29 MET HB2 H -12.212 5.004 16.111 1.00 . A A . 29 MET HB2 1 1 21 14348 1 1 29 MET HB3 H -13.828 5.581 16.084 1.00 . A A . 29 MET HB3 1 1 21 14349 1 1 29 MET HE1 H -11.656 1.857 17.170 1.00 . A A . 29 MET HE1 1 1 21 14350 1 1 29 MET HE2 H -10.518 1.362 15.883 1.00 . A A . 29 MET HE2 1 1 21 14351 1 1 29 MET HE3 H -10.720 3.094 16.273 1.00 . A A . 29 MET HE3 1 1 21 14352 1 1 29 MET HG2 H -13.839 3.218 16.766 1.00 . A A . 29 MET HG2 1 1 21 14353 1 1 29 MET HG3 H -14.685 3.369 15.223 1.00 . A A . 29 MET HG3 1 1 21 14354 1 1 29 MET N N -11.623 5.022 13.657 1.00 . A A . 29 MET N 1 1 21 14355 1 1 29 MET O O -14.548 7.329 14.126 1.00 . A A . 29 MET O 1 1 21 14356 1 1 29 MET SD S -12.576 2.242 14.952 1.00 . A A . 29 MET SD 1 1 21 14357 1 1 30 ILE C C -11.340 9.189 12.508 1.00 . A A . 30 ILE C 1 1 21 14358 1 1 30 ILE CA C -12.353 9.217 13.698 1.00 . A A . 30 ILE CA 1 1 21 14359 1 1 30 ILE CB C -11.902 10.117 14.904 1.00 . A A . 30 ILE CB 1 1 21 14360 1 1 30 ILE CD1 C -12.375 10.595 17.439 1.00 . A A . 30 ILE CD1 1 1 21 14361 1 1 30 ILE CG1 C -12.854 9.946 16.130 1.00 . A A . 30 ILE CG1 1 1 21 14362 1 1 30 ILE CG2 C -11.904 11.605 14.460 1.00 . A A . 30 ILE CG2 1 1 21 14363 1 1 30 ILE H H -11.517 7.252 13.731 1.00 . A A . 30 ILE H 1 1 21 14364 1 1 30 ILE HA H -13.374 9.533 13.396 1.00 . A A . 30 ILE HA 1 1 21 14365 1 1 30 ILE HB H -10.879 9.831 15.216 1.00 . A A . 30 ILE HB 1 1 21 14366 1 1 30 ILE HD11 H -11.376 10.226 17.736 1.00 . A A . 30 ILE HD11 1 1 21 14367 1 1 30 ILE HD12 H -12.318 11.695 17.362 1.00 . A A . 30 ILE HD12 1 1 21 14368 1 1 30 ILE HD13 H -13.068 10.366 18.270 1.00 . A A . 30 ILE HD13 1 1 21 14369 1 1 30 ILE HG12 H -13.869 10.314 15.885 1.00 . A A . 30 ILE HG12 1 1 21 14370 1 1 30 ILE HG13 H -12.990 8.870 16.347 1.00 . A A . 30 ILE HG13 1 1 21 14371 1 1 30 ILE HG21 H -11.253 11.779 13.584 1.00 . A A . 30 ILE HG21 1 1 21 14372 1 1 30 ILE HG22 H -12.915 11.959 14.183 1.00 . A A . 30 ILE HG22 1 1 21 14373 1 1 30 ILE HG23 H -11.528 12.275 15.254 1.00 . A A . 30 ILE HG23 1 1 21 14374 1 1 30 ILE N N -12.346 7.774 13.958 1.00 . A A . 30 ILE N 1 1 21 14375 1 1 30 ILE O O -10.115 9.252 12.655 1.00 . A A . 30 ILE O 1 1 21 14376 1 1 31 GLY C C -10.263 9.919 9.618 1.00 . A A . 31 GLY C 1 1 21 14377 1 1 31 GLY CA C -11.310 8.859 10.003 1.00 . A A . 31 GLY CA 1 1 21 14378 1 1 31 GLY H H -12.906 8.834 11.585 1.00 . A A . 31 GLY H 1 1 21 14379 1 1 31 GLY HA2 H -10.836 7.861 9.981 1.00 . A A . 31 GLY HA2 1 1 21 14380 1 1 31 GLY HA3 H -12.081 8.811 9.215 1.00 . A A . 31 GLY HA3 1 1 21 14381 1 1 31 GLY N N -11.953 9.016 11.334 1.00 . A A . 31 GLY N 1 1 21 14382 1 1 31 GLY O O -9.305 9.613 8.904 1.00 . A A . 31 GLY O 1 1 21 14383 1 1 32 THR C C -8.442 11.764 11.307 1.00 . A A . 32 THR C 1 1 21 14384 1 1 32 THR CA C -9.326 12.149 10.082 1.00 . A A . 32 THR CA 1 1 21 14385 1 1 32 THR CB C -9.692 13.633 10.215 1.00 . A A . 32 THR CB 1 1 21 14386 1 1 32 THR CG2 C -10.503 14.164 9.021 1.00 . A A . 32 THR CG2 1 1 21 14387 1 1 32 THR H H -11.215 11.070 10.835 1.00 . A A . 32 THR H 1 1 21 14388 1 1 32 THR HA H -8.797 12.045 9.110 1.00 . A A . 32 THR HA 1 1 21 14389 1 1 32 THR HB H -8.702 14.137 10.264 1.00 . A A . 32 THR HB 1 1 21 14390 1 1 32 THR HG1 H -9.951 13.589 12.125 1.00 . A A . 32 THR HG1 1 1 21 14391 1 1 32 THR HG21 H -9.965 14.019 8.066 1.00 . A A . 32 THR HG21 1 1 21 14392 1 1 32 THR HG22 H -11.484 13.660 8.928 1.00 . A A . 32 THR HG22 1 1 21 14393 1 1 32 THR HG23 H -10.699 15.247 9.120 1.00 . A A . 32 THR HG23 1 1 21 14394 1 1 32 THR N N -10.434 11.146 10.148 1.00 . A A . 32 THR N 1 1 21 14395 1 1 32 THR O O -8.895 11.655 12.450 1.00 . A A . 32 THR O 1 1 21 14396 1 1 32 THR OG1 O -10.474 13.897 11.380 1.00 . A A . 32 THR OG1 1 1 21 14397 1 1 33 ASN C C -6.277 9.356 11.447 1.00 . A A . 33 ASN C 1 1 21 14398 1 1 33 ASN CA C -6.108 10.882 11.769 1.00 . A A . 33 ASN CA 1 1 21 14399 1 1 33 ASN CB C -6.172 11.098 13.321 1.00 . A A . 33 ASN CB 1 1 21 14400 1 1 33 ASN CG C -5.722 12.493 13.790 1.00 . A A . 33 ASN CG 1 1 21 14401 1 1 33 ASN H H -7.056 11.841 9.976 1.00 . A A . 33 ASN H 1 1 21 14402 1 1 33 ASN HA H -5.130 11.255 11.406 1.00 . A A . 33 ASN HA 1 1 21 14403 1 1 33 ASN HB2 H -7.153 10.824 13.749 1.00 . A A . 33 ASN HB2 1 1 21 14404 1 1 33 ASN HB3 H -5.517 10.347 13.806 1.00 . A A . 33 ASN HB3 1 1 21 14405 1 1 33 ASN HD21 H -7.625 13.035 14.120 1.00 . A A . 33 ASN HD21 1 1 21 14406 1 1 33 ASN HD22 H -6.324 14.278 14.480 1.00 . A A . 33 ASN HD22 1 1 21 14407 1 1 33 ASN N N -7.182 11.530 10.947 1.00 . A A . 33 ASN N 1 1 21 14408 1 1 33 ASN ND2 N -6.652 13.356 14.170 1.00 . A A . 33 ASN ND2 1 1 21 14409 1 1 33 ASN O O -6.827 8.572 12.230 1.00 . A A . 33 ASN O 1 1 21 14410 1 1 33 ASN OD1 O -4.531 12.802 13.818 1.00 . A A . 33 ASN OD1 1 1 21 14411 1 1 34 CYS C C -4.733 6.675 10.573 1.00 . A A . 34 CYS C 1 1 21 14412 1 1 34 CYS CA C -5.790 7.534 9.805 1.00 . A A . 34 CYS CA 1 1 21 14413 1 1 34 CYS CB C -5.488 7.511 8.289 1.00 . A A . 34 CYS CB 1 1 21 14414 1 1 34 CYS H H -5.512 9.747 9.659 1.00 . A A . 34 CYS H 1 1 21 14415 1 1 34 CYS HA H -6.793 7.114 9.969 1.00 . A A . 34 CYS HA 1 1 21 14416 1 1 34 CYS HB2 H -4.483 7.880 8.100 1.00 . A A . 34 CYS HB2 1 1 21 14417 1 1 34 CYS HB3 H -5.500 6.472 7.909 1.00 . A A . 34 CYS HB3 1 1 21 14418 1 1 34 CYS N N -5.783 8.956 10.257 1.00 . A A . 34 CYS N 1 1 21 14419 1 1 34 CYS O O -3.915 7.210 11.330 1.00 . A A . 34 CYS O 1 1 21 14420 1 1 34 CYS SG S -6.740 8.446 7.402 1.00 . A A . 34 CYS SG 1 1 21 14421 1 1 35 GLU C C -3.123 3.492 9.774 1.00 . A A . 35 GLU C 1 1 21 14422 1 1 35 GLU CA C -3.633 4.465 10.896 1.00 . A A . 35 GLU CA 1 1 21 14423 1 1 35 GLU CB C -4.068 3.610 12.123 1.00 . A A . 35 GLU CB 1 1 21 14424 1 1 35 GLU CD C -5.292 3.252 14.335 1.00 . A A . 35 GLU CD 1 1 21 14425 1 1 35 GLU CG C -5.033 4.206 13.168 1.00 . A A . 35 GLU CG 1 1 21 14426 1 1 35 GLU H H -5.509 5.027 9.747 1.00 . A A . 35 GLU H 1 1 21 14427 1 1 35 GLU HA H -2.788 5.104 11.211 1.00 . A A . 35 GLU HA 1 1 21 14428 1 1 35 GLU HB2 H -4.374 2.604 11.789 1.00 . A A . 35 GLU HB2 1 1 21 14429 1 1 35 GLU HB3 H -3.134 3.392 12.671 1.00 . A A . 35 GLU HB3 1 1 21 14430 1 1 35 GLU HE2 H -6.590 1.912 14.892 1.00 . A A . 35 GLU HE2 1 1 21 14431 1 1 35 GLU HG2 H -4.617 5.156 13.556 1.00 . A A . 35 GLU HG2 1 1 21 14432 1 1 35 GLU HG3 H -5.989 4.472 12.684 1.00 . A A . 35 GLU HG3 1 1 21 14433 1 1 35 GLU N N -4.748 5.335 10.377 1.00 . A A . 35 GLU N 1 1 21 14434 1 1 35 GLU O O -3.704 3.360 8.697 1.00 . A A . 35 GLU O 1 1 21 14435 1 1 35 GLU OE1 O -4.548 3.160 15.312 1.00 . A A . 35 GLU OE1 1 1 21 14436 1 1 35 GLU OE2 O -6.434 2.512 14.159 1.00 . A A . 35 GLU OE2 1 1 21 14437 1 1 36 CYS C C -1.709 0.524 9.058 1.00 . A A . 36 CYS C 1 1 21 14438 1 1 36 CYS CA C -1.212 2.003 9.077 1.00 . A A . 36 CYS CA 1 1 21 14439 1 1 36 CYS CB C 0.308 2.100 9.461 1.00 . A A . 36 CYS CB 1 1 21 14440 1 1 36 CYS H H -1.763 2.925 11.060 1.00 . A A . 36 CYS H 1 1 21 14441 1 1 36 CYS HA H -1.347 2.446 8.058 1.00 . A A . 36 CYS HA 1 1 21 14442 1 1 36 CYS HB2 H 0.498 2.176 10.548 1.00 . A A . 36 CYS HB2 1 1 21 14443 1 1 36 CYS HB3 H 0.892 1.190 9.242 1.00 . A A . 36 CYS HB3 1 1 21 14444 1 1 36 CYS N N -1.996 2.812 10.067 1.00 . A A . 36 CYS N 1 1 21 14445 1 1 36 CYS O O -2.398 0.049 9.969 1.00 . A A . 36 CYS O 1 1 21 14446 1 1 36 CYS SG S 1.006 3.422 8.481 1.00 . A A . 36 CYS SG 1 1 21 14447 1 1 37 THR C C -0.919 -2.668 8.006 1.00 . A A . 37 THR C 1 1 21 14448 1 1 37 THR CA C -1.973 -1.539 7.688 1.00 . A A . 37 THR CA 1 1 21 14449 1 1 37 THR CB C -2.408 -1.685 6.193 1.00 . A A . 37 THR CB 1 1 21 14450 1 1 37 THR CG2 C -3.610 -0.786 5.846 1.00 . A A . 37 THR CG2 1 1 21 14451 1 1 37 THR H H -0.892 0.338 7.230 1.00 . A A . 37 THR H 1 1 21 14452 1 1 37 THR HA H -2.887 -1.693 8.290 1.00 . A A . 37 THR HA 1 1 21 14453 1 1 37 THR HB H -2.696 -2.741 6.036 1.00 . A A . 37 THR HB 1 1 21 14454 1 1 37 THR HG1 H -1.692 -1.448 4.420 1.00 . A A . 37 THR HG1 1 1 21 14455 1 1 37 THR HG21 H -4.488 -1.016 6.479 1.00 . A A . 37 THR HG21 1 1 21 14456 1 1 37 THR HG22 H -3.379 0.285 5.981 1.00 . A A . 37 THR HG22 1 1 21 14457 1 1 37 THR HG23 H -3.923 -0.922 4.795 1.00 . A A . 37 THR HG23 1 1 21 14458 1 1 37 THR N N -1.388 -0.191 7.959 1.00 . A A . 37 THR N 1 1 21 14459 1 1 37 THR O O 0.154 -2.670 7.390 1.00 . A A . 37 THR O 1 1 21 14460 1 1 37 THR OG1 O -1.347 -1.328 5.308 1.00 . A A . 37 THR OG1 1 1 21 14461 1 1 38 PRO C C -0.035 -5.725 7.858 1.00 . A A . 38 PRO C 1 1 21 14462 1 1 38 PRO CA C -0.344 -4.870 9.128 1.00 . A A . 38 PRO CA 1 1 21 14463 1 1 38 PRO CB C -1.166 -5.699 10.142 1.00 . A A . 38 PRO CB 1 1 21 14464 1 1 38 PRO CD C -2.336 -3.610 9.841 1.00 . A A . 38 PRO CD 1 1 21 14465 1 1 38 PRO CG C -2.094 -4.723 10.856 1.00 . A A . 38 PRO CG 1 1 21 14466 1 1 38 PRO HA H 0.623 -4.562 9.558 1.00 . A A . 38 PRO HA 1 1 21 14467 1 1 38 PRO HB2 H -1.788 -6.465 9.637 1.00 . A A . 38 PRO HB2 1 1 21 14468 1 1 38 PRO HB3 H -0.517 -6.245 10.852 1.00 . A A . 38 PRO HB3 1 1 21 14469 1 1 38 PRO HD2 H -3.262 -3.767 9.277 1.00 . A A . 38 PRO HD2 1 1 21 14470 1 1 38 PRO HD3 H -2.428 -2.628 10.338 1.00 . A A . 38 PRO HD3 1 1 21 14471 1 1 38 PRO HG2 H -3.035 -5.201 11.185 1.00 . A A . 38 PRO HG2 1 1 21 14472 1 1 38 PRO HG3 H -1.610 -4.322 11.766 1.00 . A A . 38 PRO HG3 1 1 21 14473 1 1 38 PRO N N -1.183 -3.651 8.925 1.00 . A A . 38 PRO N 1 1 21 14474 1 1 38 PRO O O -0.782 -5.712 6.874 1.00 . A A . 38 PRO O 1 1 21 14475 1 1 39 ARG C C 1.979 -8.779 7.621 1.00 . A A . 39 ARG C 1 1 21 14476 1 1 39 ARG CA C 1.433 -7.506 6.904 1.00 . A A . 39 ARG CA 1 1 21 14477 1 1 39 ARG CB C 2.498 -6.916 5.929 1.00 . A A . 39 ARG CB 1 1 21 14478 1 1 39 ARG CD C 4.793 -5.888 5.405 1.00 . A A . 39 ARG CD 1 1 21 14479 1 1 39 ARG CG C 3.796 -6.292 6.503 1.00 . A A . 39 ARG CG 1 1 21 14480 1 1 39 ARG CZ C 6.921 -4.572 5.250 1.00 . A A . 39 ARG CZ 1 1 21 14481 1 1 39 ARG H H 1.580 -6.422 8.821 1.00 . A A . 39 ARG H 1 1 21 14482 1 1 39 ARG HA H 0.543 -7.782 6.302 1.00 . A A . 39 ARG HA 1 1 21 14483 1 1 39 ARG HB2 H 2.766 -7.702 5.197 1.00 . A A . 39 ARG HB2 1 1 21 14484 1 1 39 ARG HB3 H 1.998 -6.148 5.312 1.00 . A A . 39 ARG HB3 1 1 21 14485 1 1 39 ARG HD2 H 5.175 -6.792 4.892 1.00 . A A . 39 ARG HD2 1 1 21 14486 1 1 39 ARG HD3 H 4.278 -5.289 4.632 1.00 . A A . 39 ARG HD3 1 1 21 14487 1 1 39 ARG HG2 H 3.526 -5.409 7.114 1.00 . A A . 39 ARG HG2 1 1 21 14488 1 1 39 ARG HG3 H 4.290 -6.999 7.194 1.00 . A A . 39 ARG HG3 1 1 21 14489 1 1 39 ARG HH11 H 6.287 -5.203 3.448 1.00 . A A . 39 ARG HH11 1 1 21 14490 1 1 39 ARG HH12 H 7.833 -4.215 3.492 1.00 . A A . 39 ARG HH12 1 1 21 14491 1 1 39 ARG HH21 H 7.753 -3.828 6.912 1.00 . A A . 39 ARG HH21 1 1 21 14492 1 1 39 ARG HH22 H 8.604 -3.490 5.322 1.00 . A A . 39 ARG HH22 1 1 21 14493 1 1 39 ARG N N 1.060 -6.505 7.941 1.00 . A A . 39 ARG N 1 1 21 14494 1 1 39 ARG NE N 5.923 -5.114 5.973 1.00 . A A . 39 ARG NE 1 1 21 14495 1 1 39 ARG NH1 N 7.024 -4.674 3.926 1.00 . A A . 39 ARG NH1 1 1 21 14496 1 1 39 ARG NH2 N 7.855 -3.896 5.894 1.00 . A A . 39 ARG NH2 1 1 21 14497 1 1 39 ARG O O 2.899 -8.709 8.443 1.00 . A A . 39 ARG O 1 1 21 14498 1 1 40 LEU C C 1.986 -11.416 9.316 1.00 . A A . 40 LEU C 1 1 21 14499 1 1 40 LEU CA C 1.724 -11.329 7.756 1.00 . A A . 40 LEU CA 1 1 21 14500 1 1 40 LEU CB C 2.930 -11.820 6.866 1.00 . A A . 40 LEU CB 1 1 21 14501 1 1 40 LEU CD1 C 5.425 -12.399 7.161 1.00 . A A . 40 LEU CD1 1 1 21 14502 1 1 40 LEU CD2 C 4.802 -10.295 5.935 1.00 . A A . 40 LEU CD2 1 1 21 14503 1 1 40 LEU CG C 4.382 -11.267 7.056 1.00 . A A . 40 LEU CG 1 1 21 14504 1 1 40 LEU H H 0.644 -9.819 6.571 1.00 . A A . 40 LEU H 1 1 21 14505 1 1 40 LEU HA H 0.843 -11.976 7.592 1.00 . A A . 40 LEU HA 1 1 21 14506 1 1 40 LEU HB2 H 2.955 -12.916 7.007 1.00 . A A . 40 LEU HB2 1 1 21 14507 1 1 40 LEU HB3 H 2.642 -11.752 5.798 1.00 . A A . 40 LEU HB3 1 1 21 14508 1 1 40 LEU HD11 H 5.190 -13.089 7.993 1.00 . A A . 40 LEU HD11 1 1 21 14509 1 1 40 LEU HD12 H 5.473 -13.008 6.239 1.00 . A A . 40 LEU HD12 1 1 21 14510 1 1 40 LEU HD13 H 6.441 -12.007 7.353 1.00 . A A . 40 LEU HD13 1 1 21 14511 1 1 40 LEU HD21 H 4.108 -9.443 5.851 1.00 . A A . 40 LEU HD21 1 1 21 14512 1 1 40 LEU HD22 H 5.805 -9.867 6.117 1.00 . A A . 40 LEU HD22 1 1 21 14513 1 1 40 LEU HD23 H 4.829 -10.789 4.945 1.00 . A A . 40 LEU HD23 1 1 21 14514 1 1 40 LEU HG H 4.430 -10.713 8.008 1.00 . A A . 40 LEU HG 1 1 21 14515 1 1 40 LEU N N 1.387 -9.945 7.267 1.00 . A A . 40 LEU N 1 1 21 14516 1 1 40 LEU O O 1.454 -10.600 10.075 1.00 . A A . 40 LEU O 1 1 21 14517 1 1 41 ILE C C 1.812 -13.216 11.974 1.00 . A A . 41 ILE C 1 1 21 14518 1 1 41 ILE CA C 3.098 -12.713 11.226 1.00 . A A . 41 ILE CA 1 1 21 14519 1 1 41 ILE CB C 3.696 -11.434 11.959 1.00 . A A . 41 ILE CB 1 1 21 14520 1 1 41 ILE CD1 C 6.134 -11.698 10.896 1.00 . A A . 41 ILE CD1 1 1 21 14521 1 1 41 ILE CG1 C 4.916 -10.807 11.206 1.00 . A A . 41 ILE CG1 1 1 21 14522 1 1 41 ILE CG2 C 4.167 -11.814 13.391 1.00 . A A . 41 ILE CG2 1 1 21 14523 1 1 41 ILE H H 3.064 -13.078 9.051 1.00 . A A . 41 ILE H 1 1 21 14524 1 1 41 ILE HA H 3.859 -13.519 11.221 1.00 . A A . 41 ILE HA 1 1 21 14525 1 1 41 ILE HB H 2.928 -10.645 12.060 1.00 . A A . 41 ILE HB 1 1 21 14526 1 1 41 ILE HD11 H 5.860 -12.578 10.287 1.00 . A A . 41 ILE HD11 1 1 21 14527 1 1 41 ILE HD12 H 6.899 -11.137 10.329 1.00 . A A . 41 ILE HD12 1 1 21 14528 1 1 41 ILE HD13 H 6.620 -12.068 11.817 1.00 . A A . 41 ILE HD13 1 1 21 14529 1 1 41 ILE HG12 H 4.560 -10.373 10.256 1.00 . A A . 41 ILE HG12 1 1 21 14530 1 1 41 ILE HG13 H 5.272 -9.926 11.772 1.00 . A A . 41 ILE HG13 1 1 21 14531 1 1 41 ILE HG21 H 4.906 -12.634 13.390 1.00 . A A . 41 ILE HG21 1 1 21 14532 1 1 41 ILE HG22 H 4.630 -10.955 13.912 1.00 . A A . 41 ILE HG22 1 1 21 14533 1 1 41 ILE HG23 H 3.325 -12.141 14.029 1.00 . A A . 41 ILE HG23 1 1 21 14534 1 1 41 ILE N N 2.718 -12.457 9.792 1.00 . A A . 41 ILE N 1 1 21 14535 1 1 41 ILE O O 0.855 -12.462 12.182 1.00 . A A . 41 ILE O 1 1 21 14536 1 1 42 MET C C 1.620 -15.366 14.764 1.00 . A A . 42 MET C 1 1 21 14537 1 1 42 MET CA C 0.880 -15.020 13.428 1.00 . A A . 42 MET CA 1 1 21 14538 1 1 42 MET CB C 0.171 -16.266 12.813 1.00 . A A . 42 MET CB 1 1 21 14539 1 1 42 MET CE C -0.573 -19.655 13.386 1.00 . A A . 42 MET CE 1 1 21 14540 1 1 42 MET CG C 1.008 -17.523 12.505 1.00 . A A . 42 MET CG 1 1 21 14541 1 1 42 MET H H 2.708 -14.993 12.189 1.00 . A A . 42 MET H 1 1 21 14542 1 1 42 MET HA H 0.099 -14.269 13.664 1.00 . A A . 42 MET HA 1 1 21 14543 1 1 42 MET HB2 H -0.646 -16.566 13.495 1.00 . A A . 42 MET HB2 1 1 21 14544 1 1 42 MET HB3 H -0.356 -15.963 11.890 1.00 . A A . 42 MET HB3 1 1 21 14545 1 1 42 MET HE1 H -1.105 -18.950 14.052 1.00 . A A . 42 MET HE1 1 1 21 14546 1 1 42 MET HE2 H -1.257 -20.493 13.161 1.00 . A A . 42 MET HE2 1 1 21 14547 1 1 42 MET HE3 H 0.296 -20.060 13.936 1.00 . A A . 42 MET HE3 1 1 21 14548 1 1 42 MET HG2 H 1.781 -17.297 11.753 1.00 . A A . 42 MET HG2 1 1 21 14549 1 1 42 MET HG3 H 1.538 -17.877 13.408 1.00 . A A . 42 MET HG3 1 1 21 14550 1 1 42 MET N N 1.851 -14.482 12.429 1.00 . A A . 42 MET N 1 1 21 14551 1 1 42 MET O O 2.853 -15.450 14.837 1.00 . A A . 42 MET O 1 1 21 14552 1 1 42 MET SD S -0.049 -18.839 11.863 1.00 . A A . 42 MET SD 1 1 21 14553 1 1 43 GLU C C 1.928 -17.294 17.312 1.00 . A A . 43 GLU C 1 1 21 14554 1 1 43 GLU CA C 1.373 -15.838 17.205 1.00 . A A . 43 GLU CA 1 1 21 14555 1 1 43 GLU CB C 0.244 -15.647 18.256 1.00 . A A . 43 GLU CB 1 1 21 14556 1 1 43 GLU CD C -1.294 -14.049 19.540 1.00 . A A . 43 GLU CD 1 1 21 14557 1 1 43 GLU CG C -0.245 -14.191 18.434 1.00 . A A . 43 GLU CG 1 1 21 14558 1 1 43 GLU H H -0.173 -15.483 15.661 1.00 . A A . 43 GLU H 1 1 21 14559 1 1 43 GLU HA H 2.188 -15.116 17.420 1.00 . A A . 43 GLU HA 1 1 21 14560 1 1 43 GLU HB2 H -0.611 -16.310 18.021 1.00 . A A . 43 GLU HB2 1 1 21 14561 1 1 43 GLU HB3 H 0.612 -15.997 19.240 1.00 . A A . 43 GLU HB3 1 1 21 14562 1 1 43 GLU HE2 H -3.225 -14.140 19.768 1.00 . A A . 43 GLU HE2 1 1 21 14563 1 1 43 GLU HG2 H 0.613 -13.534 18.671 1.00 . A A . 43 GLU HG2 1 1 21 14564 1 1 43 GLU HG3 H -0.658 -13.804 17.484 1.00 . A A . 43 GLU HG3 1 1 21 14565 1 1 43 GLU N N 0.833 -15.575 15.839 1.00 . A A . 43 GLU N 1 1 21 14566 1 1 43 GLU O O 1.366 -18.248 16.760 1.00 . A A . 43 GLU O 1 1 21 14567 1 1 43 GLU OE1 O -1.013 -13.800 20.712 1.00 . A A . 43 GLU OE1 1 1 21 14568 1 1 43 GLU OE2 O -2.571 -14.232 19.072 1.00 . A A . 43 GLU OE2 1 1 21 14569 1 1 44 GLY C C 4.918 -18.797 17.120 1.00 . A A . 44 GLY C 1 1 21 14570 1 1 44 GLY CA C 3.791 -18.702 18.163 1.00 . A A . 44 GLY CA 1 1 21 14571 1 1 44 GLY H H 3.381 -16.556 18.469 1.00 . A A . 44 GLY H 1 1 21 14572 1 1 44 GLY HA2 H 4.240 -18.743 19.173 1.00 . A A . 44 GLY HA2 1 1 21 14573 1 1 44 GLY HA3 H 3.108 -19.575 18.125 1.00 . A A . 44 GLY HA3 1 1 21 14574 1 1 44 GLY N N 3.054 -17.425 18.034 1.00 . A A . 44 GLY N 1 1 21 14575 1 1 44 GLY O O 5.953 -18.138 17.266 1.00 . A A . 44 GLY O 1 1 21 14576 1 1 45 LEU C C 5.032 -18.663 13.811 1.00 . A A . 45 LEU C 1 1 21 14577 1 1 45 LEU CA C 5.588 -19.646 14.880 1.00 . A A . 45 LEU CA 1 1 21 14578 1 1 45 LEU CB C 5.646 -21.088 14.300 1.00 . A A . 45 LEU CB 1 1 21 14579 1 1 45 LEU CD1 C 6.107 -23.578 14.516 1.00 . A A . 45 LEU CD1 1 1 21 14580 1 1 45 LEU CD2 C 7.814 -21.951 15.416 1.00 . A A . 45 LEU CD2 1 1 21 14581 1 1 45 LEU CG C 6.311 -22.195 15.167 1.00 . A A . 45 LEU CG 1 1 21 14582 1 1 45 LEU H H 3.784 -20.080 16.078 1.00 . A A . 45 LEU H 1 1 21 14583 1 1 45 LEU HA H 6.620 -19.354 15.164 1.00 . A A . 45 LEU HA 1 1 21 14584 1 1 45 LEU HB2 H 4.616 -21.406 14.043 1.00 . A A . 45 LEU HB2 1 1 21 14585 1 1 45 LEU HB3 H 6.177 -21.055 13.328 1.00 . A A . 45 LEU HB3 1 1 21 14586 1 1 45 LEU HD11 H 5.035 -23.811 14.381 1.00 . A A . 45 LEU HD11 1 1 21 14587 1 1 45 LEU HD12 H 6.583 -23.644 13.519 1.00 . A A . 45 LEU HD12 1 1 21 14588 1 1 45 LEU HD13 H 6.531 -24.390 15.137 1.00 . A A . 45 LEU HD13 1 1 21 14589 1 1 45 LEU HD21 H 8.387 -21.888 14.472 1.00 . A A . 45 LEU HD21 1 1 21 14590 1 1 45 LEU HD22 H 7.992 -21.013 15.972 1.00 . A A . 45 LEU HD22 1 1 21 14591 1 1 45 LEU HD23 H 8.265 -22.761 16.020 1.00 . A A . 45 LEU HD23 1 1 21 14592 1 1 45 LEU HG H 5.805 -22.220 16.150 1.00 . A A . 45 LEU HG 1 1 21 14593 1 1 45 LEU N N 4.687 -19.593 16.063 1.00 . A A . 45 LEU N 1 1 21 14594 1 1 45 LEU O O 3.902 -18.818 13.336 1.00 . A A . 45 LEU O 1 1 21 14595 1 1 46 SER C C 5.366 -16.918 11.106 1.00 . A A . 46 SER C 1 1 21 14596 1 1 46 SER CA C 5.375 -16.512 12.607 1.00 . A A . 46 SER CA 1 1 21 14597 1 1 46 SER CB C 6.325 -15.313 12.825 1.00 . A A . 46 SER CB 1 1 21 14598 1 1 46 SER H H 6.749 -17.633 13.922 1.00 . A A . 46 SER H 1 1 21 14599 1 1 46 SER HA H 4.356 -16.202 12.912 1.00 . A A . 46 SER HA 1 1 21 14600 1 1 46 SER HB2 H 7.378 -15.577 12.608 1.00 . A A . 46 SER HB2 1 1 21 14601 1 1 46 SER HB3 H 6.070 -14.492 12.129 1.00 . A A . 46 SER HB3 1 1 21 14602 1 1 46 SER HG H 6.469 -15.547 14.729 1.00 . A A . 46 SER HG 1 1 21 14603 1 1 46 SER N N 5.836 -17.645 13.453 1.00 . A A . 46 SER N 1 1 21 14604 1 1 46 SER O O 6.402 -17.274 10.533 1.00 . A A . 46 SER O 1 1 21 14605 1 1 46 SER OG O 6.223 -14.818 14.156 1.00 . A A . 46 SER OG 1 1 21 14606 1 1 47 PHE C C 3.050 -16.188 8.414 1.00 . A A . 47 PHE C 1 1 21 14607 1 1 47 PHE CA C 3.947 -17.271 9.083 1.00 . A A . 47 PHE CA 1 1 21 14608 1 1 47 PHE CB C 3.310 -18.702 9.022 1.00 . A A . 47 PHE CB 1 1 21 14609 1 1 47 PHE CD1 C 5.387 -20.198 8.945 1.00 . A A . 47 PHE CD1 1 1 21 14610 1 1 47 PHE CD2 C 3.678 -20.683 10.582 1.00 . A A . 47 PHE CD2 1 1 21 14611 1 1 47 PHE CE1 C 6.133 -21.280 9.406 1.00 . A A . 47 PHE CE1 1 1 21 14612 1 1 47 PHE CE2 C 4.419 -21.773 11.030 1.00 . A A . 47 PHE CE2 1 1 21 14613 1 1 47 PHE CG C 4.156 -19.885 9.535 1.00 . A A . 47 PHE CG 1 1 21 14614 1 1 47 PHE CZ C 5.648 -22.067 10.447 1.00 . A A . 47 PHE CZ 1 1 21 14615 1 1 47 PHE H H 3.393 -16.564 11.100 1.00 . A A . 47 PHE H 1 1 21 14616 1 1 47 PHE HA H 4.899 -17.297 8.528 1.00 . A A . 47 PHE HA 1 1 21 14617 1 1 47 PHE HB2 H 2.329 -18.692 9.538 1.00 . A A . 47 PHE HB2 1 1 21 14618 1 1 47 PHE HB3 H 3.049 -18.921 7.969 1.00 . A A . 47 PHE HB3 1 1 21 14619 1 1 47 PHE HD1 H 5.772 -19.601 8.130 1.00 . A A . 47 PHE HD1 1 1 21 14620 1 1 47 PHE HD2 H 2.728 -20.467 11.052 1.00 . A A . 47 PHE HD2 1 1 21 14621 1 1 47 PHE HE1 H 7.086 -21.511 8.952 1.00 . A A . 47 PHE HE1 1 1 21 14622 1 1 47 PHE HE2 H 4.043 -22.388 11.835 1.00 . A A . 47 PHE HE2 1 1 21 14623 1 1 47 PHE HZ H 6.226 -22.908 10.803 1.00 . A A . 47 PHE HZ 1 1 21 14624 1 1 47 PHE N N 4.167 -16.871 10.500 1.00 . A A . 47 PHE N 1 1 21 14625 1 1 47 PHE O O 3.575 -15.382 7.640 1.00 . A A . 47 PHE O 1 1 21 14626 1 1 48 ALA C C -0.401 -15.017 9.059 1.00 . A A . 48 ALA C 1 1 21 14627 1 1 48 ALA CA C 0.777 -15.210 8.086 1.00 . A A . 48 ALA CA 1 1 21 14628 1 1 48 ALA CB C 0.270 -15.744 6.731 1.00 . A A . 48 ALA CB 1 1 21 14629 1 1 48 ALA H H 1.443 -16.916 9.331 1.00 . A A . 48 ALA H 1 1 21 14630 1 1 48 ALA HXT H -1.188 -13.622 10.167 1.00 . A A . 48 ALA HXT 1 1 21 14631 1 1 48 ALA HA H 1.273 -14.238 7.916 1.00 . A A . 48 ALA HA 1 1 21 14632 1 1 48 ALA HB1 H -0.236 -16.724 6.822 1.00 . A A . 48 ALA HB1 1 1 21 14633 1 1 48 ALA HB2 H -0.450 -15.045 6.265 1.00 . A A . 48 ALA HB2 1 1 21 14634 1 1 48 ALA HB3 H 1.098 -15.870 6.008 1.00 . A A . 48 ALA HB3 1 1 21 14635 1 1 48 ALA N N 1.730 -16.167 8.694 1.00 . A A . 48 ALA N 1 1 21 14636 1 1 48 ALA O O -1.207 -15.902 9.353 1.00 . A A . 48 ALA O 1 1 21 14637 1 1 48 ALA OXT O -0.453 -13.741 9.561 1.00 . A A . 48 ALA OXT 1 1 22 14638 1 1 1 GLU C C 9.557 14.864 12.022 1.00 . A A . 1 GLU C 1 1 22 14639 1 1 1 GLU CA C 10.703 15.335 12.967 1.00 . A A . 1 GLU CA 1 1 22 14640 1 1 1 GLU CB C 11.737 14.224 13.340 1.00 . A A . 1 GLU CB 1 1 22 14641 1 1 1 GLU CD C 13.374 14.477 11.341 1.00 . A A . 1 GLU CD 1 1 22 14642 1 1 1 GLU CG C 12.485 13.543 12.168 1.00 . A A . 1 GLU CG 1 1 22 14643 1 1 1 GLU H1 H 9.435 16.591 14.054 1.00 . A A . 1 GLU H1 1 1 22 14644 1 1 1 GLU H2 H 9.608 15.094 14.732 1.00 . A A . 1 GLU H2 1 1 22 14645 1 1 1 GLU HA H 11.220 16.166 12.460 1.00 . A A . 1 GLU HA 1 1 22 14646 1 1 1 GLU HB2 H 12.495 14.645 14.029 1.00 . A A . 1 GLU HB2 1 1 22 14647 1 1 1 GLU HB3 H 11.240 13.428 13.928 1.00 . A A . 1 GLU HB3 1 1 22 14648 1 1 1 GLU HE2 H 13.280 15.563 9.727 1.00 . A A . 1 GLU HE2 1 1 22 14649 1 1 1 GLU HG2 H 13.118 12.732 12.574 1.00 . A A . 1 GLU HG2 1 1 22 14650 1 1 1 GLU HG3 H 11.764 13.029 11.506 1.00 . A A . 1 GLU HG3 1 1 22 14651 1 1 1 GLU N N 10.107 15.836 14.227 1.00 . A A . 1 GLU N 1 1 22 14652 1 1 1 GLU O O 9.257 15.580 11.063 1.00 . A A . 1 GLU O 1 1 22 14653 1 1 1 GLU OE1 O 14.538 14.744 11.638 1.00 . A A . 1 GLU OE1 1 1 22 14654 1 1 1 GLU OE2 O 12.721 14.975 10.241 1.00 . A A . 1 GLU OE2 1 1 22 14655 1 1 2 ASP C C 8.557 12.722 9.987 1.00 . A A . 2 ASP C 1 1 22 14656 1 1 2 ASP CA C 7.936 12.997 11.397 1.00 . A A . 2 ASP CA 1 1 22 14657 1 1 2 ASP CB C 6.635 13.853 11.262 1.00 . A A . 2 ASP CB 1 1 22 14658 1 1 2 ASP CG C 5.819 13.990 12.556 1.00 . A A . 2 ASP CG 1 1 22 14659 1 1 2 ASP H H 9.346 13.210 13.093 1.00 . A A . 2 ASP H 1 1 22 14660 1 1 2 ASP HA H 7.670 12.024 11.859 1.00 . A A . 2 ASP HA 1 1 22 14661 1 1 2 ASP HB2 H 6.844 14.856 10.845 1.00 . A A . 2 ASP HB2 1 1 22 14662 1 1 2 ASP HB3 H 5.971 13.381 10.513 1.00 . A A . 2 ASP HB3 1 1 22 14663 1 1 2 ASP HD2 H 6.794 15.659 12.793 1.00 . A A . 2 ASP HD2 1 1 22 14664 1 1 2 ASP N N 8.952 13.676 12.270 1.00 . A A . 2 ASP N 1 1 22 14665 1 1 2 ASP O O 8.496 13.558 9.078 1.00 . A A . 2 ASP O 1 1 22 14666 1 1 2 ASP OD1 O 4.992 13.158 12.928 1.00 . A A . 2 ASP OD1 1 1 22 14667 1 1 2 ASP OD2 O 6.123 15.139 13.242 1.00 . A A . 2 ASP OD2 1 1 22 14668 1 1 3 ASN C C 8.976 10.142 7.797 1.00 . A A . 3 ASN C 1 1 22 14669 1 1 3 ASN CA C 9.875 11.130 8.590 1.00 . A A . 3 ASN CA 1 1 22 14670 1 1 3 ASN CB C 11.286 10.606 9.031 1.00 . A A . 3 ASN CB 1 1 22 14671 1 1 3 ASN CG C 12.246 10.301 7.863 1.00 . A A . 3 ASN CG 1 1 22 14672 1 1 3 ASN H H 9.134 10.913 10.655 1.00 . A A . 3 ASN H 1 1 22 14673 1 1 3 ASN HA H 10.037 11.947 7.919 1.00 . A A . 3 ASN HA 1 1 22 14674 1 1 3 ASN HB2 H 11.768 11.344 9.704 1.00 . A A . 3 ASN HB2 1 1 22 14675 1 1 3 ASN HB3 H 11.194 9.697 9.657 1.00 . A A . 3 ASN HB3 1 1 22 14676 1 1 3 ASN HD21 H 13.080 12.118 8.029 1.00 . A A . 3 ASN HD21 1 1 22 14677 1 1 3 ASN HD22 H 13.732 11.013 6.717 1.00 . A A . 3 ASN HD22 1 1 22 14678 1 1 3 ASN N N 9.177 11.536 9.841 1.00 . A A . 3 ASN N 1 1 22 14679 1 1 3 ASN ND2 N 13.105 11.241 7.496 1.00 . A A . 3 ASN ND2 1 1 22 14680 1 1 3 ASN O O 8.318 10.505 6.818 1.00 . A A . 3 ASN O 1 1 22 14681 1 1 3 ASN OD1 O 12.220 9.216 7.282 1.00 . A A . 3 ASN OD1 1 1 22 14682 1 1 4 CYS C C 7.298 7.214 9.052 1.00 . A A . 4 CYS C 1 1 22 14683 1 1 4 CYS CA C 8.091 7.819 7.843 1.00 . A A . 4 CYS CA 1 1 22 14684 1 1 4 CYS CB C 8.928 6.759 7.144 1.00 . A A . 4 CYS CB 1 1 22 14685 1 1 4 CYS H H 9.624 9.003 9.078 1.00 . A A . 4 CYS H 1 1 22 14686 1 1 4 CYS HA H 7.356 8.152 7.090 1.00 . A A . 4 CYS HA 1 1 22 14687 1 1 4 CYS HB2 H 8.130 6.070 6.941 1.00 . A A . 4 CYS HB2 1 1 22 14688 1 1 4 CYS HB3 H 9.252 7.037 6.132 1.00 . A A . 4 CYS HB3 1 1 22 14689 1 1 4 CYS N N 8.978 8.920 8.288 1.00 . A A . 4 CYS N 1 1 22 14690 1 1 4 CYS O O 7.515 7.570 10.218 1.00 . A A . 4 CYS O 1 1 22 14691 1 1 4 CYS SG S 10.145 5.814 8.091 1.00 . A A . 4 CYS SG 1 1 22 14692 1 1 5 ILE C C 6.191 4.117 9.769 1.00 . A A . 5 ILE C 1 1 22 14693 1 1 5 ILE CA C 5.601 5.535 9.816 1.00 . A A . 5 ILE CA 1 1 22 14694 1 1 5 ILE CB C 4.033 5.456 9.619 1.00 . A A . 5 ILE CB 1 1 22 14695 1 1 5 ILE CD1 C 2.007 6.755 8.770 1.00 . A A . 5 ILE CD1 1 1 22 14696 1 1 5 ILE CG1 C 3.444 6.828 9.263 1.00 . A A . 5 ILE CG1 1 1 22 14697 1 1 5 ILE CG2 C 3.343 4.918 10.913 1.00 . A A . 5 ILE CG2 1 1 22 14698 1 1 5 ILE H H 6.422 5.975 7.739 1.00 . A A . 5 ILE H 1 1 22 14699 1 1 5 ILE HA H 5.772 6.009 10.792 1.00 . A A . 5 ILE HA 1 1 22 14700 1 1 5 ILE HB H 3.742 4.769 8.830 1.00 . A A . 5 ILE HB 1 1 22 14701 1 1 5 ILE HD11 H 1.339 6.319 9.527 1.00 . A A . 5 ILE HD11 1 1 22 14702 1 1 5 ILE HD12 H 1.645 7.765 8.542 1.00 . A A . 5 ILE HD12 1 1 22 14703 1 1 5 ILE HD13 H 1.902 6.146 7.857 1.00 . A A . 5 ILE HD13 1 1 22 14704 1 1 5 ILE HG12 H 3.552 7.505 10.111 1.00 . A A . 5 ILE HG12 1 1 22 14705 1 1 5 ILE HG13 H 4.015 7.295 8.448 1.00 . A A . 5 ILE HG13 1 1 22 14706 1 1 5 ILE HG21 H 3.718 3.921 11.206 1.00 . A A . 5 ILE HG21 1 1 22 14707 1 1 5 ILE HG22 H 3.441 5.587 11.786 1.00 . A A . 5 ILE HG22 1 1 22 14708 1 1 5 ILE HG23 H 2.255 4.758 10.766 1.00 . A A . 5 ILE HG23 1 1 22 14709 1 1 5 ILE N N 6.359 6.277 8.741 1.00 . A A . 5 ILE N 1 1 22 14710 1 1 5 ILE O O 5.813 3.291 8.941 1.00 . A A . 5 ILE O 1 1 22 14711 1 1 6 ALA C C 6.781 1.297 11.282 1.00 . A A . 6 ALA C 1 1 22 14712 1 1 6 ALA CA C 7.715 2.407 10.639 1.00 . A A . 6 ALA CA 1 1 22 14713 1 1 6 ALA CB C 9.044 2.502 11.411 1.00 . A A . 6 ALA CB 1 1 22 14714 1 1 6 ALA H H 7.241 4.471 11.405 1.00 . A A . 6 ALA H 1 1 22 14715 1 1 6 ALA HA H 7.882 2.144 9.562 1.00 . A A . 6 ALA HA 1 1 22 14716 1 1 6 ALA HB1 H 9.722 3.258 10.971 1.00 . A A . 6 ALA HB1 1 1 22 14717 1 1 6 ALA HB2 H 8.891 2.769 12.474 1.00 . A A . 6 ALA HB2 1 1 22 14718 1 1 6 ALA HB3 H 9.587 1.540 11.390 1.00 . A A . 6 ALA HB3 1 1 22 14719 1 1 6 ALA N N 7.124 3.781 10.661 1.00 . A A . 6 ALA N 1 1 22 14720 1 1 6 ALA O O 7.248 0.211 11.638 1.00 . A A . 6 ALA O 1 1 22 14721 1 1 7 GLU C C 3.207 0.467 11.441 1.00 . A A . 7 GLU C 1 1 22 14722 1 1 7 GLU CA C 4.490 0.791 12.192 1.00 . A A . 7 GLU CA 1 1 22 14723 1 1 7 GLU CB C 4.141 1.582 13.491 1.00 . A A . 7 GLU CB 1 1 22 14724 1 1 7 GLU CD C 4.821 2.414 15.808 1.00 . A A . 7 GLU CD 1 1 22 14725 1 1 7 GLU CG C 5.251 1.636 14.562 1.00 . A A . 7 GLU CG 1 1 22 14726 1 1 7 GLU H H 5.375 2.601 11.216 1.00 . A A . 7 GLU H 1 1 22 14727 1 1 7 GLU HA H 4.887 -0.166 12.432 1.00 . A A . 7 GLU HA 1 1 22 14728 1 1 7 GLU HB2 H 3.820 2.612 13.237 1.00 . A A . 7 GLU HB2 1 1 22 14729 1 1 7 GLU HB3 H 3.247 1.129 13.967 1.00 . A A . 7 GLU HB3 1 1 22 14730 1 1 7 GLU HE2 H 3.918 2.106 17.505 1.00 . A A . 7 GLU HE2 1 1 22 14731 1 1 7 GLU HG2 H 5.554 0.610 14.845 1.00 . A A . 7 GLU HG2 1 1 22 14732 1 1 7 GLU HG3 H 6.159 2.111 14.145 1.00 . A A . 7 GLU HG3 1 1 22 14733 1 1 7 GLU N N 5.472 1.596 11.422 1.00 . A A . 7 GLU N 1 1 22 14734 1 1 7 GLU O O 2.607 1.350 10.852 1.00 . A A . 7 GLU O 1 1 22 14735 1 1 7 GLU OE1 O 5.020 3.619 15.957 1.00 . A A . 7 GLU OE1 1 1 22 14736 1 1 7 GLU OE2 O 4.188 1.614 16.726 1.00 . A A . 7 GLU OE2 1 1 22 14737 1 1 8 ASP C C 0.524 -0.913 12.329 1.00 . A A . 8 ASP C 1 1 22 14738 1 1 8 ASP CA C 1.448 -1.295 11.151 1.00 . A A . 8 ASP CA 1 1 22 14739 1 1 8 ASP CB C 1.320 -2.829 10.912 1.00 . A A . 8 ASP CB 1 1 22 14740 1 1 8 ASP CG C 2.239 -3.749 11.742 1.00 . A A . 8 ASP CG 1 1 22 14741 1 1 8 ASP H H 3.422 -1.415 12.104 1.00 . A A . 8 ASP H 1 1 22 14742 1 1 8 ASP HA H 1.153 -0.804 10.198 1.00 . A A . 8 ASP HA 1 1 22 14743 1 1 8 ASP HB2 H 0.259 -3.126 11.020 1.00 . A A . 8 ASP HB2 1 1 22 14744 1 1 8 ASP HB3 H 1.561 -2.957 9.852 1.00 . A A . 8 ASP HB3 1 1 22 14745 1 1 8 ASP HD2 H 0.799 -3.717 13.051 1.00 . A A . 8 ASP HD2 1 1 22 14746 1 1 8 ASP N N 2.789 -0.816 11.563 1.00 . A A . 8 ASP N 1 1 22 14747 1 1 8 ASP O O 0.751 -1.205 13.510 1.00 . A A . 8 ASP O 1 1 22 14748 1 1 8 ASP OD1 O 3.350 -4.118 11.365 1.00 . A A . 8 ASP OD1 1 1 22 14749 1 1 8 ASP OD2 O 1.669 -4.105 12.938 1.00 . A A . 8 ASP OD2 1 1 22 14750 1 1 9 TYR C C -0.756 1.635 13.673 1.00 . A A . 9 TYR C 1 1 22 14751 1 1 9 TYR CA C -1.481 0.538 12.792 1.00 . A A . 9 TYR CA 1 1 22 14752 1 1 9 TYR CB C -2.281 -0.518 13.637 1.00 . A A . 9 TYR CB 1 1 22 14753 1 1 9 TYR CD1 C -4.161 -1.138 12.016 1.00 . A A . 9 TYR CD1 1 1 22 14754 1 1 9 TYR CD2 C -2.542 -2.838 12.584 1.00 . A A . 9 TYR CD2 1 1 22 14755 1 1 9 TYR CE1 C -4.734 -1.996 11.081 1.00 . A A . 9 TYR CE1 1 1 22 14756 1 1 9 TYR CE2 C -3.118 -3.696 11.650 1.00 . A A . 9 TYR CE2 1 1 22 14757 1 1 9 TYR CG C -3.056 -1.548 12.772 1.00 . A A . 9 TYR CG 1 1 22 14758 1 1 9 TYR CZ C -4.211 -3.274 10.897 1.00 . A A . 9 TYR CZ 1 1 22 14759 1 1 9 TYR H H -0.562 -0.191 10.885 1.00 . A A . 9 TYR H 1 1 22 14760 1 1 9 TYR HA H -2.188 1.103 12.160 1.00 . A A . 9 TYR HA 1 1 22 14761 1 1 9 TYR HB2 H -1.622 -1.031 14.363 1.00 . A A . 9 TYR HB2 1 1 22 14762 1 1 9 TYR HB3 H -3.010 0.016 14.275 1.00 . A A . 9 TYR HB3 1 1 22 14763 1 1 9 TYR HD1 H -4.529 -0.125 12.097 1.00 . A A . 9 TYR HD1 1 1 22 14764 1 1 9 TYR HD2 H -1.650 -3.160 13.105 1.00 . A A . 9 TYR HD2 1 1 22 14765 1 1 9 TYR HE1 H -5.562 -1.657 10.476 1.00 . A A . 9 TYR HE1 1 1 22 14766 1 1 9 TYR HE2 H -2.691 -4.676 11.486 1.00 . A A . 9 TYR HE2 1 1 22 14767 1 1 9 TYR HH H -5.487 -3.655 9.523 1.00 . A A . 9 TYR HH 1 1 22 14768 1 1 9 TYR N N -0.512 -0.193 11.912 1.00 . A A . 9 TYR N 1 1 22 14769 1 1 9 TYR O O -1.078 1.843 14.846 1.00 . A A . 9 TYR O 1 1 22 14770 1 1 9 TYR OH O -4.751 -4.103 9.947 1.00 . A A . 9 TYR OH 1 1 22 14771 1 1 10 GLY C C -0.197 4.810 13.398 1.00 . A A . 10 GLY C 1 1 22 14772 1 1 10 GLY CA C 0.780 3.633 13.567 1.00 . A A . 10 GLY CA 1 1 22 14773 1 1 10 GLY H H 0.392 2.065 12.085 1.00 . A A . 10 GLY H 1 1 22 14774 1 1 10 GLY HA2 H 1.182 3.562 14.583 1.00 . A A . 10 GLY HA2 1 1 22 14775 1 1 10 GLY HA3 H 1.678 3.861 12.967 1.00 . A A . 10 GLY HA3 1 1 22 14776 1 1 10 GLY N N 0.172 2.391 13.034 1.00 . A A . 10 GLY N 1 1 22 14777 1 1 10 GLY O O -1.375 4.625 13.096 1.00 . A A . 10 GLY O 1 1 22 14778 1 1 11 LYS C C -0.090 7.685 11.782 1.00 . A A . 11 LYS C 1 1 22 14779 1 1 11 LYS CA C -0.501 7.248 13.211 1.00 . A A . 11 LYS CA 1 1 22 14780 1 1 11 LYS CB C -0.285 8.429 14.189 1.00 . A A . 11 LYS CB 1 1 22 14781 1 1 11 LYS CD C 1.188 10.024 15.580 1.00 . A A . 11 LYS CD 1 1 22 14782 1 1 11 LYS CE C 2.616 10.370 16.041 1.00 . A A . 11 LYS CE 1 1 22 14783 1 1 11 LYS CG C 1.144 8.770 14.686 1.00 . A A . 11 LYS CG 1 1 22 14784 1 1 11 LYS H H 1.301 6.008 13.772 1.00 . A A . 11 LYS H 1 1 22 14785 1 1 11 LYS HA H -1.593 6.998 13.217 1.00 . A A . 11 LYS HA 1 1 22 14786 1 1 11 LYS HB2 H -0.726 9.342 13.743 1.00 . A A . 11 LYS HB2 1 1 22 14787 1 1 11 LYS HB3 H -0.961 8.227 15.029 1.00 . A A . 11 LYS HB3 1 1 22 14788 1 1 11 LYS HD2 H 0.757 10.882 15.028 1.00 . A A . 11 LYS HD2 1 1 22 14789 1 1 11 LYS HD3 H 0.535 9.871 16.461 1.00 . A A . 11 LYS HD3 1 1 22 14790 1 1 11 LYS HE2 H 3.050 9.531 16.616 1.00 . A A . 11 LYS HE2 1 1 22 14791 1 1 11 LYS HE3 H 3.278 10.523 15.168 1.00 . A A . 11 LYS HE3 1 1 22 14792 1 1 11 LYS HG2 H 1.561 7.908 15.239 1.00 . A A . 11 LYS HG2 1 1 22 14793 1 1 11 LYS HG3 H 1.808 8.919 13.814 1.00 . A A . 11 LYS HG3 1 1 22 14794 1 1 11 LYS HZ1 H 2.308 12.390 16.331 1.00 . A A . 11 LYS HZ1 1 1 22 14795 1 1 11 LYS HZ2 H 3.599 11.808 17.148 1.00 . A A . 11 LYS HZ2 1 1 22 14796 1 1 11 LYS N N 0.291 6.034 13.586 1.00 . A A . 11 LYS N 1 1 22 14797 1 1 11 LYS NZ N 2.636 11.584 16.875 1.00 . A A . 11 LYS NZ 1 1 22 14798 1 1 11 LYS O O 1.092 7.849 11.464 1.00 . A A . 11 LYS O 1 1 22 14799 1 1 12 CYS C C -2.025 9.503 9.274 1.00 . A A . 12 CYS C 1 1 22 14800 1 1 12 CYS CA C -0.992 8.391 9.570 1.00 . A A . 12 CYS CA 1 1 22 14801 1 1 12 CYS CB C -1.222 7.211 8.578 1.00 . A A . 12 CYS CB 1 1 22 14802 1 1 12 CYS H H -2.004 7.864 11.506 1.00 . A A . 12 CYS H 1 1 22 14803 1 1 12 CYS HA H 0.016 8.813 9.408 1.00 . A A . 12 CYS HA 1 1 22 14804 1 1 12 CYS HB2 H -0.779 7.451 7.599 1.00 . A A . 12 CYS HB2 1 1 22 14805 1 1 12 CYS HB3 H -0.718 6.290 8.895 1.00 . A A . 12 CYS HB3 1 1 22 14806 1 1 12 CYS N N -1.127 7.901 10.969 1.00 . A A . 12 CYS N 1 1 22 14807 1 1 12 CYS O O -2.848 9.898 10.111 1.00 . A A . 12 CYS O 1 1 22 14808 1 1 12 CYS SG S -2.952 6.820 8.270 1.00 . A A . 12 CYS SG 1 1 22 14809 1 1 13 THR C C -3.187 10.546 5.961 1.00 . A A . 13 THR C 1 1 22 14810 1 1 13 THR CA C -3.035 10.872 7.479 1.00 . A A . 13 THR CA 1 1 22 14811 1 1 13 THR CB C -2.729 12.404 7.713 1.00 . A A . 13 THR CB 1 1 22 14812 1 1 13 THR CG2 C -3.638 12.993 8.805 1.00 . A A . 13 THR CG2 1 1 22 14813 1 1 13 THR H H -1.219 9.534 7.457 1.00 . A A . 13 THR H 1 1 22 14814 1 1 13 THR HA H -3.989 10.627 7.967 1.00 . A A . 13 THR HA 1 1 22 14815 1 1 13 THR HB H -2.939 12.942 6.770 1.00 . A A . 13 THR HB 1 1 22 14816 1 1 13 THR HG1 H -1.292 12.176 8.978 1.00 . A A . 13 THR HG1 1 1 22 14817 1 1 13 THR HG21 H -4.707 12.890 8.542 1.00 . A A . 13 THR HG21 1 1 22 14818 1 1 13 THR HG22 H -3.484 12.499 9.782 1.00 . A A . 13 THR HG22 1 1 22 14819 1 1 13 THR HG23 H -3.442 14.071 8.946 1.00 . A A . 13 THR HG23 1 1 22 14820 1 1 13 THR N N -1.968 9.984 8.022 1.00 . A A . 13 THR N 1 1 22 14821 1 1 13 THR O O -2.251 10.173 5.242 1.00 . A A . 13 THR O 1 1 22 14822 1 1 13 THR OG1 O -1.393 12.654 8.151 1.00 . A A . 13 THR OG1 1 1 22 14823 1 1 14 TRP C C -4.538 12.178 3.598 1.00 . A A . 14 TRP C 1 1 22 14824 1 1 14 TRP CA C -4.789 10.709 4.042 1.00 . A A . 14 TRP CA 1 1 22 14825 1 1 14 TRP CB C -6.244 10.230 3.814 1.00 . A A . 14 TRP CB 1 1 22 14826 1 1 14 TRP CD1 C -5.632 7.683 4.422 1.00 . A A . 14 TRP CD1 1 1 22 14827 1 1 14 TRP CD2 C -7.755 8.101 3.877 1.00 . A A . 14 TRP CD2 1 1 22 14828 1 1 14 TRP CE2 C -7.596 6.722 4.168 1.00 . A A . 14 TRP CE2 1 1 22 14829 1 1 14 TRP CE3 C -9.032 8.613 3.523 1.00 . A A . 14 TRP CE3 1 1 22 14830 1 1 14 TRP CG C -6.525 8.725 4.032 1.00 . A A . 14 TRP CG 1 1 22 14831 1 1 14 TRP CH2 C -9.954 6.372 3.763 1.00 . A A . 14 TRP CH2 1 1 22 14832 1 1 14 TRP CZ2 C -8.708 5.848 4.111 1.00 . A A . 14 TRP CZ2 1 1 22 14833 1 1 14 TRP CZ3 C -10.113 7.733 3.473 1.00 . A A . 14 TRP CZ3 1 1 22 14834 1 1 14 TRP H H -5.042 11.161 6.206 1.00 . A A . 14 TRP H 1 1 22 14835 1 1 14 TRP HA H -4.126 10.011 3.491 1.00 . A A . 14 TRP HA 1 1 22 14836 1 1 14 TRP HB2 H -6.942 10.824 4.435 1.00 . A A . 14 TRP HB2 1 1 22 14837 1 1 14 TRP HB3 H -6.528 10.467 2.771 1.00 . A A . 14 TRP HB3 1 1 22 14838 1 1 14 TRP HD1 H -4.571 7.784 4.641 1.00 . A A . 14 TRP HD1 1 1 22 14839 1 1 14 TRP HE1 H -5.887 5.542 4.781 1.00 . A A . 14 TRP HE1 1 1 22 14840 1 1 14 TRP HE3 H -9.171 9.662 3.303 1.00 . A A . 14 TRP HE3 1 1 22 14841 1 1 14 TRP HH2 H -10.812 5.715 3.719 1.00 . A A . 14 TRP HH2 1 1 22 14842 1 1 14 TRP HZ2 H -8.604 4.797 4.340 1.00 . A A . 14 TRP HZ2 1 1 22 14843 1 1 14 TRP HZ3 H -11.091 8.108 3.208 1.00 . A A . 14 TRP HZ3 1 1 22 14844 1 1 14 TRP N N -4.440 10.726 5.497 1.00 . A A . 14 TRP N 1 1 22 14845 1 1 14 TRP NE1 N -6.289 6.448 4.516 1.00 . A A . 14 TRP NE1 1 1 22 14846 1 1 14 TRP O O -5.301 13.108 3.878 1.00 . A A . 14 TRP O 1 1 22 14847 1 1 15 GLY C C -1.835 13.804 4.024 1.00 . A A . 15 GLY C 1 1 22 14848 1 1 15 GLY CA C -2.706 13.640 2.739 1.00 . A A . 15 GLY CA 1 1 22 14849 1 1 15 GLY H H -2.846 11.451 2.837 1.00 . A A . 15 GLY H 1 1 22 14850 1 1 15 GLY HA2 H -2.089 13.612 1.821 1.00 . A A . 15 GLY HA2 1 1 22 14851 1 1 15 GLY HA3 H -3.431 14.466 2.630 1.00 . A A . 15 GLY HA3 1 1 22 14852 1 1 15 GLY N N -3.358 12.329 2.979 1.00 . A A . 15 GLY N 1 1 22 14853 1 1 15 GLY O O -2.139 14.628 4.891 1.00 . A A . 15 GLY O 1 1 22 14854 1 1 16 GLY C C 1.268 11.963 5.163 1.00 . A A . 16 GLY C 1 1 22 14855 1 1 16 GLY CA C -0.042 12.735 5.376 1.00 . A A . 16 GLY CA 1 1 22 14856 1 1 16 GLY H H -0.704 12.325 3.325 1.00 . A A . 16 GLY H 1 1 22 14857 1 1 16 GLY HA2 H -0.023 13.558 6.104 1.00 . A A . 16 GLY HA2 1 1 22 14858 1 1 16 GLY HA3 H -0.692 12.031 5.920 1.00 . A A . 16 GLY HA3 1 1 22 14859 1 1 16 GLY N N -0.802 12.948 4.134 1.00 . A A . 16 GLY N 1 1 22 14860 1 1 16 GLY O O 1.846 11.926 4.071 1.00 . A A . 16 GLY O 1 1 22 14861 1 1 17 THR C C 2.052 8.917 5.929 1.00 . A A . 17 THR C 1 1 22 14862 1 1 17 THR CA C 2.779 10.282 6.191 1.00 . A A . 17 THR CA 1 1 22 14863 1 1 17 THR CB C 3.637 10.191 7.513 1.00 . A A . 17 THR CB 1 1 22 14864 1 1 17 THR CG2 C 5.038 9.587 7.254 1.00 . A A . 17 THR CG2 1 1 22 14865 1 1 17 THR H H 1.126 11.496 7.087 1.00 . A A . 17 THR H 1 1 22 14866 1 1 17 THR HA H 3.464 10.533 5.354 1.00 . A A . 17 THR HA 1 1 22 14867 1 1 17 THR HB H 3.117 9.542 8.254 1.00 . A A . 17 THR HB 1 1 22 14868 1 1 17 THR HG1 H 2.977 11.839 8.259 1.00 . A A . 17 THR HG1 1 1 22 14869 1 1 17 THR HG21 H 4.996 8.566 6.839 1.00 . A A . 17 THR HG21 1 1 22 14870 1 1 17 THR HG22 H 5.652 10.173 6.546 1.00 . A A . 17 THR HG22 1 1 22 14871 1 1 17 THR HG23 H 5.627 9.493 8.187 1.00 . A A . 17 THR HG23 1 1 22 14872 1 1 17 THR N N 1.691 11.302 6.252 1.00 . A A . 17 THR N 1 1 22 14873 1 1 17 THR O O 0.920 8.664 6.380 1.00 . A A . 17 THR O 1 1 22 14874 1 1 17 THR OG1 O 3.850 11.489 8.064 1.00 . A A . 17 THR OG1 1 1 22 14875 1 1 18 LYS C C 3.594 5.805 5.636 1.00 . A A . 18 LYS C 1 1 22 14876 1 1 18 LYS CA C 2.427 6.621 5.010 1.00 . A A . 18 LYS CA 1 1 22 14877 1 1 18 LYS CB C 2.228 6.240 3.509 1.00 . A A . 18 LYS CB 1 1 22 14878 1 1 18 LYS CD C -0.047 7.317 2.916 1.00 . A A . 18 LYS CD 1 1 22 14879 1 1 18 LYS CE C -0.794 8.314 2.015 1.00 . A A . 18 LYS CE 1 1 22 14880 1 1 18 LYS CG C 1.450 7.194 2.570 1.00 . A A . 18 LYS CG 1 1 22 14881 1 1 18 LYS H H 3.702 8.423 4.958 1.00 . A A . 18 LYS H 1 1 22 14882 1 1 18 LYS HA H 1.490 6.339 5.524 1.00 . A A . 18 LYS HA 1 1 22 14883 1 1 18 LYS HB2 H 3.208 5.976 3.082 1.00 . A A . 18 LYS HB2 1 1 22 14884 1 1 18 LYS HB3 H 1.705 5.264 3.480 1.00 . A A . 18 LYS HB3 1 1 22 14885 1 1 18 LYS HD2 H -0.513 6.316 2.838 1.00 . A A . 18 LYS HD2 1 1 22 14886 1 1 18 LYS HD3 H -0.161 7.625 3.974 1.00 . A A . 18 LYS HD3 1 1 22 14887 1 1 18 LYS HE2 H -0.384 9.333 2.144 1.00 . A A . 18 LYS HE2 1 1 22 14888 1 1 18 LYS HE3 H -0.659 8.053 0.949 1.00 . A A . 18 LYS HE3 1 1 22 14889 1 1 18 LYS HG2 H 1.929 8.191 2.566 1.00 . A A . 18 LYS HG2 1 1 22 14890 1 1 18 LYS HG3 H 1.549 6.822 1.533 1.00 . A A . 18 LYS HG3 1 1 22 14891 1 1 18 LYS HZ1 H -2.377 8.553 3.316 1.00 . A A . 18 LYS HZ1 1 1 22 14892 1 1 18 LYS HZ2 H -2.631 7.393 2.193 1.00 . A A . 18 LYS HZ2 1 1 22 14893 1 1 18 LYS N N 2.774 8.058 5.198 1.00 . A A . 18 LYS N 1 1 22 14894 1 1 18 LYS NZ N -2.234 8.330 2.325 1.00 . A A . 18 LYS NZ 1 1 22 14895 1 1 18 LYS O O 4.639 6.301 6.089 1.00 . A A . 18 LYS O 1 1 22 14896 1 1 19 CYS C C 5.630 3.441 5.402 1.00 . A A . 19 CYS C 1 1 22 14897 1 1 19 CYS CA C 4.364 3.569 6.294 1.00 . A A . 19 CYS CA 1 1 22 14898 1 1 19 CYS CB C 3.716 2.213 6.650 1.00 . A A . 19 CYS CB 1 1 22 14899 1 1 19 CYS H H 2.548 4.283 5.088 1.00 . A A . 19 CYS H 1 1 22 14900 1 1 19 CYS HA H 4.586 4.064 7.259 1.00 . A A . 19 CYS HA 1 1 22 14901 1 1 19 CYS HB2 H 2.881 1.962 5.980 1.00 . A A . 19 CYS HB2 1 1 22 14902 1 1 19 CYS HB3 H 4.446 1.378 6.613 1.00 . A A . 19 CYS HB3 1 1 22 14903 1 1 19 CYS N N 3.381 4.487 5.656 1.00 . A A . 19 CYS N 1 1 22 14904 1 1 19 CYS O O 5.671 3.518 4.170 1.00 . A A . 19 CYS O 1 1 22 14905 1 1 19 CYS SG S 3.086 2.431 8.307 1.00 . A A . 19 CYS SG 1 1 22 14906 1 1 20 CYS C C 8.631 2.728 4.704 1.00 . A A . 20 CYS C 1 1 22 14907 1 1 20 CYS CA C 8.098 3.549 5.919 1.00 . A A . 20 CYS CA 1 1 22 14908 1 1 20 CYS CB C 8.913 3.170 7.171 1.00 . A A . 20 CYS CB 1 1 22 14909 1 1 20 CYS H H 6.386 3.300 7.223 1.00 . A A . 20 CYS H 1 1 22 14910 1 1 20 CYS HA H 8.127 4.632 5.820 1.00 . A A . 20 CYS HA 1 1 22 14911 1 1 20 CYS HB2 H 8.397 3.493 8.077 1.00 . A A . 20 CYS HB2 1 1 22 14912 1 1 20 CYS HB3 H 9.089 2.082 7.275 1.00 . A A . 20 CYS HB3 1 1 22 14913 1 1 20 CYS N N 6.675 3.360 6.240 1.00 . A A . 20 CYS N 1 1 22 14914 1 1 20 CYS O O 9.273 3.314 3.829 1.00 . A A . 20 CYS O 1 1 22 14915 1 1 20 CYS SG S 10.469 4.079 7.105 1.00 . A A . 20 CYS SG 1 1 22 14916 1 1 21 ARG C C 7.797 0.328 2.403 1.00 . A A . 21 ARG C 1 1 22 14917 1 1 21 ARG CA C 8.837 0.499 3.565 1.00 . A A . 21 ARG CA 1 1 22 14918 1 1 21 ARG CB C 9.186 -0.850 4.269 1.00 . A A . 21 ARG CB 1 1 22 14919 1 1 21 ARG CD C 10.380 -3.120 4.194 1.00 . A A . 21 ARG CD 1 1 22 14920 1 1 21 ARG CG C 10.097 -1.798 3.456 1.00 . A A . 21 ARG CG 1 1 22 14921 1 1 21 ARG CZ C 11.700 -5.183 3.586 1.00 . A A . 21 ARG CZ 1 1 22 14922 1 1 21 ARG H H 7.704 1.154 5.390 1.00 . A A . 21 ARG H 1 1 22 14923 1 1 21 ARG HA H 9.715 0.952 3.083 1.00 . A A . 21 ARG HA 1 1 22 14924 1 1 21 ARG HB2 H 9.712 -0.661 5.226 1.00 . A A . 21 ARG HB2 1 1 22 14925 1 1 21 ARG HB3 H 8.254 -1.377 4.554 1.00 . A A . 21 ARG HB3 1 1 22 14926 1 1 21 ARG HD2 H 10.867 -2.919 5.167 1.00 . A A . 21 ARG HD2 1 1 22 14927 1 1 21 ARG HD3 H 9.431 -3.643 4.420 1.00 . A A . 21 ARG HD3 1 1 22 14928 1 1 21 ARG HG2 H 9.640 -2.024 2.476 1.00 . A A . 21 ARG HG2 1 1 22 14929 1 1 21 ARG HG3 H 11.050 -1.282 3.231 1.00 . A A . 21 ARG HG3 1 1 22 14930 1 1 21 ARG HH11 H 10.823 -5.406 5.382 1.00 . A A . 21 ARG HH11 1 1 22 14931 1 1 21 ARG HH12 H 11.833 -6.808 4.763 1.00 . A A . 21 ARG HH12 1 1 22 14932 1 1 21 ARG HH21 H 12.664 -5.191 1.831 1.00 . A A . 21 ARG HH21 1 1 22 14933 1 1 21 ARG HH22 H 12.811 -6.692 2.877 1.00 . A A . 21 ARG HH22 1 1 22 14934 1 1 21 ARG N N 8.380 1.404 4.670 1.00 . A A . 21 ARG N 1 1 22 14935 1 1 21 ARG NE N 11.258 -4.008 3.367 1.00 . A A . 21 ARG NE 1 1 22 14936 1 1 21 ARG NH1 N 11.423 -5.870 4.691 1.00 . A A . 21 ARG NH1 1 1 22 14937 1 1 21 ARG NH2 N 12.469 -5.746 2.672 1.00 . A A . 21 ARG NH2 1 1 22 14938 1 1 21 ARG O O 7.652 -0.730 1.782 1.00 . A A . 21 ARG O 1 1 22 14939 1 1 22 GLY C C 4.803 0.747 1.259 1.00 . A A . 22 GLY C 1 1 22 14940 1 1 22 GLY CA C 6.102 1.527 1.023 1.00 . A A . 22 GLY CA 1 1 22 14941 1 1 22 GLY H H 7.296 2.109 2.859 1.00 . A A . 22 GLY H 1 1 22 14942 1 1 22 GLY HA2 H 5.868 2.596 0.854 1.00 . A A . 22 GLY HA2 1 1 22 14943 1 1 22 GLY HA3 H 6.545 1.188 0.083 1.00 . A A . 22 GLY HA3 1 1 22 14944 1 1 22 GLY N N 7.106 1.428 2.110 1.00 . A A . 22 GLY N 1 1 22 14945 1 1 22 GLY O O 4.449 -0.162 0.504 1.00 . A A . 22 GLY O 1 1 22 14946 1 1 23 ARG C C 1.803 1.427 3.052 1.00 . A A . 23 ARG C 1 1 22 14947 1 1 23 ARG CA C 2.982 0.411 2.904 1.00 . A A . 23 ARG CA 1 1 22 14948 1 1 23 ARG CB C 3.402 -0.214 4.263 1.00 . A A . 23 ARG CB 1 1 22 14949 1 1 23 ARG CD C 3.532 -2.816 3.856 1.00 . A A . 23 ARG CD 1 1 22 14950 1 1 23 ARG CG C 4.246 -1.505 4.257 1.00 . A A . 23 ARG CG 1 1 22 14951 1 1 23 ARG CZ C 4.147 -3.362 1.458 1.00 . A A . 23 ARG CZ 1 1 22 14952 1 1 23 ARG H H 4.715 1.793 2.890 1.00 . A A . 23 ARG H 1 1 22 14953 1 1 23 ARG HA H 2.665 -0.419 2.254 1.00 . A A . 23 ARG HA 1 1 22 14954 1 1 23 ARG HB2 H 4.036 0.517 4.775 1.00 . A A . 23 ARG HB2 1 1 22 14955 1 1 23 ARG HB3 H 2.537 -0.346 4.940 1.00 . A A . 23 ARG HB3 1 1 22 14956 1 1 23 ARG HD2 H 4.101 -3.679 4.249 1.00 . A A . 23 ARG HD2 1 1 22 14957 1 1 23 ARG HD3 H 2.545 -2.876 4.349 1.00 . A A . 23 ARG HD3 1 1 22 14958 1 1 23 ARG HG2 H 5.167 -1.349 3.666 1.00 . A A . 23 ARG HG2 1 1 22 14959 1 1 23 ARG HG3 H 4.611 -1.635 5.295 1.00 . A A . 23 ARG HG3 1 1 22 14960 1 1 23 ARG HH11 H 5.726 -3.659 2.666 1.00 . A A . 23 ARG HH11 1 1 22 14961 1 1 23 ARG HH12 H 5.962 -4.008 0.881 1.00 . A A . 23 ARG HH12 1 1 22 14962 1 1 23 ARG HH21 H 2.723 -3.137 0.069 1.00 . A A . 23 ARG HH21 1 1 22 14963 1 1 23 ARG HH22 H 4.364 -3.729 -0.498 1.00 . A A . 23 ARG HH22 1 1 22 14964 1 1 23 ARG N N 4.139 1.142 2.341 1.00 . A A . 23 ARG N 1 1 22 14965 1 1 23 ARG NE N 3.351 -2.974 2.375 1.00 . A A . 23 ARG NE 1 1 22 14966 1 1 23 ARG NH1 N 5.408 -3.713 1.692 1.00 . A A . 23 ARG NH1 1 1 22 14967 1 1 23 ARG NH2 N 3.699 -3.414 0.217 1.00 . A A . 23 ARG NH2 1 1 22 14968 1 1 23 ARG O O 1.930 2.362 3.849 1.00 . A A . 23 ARG O 1 1 22 14969 1 1 24 PRO C C -1.121 2.401 3.862 1.00 . A A . 24 PRO C 1 1 22 14970 1 1 24 PRO CA C -0.489 2.265 2.440 1.00 . A A . 24 PRO CA 1 1 22 14971 1 1 24 PRO CB C -1.499 1.706 1.418 1.00 . A A . 24 PRO CB 1 1 22 14972 1 1 24 PRO CD C 0.482 0.370 1.206 1.00 . A A . 24 PRO CD 1 1 22 14973 1 1 24 PRO CG C -0.645 0.987 0.380 1.00 . A A . 24 PRO CG 1 1 22 14974 1 1 24 PRO HA H -0.136 3.273 2.136 1.00 . A A . 24 PRO HA 1 1 22 14975 1 1 24 PRO HB2 H -2.190 0.982 1.891 1.00 . A A . 24 PRO HB2 1 1 22 14976 1 1 24 PRO HB3 H -2.127 2.498 0.969 1.00 . A A . 24 PRO HB3 1 1 22 14977 1 1 24 PRO HD2 H 0.231 -0.639 1.583 1.00 . A A . 24 PRO HD2 1 1 22 14978 1 1 24 PRO HD3 H 1.395 0.286 0.590 1.00 . A A . 24 PRO HD3 1 1 22 14979 1 1 24 PRO HG2 H -1.209 0.237 -0.200 1.00 . A A . 24 PRO HG2 1 1 22 14980 1 1 24 PRO HG3 H -0.235 1.714 -0.347 1.00 . A A . 24 PRO HG3 1 1 22 14981 1 1 24 PRO N N 0.648 1.310 2.331 1.00 . A A . 24 PRO N 1 1 22 14982 1 1 24 PRO O O -0.947 1.555 4.748 1.00 . A A . 24 PRO O 1 1 22 14983 1 1 25 CYS C C -4.079 3.789 5.055 1.00 . A A . 25 CYS C 1 1 22 14984 1 1 25 CYS CA C -2.542 3.868 5.302 1.00 . A A . 25 CYS CA 1 1 22 14985 1 1 25 CYS CB C -2.012 5.266 5.751 1.00 . A A . 25 CYS CB 1 1 22 14986 1 1 25 CYS H H -1.910 4.115 3.206 1.00 . A A . 25 CYS H 1 1 22 14987 1 1 25 CYS HA H -2.266 3.150 6.101 1.00 . A A . 25 CYS HA 1 1 22 14988 1 1 25 CYS HB2 H -1.263 5.105 6.532 1.00 . A A . 25 CYS HB2 1 1 22 14989 1 1 25 CYS HB3 H -1.526 5.783 4.916 1.00 . A A . 25 CYS HB3 1 1 22 14990 1 1 25 CYS N N -1.854 3.511 4.033 1.00 . A A . 25 CYS N 1 1 22 14991 1 1 25 CYS O O -4.606 3.958 3.948 1.00 . A A . 25 CYS O 1 1 22 14992 1 1 25 CYS SG S -3.261 6.428 6.329 1.00 . A A . 25 CYS SG 1 1 22 14993 1 1 26 ARG C C -6.689 3.750 7.551 1.00 . A A . 26 ARG C 1 1 22 14994 1 1 26 ARG CA C -6.228 3.175 6.192 1.00 . A A . 26 ARG CA 1 1 22 14995 1 1 26 ARG CB C -6.480 1.650 6.060 1.00 . A A . 26 ARG CB 1 1 22 14996 1 1 26 ARG CD C -8.063 -0.339 5.902 1.00 . A A . 26 ARG CD 1 1 22 14997 1 1 26 ARG CG C -7.951 1.190 6.055 1.00 . A A . 26 ARG CG 1 1 22 14998 1 1 26 ARG CZ C -9.863 -2.051 6.241 1.00 . A A . 26 ARG CZ 1 1 22 14999 1 1 26 ARG H H -4.238 3.475 7.029 1.00 . A A . 26 ARG H 1 1 22 15000 1 1 26 ARG HA H -6.740 3.690 5.356 1.00 . A A . 26 ARG HA 1 1 22 15001 1 1 26 ARG HB2 H -6.020 1.309 5.113 1.00 . A A . 26 ARG HB2 1 1 22 15002 1 1 26 ARG HB3 H -5.935 1.113 6.861 1.00 . A A . 26 ARG HB3 1 1 22 15003 1 1 26 ARG HD2 H -7.652 -0.658 4.925 1.00 . A A . 26 ARG HD2 1 1 22 15004 1 1 26 ARG HD3 H -7.445 -0.834 6.677 1.00 . A A . 26 ARG HD3 1 1 22 15005 1 1 26 ARG HG2 H -8.438 1.511 6.996 1.00 . A A . 26 ARG HG2 1 1 22 15006 1 1 26 ARG HG3 H -8.500 1.697 5.238 1.00 . A A . 26 ARG HG3 1 1 22 15007 1 1 26 ARG HH11 H -8.023 -2.861 6.317 1.00 . A A . 26 ARG HH11 1 1 22 15008 1 1 26 ARG HH12 H -9.446 -3.994 6.558 1.00 . A A . 26 ARG HH12 1 1 22 15009 1 1 26 ARG HH21 H -11.785 -1.493 6.215 1.00 . A A . 26 ARG HH21 1 1 22 15010 1 1 26 ARG HH22 H -11.429 -3.270 6.504 1.00 . A A . 26 ARG HH22 1 1 22 15011 1 1 26 ARG N N -4.775 3.463 6.151 1.00 . A A . 26 ARG N 1 1 22 15012 1 1 26 ARG NE N -9.474 -0.782 6.012 1.00 . A A . 26 ARG NE 1 1 22 15013 1 1 26 ARG NH1 N -9.024 -3.074 6.388 1.00 . A A . 26 ARG NH1 1 1 22 15014 1 1 26 ARG NH2 N -11.157 -2.297 6.328 1.00 . A A . 26 ARG NH2 1 1 22 15015 1 1 26 ARG O O -6.119 3.420 8.603 1.00 . A A . 26 ARG O 1 1 22 15016 1 1 27 CYS C C -8.745 4.552 9.862 1.00 . A A . 27 CYS C 1 1 22 15017 1 1 27 CYS CA C -8.027 5.411 8.764 1.00 . A A . 27 CYS CA 1 1 22 15018 1 1 27 CYS CB C -8.945 6.597 8.388 1.00 . A A . 27 CYS CB 1 1 22 15019 1 1 27 CYS H H -8.100 4.854 6.623 1.00 . A A . 27 CYS H 1 1 22 15020 1 1 27 CYS HA H -7.054 5.799 9.095 1.00 . A A . 27 CYS HA 1 1 22 15021 1 1 27 CYS HB2 H -9.904 6.252 8.024 1.00 . A A . 27 CYS HB2 1 1 22 15022 1 1 27 CYS HB3 H -9.193 7.198 9.282 1.00 . A A . 27 CYS HB3 1 1 22 15023 1 1 27 CYS N N -7.706 4.634 7.544 1.00 . A A . 27 CYS N 1 1 22 15024 1 1 27 CYS O O -9.157 3.405 9.650 1.00 . A A . 27 CYS O 1 1 22 15025 1 1 27 CYS SG S -8.179 7.722 7.221 1.00 . A A . 27 CYS SG 1 1 22 15026 1 1 28 SER C C -11.157 4.377 11.922 1.00 . A A . 28 SER C 1 1 22 15027 1 1 28 SER CA C -9.630 4.595 12.215 1.00 . A A . 28 SER CA 1 1 22 15028 1 1 28 SER CB C -9.372 5.579 13.400 1.00 . A A . 28 SER CB 1 1 22 15029 1 1 28 SER H H -8.443 6.092 11.087 1.00 . A A . 28 SER H 1 1 22 15030 1 1 28 SER HA H -9.233 3.603 12.489 1.00 . A A . 28 SER HA 1 1 22 15031 1 1 28 SER HB2 H -8.360 6.016 13.391 1.00 . A A . 28 SER HB2 1 1 22 15032 1 1 28 SER HB3 H -10.065 6.440 13.392 1.00 . A A . 28 SER HB3 1 1 22 15033 1 1 28 SER HG H -10.407 4.543 14.647 1.00 . A A . 28 SER HG 1 1 22 15034 1 1 28 SER N N -8.894 5.171 11.054 1.00 . A A . 28 SER N 1 1 22 15035 1 1 28 SER O O -11.657 4.451 10.793 1.00 . A A . 28 SER O 1 1 22 15036 1 1 28 SER OG O -9.516 4.901 14.642 1.00 . A A . 28 SER OG 1 1 22 15037 1 1 29 MET C C -14.302 4.750 12.628 1.00 . A A . 29 MET C 1 1 22 15038 1 1 29 MET CA C -13.298 3.604 12.969 1.00 . A A . 29 MET CA 1 1 22 15039 1 1 29 MET CB C -13.642 3.019 14.368 1.00 . A A . 29 MET CB 1 1 22 15040 1 1 29 MET CE C -11.903 0.119 12.638 1.00 . A A . 29 MET CE 1 1 22 15041 1 1 29 MET CG C -12.984 1.670 14.717 1.00 . A A . 29 MET CG 1 1 22 15042 1 1 29 MET H H -11.311 4.185 13.847 1.00 . A A . 29 MET H 1 1 22 15043 1 1 29 MET HA H -13.423 2.820 12.198 1.00 . A A . 29 MET HA 1 1 22 15044 1 1 29 MET HB2 H -13.403 3.752 15.164 1.00 . A A . 29 MET HB2 1 1 22 15045 1 1 29 MET HB3 H -14.736 2.888 14.442 1.00 . A A . 29 MET HB3 1 1 22 15046 1 1 29 MET HE1 H -11.547 1.048 12.158 1.00 . A A . 29 MET HE1 1 1 22 15047 1 1 29 MET HE2 H -11.117 -0.237 13.328 1.00 . A A . 29 MET HE2 1 1 22 15048 1 1 29 MET HE3 H -12.038 -0.643 11.850 1.00 . A A . 29 MET HE3 1 1 22 15049 1 1 29 MET HG2 H -11.884 1.767 14.776 1.00 . A A . 29 MET HG2 1 1 22 15050 1 1 29 MET HG3 H -13.313 1.344 15.720 1.00 . A A . 29 MET HG3 1 1 22 15051 1 1 29 MET N N -11.874 4.053 13.000 1.00 . A A . 29 MET N 1 1 22 15052 1 1 29 MET O O -15.254 4.514 11.879 1.00 . A A . 29 MET O 1 1 22 15053 1 1 29 MET SD S -13.455 0.398 13.518 1.00 . A A . 29 MET SD 1 1 22 15054 1 1 30 ILE C C -14.588 7.750 11.410 1.00 . A A . 30 ILE C 1 1 22 15055 1 1 30 ILE CA C -14.909 7.168 12.843 1.00 . A A . 30 ILE CA 1 1 22 15056 1 1 30 ILE CB C -14.676 8.193 14.034 1.00 . A A . 30 ILE CB 1 1 22 15057 1 1 30 ILE CD1 C -17.114 9.153 14.068 1.00 . A A . 30 ILE CD1 1 1 22 15058 1 1 30 ILE CG1 C -15.612 9.436 13.906 1.00 . A A . 30 ILE CG1 1 1 22 15059 1 1 30 ILE CG2 C -13.218 8.740 14.094 1.00 . A A . 30 ILE CG2 1 1 22 15060 1 1 30 ILE H H -13.188 5.994 13.672 1.00 . A A . 30 ILE H 1 1 22 15061 1 1 30 ILE HA H -15.970 6.870 12.805 1.00 . A A . 30 ILE HA 1 1 22 15062 1 1 30 ILE HB H -14.893 7.692 14.998 1.00 . A A . 30 ILE HB 1 1 22 15063 1 1 30 ILE HD11 H -17.335 8.651 15.028 1.00 . A A . 30 ILE HD11 1 1 22 15064 1 1 30 ILE HD12 H -17.697 10.092 14.049 1.00 . A A . 30 ILE HD12 1 1 22 15065 1 1 30 ILE HD13 H -17.507 8.515 13.256 1.00 . A A . 30 ILE HD13 1 1 22 15066 1 1 30 ILE HG12 H -15.344 10.177 14.685 1.00 . A A . 30 ILE HG12 1 1 22 15067 1 1 30 ILE HG13 H -15.443 9.963 12.948 1.00 . A A . 30 ILE HG13 1 1 22 15068 1 1 30 ILE HG21 H -12.468 7.929 14.156 1.00 . A A . 30 ILE HG21 1 1 22 15069 1 1 30 ILE HG22 H -12.956 9.358 13.217 1.00 . A A . 30 ILE HG22 1 1 22 15070 1 1 30 ILE HG23 H -13.059 9.373 14.987 1.00 . A A . 30 ILE HG23 1 1 22 15071 1 1 30 ILE N N -14.082 5.963 13.164 1.00 . A A . 30 ILE N 1 1 22 15072 1 1 30 ILE O O -15.527 8.199 10.746 1.00 . A A . 30 ILE O 1 1 22 15073 1 1 31 GLY C C -11.689 9.339 9.829 1.00 . A A . 31 GLY C 1 1 22 15074 1 1 31 GLY CA C -12.913 8.411 9.681 1.00 . A A . 31 GLY CA 1 1 22 15075 1 1 31 GLY H H -12.651 7.468 11.668 1.00 . A A . 31 GLY H 1 1 22 15076 1 1 31 GLY HA2 H -12.668 7.623 8.945 1.00 . A A . 31 GLY HA2 1 1 22 15077 1 1 31 GLY HA3 H -13.739 8.989 9.223 1.00 . A A . 31 GLY HA3 1 1 22 15078 1 1 31 GLY N N -13.324 7.742 10.945 1.00 . A A . 31 GLY N 1 1 22 15079 1 1 31 GLY O O -10.758 9.271 9.024 1.00 . A A . 31 GLY O 1 1 22 15080 1 1 32 THR C C -9.552 10.128 12.148 1.00 . A A . 32 THR C 1 1 22 15081 1 1 32 THR CA C -10.523 11.009 11.280 1.00 . A A . 32 THR CA 1 1 22 15082 1 1 32 THR CB C -11.016 12.268 12.086 1.00 . A A . 32 THR CB 1 1 22 15083 1 1 32 THR CG2 C -11.848 13.237 11.222 1.00 . A A . 32 THR CG2 1 1 22 15084 1 1 32 THR H H -12.485 10.016 11.504 1.00 . A A . 32 THR H 1 1 22 15085 1 1 32 THR HA H -9.966 11.354 10.386 1.00 . A A . 32 THR HA 1 1 22 15086 1 1 32 THR HB H -10.125 12.806 12.459 1.00 . A A . 32 THR HB 1 1 22 15087 1 1 32 THR HG1 H -12.077 12.679 13.643 1.00 . A A . 32 THR HG1 1 1 22 15088 1 1 32 THR HG21 H -11.281 13.581 10.337 1.00 . A A . 32 THR HG21 1 1 22 15089 1 1 32 THR HG22 H -12.787 12.780 10.859 1.00 . A A . 32 THR HG22 1 1 22 15090 1 1 32 THR HG23 H -12.129 14.139 11.796 1.00 . A A . 32 THR HG23 1 1 22 15091 1 1 32 THR N N -11.705 10.199 10.862 1.00 . A A . 32 THR N 1 1 22 15092 1 1 32 THR O O -9.834 8.969 12.471 1.00 . A A . 32 THR O 1 1 22 15093 1 1 32 THR OG1 O -11.835 11.870 13.186 1.00 . A A . 32 THR OG1 1 1 22 15094 1 1 33 ASN C C -6.750 8.789 12.553 1.00 . A A . 33 ASN C 1 1 22 15095 1 1 33 ASN CA C -7.253 10.082 13.269 1.00 . A A . 33 ASN CA 1 1 22 15096 1 1 33 ASN CB C -7.696 9.835 14.761 1.00 . A A . 33 ASN CB 1 1 22 15097 1 1 33 ASN CG C -8.676 8.739 15.252 1.00 . A A . 33 ASN CG 1 1 22 15098 1 1 33 ASN H H -8.213 11.599 12.027 1.00 . A A . 33 ASN H 1 1 22 15099 1 1 33 ASN HA H -6.398 10.784 13.259 1.00 . A A . 33 ASN HA 1 1 22 15100 1 1 33 ASN HB2 H -6.761 9.727 15.341 1.00 . A A . 33 ASN HB2 1 1 22 15101 1 1 33 ASN HB3 H -8.123 10.772 15.140 1.00 . A A . 33 ASN HB3 1 1 22 15102 1 1 33 ASN HD21 H -7.148 7.612 15.901 1.00 . A A . 33 ASN HD21 1 1 22 15103 1 1 33 ASN HD22 H -8.844 6.977 16.196 1.00 . A A . 33 ASN HD22 1 1 22 15104 1 1 33 ASN N N -8.384 10.710 12.504 1.00 . A A . 33 ASN N 1 1 22 15105 1 1 33 ASN ND2 N -8.171 7.666 15.842 1.00 . A A . 33 ASN ND2 1 1 22 15106 1 1 33 ASN O O -6.723 7.697 13.123 1.00 . A A . 33 ASN O 1 1 22 15107 1 1 33 ASN OD1 O -9.896 8.886 15.191 1.00 . A A . 33 ASN OD1 1 1 22 15108 1 1 34 CYS C C -4.801 6.961 10.904 1.00 . A A . 34 CYS C 1 1 22 15109 1 1 34 CYS CA C -6.042 7.773 10.398 1.00 . A A . 34 CYS CA 1 1 22 15110 1 1 34 CYS CB C -5.779 8.250 8.959 1.00 . A A . 34 CYS CB 1 1 22 15111 1 1 34 CYS H H -6.559 9.883 10.918 1.00 . A A . 34 CYS H 1 1 22 15112 1 1 34 CYS HA H -6.951 7.166 10.384 1.00 . A A . 34 CYS HA 1 1 22 15113 1 1 34 CYS HB2 H -4.889 8.863 8.933 1.00 . A A . 34 CYS HB2 1 1 22 15114 1 1 34 CYS HB3 H -5.565 7.387 8.302 1.00 . A A . 34 CYS HB3 1 1 22 15115 1 1 34 CYS N N -6.338 8.941 11.275 1.00 . A A . 34 CYS N 1 1 22 15116 1 1 34 CYS O O -3.977 7.482 11.665 1.00 . A A . 34 CYS O 1 1 22 15117 1 1 34 CYS SG S -7.216 9.091 8.294 1.00 . A A . 34 CYS SG 1 1 22 15118 1 1 35 GLU C C -2.891 4.055 9.721 1.00 . A A . 35 GLU C 1 1 22 15119 1 1 35 GLU CA C -3.556 4.797 10.935 1.00 . A A . 35 GLU CA 1 1 22 15120 1 1 35 GLU CB C -4.061 3.727 11.954 1.00 . A A . 35 GLU CB 1 1 22 15121 1 1 35 GLU CD C -5.326 3.048 14.068 1.00 . A A . 35 GLU CD 1 1 22 15122 1 1 35 GLU CG C -4.899 4.203 13.162 1.00 . A A . 35 GLU CG 1 1 22 15123 1 1 35 GLU H H -5.439 5.380 9.844 1.00 . A A . 35 GLU H 1 1 22 15124 1 1 35 GLU HA H -2.775 5.425 11.417 1.00 . A A . 35 GLU HA 1 1 22 15125 1 1 35 GLU HB2 H -4.517 2.897 11.397 1.00 . A A . 35 GLU HB2 1 1 22 15126 1 1 35 GLU HB3 H -3.178 3.222 12.380 1.00 . A A . 35 GLU HB3 1 1 22 15127 1 1 35 GLU HE2 H -4.580 1.903 15.455 1.00 . A A . 35 GLU HE2 1 1 22 15128 1 1 35 GLU HG2 H -4.318 4.943 13.746 1.00 . A A . 35 GLU HG2 1 1 22 15129 1 1 35 GLU HG3 H -5.801 4.742 12.819 1.00 . A A . 35 GLU HG3 1 1 22 15130 1 1 35 GLU N N -4.696 5.674 10.499 1.00 . A A . 35 GLU N 1 1 22 15131 1 1 35 GLU O O -3.295 4.177 8.566 1.00 . A A . 35 GLU O 1 1 22 15132 1 1 35 GLU OE1 O -6.454 2.557 14.053 1.00 . A A . 35 GLU OE1 1 1 22 15133 1 1 35 GLU OE2 O -4.309 2.628 14.888 1.00 . A A . 35 GLU OE2 1 1 22 15134 1 1 36 CYS C C -1.812 1.041 8.868 1.00 . A A . 36 CYS C 1 1 22 15135 1 1 36 CYS CA C -1.116 2.433 8.998 1.00 . A A . 36 CYS CA 1 1 22 15136 1 1 36 CYS CB C 0.385 2.280 9.419 1.00 . A A . 36 CYS CB 1 1 22 15137 1 1 36 CYS H H -1.785 3.162 11.039 1.00 . A A . 36 CYS H 1 1 22 15138 1 1 36 CYS HA H -1.139 2.950 8.008 1.00 . A A . 36 CYS HA 1 1 22 15139 1 1 36 CYS HB2 H 0.565 2.404 10.502 1.00 . A A . 36 CYS HB2 1 1 22 15140 1 1 36 CYS HB3 H 0.803 1.262 9.270 1.00 . A A . 36 CYS HB3 1 1 22 15141 1 1 36 CYS N N -1.843 3.264 10.016 1.00 . A A . 36 CYS N 1 1 22 15142 1 1 36 CYS O O -2.568 0.605 9.745 1.00 . A A . 36 CYS O 1 1 22 15143 1 1 36 CYS SG S 1.355 3.373 8.403 1.00 . A A . 36 CYS SG 1 1 22 15144 1 1 37 THR C C -1.025 -1.901 6.752 1.00 . A A . 37 THR C 1 1 22 15145 1 1 37 THR CA C -2.087 -1.052 7.559 1.00 . A A . 37 THR CA 1 1 22 15146 1 1 37 THR CB C -3.479 -1.021 6.849 1.00 . A A . 37 THR CB 1 1 22 15147 1 1 37 THR CG2 C -3.533 -0.295 5.488 1.00 . A A . 37 THR CG2 1 1 22 15148 1 1 37 THR H H -1.014 0.823 7.026 1.00 . A A . 37 THR H 1 1 22 15149 1 1 37 THR HA H -2.237 -1.521 8.547 1.00 . A A . 37 THR HA 1 1 22 15150 1 1 37 THR HB H -4.177 -0.578 7.576 1.00 . A A . 37 THR HB 1 1 22 15151 1 1 37 THR HG1 H -3.267 -2.724 5.983 1.00 . A A . 37 THR HG1 1 1 22 15152 1 1 37 THR HG21 H -2.777 -0.667 4.778 1.00 . A A . 37 THR HG21 1 1 22 15153 1 1 37 THR HG22 H -4.519 -0.426 5.006 1.00 . A A . 37 THR HG22 1 1 22 15154 1 1 37 THR HG23 H -3.374 0.792 5.601 1.00 . A A . 37 THR HG23 1 1 22 15155 1 1 37 THR N N -1.569 0.338 7.743 1.00 . A A . 37 THR N 1 1 22 15156 1 1 37 THR O O -0.487 -1.411 5.751 1.00 . A A . 37 THR O 1 1 22 15157 1 1 37 THR OG1 O -3.908 -2.352 6.594 1.00 . A A . 37 THR OG1 1 1 22 15158 1 1 38 PRO C C -0.241 -4.826 5.260 1.00 . A A . 38 PRO C 1 1 22 15159 1 1 38 PRO CA C 0.309 -4.027 6.483 1.00 . A A . 38 PRO CA 1 1 22 15160 1 1 38 PRO CB C 0.779 -4.928 7.644 1.00 . A A . 38 PRO CB 1 1 22 15161 1 1 38 PRO CD C -1.231 -3.795 8.384 1.00 . A A . 38 PRO CD 1 1 22 15162 1 1 38 PRO CG C -0.455 -5.104 8.539 1.00 . A A . 38 PRO CG 1 1 22 15163 1 1 38 PRO HA H 1.169 -3.425 6.130 1.00 . A A . 38 PRO HA 1 1 22 15164 1 1 38 PRO HB2 H 1.193 -5.898 7.313 1.00 . A A . 38 PRO HB2 1 1 22 15165 1 1 38 PRO HB3 H 1.590 -4.429 8.204 1.00 . A A . 38 PRO HB3 1 1 22 15166 1 1 38 PRO HD2 H -2.323 -3.948 8.337 1.00 . A A . 38 PRO HD2 1 1 22 15167 1 1 38 PRO HD3 H -1.060 -3.121 9.241 1.00 . A A . 38 PRO HD3 1 1 22 15168 1 1 38 PRO HG2 H -1.069 -5.952 8.181 1.00 . A A . 38 PRO HG2 1 1 22 15169 1 1 38 PRO HG3 H -0.188 -5.317 9.590 1.00 . A A . 38 PRO HG3 1 1 22 15170 1 1 38 PRO N N -0.724 -3.182 7.139 1.00 . A A . 38 PRO N 1 1 22 15171 1 1 38 PRO O O -0.705 -5.964 5.408 1.00 . A A . 38 PRO O 1 1 22 15172 1 1 39 ARG C C 0.065 -5.747 2.106 1.00 . A A . 39 ARG C 1 1 22 15173 1 1 39 ARG CA C -0.898 -4.795 2.872 1.00 . A A . 39 ARG CA 1 1 22 15174 1 1 39 ARG CB C -1.364 -3.656 1.925 1.00 . A A . 39 ARG CB 1 1 22 15175 1 1 39 ARG CD C -3.188 -1.901 1.472 1.00 . A A . 39 ARG CD 1 1 22 15176 1 1 39 ARG CG C -2.410 -2.695 2.533 1.00 . A A . 39 ARG CG 1 1 22 15177 1 1 39 ARG CZ C -5.036 -0.210 1.446 1.00 . A A . 39 ARG CZ 1 1 22 15178 1 1 39 ARG H H 0.201 -3.282 4.054 1.00 . A A . 39 ARG H 1 1 22 15179 1 1 39 ARG HA H -1.804 -5.353 3.189 1.00 . A A . 39 ARG HA 1 1 22 15180 1 1 39 ARG HB2 H -0.502 -3.072 1.548 1.00 . A A . 39 ARG HB2 1 1 22 15181 1 1 39 ARG HB3 H -1.806 -4.128 1.027 1.00 . A A . 39 ARG HB3 1 1 22 15182 1 1 39 ARG HD2 H -2.488 -1.297 0.870 1.00 . A A . 39 ARG HD2 1 1 22 15183 1 1 39 ARG HD3 H -3.685 -2.596 0.768 1.00 . A A . 39 ARG HD3 1 1 22 15184 1 1 39 ARG HG2 H -3.121 -3.260 3.166 1.00 . A A . 39 ARG HG2 1 1 22 15185 1 1 39 ARG HG3 H -1.890 -2.001 3.219 1.00 . A A . 39 ARG HG3 1 1 22 15186 1 1 39 ARG HH11 H -4.381 -0.655 -0.403 1.00 . A A . 39 ARG HH11 1 1 22 15187 1 1 39 ARG HH12 H -5.741 0.570 -0.270 1.00 . A A . 39 ARG HH12 1 1 22 15188 1 1 39 ARG HH21 H -5.853 0.392 3.172 1.00 . A A . 39 ARG HH21 1 1 22 15189 1 1 39 ARG HH22 H -6.519 1.123 1.626 1.00 . A A . 39 ARG HH22 1 1 22 15190 1 1 39 ARG N N -0.204 -4.225 4.058 1.00 . A A . 39 ARG N 1 1 22 15191 1 1 39 ARG NE N -4.198 -1.026 2.111 1.00 . A A . 39 ARG NE 1 1 22 15192 1 1 39 ARG NH1 N -5.056 -0.086 0.121 1.00 . A A . 39 ARG NH1 1 1 22 15193 1 1 39 ARG NH2 N -5.887 0.509 2.153 1.00 . A A . 39 ARG NH2 1 1 22 15194 1 1 39 ARG O O 1.146 -5.350 1.658 1.00 . A A . 39 ARG O 1 1 22 15195 1 1 40 LEU C C 0.221 -7.741 -0.395 1.00 . A A . 40 LEU C 1 1 22 15196 1 1 40 LEU CA C 0.344 -8.036 1.134 1.00 . A A . 40 LEU CA 1 1 22 15197 1 1 40 LEU CB C -0.243 -9.442 1.479 1.00 . A A . 40 LEU CB 1 1 22 15198 1 1 40 LEU CD1 C -0.832 -11.276 3.143 1.00 . A A . 40 LEU CD1 1 1 22 15199 1 1 40 LEU CD2 C 1.449 -10.199 3.285 1.00 . A A . 40 LEU CD2 1 1 22 15200 1 1 40 LEU CG C -0.035 -9.974 2.927 1.00 . A A . 40 LEU CG 1 1 22 15201 1 1 40 LEU H H -1.297 -7.196 2.355 1.00 . A A . 40 LEU H 1 1 22 15202 1 1 40 LEU HA H 1.416 -8.019 1.385 1.00 . A A . 40 LEU HA 1 1 22 15203 1 1 40 LEU HB2 H -1.328 -9.443 1.250 1.00 . A A . 40 LEU HB2 1 1 22 15204 1 1 40 LEU HB3 H 0.184 -10.185 0.777 1.00 . A A . 40 LEU HB3 1 1 22 15205 1 1 40 LEU HD11 H -1.912 -11.127 2.955 1.00 . A A . 40 LEU HD11 1 1 22 15206 1 1 40 LEU HD12 H -0.492 -12.089 2.474 1.00 . A A . 40 LEU HD12 1 1 22 15207 1 1 40 LEU HD13 H -0.740 -11.644 4.182 1.00 . A A . 40 LEU HD13 1 1 22 15208 1 1 40 LEU HD21 H 1.938 -10.917 2.601 1.00 . A A . 40 LEU HD21 1 1 22 15209 1 1 40 LEU HD22 H 2.027 -9.258 3.243 1.00 . A A . 40 LEU HD22 1 1 22 15210 1 1 40 LEU HD23 H 1.567 -10.591 4.313 1.00 . A A . 40 LEU HD23 1 1 22 15211 1 1 40 LEU HG H -0.442 -9.228 3.636 1.00 . A A . 40 LEU HG 1 1 22 15212 1 1 40 LEU N N -0.378 -7.007 1.939 1.00 . A A . 40 LEU N 1 1 22 15213 1 1 40 LEU O O 1.250 -7.559 -1.052 1.00 . A A . 40 LEU O 1 1 22 15214 1 1 41 ILE C C -1.504 -5.499 -1.954 1.00 . A A . 41 ILE C 1 1 22 15215 1 1 41 ILE CA C -1.267 -7.012 -2.263 1.00 . A A . 41 ILE CA 1 1 22 15216 1 1 41 ILE CB C -2.502 -7.669 -2.991 1.00 . A A . 41 ILE CB 1 1 22 15217 1 1 41 ILE CD1 C -1.106 -9.762 -3.893 1.00 . A A . 41 ILE CD1 1 1 22 15218 1 1 41 ILE CG1 C -2.354 -9.217 -3.171 1.00 . A A . 41 ILE CG1 1 1 22 15219 1 1 41 ILE CG2 C -2.682 -7.028 -4.394 1.00 . A A . 41 ILE CG2 1 1 22 15220 1 1 41 ILE H H -1.754 -7.777 -0.241 1.00 . A A . 41 ILE H 1 1 22 15221 1 1 41 ILE HA H -0.378 -7.141 -2.916 1.00 . A A . 41 ILE HA 1 1 22 15222 1 1 41 ILE HB H -3.425 -7.493 -2.409 1.00 . A A . 41 ILE HB 1 1 22 15223 1 1 41 ILE HD11 H -1.030 -9.388 -4.930 1.00 . A A . 41 ILE HD11 1 1 22 15224 1 1 41 ILE HD12 H -0.172 -9.488 -3.369 1.00 . A A . 41 ILE HD12 1 1 22 15225 1 1 41 ILE HD13 H -1.132 -10.865 -3.948 1.00 . A A . 41 ILE HD13 1 1 22 15226 1 1 41 ILE HG12 H -2.402 -9.694 -2.174 1.00 . A A . 41 ILE HG12 1 1 22 15227 1 1 41 ILE HG13 H -3.250 -9.605 -3.690 1.00 . A A . 41 ILE HG13 1 1 22 15228 1 1 41 ILE HG21 H -1.773 -7.106 -5.019 1.00 . A A . 41 ILE HG21 1 1 22 15229 1 1 41 ILE HG22 H -3.509 -7.497 -4.958 1.00 . A A . 41 ILE HG22 1 1 22 15230 1 1 41 ILE HG23 H -2.931 -5.953 -4.323 1.00 . A A . 41 ILE HG23 1 1 22 15231 1 1 41 ILE N N -1.012 -7.635 -0.933 1.00 . A A . 41 ILE N 1 1 22 15232 1 1 41 ILE O O -2.506 -5.117 -1.336 1.00 . A A . 41 ILE O 1 1 22 15233 1 1 42 MET C C -1.691 -2.374 -2.573 1.00 . A A . 42 MET C 1 1 22 15234 1 1 42 MET CA C -0.485 -3.214 -2.027 1.00 . A A . 42 MET CA 1 1 22 15235 1 1 42 MET CB C 0.872 -2.699 -2.589 1.00 . A A . 42 MET CB 1 1 22 15236 1 1 42 MET CE C 2.999 0.868 -2.359 1.00 . A A . 42 MET CE 1 1 22 15237 1 1 42 MET CG C 1.290 -1.309 -2.089 1.00 . A A . 42 MET CG 1 1 22 15238 1 1 42 MET H H 0.228 -5.121 -2.883 1.00 . A A . 42 MET H 1 1 22 15239 1 1 42 MET HA H -0.506 -3.114 -0.930 1.00 . A A . 42 MET HA 1 1 22 15240 1 1 42 MET HB2 H 1.689 -3.392 -2.306 1.00 . A A . 42 MET HB2 1 1 22 15241 1 1 42 MET HB3 H 0.864 -2.700 -3.697 1.00 . A A . 42 MET HB3 1 1 22 15242 1 1 42 MET HE1 H 2.783 1.055 -1.291 1.00 . A A . 42 MET HE1 1 1 22 15243 1 1 42 MET HE2 H 4.007 1.266 -2.577 1.00 . A A . 42 MET HE2 1 1 22 15244 1 1 42 MET HE3 H 2.268 1.435 -2.963 1.00 . A A . 42 MET HE3 1 1 22 15245 1 1 42 MET HG2 H 0.556 -0.539 -2.392 1.00 . A A . 42 MET HG2 1 1 22 15246 1 1 42 MET HG3 H 1.336 -1.302 -0.987 1.00 . A A . 42 MET HG3 1 1 22 15247 1 1 42 MET N N -0.542 -4.663 -2.384 1.00 . A A . 42 MET N 1 1 22 15248 1 1 42 MET O O -2.212 -1.532 -1.836 1.00 . A A . 42 MET O 1 1 22 15249 1 1 42 MET SD S 2.919 -0.893 -2.743 1.00 . A A . 42 MET SD 1 1 22 15250 1 1 43 GLU C C -4.646 -2.462 -3.786 1.00 . A A . 43 GLU C 1 1 22 15251 1 1 43 GLU CA C -3.318 -1.922 -4.413 1.00 . A A . 43 GLU CA 1 1 22 15252 1 1 43 GLU CB C -3.303 -2.143 -5.956 1.00 . A A . 43 GLU CB 1 1 22 15253 1 1 43 GLU CD C -3.291 -3.643 -8.038 1.00 . A A . 43 GLU CD 1 1 22 15254 1 1 43 GLU CG C -3.367 -3.590 -6.511 1.00 . A A . 43 GLU CG 1 1 22 15255 1 1 43 GLU H H -1.630 -3.358 -4.300 1.00 . A A . 43 GLU H 1 1 22 15256 1 1 43 GLU HA H -3.244 -0.832 -4.215 1.00 . A A . 43 GLU HA 1 1 22 15257 1 1 43 GLU HB2 H -4.140 -1.564 -6.392 1.00 . A A . 43 GLU HB2 1 1 22 15258 1 1 43 GLU HB3 H -2.398 -1.650 -6.361 1.00 . A A . 43 GLU HB3 1 1 22 15259 1 1 43 GLU HE2 H -1.953 -3.701 -9.451 1.00 . A A . 43 GLU HE2 1 1 22 15260 1 1 43 GLU HG2 H -2.550 -4.202 -6.085 1.00 . A A . 43 GLU HG2 1 1 22 15261 1 1 43 GLU HG3 H -4.302 -4.082 -6.187 1.00 . A A . 43 GLU HG3 1 1 22 15262 1 1 43 GLU N N -2.139 -2.608 -3.822 1.00 . A A . 43 GLU N 1 1 22 15263 1 1 43 GLU O O -4.847 -3.673 -3.635 1.00 . A A . 43 GLU O 1 1 22 15264 1 1 43 GLU OE1 O -4.284 -3.660 -8.765 1.00 . A A . 43 GLU OE1 1 1 22 15265 1 1 43 GLU OE2 O -1.997 -3.669 -8.493 1.00 . A A . 43 GLU OE2 1 1 22 15266 1 1 44 GLY C C -7.656 -0.609 -2.430 1.00 . A A . 44 GLY C 1 1 22 15267 1 1 44 GLY CA C -6.856 -1.861 -2.850 1.00 . A A . 44 GLY CA 1 1 22 15268 1 1 44 GLY H H -5.246 -0.557 -3.597 1.00 . A A . 44 GLY H 1 1 22 15269 1 1 44 GLY HA2 H -7.448 -2.429 -3.593 1.00 . A A . 44 GLY HA2 1 1 22 15270 1 1 44 GLY HA3 H -6.714 -2.544 -1.987 1.00 . A A . 44 GLY HA3 1 1 22 15271 1 1 44 GLY N N -5.536 -1.526 -3.423 1.00 . A A . 44 GLY N 1 1 22 15272 1 1 44 GLY O O -7.504 0.485 -2.985 1.00 . A A . 44 GLY O 1 1 22 15273 1 1 45 LEU C C -9.616 -0.065 0.639 1.00 . A A . 45 LEU C 1 1 22 15274 1 1 45 LEU CA C -9.383 0.276 -0.863 1.00 . A A . 45 LEU CA 1 1 22 15275 1 1 45 LEU CB C -10.700 0.409 -1.700 1.00 . A A . 45 LEU CB 1 1 22 15276 1 1 45 LEU CD1 C -11.119 2.950 -1.449 1.00 . A A . 45 LEU CD1 1 1 22 15277 1 1 45 LEU CD2 C -13.016 1.401 -2.067 1.00 . A A . 45 LEU CD2 1 1 22 15278 1 1 45 LEU CG C -11.696 1.528 -1.281 1.00 . A A . 45 LEU CG 1 1 22 15279 1 1 45 LEU H H -8.571 -1.768 -1.077 1.00 . A A . 45 LEU H 1 1 22 15280 1 1 45 LEU HA H -8.834 1.232 -0.899 1.00 . A A . 45 LEU HA 1 1 22 15281 1 1 45 LEU HB2 H -10.436 0.565 -2.765 1.00 . A A . 45 LEU HB2 1 1 22 15282 1 1 45 LEU HB3 H -11.231 -0.564 -1.690 1.00 . A A . 45 LEU HB3 1 1 22 15283 1 1 45 LEU HD11 H -10.826 3.159 -2.495 1.00 . A A . 45 LEU HD11 1 1 22 15284 1 1 45 LEU HD12 H -11.850 3.725 -1.152 1.00 . A A . 45 LEU HD12 1 1 22 15285 1 1 45 LEU HD13 H -10.225 3.107 -0.820 1.00 . A A . 45 LEU HD13 1 1 22 15286 1 1 45 LEU HD21 H -13.486 0.410 -1.915 1.00 . A A . 45 LEU HD21 1 1 22 15287 1 1 45 LEU HD22 H -13.759 2.154 -1.745 1.00 . A A . 45 LEU HD22 1 1 22 15288 1 1 45 LEU HD23 H -12.868 1.529 -3.156 1.00 . A A . 45 LEU HD23 1 1 22 15289 1 1 45 LEU HG H -11.945 1.391 -0.212 1.00 . A A . 45 LEU HG 1 1 22 15290 1 1 45 LEU N N -8.545 -0.810 -1.445 1.00 . A A . 45 LEU N 1 1 22 15291 1 1 45 LEU O O -9.033 0.598 1.502 1.00 . A A . 45 LEU O 1 1 22 15292 1 1 46 SER C C -9.736 -3.007 2.322 1.00 . A A . 46 SER C 1 1 22 15293 1 1 46 SER CA C -10.540 -1.677 2.304 1.00 . A A . 46 SER CA 1 1 22 15294 1 1 46 SER CB C -12.034 -1.900 2.639 1.00 . A A . 46 SER CB 1 1 22 15295 1 1 46 SER H H -10.828 -1.546 0.113 1.00 . A A . 46 SER H 1 1 22 15296 1 1 46 SER HA H -10.133 -0.991 3.075 1.00 . A A . 46 SER HA 1 1 22 15297 1 1 46 SER HB2 H -12.535 -2.530 1.878 1.00 . A A . 46 SER HB2 1 1 22 15298 1 1 46 SER HB3 H -12.137 -2.446 3.595 1.00 . A A . 46 SER HB3 1 1 22 15299 1 1 46 SER HG H -12.276 -0.170 3.447 1.00 . A A . 46 SER HG 1 1 22 15300 1 1 46 SER N N -10.426 -1.099 0.942 1.00 . A A . 46 SER N 1 1 22 15301 1 1 46 SER O O -10.253 -4.072 1.966 1.00 . A A . 46 SER O 1 1 22 15302 1 1 46 SER OG O -12.723 -0.659 2.752 1.00 . A A . 46 SER OG 1 1 22 15303 1 1 47 PHE C C -6.609 -4.006 3.915 1.00 . A A . 47 PHE C 1 1 22 15304 1 1 47 PHE CA C -7.498 -4.059 2.639 1.00 . A A . 47 PHE CA 1 1 22 15305 1 1 47 PHE CB C -6.642 -3.961 1.336 1.00 . A A . 47 PHE CB 1 1 22 15306 1 1 47 PHE CD1 C -4.706 -5.614 1.610 1.00 . A A . 47 PHE CD1 1 1 22 15307 1 1 47 PHE CD2 C -6.360 -6.058 -0.090 1.00 . A A . 47 PHE CD2 1 1 22 15308 1 1 47 PHE CE1 C -4.041 -6.789 1.271 1.00 . A A . 47 PHE CE1 1 1 22 15309 1 1 47 PHE CE2 C -5.686 -7.228 -0.437 1.00 . A A . 47 PHE CE2 1 1 22 15310 1 1 47 PHE CG C -5.879 -5.244 0.942 1.00 . A A . 47 PHE CG 1 1 22 15311 1 1 47 PHE CZ C -4.531 -7.594 0.249 1.00 . A A . 47 PHE CZ 1 1 22 15312 1 1 47 PHE H H -8.137 -1.969 2.953 1.00 . A A . 47 PHE H 1 1 22 15313 1 1 47 PHE HA H -8.061 -5.015 2.618 1.00 . A A . 47 PHE HA 1 1 22 15314 1 1 47 PHE HB2 H -7.297 -3.670 0.490 1.00 . A A . 47 PHE HB2 1 1 22 15315 1 1 47 PHE HB3 H -5.935 -3.116 1.407 1.00 . A A . 47 PHE HB3 1 1 22 15316 1 1 47 PHE HD1 H -4.317 -5.010 2.415 1.00 . A A . 47 PHE HD1 1 1 22 15317 1 1 47 PHE HD2 H -7.261 -5.793 -0.626 1.00 . A A . 47 PHE HD2 1 1 22 15318 1 1 47 PHE HE1 H -3.152 -7.079 1.808 1.00 . A A . 47 PHE HE1 1 1 22 15319 1 1 47 PHE HE2 H -6.061 -7.853 -1.234 1.00 . A A . 47 PHE HE2 1 1 22 15320 1 1 47 PHE HZ H -4.010 -8.503 -0.017 1.00 . A A . 47 PHE HZ 1 1 22 15321 1 1 47 PHE N N -8.444 -2.913 2.696 1.00 . A A . 47 PHE N 1 1 22 15322 1 1 47 PHE O O -5.951 -2.998 4.199 1.00 . A A . 47 PHE O 1 1 22 15323 1 1 48 ALA C C -4.349 -5.713 5.588 1.00 . A A . 48 ALA C 1 1 22 15324 1 1 48 ALA CA C -5.790 -5.253 5.907 1.00 . A A . 48 ALA CA 1 1 22 15325 1 1 48 ALA CB C -6.496 -6.262 6.833 1.00 . A A . 48 ALA CB 1 1 22 15326 1 1 48 ALA H H -7.158 -5.898 4.303 1.00 . A A . 48 ALA H 1 1 22 15327 1 1 48 ALA HXT H -3.381 -7.199 4.775 1.00 . A A . 48 ALA HXT 1 1 22 15328 1 1 48 ALA HA H -5.735 -4.282 6.437 1.00 . A A . 48 ALA HA 1 1 22 15329 1 1 48 ALA HB1 H -7.518 -5.928 7.095 1.00 . A A . 48 ALA HB1 1 1 22 15330 1 1 48 ALA HB2 H -6.587 -7.268 6.380 1.00 . A A . 48 ALA HB2 1 1 22 15331 1 1 48 ALA HB3 H -5.951 -6.382 7.788 1.00 . A A . 48 ALA HB3 1 1 22 15332 1 1 48 ALA N N -6.585 -5.127 4.662 1.00 . A A . 48 ALA N 1 1 22 15333 1 1 48 ALA O O -3.364 -5.038 5.874 1.00 . A A . 48 ALA O 1 1 22 15334 1 1 48 ALA OXT O -4.286 -6.933 4.955 1.00 . A A . 48 ALA OXT 1 1 23 15335 1 1 1 GLU C C 13.521 11.954 11.857 1.00 . A A . 1 GLU C 1 1 23 15336 1 1 1 GLU CA C 13.823 13.345 12.488 1.00 . A A . 1 GLU CA 1 1 23 15337 1 1 1 GLU CB C 12.940 13.651 13.740 1.00 . A A . 1 GLU CB 1 1 23 15338 1 1 1 GLU CD C 12.984 16.225 14.108 1.00 . A A . 1 GLU CD 1 1 23 15339 1 1 1 GLU CG C 13.375 14.838 14.633 1.00 . A A . 1 GLU CG 1 1 23 15340 1 1 1 GLU H1 H 14.177 14.212 10.617 1.00 . A A . 1 GLU H1 1 1 23 15341 1 1 1 GLU H2 H 12.618 14.389 11.133 1.00 . A A . 1 GLU H2 1 1 23 15342 1 1 1 GLU HA H 14.884 13.356 12.780 1.00 . A A . 1 GLU HA 1 1 23 15343 1 1 1 GLU HB2 H 11.873 13.756 13.464 1.00 . A A . 1 GLU HB2 1 1 23 15344 1 1 1 GLU HB3 H 12.963 12.756 14.390 1.00 . A A . 1 GLU HB3 1 1 23 15345 1 1 1 GLU HE2 H 13.796 17.759 13.227 1.00 . A A . 1 GLU HE2 1 1 23 15346 1 1 1 GLU HG2 H 12.905 14.719 15.627 1.00 . A A . 1 GLU HG2 1 1 23 15347 1 1 1 GLU HG3 H 14.463 14.790 14.831 1.00 . A A . 1 GLU HG3 1 1 23 15348 1 1 1 GLU N N 13.595 14.377 11.446 1.00 . A A . 1 GLU N 1 1 23 15349 1 1 1 GLU O O 14.467 11.212 11.574 1.00 . A A . 1 GLU O 1 1 23 15350 1 1 1 GLU OE1 O 11.841 16.676 14.174 1.00 . A A . 1 GLU OE1 1 1 23 15351 1 1 1 GLU OE2 O 14.049 16.895 13.560 1.00 . A A . 1 GLU OE2 1 1 23 15352 1 1 2 ASP C C 10.748 10.833 9.837 1.00 . A A . 2 ASP C 1 1 23 15353 1 1 2 ASP CA C 11.836 10.398 10.861 1.00 . A A . 2 ASP CA 1 1 23 15354 1 1 2 ASP CB C 11.315 9.289 11.827 1.00 . A A . 2 ASP CB 1 1 23 15355 1 1 2 ASP CG C 10.103 9.578 12.734 1.00 . A A . 2 ASP CG 1 1 23 15356 1 1 2 ASP H H 11.574 12.334 11.914 1.00 . A A . 2 ASP H 1 1 23 15357 1 1 2 ASP HA H 12.706 9.976 10.315 1.00 . A A . 2 ASP HA 1 1 23 15358 1 1 2 ASP HB2 H 11.098 8.382 11.231 1.00 . A A . 2 ASP HB2 1 1 23 15359 1 1 2 ASP HB3 H 12.151 8.975 12.480 1.00 . A A . 2 ASP HB3 1 1 23 15360 1 1 2 ASP HD2 H 9.056 8.758 11.312 1.00 . A A . 2 ASP HD2 1 1 23 15361 1 1 2 ASP N N 12.239 11.613 11.619 1.00 . A A . 2 ASP N 1 1 23 15362 1 1 2 ASP O O 9.698 11.377 10.201 1.00 . A A . 2 ASP O 1 1 23 15363 1 1 2 ASP OD1 O 10.195 10.125 13.833 1.00 . A A . 2 ASP OD1 1 1 23 15364 1 1 2 ASP OD2 O 8.922 9.159 12.174 1.00 . A A . 2 ASP OD2 1 1 23 15365 1 1 3 ASN C C 9.218 9.847 6.826 1.00 . A A . 3 ASN C 1 1 23 15366 1 1 3 ASN CA C 10.117 10.988 7.415 1.00 . A A . 3 ASN CA 1 1 23 15367 1 1 3 ASN CB C 11.049 11.545 6.307 1.00 . A A . 3 ASN CB 1 1 23 15368 1 1 3 ASN CG C 11.759 12.884 6.612 1.00 . A A . 3 ASN CG 1 1 23 15369 1 1 3 ASN H H 11.896 10.071 8.381 1.00 . A A . 3 ASN H 1 1 23 15370 1 1 3 ASN HA H 9.408 11.749 7.763 1.00 . A A . 3 ASN HA 1 1 23 15371 1 1 3 ASN HB2 H 11.760 10.735 6.050 1.00 . A A . 3 ASN HB2 1 1 23 15372 1 1 3 ASN HB3 H 10.473 11.714 5.377 1.00 . A A . 3 ASN HB3 1 1 23 15373 1 1 3 ASN HD21 H 13.529 11.952 6.759 1.00 . A A . 3 ASN HD21 1 1 23 15374 1 1 3 ASN HD22 H 13.513 13.769 7.013 1.00 . A A . 3 ASN HD22 1 1 23 15375 1 1 3 ASN N N 11.028 10.591 8.545 1.00 . A A . 3 ASN N 1 1 23 15376 1 1 3 ASN ND2 N 13.068 12.867 6.814 1.00 . A A . 3 ASN ND2 1 1 23 15377 1 1 3 ASN O O 8.630 9.990 5.749 1.00 . A A . 3 ASN O 1 1 23 15378 1 1 3 ASN OD1 O 11.131 13.941 6.667 1.00 . A A . 3 ASN OD1 1 1 23 15379 1 1 4 CYS C C 7.498 7.107 8.610 1.00 . A A . 4 CYS C 1 1 23 15380 1 1 4 CYS CA C 8.146 7.643 7.287 1.00 . A A . 4 CYS CA 1 1 23 15381 1 1 4 CYS CB C 8.888 6.539 6.553 1.00 . A A . 4 CYS CB 1 1 23 15382 1 1 4 CYS H H 9.660 8.907 8.408 1.00 . A A . 4 CYS H 1 1 23 15383 1 1 4 CYS HA H 7.332 7.945 6.607 1.00 . A A . 4 CYS HA 1 1 23 15384 1 1 4 CYS HB2 H 8.080 5.838 6.501 1.00 . A A . 4 CYS HB2 1 1 23 15385 1 1 4 CYS HB3 H 9.066 6.743 5.489 1.00 . A A . 4 CYS HB3 1 1 23 15386 1 1 4 CYS N N 9.075 8.761 7.580 1.00 . A A . 4 CYS N 1 1 23 15387 1 1 4 CYS O O 7.900 7.455 9.728 1.00 . A A . 4 CYS O 1 1 23 15388 1 1 4 CYS SG S 10.220 5.658 7.389 1.00 . A A . 4 CYS SG 1 1 23 15389 1 1 5 ILE C C 6.186 4.144 9.627 1.00 . A A . 5 ILE C 1 1 23 15390 1 1 5 ILE CA C 5.750 5.624 9.626 1.00 . A A . 5 ILE CA 1 1 23 15391 1 1 5 ILE CB C 4.168 5.704 9.575 1.00 . A A . 5 ILE CB 1 1 23 15392 1 1 5 ILE CD1 C 2.268 7.162 8.689 1.00 . A A . 5 ILE CD1 1 1 23 15393 1 1 5 ILE CG1 C 3.687 7.131 9.234 1.00 . A A . 5 ILE CG1 1 1 23 15394 1 1 5 ILE CG2 C 3.541 5.290 10.940 1.00 . A A . 5 ILE CG2 1 1 23 15395 1 1 5 ILE H H 6.379 5.933 7.444 1.00 . A A . 5 ILE H 1 1 23 15396 1 1 5 ILE HA H 6.054 6.126 10.548 1.00 . A A . 5 ILE HA 1 1 23 15397 1 1 5 ILE HB H 3.723 5.009 8.866 1.00 . A A . 5 ILE HB 1 1 23 15398 1 1 5 ILE HD11 H 1.575 6.647 9.366 1.00 . A A . 5 ILE HD11 1 1 23 15399 1 1 5 ILE HD12 H 1.928 8.200 8.569 1.00 . A A . 5 ILE HD12 1 1 23 15400 1 1 5 ILE HD13 H 2.179 6.662 7.711 1.00 . A A . 5 ILE HD13 1 1 23 15401 1 1 5 ILE HG12 H 3.788 7.788 10.105 1.00 . A A . 5 ILE HG12 1 1 23 15402 1 1 5 ILE HG13 H 4.313 7.594 8.459 1.00 . A A . 5 ILE HG13 1 1 23 15403 1 1 5 ILE HG21 H 3.863 4.284 11.262 1.00 . A A . 5 ILE HG21 1 1 23 15404 1 1 5 ILE HG22 H 3.761 5.992 11.762 1.00 . A A . 5 ILE HG22 1 1 23 15405 1 1 5 ILE HG23 H 2.436 5.217 10.868 1.00 . A A . 5 ILE HG23 1 1 23 15406 1 1 5 ILE N N 6.466 6.237 8.443 1.00 . A A . 5 ILE N 1 1 23 15407 1 1 5 ILE O O 5.586 3.324 8.931 1.00 . A A . 5 ILE O 1 1 23 15408 1 1 6 ALA C C 6.720 1.232 10.957 1.00 . A A . 6 ALA C 1 1 23 15409 1 1 6 ALA CA C 7.721 2.351 10.429 1.00 . A A . 6 ALA CA 1 1 23 15410 1 1 6 ALA CB C 8.989 2.365 11.303 1.00 . A A . 6 ALA CB 1 1 23 15411 1 1 6 ALA H H 7.499 4.512 11.070 1.00 . A A . 6 ALA H 1 1 23 15412 1 1 6 ALA HA H 7.918 2.112 9.360 1.00 . A A . 6 ALA HA 1 1 23 15413 1 1 6 ALA HB1 H 9.744 3.080 10.924 1.00 . A A . 6 ALA HB1 1 1 23 15414 1 1 6 ALA HB2 H 8.775 2.634 12.356 1.00 . A A . 6 ALA HB2 1 1 23 15415 1 1 6 ALA HB3 H 9.480 1.375 11.315 1.00 . A A . 6 ALA HB3 1 1 23 15416 1 1 6 ALA N N 7.204 3.772 10.427 1.00 . A A . 6 ALA N 1 1 23 15417 1 1 6 ALA O O 6.985 0.035 10.841 1.00 . A A . 6 ALA O 1 1 23 15418 1 1 7 GLU C C 4.137 -0.435 12.213 1.00 . A A . 7 GLU C 1 1 23 15419 1 1 7 GLU CA C 4.290 1.080 11.825 1.00 . A A . 7 GLU CA 1 1 23 15420 1 1 7 GLU CB C 3.415 1.296 10.524 1.00 . A A . 7 GLU CB 1 1 23 15421 1 1 7 GLU CD C 4.717 -0.261 8.749 1.00 . A A . 7 GLU CD 1 1 23 15422 1 1 7 GLU CG C 3.407 0.252 9.355 1.00 . A A . 7 GLU CG 1 1 23 15423 1 1 7 GLU H H 5.649 2.735 11.353 1.00 . A A . 7 GLU H 1 1 23 15424 1 1 7 GLU HA H 3.912 1.673 12.686 1.00 . A A . 7 GLU HA 1 1 23 15425 1 1 7 GLU HB2 H 2.369 1.326 10.877 1.00 . A A . 7 GLU HB2 1 1 23 15426 1 1 7 GLU HB3 H 3.517 2.325 10.128 1.00 . A A . 7 GLU HB3 1 1 23 15427 1 1 7 GLU HE2 H 6.193 0.364 7.647 1.00 . A A . 7 GLU HE2 1 1 23 15428 1 1 7 GLU HG2 H 2.827 -0.631 9.685 1.00 . A A . 7 GLU HG2 1 1 23 15429 1 1 7 GLU HG3 H 2.820 0.643 8.518 1.00 . A A . 7 GLU HG3 1 1 23 15430 1 1 7 GLU N N 5.582 1.714 11.462 1.00 . A A . 7 GLU N 1 1 23 15431 1 1 7 GLU O O 4.868 -1.361 11.860 1.00 . A A . 7 GLU O 1 1 23 15432 1 1 7 GLU OE1 O 5.115 -1.417 8.883 1.00 . A A . 7 GLU OE1 1 1 23 15433 1 1 7 GLU OE2 O 5.377 0.698 8.027 1.00 . A A . 7 GLU OE2 1 1 23 15434 1 1 8 ASP C C 0.990 -1.006 13.837 1.00 . A A . 8 ASP C 1 1 23 15435 1 1 8 ASP CA C 2.164 -1.758 13.169 1.00 . A A . 8 ASP CA 1 1 23 15436 1 1 8 ASP CB C 2.673 -2.875 14.117 1.00 . A A . 8 ASP CB 1 1 23 15437 1 1 8 ASP CG C 4.187 -3.094 14.211 1.00 . A A . 8 ASP CG 1 1 23 15438 1 1 8 ASP H H 2.548 0.371 13.040 1.00 . A A . 8 ASP H 1 1 23 15439 1 1 8 ASP HA H 1.919 -2.158 12.172 1.00 . A A . 8 ASP HA 1 1 23 15440 1 1 8 ASP HB2 H 2.184 -2.738 15.089 1.00 . A A . 8 ASP HB2 1 1 23 15441 1 1 8 ASP HB3 H 2.230 -3.811 13.728 1.00 . A A . 8 ASP HB3 1 1 23 15442 1 1 8 ASP HD2 H 4.126 -1.711 15.579 1.00 . A A . 8 ASP HD2 1 1 23 15443 1 1 8 ASP N N 2.967 -0.548 12.860 1.00 . A A . 8 ASP N 1 1 23 15444 1 1 8 ASP O O 1.012 -0.591 15.005 1.00 . A A . 8 ASP O 1 1 23 15445 1 1 8 ASP OD1 O 4.801 -3.908 13.521 1.00 . A A . 8 ASP OD1 1 1 23 15446 1 1 8 ASP OD2 O 4.769 -2.277 15.146 1.00 . A A . 8 ASP OD2 1 1 23 15447 1 1 9 TYR C C -0.681 1.505 13.792 1.00 . A A . 9 TYR C 1 1 23 15448 1 1 9 TYR CA C -1.179 0.130 13.209 1.00 . A A . 9 TYR CA 1 1 23 15449 1 1 9 TYR CB C -2.221 -0.627 14.095 1.00 . A A . 9 TYR CB 1 1 23 15450 1 1 9 TYR CD1 C -3.879 -1.468 12.350 1.00 . A A . 9 TYR CD1 1 1 23 15451 1 1 9 TYR CD2 C -2.440 -3.088 13.420 1.00 . A A . 9 TYR CD2 1 1 23 15452 1 1 9 TYR CE1 C -4.357 -2.457 11.494 1.00 . A A . 9 TYR CE1 1 1 23 15453 1 1 9 TYR CE2 C -2.924 -4.077 12.566 1.00 . A A . 9 TYR CE2 1 1 23 15454 1 1 9 TYR CG C -2.909 -1.772 13.312 1.00 . A A . 9 TYR CG 1 1 23 15455 1 1 9 TYR CZ C -3.877 -3.760 11.600 1.00 . A A . 9 TYR CZ 1 1 23 15456 1 1 9 TYR H H 0.191 -1.367 12.156 1.00 . A A . 9 TYR H 1 1 23 15457 1 1 9 TYR HA H -1.668 0.413 12.255 1.00 . A A . 9 TYR HA 1 1 23 15458 1 1 9 TYR HB2 H -1.763 -0.997 15.033 1.00 . A A . 9 TYR HB2 1 1 23 15459 1 1 9 TYR HB3 H -3.000 0.082 14.432 1.00 . A A . 9 TYR HB3 1 1 23 15460 1 1 9 TYR HD1 H -4.210 -0.448 12.217 1.00 . A A . 9 TYR HD1 1 1 23 15461 1 1 9 TYR HD2 H -1.650 -3.336 14.117 1.00 . A A . 9 TYR HD2 1 1 23 15462 1 1 9 TYR HE1 H -5.078 -2.202 10.730 1.00 . A A . 9 TYR HE1 1 1 23 15463 1 1 9 TYR HE2 H -2.534 -5.082 12.635 1.00 . A A . 9 TYR HE2 1 1 23 15464 1 1 9 TYR HH H -4.939 -4.327 10.115 1.00 . A A . 9 TYR HH 1 1 23 15465 1 1 9 TYR N N -0.016 -0.804 12.982 1.00 . A A . 9 TYR N 1 1 23 15466 1 1 9 TYR O O -1.219 2.041 14.765 1.00 . A A . 9 TYR O 1 1 23 15467 1 1 9 TYR OH O -4.315 -4.722 10.728 1.00 . A A . 9 TYR OH 1 1 23 15468 1 1 10 GLY C C -0.185 4.541 13.119 1.00 . A A . 10 GLY C 1 1 23 15469 1 1 10 GLY CA C 0.861 3.443 13.335 1.00 . A A . 10 GLY CA 1 1 23 15470 1 1 10 GLY H H 0.738 1.412 12.398 1.00 . A A . 10 GLY H 1 1 23 15471 1 1 10 GLY HA2 H 1.349 3.527 14.321 1.00 . A A . 10 GLY HA2 1 1 23 15472 1 1 10 GLY HA3 H 1.684 3.665 12.628 1.00 . A A . 10 GLY HA3 1 1 23 15473 1 1 10 GLY N N 0.346 2.069 13.098 1.00 . A A . 10 GLY N 1 1 23 15474 1 1 10 GLY O O -1.292 4.278 12.653 1.00 . A A . 10 GLY O 1 1 23 15475 1 1 11 LYS C C -0.115 7.473 11.726 1.00 . A A . 11 LYS C 1 1 23 15476 1 1 11 LYS CA C -0.672 6.946 13.069 1.00 . A A . 11 LYS CA 1 1 23 15477 1 1 11 LYS CB C -0.657 8.085 14.099 1.00 . A A . 11 LYS CB 1 1 23 15478 1 1 11 LYS CD C -1.729 10.275 14.966 1.00 . A A . 11 LYS CD 1 1 23 15479 1 1 11 LYS CE C -2.665 11.447 14.618 1.00 . A A . 11 LYS CE 1 1 23 15480 1 1 11 LYS CG C -1.662 9.235 13.834 1.00 . A A . 11 LYS CG 1 1 23 15481 1 1 11 LYS H H 1.181 5.806 13.659 1.00 . A A . 11 LYS H 1 1 23 15482 1 1 11 LYS HA H -1.736 6.624 12.979 1.00 . A A . 11 LYS HA 1 1 23 15483 1 1 11 LYS HB2 H -0.939 7.628 15.049 1.00 . A A . 11 LYS HB2 1 1 23 15484 1 1 11 LYS HB3 H 0.359 8.492 14.179 1.00 . A A . 11 LYS HB3 1 1 23 15485 1 1 11 LYS HD2 H -2.070 9.780 15.896 1.00 . A A . 11 LYS HD2 1 1 23 15486 1 1 11 LYS HD3 H -0.712 10.659 15.179 1.00 . A A . 11 LYS HD3 1 1 23 15487 1 1 11 LYS HE2 H -2.302 11.974 13.716 1.00 . A A . 11 LYS HE2 1 1 23 15488 1 1 11 LYS HE3 H -3.677 11.077 14.373 1.00 . A A . 11 LYS HE3 1 1 23 15489 1 1 11 LYS HG2 H -1.393 9.746 12.890 1.00 . A A . 11 LYS HG2 1 1 23 15490 1 1 11 LYS HG3 H -2.671 8.813 13.667 1.00 . A A . 11 LYS HG3 1 1 23 15491 1 1 11 LYS HZ1 H -3.177 11.958 16.550 1.00 . A A . 11 LYS HZ1 1 1 23 15492 1 1 11 LYS HZ2 H -3.403 13.171 15.478 1.00 . A A . 11 LYS HZ2 1 1 23 15493 1 1 11 LYS N N 0.175 5.779 13.457 1.00 . A A . 11 LYS N 1 1 23 15494 1 1 11 LYS NZ N -2.762 12.411 15.729 1.00 . A A . 11 LYS NZ 1 1 23 15495 1 1 11 LYS O O 1.087 7.645 11.502 1.00 . A A . 11 LYS O 1 1 23 15496 1 1 12 CYS C C -1.979 9.397 9.255 1.00 . A A . 12 CYS C 1 1 23 15497 1 1 12 CYS CA C -0.918 8.312 9.535 1.00 . A A . 12 CYS CA 1 1 23 15498 1 1 12 CYS CB C -1.046 7.185 8.469 1.00 . A A . 12 CYS CB 1 1 23 15499 1 1 12 CYS H H -1.954 7.643 11.457 1.00 . A A . 12 CYS H 1 1 23 15500 1 1 12 CYS HA H 0.074 8.791 9.456 1.00 . A A . 12 CYS HA 1 1 23 15501 1 1 12 CYS HB2 H -0.680 7.538 7.488 1.00 . A A . 12 CYS HB2 1 1 23 15502 1 1 12 CYS HB3 H -0.410 6.324 8.701 1.00 . A A . 12 CYS HB3 1 1 23 15503 1 1 12 CYS N N -1.101 7.721 10.884 1.00 . A A . 12 CYS N 1 1 23 15504 1 1 12 CYS O O -2.884 9.673 10.055 1.00 . A A . 12 CYS O 1 1 23 15505 1 1 12 CYS SG S -2.732 6.581 8.279 1.00 . A A . 12 CYS SG 1 1 23 15506 1 1 13 THR C C -2.905 10.657 5.983 1.00 . A A . 13 THR C 1 1 23 15507 1 1 13 THR CA C -2.921 10.888 7.524 1.00 . A A . 13 THR CA 1 1 23 15508 1 1 13 THR CB C -2.752 12.431 7.881 1.00 . A A . 13 THR CB 1 1 23 15509 1 1 13 THR CG2 C -1.734 12.792 8.986 1.00 . A A . 13 THR CG2 1 1 23 15510 1 1 13 THR H H -1.036 9.655 7.512 1.00 . A A . 13 THR H 1 1 23 15511 1 1 13 THR HA H -3.906 10.544 7.927 1.00 . A A . 13 THR HA 1 1 23 15512 1 1 13 THR HB H -3.773 12.768 8.139 1.00 . A A . 13 THR HB 1 1 23 15513 1 1 13 THR HG1 H -2.270 14.111 7.078 1.00 . A A . 13 THR HG1 1 1 23 15514 1 1 13 THR HG21 H -1.976 12.308 9.948 1.00 . A A . 13 THR HG21 1 1 23 15515 1 1 13 THR HG22 H -0.704 12.496 8.708 1.00 . A A . 13 THR HG22 1 1 23 15516 1 1 13 THR HG23 H -1.711 13.883 9.167 1.00 . A A . 13 THR HG23 1 1 23 15517 1 1 13 THR N N -1.848 10.001 8.062 1.00 . A A . 13 THR N 1 1 23 15518 1 1 13 THR O O -1.873 10.434 5.332 1.00 . A A . 13 THR O 1 1 23 15519 1 1 13 THR OG1 O -2.295 13.200 6.775 1.00 . A A . 13 THR OG1 1 1 23 15520 1 1 14 TRP C C -4.020 12.362 3.535 1.00 . A A . 14 TRP C 1 1 23 15521 1 1 14 TRP CA C -4.296 10.880 3.938 1.00 . A A . 14 TRP CA 1 1 23 15522 1 1 14 TRP CB C -5.725 10.415 3.557 1.00 . A A . 14 TRP CB 1 1 23 15523 1 1 14 TRP CD1 C -5.274 7.840 4.215 1.00 . A A . 14 TRP CD1 1 1 23 15524 1 1 14 TRP CD2 C -7.352 8.383 3.607 1.00 . A A . 14 TRP CD2 1 1 23 15525 1 1 14 TRP CE2 C -7.291 7.002 3.919 1.00 . A A . 14 TRP CE2 1 1 23 15526 1 1 14 TRP CE3 C -8.581 8.972 3.205 1.00 . A A . 14 TRP CE3 1 1 23 15527 1 1 14 TRP CG C -6.090 8.929 3.787 1.00 . A A . 14 TRP CG 1 1 23 15528 1 1 14 TRP CH2 C -9.653 6.798 3.434 1.00 . A A . 14 TRP CH2 1 1 23 15529 1 1 14 TRP CZ2 C -8.455 6.200 3.831 1.00 . A A . 14 TRP CZ2 1 1 23 15530 1 1 14 TRP CZ3 C -9.715 8.162 3.127 1.00 . A A . 14 TRP CZ3 1 1 23 15531 1 1 14 TRP H H -4.813 11.131 6.096 1.00 . A A . 14 TRP H 1 1 23 15532 1 1 14 TRP HA H -3.582 10.203 3.425 1.00 . A A . 14 TRP HA 1 1 23 15533 1 1 14 TRP HB2 H -6.472 11.048 4.074 1.00 . A A . 14 TRP HB2 1 1 23 15534 1 1 14 TRP HB3 H -5.882 10.625 2.482 1.00 . A A . 14 TRP HB3 1 1 23 15535 1 1 14 TRP HD1 H -4.217 7.881 4.466 1.00 . A A . 14 TRP HD1 1 1 23 15536 1 1 14 TRP HE1 H -5.675 5.721 4.593 1.00 . A A . 14 TRP HE1 1 1 23 15537 1 1 14 TRP HE3 H -8.644 10.024 2.968 1.00 . A A . 14 TRP HE3 1 1 23 15538 1 1 14 TRP HH2 H -10.548 6.197 3.365 1.00 . A A . 14 TRP HH2 1 1 23 15539 1 1 14 TRP HZ2 H -8.428 5.147 4.069 1.00 . A A . 14 TRP HZ2 1 1 23 15540 1 1 14 TRP HZ3 H -10.656 8.597 2.824 1.00 . A A . 14 TRP HZ3 1 1 23 15541 1 1 14 TRP N N -4.107 10.823 5.415 1.00 . A A . 14 TRP N 1 1 23 15542 1 1 14 TRP NE1 N -6.011 6.648 4.306 1.00 . A A . 14 TRP NE1 1 1 23 15543 1 1 14 TRP O O -4.830 13.267 3.764 1.00 . A A . 14 TRP O 1 1 23 15544 1 1 15 GLY C C -1.294 14.234 3.984 1.00 . A A . 15 GLY C 1 1 23 15545 1 1 15 GLY CA C -2.219 13.917 2.777 1.00 . A A . 15 GLY CA 1 1 23 15546 1 1 15 GLY H H -2.252 11.719 2.866 1.00 . A A . 15 GLY H 1 1 23 15547 1 1 15 GLY HA2 H -1.642 13.924 1.832 1.00 . A A . 15 GLY HA2 1 1 23 15548 1 1 15 GLY HA3 H -2.992 14.698 2.664 1.00 . A A . 15 GLY HA3 1 1 23 15549 1 1 15 GLY N N -2.810 12.571 2.991 1.00 . A A . 15 GLY N 1 1 23 15550 1 1 15 GLY O O -1.581 15.129 4.782 1.00 . A A . 15 GLY O 1 1 23 15551 1 1 16 GLY C C 1.815 12.424 5.051 1.00 . A A . 16 GLY C 1 1 23 15552 1 1 16 GLY CA C 0.667 13.410 5.288 1.00 . A A . 16 GLY CA 1 1 23 15553 1 1 16 GLY H H -0.122 12.765 3.342 1.00 . A A . 16 GLY H 1 1 23 15554 1 1 16 GLY HA2 H 1.071 14.369 5.637 1.00 . A A . 16 GLY HA2 1 1 23 15555 1 1 16 GLY HA3 H 0.049 13.057 6.136 1.00 . A A . 16 GLY HA3 1 1 23 15556 1 1 16 GLY N N -0.209 13.453 4.097 1.00 . A A . 16 GLY N 1 1 23 15557 1 1 16 GLY O O 2.265 12.172 3.925 1.00 . A A . 16 GLY O 1 1 23 15558 1 1 17 THR C C 2.334 9.421 5.861 1.00 . A A . 17 THR C 1 1 23 15559 1 1 17 THR CA C 3.213 10.695 6.128 1.00 . A A . 17 THR CA 1 1 23 15560 1 1 17 THR CB C 4.039 10.483 7.457 1.00 . A A . 17 THR CB 1 1 23 15561 1 1 17 THR CG2 C 5.377 9.755 7.179 1.00 . A A . 17 THR CG2 1 1 23 15562 1 1 17 THR H H 1.870 12.306 7.001 1.00 . A A . 17 THR H 1 1 23 15563 1 1 17 THR HA H 3.933 10.873 5.299 1.00 . A A . 17 THR HA 1 1 23 15564 1 1 17 THR HB H 3.464 9.851 8.167 1.00 . A A . 17 THR HB 1 1 23 15565 1 1 17 THR HG1 H 4.872 11.526 8.844 1.00 . A A . 17 THR HG1 1 1 23 15566 1 1 17 THR HG21 H 5.230 8.780 6.687 1.00 . A A . 17 THR HG21 1 1 23 15567 1 1 17 THR HG22 H 6.068 10.311 6.522 1.00 . A A . 17 THR HG22 1 1 23 15568 1 1 17 THR HG23 H 5.930 9.519 8.109 1.00 . A A . 17 THR HG23 1 1 23 15569 1 1 17 THR N N 2.267 11.850 6.171 1.00 . A A . 17 THR N 1 1 23 15570 1 1 17 THR O O 1.231 9.215 6.403 1.00 . A A . 17 THR O 1 1 23 15571 1 1 17 THR OG1 O 4.368 11.735 8.054 1.00 . A A . 17 THR OG1 1 1 23 15572 1 1 18 LYS C C 3.521 6.282 5.400 1.00 . A A . 18 LYS C 1 1 23 15573 1 1 18 LYS CA C 2.485 7.207 4.710 1.00 . A A . 18 LYS CA 1 1 23 15574 1 1 18 LYS CB C 2.376 6.919 3.179 1.00 . A A . 18 LYS CB 1 1 23 15575 1 1 18 LYS CD C 2.598 9.068 1.705 1.00 . A A . 18 LYS CD 1 1 23 15576 1 1 18 LYS CE C 1.825 10.092 0.854 1.00 . A A . 18 LYS CE 1 1 23 15577 1 1 18 LYS CG C 1.684 7.950 2.252 1.00 . A A . 18 LYS CG 1 1 23 15578 1 1 18 LYS H H 3.880 8.901 4.763 1.00 . A A . 18 LYS H 1 1 23 15579 1 1 18 LYS HA H 1.491 6.977 5.132 1.00 . A A . 18 LYS HA 1 1 23 15580 1 1 18 LYS HB2 H 3.346 6.570 2.790 1.00 . A A . 18 LYS HB2 1 1 23 15581 1 1 18 LYS HB3 H 1.767 5.999 3.094 1.00 . A A . 18 LYS HB3 1 1 23 15582 1 1 18 LYS HD2 H 3.099 9.595 2.537 1.00 . A A . 18 LYS HD2 1 1 23 15583 1 1 18 LYS HD3 H 3.410 8.614 1.105 1.00 . A A . 18 LYS HD3 1 1 23 15584 1 1 18 LYS HE2 H 1.340 9.595 -0.006 1.00 . A A . 18 LYS HE2 1 1 23 15585 1 1 18 LYS HE3 H 1.012 10.551 1.448 1.00 . A A . 18 LYS HE3 1 1 23 15586 1 1 18 LYS HG2 H 1.251 7.407 1.390 1.00 . A A . 18 LYS HG2 1 1 23 15587 1 1 18 LYS HG3 H 0.815 8.388 2.780 1.00 . A A . 18 LYS HG3 1 1 23 15588 1 1 18 LYS HZ1 H 3.121 11.673 1.144 1.00 . A A . 18 LYS HZ1 1 1 23 15589 1 1 18 LYS HZ2 H 2.167 11.850 -0.172 1.00 . A A . 18 LYS HZ2 1 1 23 15590 1 1 18 LYS N N 2.930 8.592 4.995 1.00 . A A . 18 LYS N 1 1 23 15591 1 1 18 LYS NZ N 2.711 11.159 0.356 1.00 . A A . 18 LYS NZ 1 1 23 15592 1 1 18 LYS O O 4.538 6.663 6.001 1.00 . A A . 18 LYS O 1 1 23 15593 1 1 19 CYS C C 5.302 3.676 5.425 1.00 . A A . 19 CYS C 1 1 23 15594 1 1 19 CYS CA C 3.959 3.989 6.115 1.00 . A A . 19 CYS CA 1 1 23 15595 1 1 19 CYS CB C 3.039 2.789 6.263 1.00 . A A . 19 CYS CB 1 1 23 15596 1 1 19 CYS H H 2.445 4.828 4.648 1.00 . A A . 19 CYS H 1 1 23 15597 1 1 19 CYS HA H 4.169 4.404 7.125 1.00 . A A . 19 CYS HA 1 1 23 15598 1 1 19 CYS HB2 H 2.762 2.404 5.290 1.00 . A A . 19 CYS HB2 1 1 23 15599 1 1 19 CYS HB3 H 3.522 1.996 6.870 1.00 . A A . 19 CYS HB3 1 1 23 15600 1 1 19 CYS N N 3.219 4.996 5.315 1.00 . A A . 19 CYS N 1 1 23 15601 1 1 19 CYS O O 5.448 3.797 4.198 1.00 . A A . 19 CYS O 1 1 23 15602 1 1 19 CYS SG S 1.531 3.329 7.033 1.00 . A A . 19 CYS SG 1 1 23 15603 1 1 20 CYS C C 7.886 2.164 4.730 1.00 . A A . 20 CYS C 1 1 23 15604 1 1 20 CYS CA C 7.713 3.286 5.818 1.00 . A A . 20 CYS CA 1 1 23 15605 1 1 20 CYS CB C 8.690 3.065 6.986 1.00 . A A . 20 CYS CB 1 1 23 15606 1 1 20 CYS H H 6.047 3.287 7.256 1.00 . A A . 20 CYS H 1 1 23 15607 1 1 20 CYS HA H 7.857 4.324 5.502 1.00 . A A . 20 CYS HA 1 1 23 15608 1 1 20 CYS HB2 H 8.356 3.541 7.909 1.00 . A A . 20 CYS HB2 1 1 23 15609 1 1 20 CYS HB3 H 8.886 1.992 7.121 1.00 . A A . 20 CYS HB3 1 1 23 15610 1 1 20 CYS N N 6.305 3.326 6.264 1.00 . A A . 20 CYS N 1 1 23 15611 1 1 20 CYS O O 6.945 1.464 4.360 1.00 . A A . 20 CYS O 1 1 23 15612 1 1 20 CYS SG S 10.273 3.820 6.565 1.00 . A A . 20 CYS SG 1 1 23 15613 1 1 21 ARG C C 8.549 0.584 2.146 1.00 . A A . 21 ARG C 1 1 23 15614 1 1 21 ARG CA C 9.626 1.304 3.031 1.00 . A A . 21 ARG CA 1 1 23 15615 1 1 21 ARG CB C 10.643 0.249 3.580 1.00 . A A . 21 ARG CB 1 1 23 15616 1 1 21 ARG CD C 12.907 1.587 3.354 1.00 . A A . 21 ARG CD 1 1 23 15617 1 1 21 ARG CG C 11.946 0.771 4.246 1.00 . A A . 21 ARG CG 1 1 23 15618 1 1 21 ARG CZ C 14.299 1.059 1.314 1.00 . A A . 21 ARG CZ 1 1 23 15619 1 1 21 ARG H H 9.600 2.858 4.608 1.00 . A A . 21 ARG H 1 1 23 15620 1 1 21 ARG HA H 10.151 2.009 2.357 1.00 . A A . 21 ARG HA 1 1 23 15621 1 1 21 ARG HB2 H 10.132 -0.426 4.294 1.00 . A A . 21 ARG HB2 1 1 23 15622 1 1 21 ARG HB3 H 10.955 -0.421 2.755 1.00 . A A . 21 ARG HB3 1 1 23 15623 1 1 21 ARG HD2 H 12.388 2.463 2.923 1.00 . A A . 21 ARG HD2 1 1 23 15624 1 1 21 ARG HD3 H 13.721 1.998 3.981 1.00 . A A . 21 ARG HD3 1 1 23 15625 1 1 21 ARG HG2 H 11.680 1.386 5.125 1.00 . A A . 21 ARG HG2 1 1 23 15626 1 1 21 ARG HG3 H 12.495 -0.090 4.674 1.00 . A A . 21 ARG HG3 1 1 23 15627 1 1 21 ARG HH11 H 14.471 3.000 1.810 1.00 . A A . 21 ARG HH11 1 1 23 15628 1 1 21 ARG HH12 H 15.412 2.424 0.344 1.00 . A A . 21 ARG HH12 1 1 23 15629 1 1 21 ARG HH21 H 14.283 -0.824 0.634 1.00 . A A . 21 ARG HH21 1 1 23 15630 1 1 21 ARG HH22 H 15.310 0.391 -0.280 1.00 . A A . 21 ARG HH22 1 1 23 15631 1 1 21 ARG N N 9.126 2.049 4.243 1.00 . A A . 21 ARG N 1 1 23 15632 1 1 21 ARG NE N 13.502 0.752 2.260 1.00 . A A . 21 ARG NE 1 1 23 15633 1 1 21 ARG NH1 N 14.776 2.288 1.138 1.00 . A A . 21 ARG NH1 1 1 23 15634 1 1 21 ARG NH2 N 14.668 0.113 0.471 1.00 . A A . 21 ARG NH2 1 1 23 15635 1 1 21 ARG O O 8.525 -0.616 1.856 1.00 . A A . 21 ARG O 1 1 23 15636 1 1 22 GLY C C 5.324 0.496 1.337 1.00 . A A . 22 GLY C 1 1 23 15637 1 1 22 GLY CA C 6.550 1.234 0.785 1.00 . A A . 22 GLY CA 1 1 23 15638 1 1 22 GLY H H 7.837 2.374 2.255 1.00 . A A . 22 GLY H 1 1 23 15639 1 1 22 GLY HA2 H 6.223 2.200 0.355 1.00 . A A . 22 GLY HA2 1 1 23 15640 1 1 22 GLY HA3 H 6.919 0.672 -0.073 1.00 . A A . 22 GLY HA3 1 1 23 15641 1 1 22 GLY N N 7.667 1.499 1.715 1.00 . A A . 22 GLY N 1 1 23 15642 1 1 22 GLY O O 4.995 -0.599 0.872 1.00 . A A . 22 GLY O 1 1 23 15643 1 1 23 ARG C C 2.239 1.537 2.917 1.00 . A A . 23 ARG C 1 1 23 15644 1 1 23 ARG CA C 3.476 0.540 2.994 1.00 . A A . 23 ARG CA 1 1 23 15645 1 1 23 ARG CB C 3.833 0.249 4.480 1.00 . A A . 23 ARG CB 1 1 23 15646 1 1 23 ARG CD C 5.679 -1.619 4.222 1.00 . A A . 23 ARG CD 1 1 23 15647 1 1 23 ARG CG C 4.431 -1.080 4.948 1.00 . A A . 23 ARG CG 1 1 23 15648 1 1 23 ARG CZ C 7.320 -2.418 5.973 1.00 . A A . 23 ARG CZ 1 1 23 15649 1 1 23 ARG H H 5.211 1.942 2.647 1.00 . A A . 23 ARG H 1 1 23 15650 1 1 23 ARG HA H 3.197 -0.418 2.521 1.00 . A A . 23 ARG HA 1 1 23 15651 1 1 23 ARG HB2 H 4.482 1.049 4.875 1.00 . A A . 23 ARG HB2 1 1 23 15652 1 1 23 ARG HB3 H 2.904 0.306 5.078 1.00 . A A . 23 ARG HB3 1 1 23 15653 1 1 23 ARG HD2 H 5.379 -2.108 3.278 1.00 . A A . 23 ARG HD2 1 1 23 15654 1 1 23 ARG HD3 H 6.356 -0.807 3.915 1.00 . A A . 23 ARG HD3 1 1 23 15655 1 1 23 ARG HG2 H 4.663 -0.913 6.019 1.00 . A A . 23 ARG HG2 1 1 23 15656 1 1 23 ARG HG3 H 3.633 -1.836 4.953 1.00 . A A . 23 ARG HG3 1 1 23 15657 1 1 23 ARG HH11 H 7.374 -0.414 5.816 1.00 . A A . 23 ARG HH11 1 1 23 15658 1 1 23 ARG HH12 H 8.492 -1.187 7.049 1.00 . A A . 23 ARG HH12 1 1 23 15659 1 1 23 ARG HH21 H 7.440 -4.388 6.315 1.00 . A A . 23 ARG HH21 1 1 23 15660 1 1 23 ARG HH22 H 8.525 -3.292 7.310 1.00 . A A . 23 ARG HH22 1 1 23 15661 1 1 23 ARG N N 4.668 1.128 2.315 1.00 . A A . 23 ARG N 1 1 23 15662 1 1 23 ARG NE N 6.427 -2.598 5.078 1.00 . A A . 23 ARG NE 1 1 23 15663 1 1 23 ARG NH1 N 7.776 -1.216 6.314 1.00 . A A . 23 ARG NH1 1 1 23 15664 1 1 23 ARG NH2 N 7.812 -3.473 6.595 1.00 . A A . 23 ARG NH2 1 1 23 15665 1 1 23 ARG O O 2.417 2.766 3.038 1.00 . A A . 23 ARG O 1 1 23 15666 1 1 24 PRO C C -0.880 2.250 4.140 1.00 . A A . 24 PRO C 1 1 23 15667 1 1 24 PRO CA C -0.263 1.885 2.744 1.00 . A A . 24 PRO CA 1 1 23 15668 1 1 24 PRO CB C -1.199 1.006 1.887 1.00 . A A . 24 PRO CB 1 1 23 15669 1 1 24 PRO CD C 0.653 -0.378 2.525 1.00 . A A . 24 PRO CD 1 1 23 15670 1 1 24 PRO CG C -0.857 -0.422 2.307 1.00 . A A . 24 PRO CG 1 1 23 15671 1 1 24 PRO HA H -0.061 2.842 2.220 1.00 . A A . 24 PRO HA 1 1 23 15672 1 1 24 PRO HB2 H -2.274 1.234 2.016 1.00 . A A . 24 PRO HB2 1 1 23 15673 1 1 24 PRO HB3 H -0.979 1.148 0.811 1.00 . A A . 24 PRO HB3 1 1 23 15674 1 1 24 PRO HD2 H 0.961 -1.033 3.360 1.00 . A A . 24 PRO HD2 1 1 23 15675 1 1 24 PRO HD3 H 1.173 -0.712 1.608 1.00 . A A . 24 PRO HD3 1 1 23 15676 1 1 24 PRO HG2 H -1.372 -0.670 3.249 1.00 . A A . 24 PRO HG2 1 1 23 15677 1 1 24 PRO HG3 H -1.163 -1.180 1.565 1.00 . A A . 24 PRO HG3 1 1 23 15678 1 1 24 PRO N N 0.963 1.041 2.801 1.00 . A A . 24 PRO N 1 1 23 15679 1 1 24 PRO O O -0.508 1.712 5.189 1.00 . A A . 24 PRO O 1 1 23 15680 1 1 25 CYS C C -4.130 3.675 4.968 1.00 . A A . 25 CYS C 1 1 23 15681 1 1 25 CYS CA C -2.603 3.671 5.289 1.00 . A A . 25 CYS CA 1 1 23 15682 1 1 25 CYS CB C -2.017 5.073 5.637 1.00 . A A . 25 CYS CB 1 1 23 15683 1 1 25 CYS H H -2.084 3.505 3.151 1.00 . A A . 25 CYS H 1 1 23 15684 1 1 25 CYS HA H -2.426 3.005 6.151 1.00 . A A . 25 CYS HA 1 1 23 15685 1 1 25 CYS HB2 H -1.159 4.931 6.304 1.00 . A A . 25 CYS HB2 1 1 23 15686 1 1 25 CYS HB3 H -1.652 5.561 4.729 1.00 . A A . 25 CYS HB3 1 1 23 15687 1 1 25 CYS N N -1.870 3.162 4.094 1.00 . A A . 25 CYS N 1 1 23 15688 1 1 25 CYS O O -4.582 3.857 3.831 1.00 . A A . 25 CYS O 1 1 23 15689 1 1 25 CYS SG S -3.186 6.249 6.355 1.00 . A A . 25 CYS SG 1 1 23 15690 1 1 26 ARG C C -6.890 3.859 7.336 1.00 . A A . 26 ARG C 1 1 23 15691 1 1 26 ARG CA C -6.390 3.283 5.988 1.00 . A A . 26 ARG CA 1 1 23 15692 1 1 26 ARG CB C -6.822 1.795 5.806 1.00 . A A . 26 ARG CB 1 1 23 15693 1 1 26 ARG CD C -6.880 -0.673 6.675 1.00 . A A . 26 ARG CD 1 1 23 15694 1 1 26 ARG CG C -6.235 0.723 6.766 1.00 . A A . 26 ARG CG 1 1 23 15695 1 1 26 ARG CZ C -6.996 -2.620 5.103 1.00 . A A . 26 ARG CZ 1 1 23 15696 1 1 26 ARG H H -4.445 3.454 6.950 1.00 . A A . 26 ARG H 1 1 23 15697 1 1 26 ARG HA H -6.803 3.867 5.142 1.00 . A A . 26 ARG HA 1 1 23 15698 1 1 26 ARG HB2 H -7.927 1.751 5.854 1.00 . A A . 26 ARG HB2 1 1 23 15699 1 1 26 ARG HB3 H -6.583 1.495 4.768 1.00 . A A . 26 ARG HB3 1 1 23 15700 1 1 26 ARG HD2 H -6.479 -1.297 7.497 1.00 . A A . 26 ARG HD2 1 1 23 15701 1 1 26 ARG HD3 H -7.968 -0.595 6.862 1.00 . A A . 26 ARG HD3 1 1 23 15702 1 1 26 ARG HG2 H -5.143 0.643 6.614 1.00 . A A . 26 ARG HG2 1 1 23 15703 1 1 26 ARG HG3 H -6.351 1.061 7.811 1.00 . A A . 26 ARG HG3 1 1 23 15704 1 1 26 ARG HH11 H -7.804 -3.038 6.898 1.00 . A A . 26 ARG HH11 1 1 23 15705 1 1 26 ARG HH12 H -7.827 -4.373 5.640 1.00 . A A . 26 ARG HH12 1 1 23 15706 1 1 26 ARG HH21 H -6.259 -2.452 3.251 1.00 . A A . 26 ARG HH21 1 1 23 15707 1 1 26 ARG HH22 H -7.011 -4.061 3.714 1.00 . A A . 26 ARG HH22 1 1 23 15708 1 1 26 ARG N N -4.915 3.441 6.032 1.00 . A A . 26 ARG N 1 1 23 15709 1 1 26 ARG NE N -6.640 -1.351 5.378 1.00 . A A . 26 ARG NE 1 1 23 15710 1 1 26 ARG NH1 N -7.605 -3.427 5.970 1.00 . A A . 26 ARG NH1 1 1 23 15711 1 1 26 ARG NH2 N -6.727 -3.093 3.901 1.00 . A A . 26 ARG NH2 1 1 23 15712 1 1 26 ARG O O -6.395 3.486 8.411 1.00 . A A . 26 ARG O 1 1 23 15713 1 1 27 CYS C C -9.016 4.694 9.565 1.00 . A A . 27 CYS C 1 1 23 15714 1 1 27 CYS CA C -8.199 5.550 8.533 1.00 . A A . 27 CYS CA 1 1 23 15715 1 1 27 CYS CB C -9.018 6.802 8.154 1.00 . A A . 27 CYS CB 1 1 23 15716 1 1 27 CYS H H -8.200 5.056 6.373 1.00 . A A . 27 CYS H 1 1 23 15717 1 1 27 CYS HA H -7.227 5.871 8.932 1.00 . A A . 27 CYS HA 1 1 23 15718 1 1 27 CYS HB2 H -10.000 6.540 7.781 1.00 . A A . 27 CYS HB2 1 1 23 15719 1 1 27 CYS HB3 H -9.215 7.407 9.056 1.00 . A A . 27 CYS HB3 1 1 23 15720 1 1 27 CYS N N -7.862 4.791 7.305 1.00 . A A . 27 CYS N 1 1 23 15721 1 1 27 CYS O O -9.459 3.570 9.302 1.00 . A A . 27 CYS O 1 1 23 15722 1 1 27 CYS SG S -8.143 7.868 7.006 1.00 . A A . 27 CYS SG 1 1 23 15723 1 1 28 SER C C -11.347 4.336 11.747 1.00 . A A . 28 SER C 1 1 23 15724 1 1 28 SER CA C -9.815 4.618 11.946 1.00 . A A . 28 SER CA 1 1 23 15725 1 1 28 SER CB C -9.518 5.573 13.146 1.00 . A A . 28 SER CB 1 1 23 15726 1 1 28 SER H H -8.700 6.180 10.847 1.00 . A A . 28 SER H 1 1 23 15727 1 1 28 SER HA H -9.355 3.636 12.153 1.00 . A A . 28 SER HA 1 1 23 15728 1 1 28 SER HB2 H -8.520 6.039 13.085 1.00 . A A . 28 SER HB2 1 1 23 15729 1 1 28 SER HB3 H -10.249 6.400 13.197 1.00 . A A . 28 SER HB3 1 1 23 15730 1 1 28 SER HG H -8.890 4.179 14.314 1.00 . A A . 28 SER HG 1 1 23 15731 1 1 28 SER N N -9.176 5.275 10.772 1.00 . A A . 28 SER N 1 1 23 15732 1 1 28 SER O O -11.929 4.425 10.660 1.00 . A A . 28 SER O 1 1 23 15733 1 1 28 SER OG O -9.562 4.861 14.378 1.00 . A A . 28 SER OG 1 1 23 15734 1 1 29 MET C C -14.453 4.540 12.663 1.00 . A A . 29 MET C 1 1 23 15735 1 1 29 MET CA C -13.372 3.457 12.961 1.00 . A A . 29 MET CA 1 1 23 15736 1 1 29 MET CB C -13.535 2.902 14.405 1.00 . A A . 29 MET CB 1 1 23 15737 1 1 29 MET CE C -13.061 4.075 18.382 1.00 . A A . 29 MET CE 1 1 23 15738 1 1 29 MET CG C -13.389 3.813 15.643 1.00 . A A . 29 MET CG 1 1 23 15739 1 1 29 MET H H -11.337 4.073 13.668 1.00 . A A . 29 MET H 1 1 23 15740 1 1 29 MET HA H -13.532 2.641 12.230 1.00 . A A . 29 MET HA 1 1 23 15741 1 1 29 MET HB2 H -14.512 2.397 14.472 1.00 . A A . 29 MET HB2 1 1 23 15742 1 1 29 MET HB3 H -12.781 2.119 14.521 1.00 . A A . 29 MET HB3 1 1 23 15743 1 1 29 MET HE1 H -13.892 4.804 18.385 1.00 . A A . 29 MET HE1 1 1 23 15744 1 1 29 MET HE2 H -12.996 3.624 19.388 1.00 . A A . 29 MET HE2 1 1 23 15745 1 1 29 MET HE3 H -12.120 4.623 18.191 1.00 . A A . 29 MET HE3 1 1 23 15746 1 1 29 MET HG2 H -12.473 4.429 15.582 1.00 . A A . 29 MET HG2 1 1 23 15747 1 1 29 MET HG3 H -14.244 4.504 15.721 1.00 . A A . 29 MET HG3 1 1 23 15748 1 1 29 MET N N -11.960 3.942 12.865 1.00 . A A . 29 MET N 1 1 23 15749 1 1 29 MET O O -15.422 4.280 11.944 1.00 . A A . 29 MET O 1 1 23 15750 1 1 29 MET SD S -13.327 2.800 17.134 1.00 . A A . 29 MET SD 1 1 23 15751 1 1 30 ILE C C -14.691 7.477 11.472 1.00 . A A . 30 ILE C 1 1 23 15752 1 1 30 ILE CA C -15.059 6.957 12.908 1.00 . A A . 30 ILE CA 1 1 23 15753 1 1 30 ILE CB C -14.807 8.038 14.038 1.00 . A A . 30 ILE CB 1 1 23 15754 1 1 30 ILE CD1 C -14.812 8.301 16.643 1.00 . A A . 30 ILE CD1 1 1 23 15755 1 1 30 ILE CG1 C -15.370 7.559 15.417 1.00 . A A . 30 ILE CG1 1 1 23 15756 1 1 30 ILE CG2 C -15.509 9.385 13.696 1.00 . A A . 30 ILE CG2 1 1 23 15757 1 1 30 ILE H H -13.353 5.698 13.737 1.00 . A A . 30 ILE H 1 1 23 15758 1 1 30 ILE HA H -16.129 6.687 12.899 1.00 . A A . 30 ILE HA 1 1 23 15759 1 1 30 ILE HB H -13.718 8.224 14.133 1.00 . A A . 30 ILE HB 1 1 23 15760 1 1 30 ILE HD11 H -13.710 8.226 16.696 1.00 . A A . 30 ILE HD11 1 1 23 15761 1 1 30 ILE HD12 H -15.075 9.374 16.638 1.00 . A A . 30 ILE HD12 1 1 23 15762 1 1 30 ILE HD13 H -15.214 7.873 17.580 1.00 . A A . 30 ILE HD13 1 1 23 15763 1 1 30 ILE HG12 H -16.476 7.601 15.427 1.00 . A A . 30 ILE HG12 1 1 23 15764 1 1 30 ILE HG13 H -15.140 6.493 15.576 1.00 . A A . 30 ILE HG13 1 1 23 15765 1 1 30 ILE HG21 H -16.599 9.264 13.551 1.00 . A A . 30 ILE HG21 1 1 23 15766 1 1 30 ILE HG22 H -15.365 10.145 14.485 1.00 . A A . 30 ILE HG22 1 1 23 15767 1 1 30 ILE HG23 H -15.107 9.839 12.772 1.00 . A A . 30 ILE HG23 1 1 23 15768 1 1 30 ILE N N -14.236 5.743 13.204 1.00 . A A . 30 ILE N 1 1 23 15769 1 1 30 ILE O O -15.590 7.624 10.639 1.00 . A A . 30 ILE O 1 1 23 15770 1 1 31 GLY C C -11.745 9.370 10.143 1.00 . A A . 31 GLY C 1 1 23 15771 1 1 31 GLY CA C -12.964 8.442 9.970 1.00 . A A . 31 GLY CA 1 1 23 15772 1 1 31 GLY H H -12.796 7.569 12.019 1.00 . A A . 31 GLY H 1 1 23 15773 1 1 31 GLY HA2 H -12.713 7.666 9.227 1.00 . A A . 31 GLY HA2 1 1 23 15774 1 1 31 GLY HA3 H -13.784 9.033 9.517 1.00 . A A . 31 GLY HA3 1 1 23 15775 1 1 31 GLY N N -13.405 7.766 11.215 1.00 . A A . 31 GLY N 1 1 23 15776 1 1 31 GLY O O -10.813 9.312 9.338 1.00 . A A . 31 GLY O 1 1 23 15777 1 1 32 THR C C -9.618 10.304 12.442 1.00 . A A . 32 THR C 1 1 23 15778 1 1 32 THR CA C -10.612 11.101 11.535 1.00 . A A . 32 THR CA 1 1 23 15779 1 1 32 THR CB C -11.092 12.381 12.296 1.00 . A A . 32 THR CB 1 1 23 15780 1 1 32 THR CG2 C -11.946 13.312 11.412 1.00 . A A . 32 THR CG2 1 1 23 15781 1 1 32 THR H H -12.568 10.084 11.800 1.00 . A A . 32 THR H 1 1 23 15782 1 1 32 THR HA H -10.083 11.420 10.613 1.00 . A A . 32 THR HA 1 1 23 15783 1 1 32 THR HB H -10.185 12.929 12.623 1.00 . A A . 32 THR HB 1 1 23 15784 1 1 32 THR HG1 H -11.327 11.486 13.987 1.00 . A A . 32 THR HG1 1 1 23 15785 1 1 32 THR HG21 H -11.398 13.626 10.505 1.00 . A A . 32 THR HG21 1 1 23 15786 1 1 32 THR HG22 H -12.886 12.831 11.083 1.00 . A A . 32 THR HG22 1 1 23 15787 1 1 32 THR HG23 H -12.226 14.232 11.957 1.00 . A A . 32 THR HG23 1 1 23 15788 1 1 32 THR N N -11.770 10.233 11.172 1.00 . A A . 32 THR N 1 1 23 15789 1 1 32 THR O O -9.962 9.309 13.091 1.00 . A A . 32 THR O 1 1 23 15790 1 1 32 THR OG1 O -11.887 12.032 13.430 1.00 . A A . 32 THR OG1 1 1 23 15791 1 1 33 ASN C C -6.788 8.863 12.408 1.00 . A A . 33 ASN C 1 1 23 15792 1 1 33 ASN CA C -7.182 10.178 13.154 1.00 . A A . 33 ASN CA 1 1 23 15793 1 1 33 ASN CB C -7.504 9.912 14.669 1.00 . A A . 33 ASN CB 1 1 23 15794 1 1 33 ASN CG C -6.269 9.943 15.590 1.00 . A A . 33 ASN CG 1 1 23 15795 1 1 33 ASN H H -8.208 11.551 11.784 1.00 . A A . 33 ASN H 1 1 23 15796 1 1 33 ASN HA H -6.336 10.887 13.068 1.00 . A A . 33 ASN HA 1 1 23 15797 1 1 33 ASN HB2 H -8.224 10.658 15.046 1.00 . A A . 33 ASN HB2 1 1 23 15798 1 1 33 ASN HB3 H -8.058 8.962 14.808 1.00 . A A . 33 ASN HB3 1 1 23 15799 1 1 33 ASN HD21 H -5.976 7.974 15.339 1.00 . A A . 33 ASN HD21 1 1 23 15800 1 1 33 ASN HD22 H -4.793 8.868 16.419 1.00 . A A . 33 ASN HD22 1 1 23 15801 1 1 33 ASN N N -8.358 10.793 12.458 1.00 . A A . 33 ASN N 1 1 23 15802 1 1 33 ASN ND2 N -5.615 8.811 15.808 1.00 . A A . 33 ASN ND2 1 1 23 15803 1 1 33 ASN O O -6.879 7.766 12.967 1.00 . A A . 33 ASN O 1 1 23 15804 1 1 33 ASN OD1 O -5.896 10.991 16.115 1.00 . A A . 33 ASN OD1 1 1 23 15805 1 1 34 CYS C C -4.961 6.883 10.834 1.00 . A A . 34 CYS C 1 1 23 15806 1 1 34 CYS CA C -6.115 7.778 10.275 1.00 . A A . 34 CYS CA 1 1 23 15807 1 1 34 CYS CB C -5.764 8.198 8.835 1.00 . A A . 34 CYS CB 1 1 23 15808 1 1 34 CYS H H -6.459 9.927 10.762 1.00 . A A . 34 CYS H 1 1 23 15809 1 1 34 CYS HA H -7.071 7.238 10.239 1.00 . A A . 34 CYS HA 1 1 23 15810 1 1 34 CYS HB2 H -4.822 8.729 8.820 1.00 . A A . 34 CYS HB2 1 1 23 15811 1 1 34 CYS HB3 H -5.606 7.302 8.205 1.00 . A A . 34 CYS HB3 1 1 23 15812 1 1 34 CYS N N -6.333 8.978 11.138 1.00 . A A . 34 CYS N 1 1 23 15813 1 1 34 CYS O O -4.065 7.380 11.528 1.00 . A A . 34 CYS O 1 1 23 15814 1 1 34 CYS SG S -7.102 9.151 8.112 1.00 . A A . 34 CYS SG 1 1 23 15815 1 1 35 GLU C C -3.268 3.953 9.724 1.00 . A A . 35 GLU C 1 1 23 15816 1 1 35 GLU CA C -3.894 4.644 10.967 1.00 . A A . 35 GLU CA 1 1 23 15817 1 1 35 GLU CB C -4.389 3.532 11.943 1.00 . A A . 35 GLU CB 1 1 23 15818 1 1 35 GLU CD C -5.724 2.764 13.978 1.00 . A A . 35 GLU CD 1 1 23 15819 1 1 35 GLU CG C -5.171 3.957 13.195 1.00 . A A . 35 GLU CG 1 1 23 15820 1 1 35 GLU H H -5.706 5.313 9.830 1.00 . A A . 35 GLU H 1 1 23 15821 1 1 35 GLU HA H -3.100 5.214 11.483 1.00 . A A . 35 GLU HA 1 1 23 15822 1 1 35 GLU HB2 H -4.854 2.727 11.360 1.00 . A A . 35 GLU HB2 1 1 23 15823 1 1 35 GLU HB3 H -3.495 3.009 12.335 1.00 . A A . 35 GLU HB3 1 1 23 15824 1 1 35 GLU HE2 H -7.424 1.877 14.319 1.00 . A A . 35 GLU HE2 1 1 23 15825 1 1 35 GLU HG2 H -4.490 4.533 13.850 1.00 . A A . 35 GLU HG2 1 1 23 15826 1 1 35 GLU HG3 H -5.990 4.642 12.920 1.00 . A A . 35 GLU HG3 1 1 23 15827 1 1 35 GLU N N -4.997 5.564 10.539 1.00 . A A . 35 GLU N 1 1 23 15828 1 1 35 GLU O O -3.704 4.056 8.578 1.00 . A A . 35 GLU O 1 1 23 15829 1 1 35 GLU OE1 O -5.023 2.022 14.667 1.00 . A A . 35 GLU OE1 1 1 23 15830 1 1 35 GLU OE2 O -7.080 2.623 13.822 1.00 . A A . 35 GLU OE2 1 1 23 15831 1 1 36 CYS C C -1.984 0.950 9.055 1.00 . A A . 36 CYS C 1 1 23 15832 1 1 36 CYS CA C -1.446 2.417 9.049 1.00 . A A . 36 CYS CA 1 1 23 15833 1 1 36 CYS CB C 0.039 2.467 9.440 1.00 . A A . 36 CYS CB 1 1 23 15834 1 1 36 CYS H H -2.101 3.141 11.039 1.00 . A A . 36 CYS H 1 1 23 15835 1 1 36 CYS HA H -1.533 2.864 8.024 1.00 . A A . 36 CYS HA 1 1 23 15836 1 1 36 CYS HB2 H 0.402 3.500 9.597 1.00 . A A . 36 CYS HB2 1 1 23 15837 1 1 36 CYS HB3 H 0.251 1.891 10.357 1.00 . A A . 36 CYS HB3 1 1 23 15838 1 1 36 CYS N N -2.188 3.238 10.018 1.00 . A A . 36 CYS N 1 1 23 15839 1 1 36 CYS O O -2.640 0.502 10.003 1.00 . A A . 36 CYS O 1 1 23 15840 1 1 36 CYS SG S 0.846 1.787 8.020 1.00 . A A . 36 CYS SG 1 1 23 15841 1 1 37 THR C C -0.493 -1.905 7.552 1.00 . A A . 37 THR C 1 1 23 15842 1 1 37 THR CA C -1.877 -1.285 7.979 1.00 . A A . 37 THR CA 1 1 23 15843 1 1 37 THR CB C -3.039 -1.715 7.041 1.00 . A A . 37 THR CB 1 1 23 15844 1 1 37 THR CG2 C -2.946 -1.233 5.580 1.00 . A A . 37 THR CG2 1 1 23 15845 1 1 37 THR H H -1.156 0.682 7.248 1.00 . A A . 37 THR H 1 1 23 15846 1 1 37 THR HA H -2.155 -1.639 8.986 1.00 . A A . 37 THR HA 1 1 23 15847 1 1 37 THR HB H -3.955 -1.373 7.542 1.00 . A A . 37 THR HB 1 1 23 15848 1 1 37 THR HG1 H -3.886 -3.353 6.484 1.00 . A A . 37 THR HG1 1 1 23 15849 1 1 37 THR HG21 H -2.889 -0.132 5.506 1.00 . A A . 37 THR HG21 1 1 23 15850 1 1 37 THR HG22 H -2.062 -1.656 5.073 1.00 . A A . 37 THR HG22 1 1 23 15851 1 1 37 THR HG23 H -3.830 -1.551 5.000 1.00 . A A . 37 THR HG23 1 1 23 15852 1 1 37 THR N N -1.664 0.191 7.995 1.00 . A A . 37 THR N 1 1 23 15853 1 1 37 THR O O 0.083 -1.473 6.543 1.00 . A A . 37 THR O 1 1 23 15854 1 1 37 THR OG1 O -3.092 -3.138 6.980 1.00 . A A . 37 THR OG1 1 1 23 15855 1 1 38 PRO C C 1.530 -4.410 6.868 1.00 . A A . 38 PRO C 1 1 23 15856 1 1 38 PRO CA C 1.454 -3.401 8.056 1.00 . A A . 38 PRO CA 1 1 23 15857 1 1 38 PRO CB C 1.824 -4.007 9.425 1.00 . A A . 38 PRO CB 1 1 23 15858 1 1 38 PRO CD C -0.541 -3.473 9.506 1.00 . A A . 38 PRO CD 1 1 23 15859 1 1 38 PRO CG C 0.498 -4.456 10.050 1.00 . A A . 38 PRO CG 1 1 23 15860 1 1 38 PRO HA H 2.155 -2.568 7.840 1.00 . A A . 38 PRO HA 1 1 23 15861 1 1 38 PRO HB2 H 2.561 -4.830 9.362 1.00 . A A . 38 PRO HB2 1 1 23 15862 1 1 38 PRO HB3 H 2.288 -3.229 10.061 1.00 . A A . 38 PRO HB3 1 1 23 15863 1 1 38 PRO HD2 H -1.508 -3.960 9.267 1.00 . A A . 38 PRO HD2 1 1 23 15864 1 1 38 PRO HD3 H -0.767 -2.671 10.235 1.00 . A A . 38 PRO HD3 1 1 23 15865 1 1 38 PRO HG2 H 0.255 -5.485 9.724 1.00 . A A . 38 PRO HG2 1 1 23 15866 1 1 38 PRO HG3 H 0.533 -4.464 11.155 1.00 . A A . 38 PRO HG3 1 1 23 15867 1 1 38 PRO N N 0.076 -2.904 8.290 1.00 . A A . 38 PRO N 1 1 23 15868 1 1 38 PRO O O 1.152 -5.579 7.002 1.00 . A A . 38 PRO O 1 1 23 15869 1 1 39 ARG C C 3.611 -5.191 4.299 1.00 . A A . 39 ARG C 1 1 23 15870 1 1 39 ARG CA C 2.129 -4.742 4.469 1.00 . A A . 39 ARG CA 1 1 23 15871 1 1 39 ARG CB C 1.632 -3.876 3.276 1.00 . A A . 39 ARG CB 1 1 23 15872 1 1 39 ARG CD C 1.295 -3.604 0.755 1.00 . A A . 39 ARG CD 1 1 23 15873 1 1 39 ARG CG C 1.589 -4.588 1.905 1.00 . A A . 39 ARG CG 1 1 23 15874 1 1 39 ARG CZ C 2.574 -4.248 -1.309 1.00 . A A . 39 ARG CZ 1 1 23 15875 1 1 39 ARG H H 2.283 -2.938 5.732 1.00 . A A . 39 ARG H 1 1 23 15876 1 1 39 ARG HA H 1.483 -5.643 4.515 1.00 . A A . 39 ARG HA 1 1 23 15877 1 1 39 ARG HB2 H 0.616 -3.492 3.493 1.00 . A A . 39 ARG HB2 1 1 23 15878 1 1 39 ARG HB3 H 2.271 -2.975 3.193 1.00 . A A . 39 ARG HB3 1 1 23 15879 1 1 39 ARG HD2 H 0.268 -3.210 0.854 1.00 . A A . 39 ARG HD2 1 1 23 15880 1 1 39 ARG HD3 H 1.947 -2.714 0.833 1.00 . A A . 39 ARG HD3 1 1 23 15881 1 1 39 ARG HG2 H 2.558 -5.087 1.714 1.00 . A A . 39 ARG HG2 1 1 23 15882 1 1 39 ARG HG3 H 0.834 -5.398 1.922 1.00 . A A . 39 ARG HG3 1 1 23 15883 1 1 39 ARG HH11 H 3.736 -3.314 0.044 1.00 . A A . 39 ARG HH11 1 1 23 15884 1 1 39 ARG HH12 H 4.532 -3.826 -1.527 1.00 . A A . 39 ARG HH12 1 1 23 15885 1 1 39 ARG HH21 H 1.643 -5.194 -2.808 1.00 . A A . 39 ARG HH21 1 1 23 15886 1 1 39 ARG HH22 H 3.424 -4.815 -3.028 1.00 . A A . 39 ARG HH22 1 1 23 15887 1 1 39 ARG N N 2.010 -3.927 5.707 1.00 . A A . 39 ARG N 1 1 23 15888 1 1 39 ARG NE N 1.433 -4.221 -0.587 1.00 . A A . 39 ARG NE 1 1 23 15889 1 1 39 ARG NH1 N 3.734 -3.742 -0.888 1.00 . A A . 39 ARG NH1 1 1 23 15890 1 1 39 ARG NH2 N 2.543 -4.811 -2.502 1.00 . A A . 39 ARG NH2 1 1 23 15891 1 1 39 ARG O O 4.409 -4.534 3.623 1.00 . A A . 39 ARG O 1 1 23 15892 1 1 40 LEU C C 4.895 -8.434 4.097 1.00 . A A . 40 LEU C 1 1 23 15893 1 1 40 LEU CA C 5.249 -7.030 4.666 1.00 . A A . 40 LEU CA 1 1 23 15894 1 1 40 LEU CB C 6.090 -7.087 5.983 1.00 . A A . 40 LEU CB 1 1 23 15895 1 1 40 LEU CD1 C 6.478 -8.298 8.213 1.00 . A A . 40 LEU CD1 1 1 23 15896 1 1 40 LEU CD2 C 4.792 -6.434 8.130 1.00 . A A . 40 LEU CD2 1 1 23 15897 1 1 40 LEU CG C 5.448 -7.576 7.323 1.00 . A A . 40 LEU CG 1 1 23 15898 1 1 40 LEU H H 3.189 -6.792 5.421 1.00 . A A . 40 LEU H 1 1 23 15899 1 1 40 LEU HA H 5.869 -6.492 3.920 1.00 . A A . 40 LEU HA 1 1 23 15900 1 1 40 LEU HB2 H 6.975 -7.710 5.752 1.00 . A A . 40 LEU HB2 1 1 23 15901 1 1 40 LEU HB3 H 6.533 -6.086 6.149 1.00 . A A . 40 LEU HB3 1 1 23 15902 1 1 40 LEU HD11 H 6.909 -9.178 7.699 1.00 . A A . 40 LEU HD11 1 1 23 15903 1 1 40 LEU HD12 H 7.320 -7.638 8.496 1.00 . A A . 40 LEU HD12 1 1 23 15904 1 1 40 LEU HD13 H 6.022 -8.671 9.149 1.00 . A A . 40 LEU HD13 1 1 23 15905 1 1 40 LEU HD21 H 4.017 -5.903 7.551 1.00 . A A . 40 LEU HD21 1 1 23 15906 1 1 40 LEU HD22 H 4.291 -6.814 9.040 1.00 . A A . 40 LEU HD22 1 1 23 15907 1 1 40 LEU HD23 H 5.528 -5.674 8.453 1.00 . A A . 40 LEU HD23 1 1 23 15908 1 1 40 LEU HG H 4.659 -8.311 7.090 1.00 . A A . 40 LEU HG 1 1 23 15909 1 1 40 LEU N N 3.950 -6.342 4.899 1.00 . A A . 40 LEU N 1 1 23 15910 1 1 40 LEU O O 4.766 -9.418 4.831 1.00 . A A . 40 LEU O 1 1 23 15911 1 1 41 ILE C C 2.672 -10.079 2.839 1.00 . A A . 41 ILE C 1 1 23 15912 1 1 41 ILE CA C 3.882 -9.515 1.996 1.00 . A A . 41 ILE CA 1 1 23 15913 1 1 41 ILE CB C 4.839 -10.689 1.504 1.00 . A A . 41 ILE CB 1 1 23 15914 1 1 41 ILE CD1 C 6.410 -12.663 2.219 1.00 . A A . 41 ILE CD1 1 1 23 15915 1 1 41 ILE CG1 C 5.736 -11.338 2.612 1.00 . A A . 41 ILE CG1 1 1 23 15916 1 1 41 ILE CG2 C 5.756 -10.109 0.390 1.00 . A A . 41 ILE CG2 1 1 23 15917 1 1 41 ILE H H 4.852 -7.563 2.311 1.00 . A A . 41 ILE H 1 1 23 15918 1 1 41 ILE HA H 3.424 -9.026 1.113 1.00 . A A . 41 ILE HA 1 1 23 15919 1 1 41 ILE HB H 4.225 -11.504 1.074 1.00 . A A . 41 ILE HB 1 1 23 15920 1 1 41 ILE HD11 H 5.668 -13.422 1.910 1.00 . A A . 41 ILE HD11 1 1 23 15921 1 1 41 ILE HD12 H 7.126 -12.536 1.388 1.00 . A A . 41 ILE HD12 1 1 23 15922 1 1 41 ILE HD13 H 6.974 -13.086 3.070 1.00 . A A . 41 ILE HD13 1 1 23 15923 1 1 41 ILE HG12 H 6.512 -10.629 2.959 1.00 . A A . 41 ILE HG12 1 1 23 15924 1 1 41 ILE HG13 H 5.126 -11.555 3.506 1.00 . A A . 41 ILE HG13 1 1 23 15925 1 1 41 ILE HG21 H 5.166 -9.649 -0.425 1.00 . A A . 41 ILE HG21 1 1 23 15926 1 1 41 ILE HG22 H 6.450 -9.335 0.768 1.00 . A A . 41 ILE HG22 1 1 23 15927 1 1 41 ILE HG23 H 6.373 -10.893 -0.086 1.00 . A A . 41 ILE HG23 1 1 23 15928 1 1 41 ILE N N 4.660 -8.464 2.761 1.00 . A A . 41 ILE N 1 1 23 15929 1 1 41 ILE O O 2.649 -11.235 3.275 1.00 . A A . 41 ILE O 1 1 23 15930 1 1 42 MET C C -0.778 -9.162 2.858 1.00 . A A . 42 MET C 1 1 23 15931 1 1 42 MET CA C 0.410 -9.566 3.773 1.00 . A A . 42 MET CA 1 1 23 15932 1 1 42 MET CB C 0.350 -8.835 5.147 1.00 . A A . 42 MET CB 1 1 23 15933 1 1 42 MET CE C 2.105 -9.504 8.873 1.00 . A A . 42 MET CE 1 1 23 15934 1 1 42 MET CG C 1.340 -9.355 6.204 1.00 . A A . 42 MET CG 1 1 23 15935 1 1 42 MET H H 1.792 -8.294 2.603 1.00 . A A . 42 MET H 1 1 23 15936 1 1 42 MET HA H 0.358 -10.655 3.977 1.00 . A A . 42 MET HA 1 1 23 15937 1 1 42 MET HB2 H 0.486 -7.743 5.022 1.00 . A A . 42 MET HB2 1 1 23 15938 1 1 42 MET HB3 H -0.666 -8.950 5.568 1.00 . A A . 42 MET HB3 1 1 23 15939 1 1 42 MET HE1 H 1.890 -10.587 8.837 1.00 . A A . 42 MET HE1 1 1 23 15940 1 1 42 MET HE2 H 3.156 -9.351 8.572 1.00 . A A . 42 MET HE2 1 1 23 15941 1 1 42 MET HE3 H 1.998 -9.169 9.920 1.00 . A A . 42 MET HE3 1 1 23 15942 1 1 42 MET HG2 H 1.264 -10.454 6.303 1.00 . A A . 42 MET HG2 1 1 23 15943 1 1 42 MET HG3 H 2.382 -9.128 5.915 1.00 . A A . 42 MET HG3 1 1 23 15944 1 1 42 MET N N 1.660 -9.211 3.045 1.00 . A A . 42 MET N 1 1 23 15945 1 1 42 MET O O -1.280 -8.033 2.899 1.00 . A A . 42 MET O 1 1 23 15946 1 1 42 MET SD S 0.982 -8.587 7.798 1.00 . A A . 42 MET SD 1 1 23 15947 1 1 43 GLU C C -2.655 -11.290 0.385 1.00 . A A . 43 GLU C 1 1 23 15948 1 1 43 GLU CA C -2.245 -9.907 0.974 1.00 . A A . 43 GLU CA 1 1 23 15949 1 1 43 GLU CB C -1.749 -8.970 -0.176 1.00 . A A . 43 GLU CB 1 1 23 15950 1 1 43 GLU CD C -0.135 -8.350 -2.064 1.00 . A A . 43 GLU CD 1 1 23 15951 1 1 43 GLU CG C -0.495 -9.379 -0.990 1.00 . A A . 43 GLU CG 1 1 23 15952 1 1 43 GLU H H -0.679 -11.004 2.073 1.00 . A A . 43 GLU H 1 1 23 15953 1 1 43 GLU HA H -3.125 -9.441 1.463 1.00 . A A . 43 GLU HA 1 1 23 15954 1 1 43 GLU HB2 H -2.589 -8.815 -0.880 1.00 . A A . 43 GLU HB2 1 1 23 15955 1 1 43 GLU HB3 H -1.573 -7.966 0.255 1.00 . A A . 43 GLU HB3 1 1 23 15956 1 1 43 GLU HE2 H 0.789 -6.644 -2.224 1.00 . A A . 43 GLU HE2 1 1 23 15957 1 1 43 GLU HG2 H 0.371 -9.523 -0.316 1.00 . A A . 43 GLU HG2 1 1 23 15958 1 1 43 GLU HG3 H -0.660 -10.358 -1.476 1.00 . A A . 43 GLU HG3 1 1 23 15959 1 1 43 GLU N N -1.184 -10.115 1.997 1.00 . A A . 43 GLU N 1 1 23 15960 1 1 43 GLU O O -1.836 -12.207 0.233 1.00 . A A . 43 GLU O 1 1 23 15961 1 1 43 GLU OE1 O -0.452 -8.464 -3.247 1.00 . A A . 43 GLU OE1 1 1 23 15962 1 1 43 GLU OE2 O 0.569 -7.290 -1.550 1.00 . A A . 43 GLU OE2 1 1 23 15963 1 1 44 GLY C C -3.957 -12.548 -2.265 1.00 . A A . 44 GLY C 1 1 23 15964 1 1 44 GLY CA C -4.435 -12.555 -0.797 1.00 . A A . 44 GLY CA 1 1 23 15965 1 1 44 GLY H H -4.512 -10.565 0.149 1.00 . A A . 44 GLY H 1 1 23 15966 1 1 44 GLY HA2 H -4.131 -13.502 -0.309 1.00 . A A . 44 GLY HA2 1 1 23 15967 1 1 44 GLY HA3 H -5.540 -12.562 -0.757 1.00 . A A . 44 GLY HA3 1 1 23 15968 1 1 44 GLY N N -3.934 -11.396 -0.020 1.00 . A A . 44 GLY N 1 1 23 15969 1 1 44 GLY O O -3.016 -13.272 -2.604 1.00 . A A . 44 GLY O 1 1 23 15970 1 1 45 LEU C C -4.388 -9.999 -4.852 1.00 . A A . 45 LEU C 1 1 23 15971 1 1 45 LEU CA C -4.155 -11.498 -4.511 1.00 . A A . 45 LEU CA 1 1 23 15972 1 1 45 LEU CB C -4.957 -12.438 -5.463 1.00 . A A . 45 LEU CB 1 1 23 15973 1 1 45 LEU CD1 C -3.125 -12.960 -7.215 1.00 . A A . 45 LEU CD1 1 1 23 15974 1 1 45 LEU CD2 C -5.564 -13.235 -7.806 1.00 . A A . 45 LEU CD2 1 1 23 15975 1 1 45 LEU CG C -4.553 -12.429 -6.967 1.00 . A A . 45 LEU CG 1 1 23 15976 1 1 45 LEU H H -5.352 -11.169 -2.685 1.00 . A A . 45 LEU H 1 1 23 15977 1 1 45 LEU HA H -3.075 -11.735 -4.606 1.00 . A A . 45 LEU HA 1 1 23 15978 1 1 45 LEU HB2 H -4.879 -13.479 -5.093 1.00 . A A . 45 LEU HB2 1 1 23 15979 1 1 45 LEU HB3 H -6.035 -12.195 -5.377 1.00 . A A . 45 LEU HB3 1 1 23 15980 1 1 45 LEU HD11 H -2.997 -13.996 -6.849 1.00 . A A . 45 LEU HD11 1 1 23 15981 1 1 45 LEU HD12 H -2.870 -12.957 -8.291 1.00 . A A . 45 LEU HD12 1 1 23 15982 1 1 45 LEU HD13 H -2.362 -12.337 -6.713 1.00 . A A . 45 LEU HD13 1 1 23 15983 1 1 45 LEU HD21 H -6.590 -12.835 -7.700 1.00 . A A . 45 LEU HD21 1 1 23 15984 1 1 45 LEU HD22 H -5.321 -13.199 -8.884 1.00 . A A . 45 LEU HD22 1 1 23 15985 1 1 45 LEU HD23 H -5.595 -14.301 -7.511 1.00 . A A . 45 LEU HD23 1 1 23 15986 1 1 45 LEU HG H -4.592 -11.386 -7.333 1.00 . A A . 45 LEU HG 1 1 23 15987 1 1 45 LEU N N -4.593 -11.715 -3.108 1.00 . A A . 45 LEU N 1 1 23 15988 1 1 45 LEU O O -5.532 -9.532 -4.885 1.00 . A A . 45 LEU O 1 1 23 15989 1 1 46 SER C C -3.734 -6.892 -4.461 1.00 . A A . 46 SER C 1 1 23 15990 1 1 46 SER CA C -3.235 -7.849 -5.592 1.00 . A A . 46 SER CA 1 1 23 15991 1 1 46 SER CB C -4.103 -7.637 -6.866 1.00 . A A . 46 SER CB 1 1 23 15992 1 1 46 SER H H -2.410 -9.816 -5.042 1.00 . A A . 46 SER H 1 1 23 15993 1 1 46 SER HA H -2.184 -7.602 -5.838 1.00 . A A . 46 SER HA 1 1 23 15994 1 1 46 SER HB2 H -5.177 -7.828 -6.687 1.00 . A A . 46 SER HB2 1 1 23 15995 1 1 46 SER HB3 H -4.042 -6.581 -7.192 1.00 . A A . 46 SER HB3 1 1 23 15996 1 1 46 SER HG H -4.229 -8.274 -8.677 1.00 . A A . 46 SER HG 1 1 23 15997 1 1 46 SER N N -3.278 -9.274 -5.123 1.00 . A A . 46 SER N 1 1 23 15998 1 1 46 SER O O -4.918 -6.864 -4.107 1.00 . A A . 46 SER O 1 1 23 15999 1 1 46 SER OG O -3.650 -8.461 -7.934 1.00 . A A . 46 SER OG 1 1 23 16000 1 1 47 PHE C C -2.028 -3.959 -2.972 1.00 . A A . 47 PHE C 1 1 23 16001 1 1 47 PHE CA C -3.085 -5.095 -2.855 1.00 . A A . 47 PHE CA 1 1 23 16002 1 1 47 PHE CB C -3.030 -5.771 -1.449 1.00 . A A . 47 PHE CB 1 1 23 16003 1 1 47 PHE CD1 C -4.413 -4.099 -0.081 1.00 . A A . 47 PHE CD1 1 1 23 16004 1 1 47 PHE CD2 C -2.254 -4.774 0.764 1.00 . A A . 47 PHE CD2 1 1 23 16005 1 1 47 PHE CE1 C -4.564 -3.235 1.001 1.00 . A A . 47 PHE CE1 1 1 23 16006 1 1 47 PHE CE2 C -2.413 -3.918 1.852 1.00 . A A . 47 PHE CE2 1 1 23 16007 1 1 47 PHE CG C -3.248 -4.864 -0.218 1.00 . A A . 47 PHE CG 1 1 23 16008 1 1 47 PHE CZ C -3.564 -3.144 1.965 1.00 . A A . 47 PHE CZ 1 1 23 16009 1 1 47 PHE H H -1.854 -6.213 -4.304 1.00 . A A . 47 PHE H 1 1 23 16010 1 1 47 PHE HA H -4.102 -4.677 -3.012 1.00 . A A . 47 PHE HA 1 1 23 16011 1 1 47 PHE HB2 H -3.785 -6.580 -1.407 1.00 . A A . 47 PHE HB2 1 1 23 16012 1 1 47 PHE HB3 H -2.063 -6.300 -1.354 1.00 . A A . 47 PHE HB3 1 1 23 16013 1 1 47 PHE HD1 H -5.195 -4.153 -0.825 1.00 . A A . 47 PHE HD1 1 1 23 16014 1 1 47 PHE HD2 H -1.345 -5.354 0.682 1.00 . A A . 47 PHE HD2 1 1 23 16015 1 1 47 PHE HE1 H -5.456 -2.633 1.090 1.00 . A A . 47 PHE HE1 1 1 23 16016 1 1 47 PHE HE2 H -1.638 -3.843 2.600 1.00 . A A . 47 PHE HE2 1 1 23 16017 1 1 47 PHE HZ H -3.680 -2.469 2.799 1.00 . A A . 47 PHE HZ 1 1 23 16018 1 1 47 PHE N N -2.795 -6.100 -3.912 1.00 . A A . 47 PHE N 1 1 23 16019 1 1 47 PHE O O -0.817 -4.209 -2.962 1.00 . A A . 47 PHE O 1 1 23 16020 1 1 48 ALA C C -1.626 -1.038 -1.436 1.00 . A A . 48 ALA C 1 1 23 16021 1 1 48 ALA CA C -1.661 -1.501 -2.907 1.00 . A A . 48 ALA CA 1 1 23 16022 1 1 48 ALA CB C -2.228 -0.391 -3.810 1.00 . A A . 48 ALA CB 1 1 23 16023 1 1 48 ALA H H -3.541 -2.644 -2.968 1.00 . A A . 48 ALA H 1 1 23 16024 1 1 48 ALA HXT H -0.343 -0.814 0.007 1.00 . A A . 48 ALA HXT 1 1 23 16025 1 1 48 ALA HA H -0.629 -1.715 -3.249 1.00 . A A . 48 ALA HA 1 1 23 16026 1 1 48 ALA HB1 H -3.265 -0.109 -3.543 1.00 . A A . 48 ALA HB1 1 1 23 16027 1 1 48 ALA HB2 H -1.616 0.529 -3.751 1.00 . A A . 48 ALA HB2 1 1 23 16028 1 1 48 ALA HB3 H -2.234 -0.696 -4.874 1.00 . A A . 48 ALA HB3 1 1 23 16029 1 1 48 ALA N N -2.517 -2.706 -3.012 1.00 . A A . 48 ALA N 1 1 23 16030 1 1 48 ALA O O -2.620 -0.676 -0.800 1.00 . A A . 48 ALA O 1 1 23 16031 1 1 48 ALA OXT O -0.360 -1.089 -0.913 1.00 . A A . 48 ALA OXT 1 1 24 16032 1 1 1 GLU C C 13.694 13.106 5.109 1.00 . A A . 1 GLU C 1 1 24 16033 1 1 1 GLU CA C 13.271 13.970 3.891 1.00 . A A . 1 GLU CA 1 1 24 16034 1 1 1 GLU CB C 14.512 14.688 3.285 1.00 . A A . 1 GLU CB 1 1 24 16035 1 1 1 GLU CD C 13.976 14.552 0.753 1.00 . A A . 1 GLU CD 1 1 24 16036 1 1 1 GLU CG C 14.297 15.449 1.956 1.00 . A A . 1 GLU CG 1 1 24 16037 1 1 1 GLU H1 H 11.443 14.502 4.754 1.00 . A A . 1 GLU H1 1 1 24 16038 1 1 1 GLU H2 H 12.654 15.581 5.071 1.00 . A A . 1 GLU H2 1 1 24 16039 1 1 1 GLU HA H 12.801 13.332 3.116 1.00 . A A . 1 GLU HA 1 1 24 16040 1 1 1 GLU HB2 H 14.933 15.395 4.026 1.00 . A A . 1 GLU HB2 1 1 24 16041 1 1 1 GLU HB3 H 15.320 13.948 3.124 1.00 . A A . 1 GLU HB3 1 1 24 16042 1 1 1 GLU HE2 H 12.431 13.913 -0.245 1.00 . A A . 1 GLU HE2 1 1 24 16043 1 1 1 GLU HG2 H 13.513 16.219 2.077 1.00 . A A . 1 GLU HG2 1 1 24 16044 1 1 1 GLU HG3 H 15.216 16.018 1.722 1.00 . A A . 1 GLU HG3 1 1 24 16045 1 1 1 GLU N N 12.269 14.959 4.351 1.00 . A A . 1 GLU N 1 1 24 16046 1 1 1 GLU O O 14.219 13.622 6.102 1.00 . A A . 1 GLU O 1 1 24 16047 1 1 1 GLU OE1 O 14.836 13.973 0.092 1.00 . A A . 1 GLU OE1 1 1 24 16048 1 1 1 GLU OE2 O 12.628 14.475 0.508 1.00 . A A . 1 GLU OE2 1 1 24 16049 1 1 2 ASP C C 12.973 11.061 7.367 1.00 . A A . 2 ASP C 1 1 24 16050 1 1 2 ASP CA C 13.756 10.740 6.046 1.00 . A A . 2 ASP CA 1 1 24 16051 1 1 2 ASP CB C 15.301 10.673 6.277 1.00 . A A . 2 ASP CB 1 1 24 16052 1 1 2 ASP CG C 15.762 9.452 7.086 1.00 . A A . 2 ASP CG 1 1 24 16053 1 1 2 ASP H H 13.017 11.509 4.116 1.00 . A A . 2 ASP H 1 1 24 16054 1 1 2 ASP HA H 13.403 9.760 5.669 1.00 . A A . 2 ASP HA 1 1 24 16055 1 1 2 ASP HB2 H 15.822 10.626 5.301 1.00 . A A . 2 ASP HB2 1 1 24 16056 1 1 2 ASP HB3 H 15.682 11.597 6.753 1.00 . A A . 2 ASP HB3 1 1 24 16057 1 1 2 ASP HD2 H 15.756 10.667 8.607 1.00 . A A . 2 ASP HD2 1 1 24 16058 1 1 2 ASP N N 13.455 11.777 5.004 1.00 . A A . 2 ASP N 1 1 24 16059 1 1 2 ASP O O 13.480 11.736 8.270 1.00 . A A . 2 ASP O 1 1 24 16060 1 1 2 ASP OD1 O 15.940 8.339 6.591 1.00 . A A . 2 ASP OD1 1 1 24 16061 1 1 2 ASP OD2 O 15.946 9.746 8.413 1.00 . A A . 2 ASP OD2 1 1 24 16062 1 1 3 ASN C C 9.555 9.907 8.184 1.00 . A A . 3 ASN C 1 1 24 16063 1 1 3 ASN CA C 10.877 10.584 8.656 1.00 . A A . 3 ASN CA 1 1 24 16064 1 1 3 ASN CB C 10.578 11.990 9.249 1.00 . A A . 3 ASN CB 1 1 24 16065 1 1 3 ASN CG C 10.013 13.134 8.372 1.00 . A A . 3 ASN CG 1 1 24 16066 1 1 3 ASN H H 11.464 9.886 6.715 1.00 . A A . 3 ASN H 1 1 24 16067 1 1 3 ASN HA H 11.379 9.992 9.449 1.00 . A A . 3 ASN HA 1 1 24 16068 1 1 3 ASN HB2 H 9.863 11.764 10.059 1.00 . A A . 3 ASN HB2 1 1 24 16069 1 1 3 ASN HB3 H 11.474 12.355 9.787 1.00 . A A . 3 ASN HB3 1 1 24 16070 1 1 3 ASN HD21 H 11.865 13.705 7.857 1.00 . A A . 3 ASN HD21 1 1 24 16071 1 1 3 ASN HD22 H 10.466 14.671 7.167 1.00 . A A . 3 ASN HD22 1 1 24 16072 1 1 3 ASN N N 11.725 10.561 7.442 1.00 . A A . 3 ASN N 1 1 24 16073 1 1 3 ASN ND2 N 10.869 13.918 7.735 1.00 . A A . 3 ASN ND2 1 1 24 16074 1 1 3 ASN O O 8.631 10.507 7.628 1.00 . A A . 3 ASN O 1 1 24 16075 1 1 3 ASN OD1 O 8.801 13.331 8.280 1.00 . A A . 3 ASN OD1 1 1 24 16076 1 1 4 CYS C C 7.647 7.094 9.106 1.00 . A A . 4 CYS C 1 1 24 16077 1 1 4 CYS CA C 8.522 7.657 7.932 1.00 . A A . 4 CYS CA 1 1 24 16078 1 1 4 CYS CB C 9.232 6.545 7.177 1.00 . A A . 4 CYS CB 1 1 24 16079 1 1 4 CYS H H 10.507 8.375 8.726 1.00 . A A . 4 CYS H 1 1 24 16080 1 1 4 CYS HA H 7.838 8.119 7.200 1.00 . A A . 4 CYS HA 1 1 24 16081 1 1 4 CYS HB2 H 8.388 5.906 6.998 1.00 . A A . 4 CYS HB2 1 1 24 16082 1 1 4 CYS HB3 H 9.543 6.825 6.160 1.00 . A A . 4 CYS HB3 1 1 24 16083 1 1 4 CYS N N 9.557 8.602 8.424 1.00 . A A . 4 CYS N 1 1 24 16084 1 1 4 CYS O O 7.890 7.381 10.285 1.00 . A A . 4 CYS O 1 1 24 16085 1 1 4 CYS SG S 10.417 5.500 8.048 1.00 . A A . 4 CYS SG 1 1 24 16086 1 1 5 ILE C C 6.207 4.112 9.726 1.00 . A A . 5 ILE C 1 1 24 16087 1 1 5 ILE CA C 5.769 5.586 9.813 1.00 . A A . 5 ILE CA 1 1 24 16088 1 1 5 ILE CB C 4.205 5.720 9.606 1.00 . A A . 5 ILE CB 1 1 24 16089 1 1 5 ILE CD1 C 2.403 7.446 9.053 1.00 . A A . 5 ILE CD1 1 1 24 16090 1 1 5 ILE CG1 C 3.835 7.200 9.453 1.00 . A A . 5 ILE CG1 1 1 24 16091 1 1 5 ILE CG2 C 3.408 5.080 10.797 1.00 . A A . 5 ILE CG2 1 1 24 16092 1 1 5 ILE H H 6.627 6.013 7.741 1.00 . A A . 5 ILE H 1 1 24 16093 1 1 5 ILE HA H 5.988 6.002 10.808 1.00 . A A . 5 ILE HA 1 1 24 16094 1 1 5 ILE HB H 3.851 5.218 8.715 1.00 . A A . 5 ILE HB 1 1 24 16095 1 1 5 ILE HD11 H 1.725 7.015 9.802 1.00 . A A . 5 ILE HD11 1 1 24 16096 1 1 5 ILE HD12 H 2.183 8.522 8.999 1.00 . A A . 5 ILE HD12 1 1 24 16097 1 1 5 ILE HD13 H 2.171 6.993 8.072 1.00 . A A . 5 ILE HD13 1 1 24 16098 1 1 5 ILE HG12 H 4.055 7.737 10.367 1.00 . A A . 5 ILE HG12 1 1 24 16099 1 1 5 ILE HG13 H 4.452 7.652 8.662 1.00 . A A . 5 ILE HG13 1 1 24 16100 1 1 5 ILE HG21 H 3.655 4.015 10.965 1.00 . A A . 5 ILE HG21 1 1 24 16101 1 1 5 ILE HG22 H 3.519 5.605 11.762 1.00 . A A . 5 ILE HG22 1 1 24 16102 1 1 5 ILE HG23 H 2.315 5.051 10.594 1.00 . A A . 5 ILE HG23 1 1 24 16103 1 1 5 ILE N N 6.611 6.275 8.758 1.00 . A A . 5 ILE N 1 1 24 16104 1 1 5 ILE O O 5.699 3.331 8.924 1.00 . A A . 5 ILE O 1 1 24 16105 1 1 6 ALA C C 6.745 1.195 11.096 1.00 . A A . 6 ALA C 1 1 24 16106 1 1 6 ALA CA C 7.687 2.289 10.454 1.00 . A A . 6 ALA CA 1 1 24 16107 1 1 6 ALA CB C 9.058 2.304 11.158 1.00 . A A . 6 ALA CB 1 1 24 16108 1 1 6 ALA H H 7.388 4.358 11.291 1.00 . A A . 6 ALA H 1 1 24 16109 1 1 6 ALA HA H 7.791 2.050 9.368 1.00 . A A . 6 ALA HA 1 1 24 16110 1 1 6 ALA HB1 H 9.744 3.045 10.707 1.00 . A A . 6 ALA HB1 1 1 24 16111 1 1 6 ALA HB2 H 8.973 2.539 12.236 1.00 . A A . 6 ALA HB2 1 1 24 16112 1 1 6 ALA HB3 H 9.559 1.322 11.077 1.00 . A A . 6 ALA HB3 1 1 24 16113 1 1 6 ALA N N 7.160 3.686 10.558 1.00 . A A . 6 ALA N 1 1 24 16114 1 1 6 ALA O O 7.182 0.074 11.378 1.00 . A A . 6 ALA O 1 1 24 16115 1 1 7 GLU C C 3.170 0.474 11.387 1.00 . A A . 7 GLU C 1 1 24 16116 1 1 7 GLU CA C 4.490 0.748 12.099 1.00 . A A . 7 GLU CA 1 1 24 16117 1 1 7 GLU CB C 4.220 1.522 13.428 1.00 . A A . 7 GLU CB 1 1 24 16118 1 1 7 GLU CD C 5.025 2.258 15.739 1.00 . A A . 7 GLU CD 1 1 24 16119 1 1 7 GLU CG C 5.372 1.498 14.457 1.00 . A A . 7 GLU CG 1 1 24 16120 1 1 7 GLU H H 5.404 2.564 11.159 1.00 . A A . 7 GLU H 1 1 24 16121 1 1 7 GLU HA H 4.878 -0.229 12.290 1.00 . A A . 7 GLU HA 1 1 24 16122 1 1 7 GLU HB2 H 3.937 2.571 13.207 1.00 . A A . 7 GLU HB2 1 1 24 16123 1 1 7 GLU HB3 H 3.325 1.099 13.926 1.00 . A A . 7 GLU HB3 1 1 24 16124 1 1 7 GLU HE2 H 5.068 4.073 16.440 1.00 . A A . 7 GLU HE2 1 1 24 16125 1 1 7 GLU HG2 H 5.626 0.452 14.712 1.00 . A A . 7 GLU HG2 1 1 24 16126 1 1 7 GLU HG3 H 6.293 1.926 14.018 1.00 . A A . 7 GLU HG3 1 1 24 16127 1 1 7 GLU N N 5.463 1.546 11.316 1.00 . A A . 7 GLU N 1 1 24 16128 1 1 7 GLU O O 2.624 1.337 10.714 1.00 . A A . 7 GLU O 1 1 24 16129 1 1 7 GLU OE1 O 4.562 1.716 16.743 1.00 . A A . 7 GLU OE1 1 1 24 16130 1 1 7 GLU OE2 O 5.287 3.600 15.634 1.00 . A A . 7 GLU OE2 1 1 24 16131 1 1 8 ASP C C 0.465 -0.694 12.493 1.00 . A A . 8 ASP C 1 1 24 16132 1 1 8 ASP CA C 1.317 -1.217 11.308 1.00 . A A . 8 ASP CA 1 1 24 16133 1 1 8 ASP CB C 1.151 -2.748 11.238 1.00 . A A . 8 ASP CB 1 1 24 16134 1 1 8 ASP CG C 2.060 -3.438 10.207 1.00 . A A . 8 ASP CG 1 1 24 16135 1 1 8 ASP H H 3.299 -1.339 12.221 1.00 . A A . 8 ASP H 1 1 24 16136 1 1 8 ASP HA H 0.988 -0.839 10.312 1.00 . A A . 8 ASP HA 1 1 24 16137 1 1 8 ASP HB2 H 1.257 -3.146 12.254 1.00 . A A . 8 ASP HB2 1 1 24 16138 1 1 8 ASP HB3 H 0.111 -2.972 10.952 1.00 . A A . 8 ASP HB3 1 1 24 16139 1 1 8 ASP HD2 H 2.313 -4.778 11.595 1.00 . A A . 8 ASP HD2 1 1 24 16140 1 1 8 ASP N N 2.684 -0.764 11.635 1.00 . A A . 8 ASP N 1 1 24 16141 1 1 8 ASP O O 0.778 -0.828 13.684 1.00 . A A . 8 ASP O 1 1 24 16142 1 1 8 ASP OD1 O 2.273 -2.998 9.077 1.00 . A A . 8 ASP OD1 1 1 24 16143 1 1 8 ASP OD2 O 2.598 -4.600 10.696 1.00 . A A . 8 ASP OD2 1 1 24 16144 1 1 9 TYR C C -0.813 1.974 13.634 1.00 . A A . 9 TYR C 1 1 24 16145 1 1 9 TYR CA C -1.551 0.750 12.935 1.00 . A A . 9 TYR CA 1 1 24 16146 1 1 9 TYR CB C -2.256 -0.214 13.962 1.00 . A A . 9 TYR CB 1 1 24 16147 1 1 9 TYR CD1 C -4.041 -1.264 12.444 1.00 . A A . 9 TYR CD1 1 1 24 16148 1 1 9 TYR CD2 C -2.338 -2.700 13.382 1.00 . A A . 9 TYR CD2 1 1 24 16149 1 1 9 TYR CE1 C -4.471 -2.312 11.631 1.00 . A A . 9 TYR CE1 1 1 24 16150 1 1 9 TYR CE2 C -2.771 -3.745 12.568 1.00 . A A . 9 TYR CE2 1 1 24 16151 1 1 9 TYR CG C -2.955 -1.443 13.312 1.00 . A A . 9 TYR CG 1 1 24 16152 1 1 9 TYR CZ C -3.834 -3.549 11.691 1.00 . A A . 9 TYR CZ 1 1 24 16153 1 1 9 TYR H H -0.735 -0.231 11.079 1.00 . A A . 9 TYR H 1 1 24 16154 1 1 9 TYR HA H -2.316 1.209 12.286 1.00 . A A . 9 TYR HA 1 1 24 16155 1 1 9 TYR HB2 H -1.542 -0.538 14.744 1.00 . A A . 9 TYR HB2 1 1 24 16156 1 1 9 TYR HB3 H -3.018 0.362 14.521 1.00 . A A . 9 TYR HB3 1 1 24 16157 1 1 9 TYR HD1 H -4.499 -0.291 12.333 1.00 . A A . 9 TYR HD1 1 1 24 16158 1 1 9 TYR HD2 H -1.466 -2.849 14.002 1.00 . A A . 9 TYR HD2 1 1 24 16159 1 1 9 TYR HE1 H -5.268 -2.153 10.919 1.00 . A A . 9 TYR HE1 1 1 24 16160 1 1 9 TYR HE2 H -2.249 -4.693 12.585 1.00 . A A . 9 TYR HE2 1 1 24 16161 1 1 9 TYR HH H -4.956 -4.255 10.313 1.00 . A A . 9 TYR HH 1 1 24 16162 1 1 9 TYR N N -0.622 -0.069 12.083 1.00 . A A . 9 TYR N 1 1 24 16163 1 1 9 TYR O O -1.254 2.445 14.686 1.00 . A A . 9 TYR O 1 1 24 16164 1 1 9 TYR OH O -4.227 -4.563 10.857 1.00 . A A . 9 TYR OH 1 1 24 16165 1 1 10 GLY C C 0.113 4.970 12.711 1.00 . A A . 10 GLY C 1 1 24 16166 1 1 10 GLY CA C 0.879 3.827 13.371 1.00 . A A . 10 GLY CA 1 1 24 16167 1 1 10 GLY H H 0.514 2.059 12.128 1.00 . A A . 10 GLY H 1 1 24 16168 1 1 10 GLY HA2 H 0.998 3.941 14.452 1.00 . A A . 10 GLY HA2 1 1 24 16169 1 1 10 GLY HA3 H 1.910 3.950 13.032 1.00 . A A . 10 GLY HA3 1 1 24 16170 1 1 10 GLY N N 0.251 2.537 12.996 1.00 . A A . 10 GLY N 1 1 24 16171 1 1 10 GLY O O -0.484 4.845 11.639 1.00 . A A . 10 GLY O 1 1 24 16172 1 1 11 LYS C C -0.153 7.958 11.770 1.00 . A A . 11 LYS C 1 1 24 16173 1 1 11 LYS CA C -0.730 7.254 13.036 1.00 . A A . 11 LYS CA 1 1 24 16174 1 1 11 LYS CB C -0.826 8.324 14.145 1.00 . A A . 11 LYS CB 1 1 24 16175 1 1 11 LYS CD C -1.375 8.997 16.570 1.00 . A A . 11 LYS CD 1 1 24 16176 1 1 11 LYS CE C -1.735 8.558 18.003 1.00 . A A . 11 LYS CE 1 1 24 16177 1 1 11 LYS CG C -1.204 7.839 15.563 1.00 . A A . 11 LYS CG 1 1 24 16178 1 1 11 LYS H H 0.840 5.998 14.149 1.00 . A A . 11 LYS H 1 1 24 16179 1 1 11 LYS HA H -1.760 6.867 12.857 1.00 . A A . 11 LYS HA 1 1 24 16180 1 1 11 LYS HB2 H 0.105 8.899 14.141 1.00 . A A . 11 LYS HB2 1 1 24 16181 1 1 11 LYS HB3 H -1.590 9.061 13.830 1.00 . A A . 11 LYS HB3 1 1 24 16182 1 1 11 LYS HD2 H -0.428 9.568 16.614 1.00 . A A . 11 LYS HD2 1 1 24 16183 1 1 11 LYS HD3 H -2.128 9.718 16.198 1.00 . A A . 11 LYS HD3 1 1 24 16184 1 1 11 LYS HE2 H -1.015 7.803 18.370 1.00 . A A . 11 LYS HE2 1 1 24 16185 1 1 11 LYS HE3 H -1.632 9.423 18.684 1.00 . A A . 11 LYS HE3 1 1 24 16186 1 1 11 LYS HG2 H -2.140 7.252 15.506 1.00 . A A . 11 LYS HG2 1 1 24 16187 1 1 11 LYS HG3 H -0.432 7.140 15.937 1.00 . A A . 11 LYS HG3 1 1 24 16188 1 1 11 LYS HZ1 H -3.212 7.185 17.554 1.00 . A A . 11 LYS HZ1 1 1 24 16189 1 1 11 LYS HZ2 H -3.286 7.734 19.092 1.00 . A A . 11 LYS HZ2 1 1 24 16190 1 1 11 LYS N N 0.149 6.101 13.396 1.00 . A A . 11 LYS N 1 1 24 16191 1 1 11 LYS NZ N -3.108 8.030 18.126 1.00 . A A . 11 LYS NZ 1 1 24 16192 1 1 11 LYS O O 1.003 8.385 11.696 1.00 . A A . 11 LYS O 1 1 24 16193 1 1 12 CYS C C -1.958 9.467 8.977 1.00 . A A . 12 CYS C 1 1 24 16194 1 1 12 CYS CA C -0.820 8.519 9.425 1.00 . A A . 12 CYS CA 1 1 24 16195 1 1 12 CYS CB C -0.770 7.316 8.445 1.00 . A A . 12 CYS CB 1 1 24 16196 1 1 12 CYS H H -1.962 7.756 11.203 1.00 . A A . 12 CYS H 1 1 24 16197 1 1 12 CYS HA H 0.147 9.063 9.386 1.00 . A A . 12 CYS HA 1 1 24 16198 1 1 12 CYS HB2 H -0.547 7.637 7.411 1.00 . A A . 12 CYS HB2 1 1 24 16199 1 1 12 CYS HB3 H 0.018 6.602 8.693 1.00 . A A . 12 CYS HB3 1 1 24 16200 1 1 12 CYS N N -1.060 8.029 10.805 1.00 . A A . 12 CYS N 1 1 24 16201 1 1 12 CYS O O -2.967 9.670 9.664 1.00 . A A . 12 CYS O 1 1 24 16202 1 1 12 CYS SG S -2.250 6.335 8.425 1.00 . A A . 12 CYS SG 1 1 24 16203 1 1 13 THR C C -2.701 10.548 5.564 1.00 . A A . 13 THR C 1 1 24 16204 1 1 13 THR CA C -2.884 10.783 7.096 1.00 . A A . 13 THR CA 1 1 24 16205 1 1 13 THR CB C -2.909 12.345 7.425 1.00 . A A . 13 THR CB 1 1 24 16206 1 1 13 THR CG2 C -2.115 12.824 8.662 1.00 . A A . 13 THR CG2 1 1 24 16207 1 1 13 THR H H -0.897 9.752 7.316 1.00 . A A . 13 THR H 1 1 24 16208 1 1 13 THR HA H -3.865 10.342 7.407 1.00 . A A . 13 THR HA 1 1 24 16209 1 1 13 THR HB H -3.982 12.597 7.514 1.00 . A A . 13 THR HB 1 1 24 16210 1 1 13 THR HG1 H -1.420 12.867 6.326 1.00 . A A . 13 THR HG1 1 1 24 16211 1 1 13 THR HG21 H -2.460 12.342 9.592 1.00 . A A . 13 THR HG21 1 1 24 16212 1 1 13 THR HG22 H -1.031 12.622 8.556 1.00 . A A . 13 THR HG22 1 1 24 16213 1 1 13 THR HG23 H -2.215 13.917 8.802 1.00 . A A . 13 THR HG23 1 1 24 16214 1 1 13 THR N N -1.780 10.041 7.774 1.00 . A A . 13 THR N 1 1 24 16215 1 1 13 THR O O -1.595 10.393 5.030 1.00 . A A . 13 THR O 1 1 24 16216 1 1 13 THR OG1 O -2.341 13.130 6.383 1.00 . A A . 13 THR OG1 1 1 24 16217 1 1 14 TRP C C -3.641 12.188 3.015 1.00 . A A . 14 TRP C 1 1 24 16218 1 1 14 TRP CA C -3.872 10.685 3.369 1.00 . A A . 14 TRP CA 1 1 24 16219 1 1 14 TRP CB C -5.215 10.132 2.819 1.00 . A A . 14 TRP CB 1 1 24 16220 1 1 14 TRP CD1 C -5.754 7.816 3.938 1.00 . A A . 14 TRP CD1 1 1 24 16221 1 1 14 TRP CD2 C -4.809 7.685 1.929 1.00 . A A . 14 TRP CD2 1 1 24 16222 1 1 14 TRP CE2 C -4.988 6.381 2.458 1.00 . A A . 14 TRP CE2 1 1 24 16223 1 1 14 TRP CE3 C -4.193 7.869 0.664 1.00 . A A . 14 TRP CE3 1 1 24 16224 1 1 14 TRP CG C -5.284 8.595 2.860 1.00 . A A . 14 TRP CG 1 1 24 16225 1 1 14 TRP CH2 C -3.958 5.451 0.475 1.00 . A A . 14 TRP CH2 1 1 24 16226 1 1 14 TRP CZ2 C -4.547 5.254 1.725 1.00 . A A . 14 TRP CZ2 1 1 24 16227 1 1 14 TRP CZ3 C -3.783 6.739 -0.047 1.00 . A A . 14 TRP CZ3 1 1 24 16228 1 1 14 TRP H H -4.654 10.826 5.465 1.00 . A A . 14 TRP H 1 1 24 16229 1 1 14 TRP HA H -3.054 10.063 2.945 1.00 . A A . 14 TRP HA 1 1 24 16230 1 1 14 TRP HB2 H -6.078 10.573 3.354 1.00 . A A . 14 TRP HB2 1 1 24 16231 1 1 14 TRP HB3 H -5.344 10.456 1.768 1.00 . A A . 14 TRP HB3 1 1 24 16232 1 1 14 TRP HD1 H -6.158 8.227 4.850 1.00 . A A . 14 TRP HD1 1 1 24 16233 1 1 14 TRP HE1 H -5.806 5.661 4.338 1.00 . A A . 14 TRP HE1 1 1 24 16234 1 1 14 TRP HE3 H -4.038 8.858 0.256 1.00 . A A . 14 TRP HE3 1 1 24 16235 1 1 14 TRP HH2 H -3.620 4.597 -0.092 1.00 . A A . 14 TRP HH2 1 1 24 16236 1 1 14 TRP HZ2 H -4.653 4.255 2.120 1.00 . A A . 14 TRP HZ2 1 1 24 16237 1 1 14 TRP HZ3 H -3.314 6.861 -1.012 1.00 . A A . 14 TRP HZ3 1 1 24 16238 1 1 14 TRP N N -3.844 10.631 4.863 1.00 . A A . 14 TRP N 1 1 24 16239 1 1 14 TRP NE1 N -5.578 6.439 3.710 1.00 . A A . 14 TRP NE1 1 1 24 16240 1 1 14 TRP O O -4.524 13.043 3.143 1.00 . A A . 14 TRP O 1 1 24 16241 1 1 15 GLY C C -1.002 14.139 3.788 1.00 . A A . 15 GLY C 1 1 24 16242 1 1 15 GLY CA C -1.827 13.834 2.504 1.00 . A A . 15 GLY CA 1 1 24 16243 1 1 15 GLY H H -1.776 11.639 2.579 1.00 . A A . 15 GLY H 1 1 24 16244 1 1 15 GLY HA2 H -1.183 13.892 1.606 1.00 . A A . 15 GLY HA2 1 1 24 16245 1 1 15 GLY HA3 H -2.617 14.593 2.361 1.00 . A A . 15 GLY HA3 1 1 24 16246 1 1 15 GLY N N -2.385 12.463 2.631 1.00 . A A . 15 GLY N 1 1 24 16247 1 1 15 GLY O O -1.335 15.045 4.555 1.00 . A A . 15 GLY O 1 1 24 16248 1 1 16 GLY C C 1.999 12.288 5.078 1.00 . A A . 16 GLY C 1 1 24 16249 1 1 16 GLY CA C 0.828 13.266 5.255 1.00 . A A . 16 GLY CA 1 1 24 16250 1 1 16 GLY H H 0.182 12.640 3.254 1.00 . A A . 16 GLY H 1 1 24 16251 1 1 16 GLY HA2 H 1.183 14.219 5.672 1.00 . A A . 16 GLY HA2 1 1 24 16252 1 1 16 GLY HA3 H 0.147 12.877 6.037 1.00 . A A . 16 GLY HA3 1 1 24 16253 1 1 16 GLY N N 0.051 13.334 3.998 1.00 . A A . 16 GLY N 1 1 24 16254 1 1 16 GLY O O 2.495 12.028 3.973 1.00 . A A . 16 GLY O 1 1 24 16255 1 1 17 THR C C 2.508 9.288 6.025 1.00 . A A . 17 THR C 1 1 24 16256 1 1 17 THR CA C 3.380 10.578 6.211 1.00 . A A . 17 THR CA 1 1 24 16257 1 1 17 THR CB C 4.237 10.436 7.530 1.00 . A A . 17 THR CB 1 1 24 16258 1 1 17 THR CG2 C 5.579 9.720 7.253 1.00 . A A . 17 THR CG2 1 1 24 16259 1 1 17 THR H H 1.994 12.178 7.034 1.00 . A A . 17 THR H 1 1 24 16260 1 1 17 THR HA H 4.082 10.715 5.360 1.00 . A A . 17 THR HA 1 1 24 16261 1 1 17 THR HB H 3.694 9.819 8.280 1.00 . A A . 17 THR HB 1 1 24 16262 1 1 17 THR HG1 H 5.074 11.552 8.856 1.00 . A A . 17 THR HG1 1 1 24 16263 1 1 17 THR HG21 H 5.446 8.706 6.840 1.00 . A A . 17 THR HG21 1 1 24 16264 1 1 17 THR HG22 H 6.227 10.257 6.537 1.00 . A A . 17 THR HG22 1 1 24 16265 1 1 17 THR HG23 H 6.164 9.578 8.181 1.00 . A A . 17 THR HG23 1 1 24 16266 1 1 17 THR N N 2.421 11.727 6.217 1.00 . A A . 17 THR N 1 1 24 16267 1 1 17 THR O O 1.406 9.125 6.577 1.00 . A A . 17 THR O 1 1 24 16268 1 1 17 THR OG1 O 4.552 11.717 8.067 1.00 . A A . 17 THR OG1 1 1 24 16269 1 1 18 LYS C C 3.733 6.083 5.639 1.00 . A A . 18 LYS C 1 1 24 16270 1 1 18 LYS CA C 2.616 6.988 5.057 1.00 . A A . 18 LYS CA 1 1 24 16271 1 1 18 LYS CB C 2.317 6.645 3.564 1.00 . A A . 18 LYS CB 1 1 24 16272 1 1 18 LYS CD C 0.185 8.160 3.161 1.00 . A A . 18 LYS CD 1 1 24 16273 1 1 18 LYS CE C -0.861 7.102 3.572 1.00 . A A . 18 LYS CE 1 1 24 16274 1 1 18 LYS CG C 1.565 7.660 2.664 1.00 . A A . 18 LYS CG 1 1 24 16275 1 1 18 LYS H H 4.035 8.665 4.944 1.00 . A A . 18 LYS H 1 1 24 16276 1 1 18 LYS HA H 1.686 6.770 5.610 1.00 . A A . 18 LYS HA 1 1 24 16277 1 1 18 LYS HB2 H 3.249 6.309 3.082 1.00 . A A . 18 LYS HB2 1 1 24 16278 1 1 18 LYS HB3 H 1.717 5.714 3.559 1.00 . A A . 18 LYS HB3 1 1 24 16279 1 1 18 LYS HD2 H 0.346 8.830 4.024 1.00 . A A . 18 LYS HD2 1 1 24 16280 1 1 18 LYS HD3 H -0.252 8.817 2.386 1.00 . A A . 18 LYS HD3 1 1 24 16281 1 1 18 LYS HE2 H -0.505 6.530 4.448 1.00 . A A . 18 LYS HE2 1 1 24 16282 1 1 18 LYS HE3 H -1.785 7.610 3.905 1.00 . A A . 18 LYS HE3 1 1 24 16283 1 1 18 LYS HG2 H 2.216 8.537 2.488 1.00 . A A . 18 LYS HG2 1 1 24 16284 1 1 18 LYS HG3 H 1.438 7.205 1.664 1.00 . A A . 18 LYS HG3 1 1 24 16285 1 1 18 LYS HZ1 H -1.878 5.470 2.824 1.00 . A A . 18 LYS HZ1 1 1 24 16286 1 1 18 LYS HZ2 H -0.370 5.628 2.213 1.00 . A A . 18 LYS HZ2 1 1 24 16287 1 1 18 LYS N N 3.088 8.387 5.224 1.00 . A A . 18 LYS N 1 1 24 16288 1 1 18 LYS NZ N -1.201 6.164 2.488 1.00 . A A . 18 LYS NZ 1 1 24 16289 1 1 18 LYS O O 4.799 6.502 6.127 1.00 . A A . 18 LYS O 1 1 24 16290 1 1 19 CYS C C 5.574 3.531 5.396 1.00 . A A . 19 CYS C 1 1 24 16291 1 1 19 CYS CA C 4.340 3.815 6.297 1.00 . A A . 19 CYS CA 1 1 24 16292 1 1 19 CYS CB C 3.550 2.566 6.728 1.00 . A A . 19 CYS CB 1 1 24 16293 1 1 19 CYS H H 2.592 4.612 5.053 1.00 . A A . 19 CYS H 1 1 24 16294 1 1 19 CYS HA H 4.635 4.329 7.237 1.00 . A A . 19 CYS HA 1 1 24 16295 1 1 19 CYS HB2 H 2.742 2.318 6.017 1.00 . A A . 19 CYS HB2 1 1 24 16296 1 1 19 CYS HB3 H 4.199 1.669 6.789 1.00 . A A . 19 CYS HB3 1 1 24 16297 1 1 19 CYS N N 3.443 4.780 5.615 1.00 . A A . 19 CYS N 1 1 24 16298 1 1 19 CYS O O 5.587 3.500 4.162 1.00 . A A . 19 CYS O 1 1 24 16299 1 1 19 CYS SG S 2.891 2.987 8.349 1.00 . A A . 19 CYS SG 1 1 24 16300 1 1 20 CYS C C 8.510 2.639 4.641 1.00 . A A . 20 CYS C 1 1 24 16301 1 1 20 CYS CA C 8.065 3.511 5.854 1.00 . A A . 20 CYS CA 1 1 24 16302 1 1 20 CYS CB C 8.872 3.061 7.091 1.00 . A A . 20 CYS CB 1 1 24 16303 1 1 20 CYS H H 6.371 3.489 7.203 1.00 . A A . 20 CYS H 1 1 24 16304 1 1 20 CYS HA H 8.177 4.591 5.738 1.00 . A A . 20 CYS HA 1 1 24 16305 1 1 20 CYS HB2 H 8.414 3.460 7.998 1.00 . A A . 20 CYS HB2 1 1 24 16306 1 1 20 CYS HB3 H 8.929 1.964 7.219 1.00 . A A . 20 CYS HB3 1 1 24 16307 1 1 20 CYS N N 6.637 3.449 6.213 1.00 . A A . 20 CYS N 1 1 24 16308 1 1 20 CYS O O 9.188 3.159 3.752 1.00 . A A . 20 CYS O 1 1 24 16309 1 1 20 CYS SG S 10.520 3.783 6.999 1.00 . A A . 20 CYS SG 1 1 24 16310 1 1 21 ARG C C 7.560 0.258 2.366 1.00 . A A . 21 ARG C 1 1 24 16311 1 1 21 ARG CA C 8.572 0.375 3.554 1.00 . A A . 21 ARG CA 1 1 24 16312 1 1 21 ARG CB C 8.778 -1.002 4.257 1.00 . A A . 21 ARG CB 1 1 24 16313 1 1 21 ARG CD C 10.092 -2.475 5.895 1.00 . A A . 21 ARG CD 1 1 24 16314 1 1 21 ARG CG C 9.975 -1.090 5.234 1.00 . A A . 21 ARG CG 1 1 24 16315 1 1 21 ARG CZ C 11.710 -3.453 7.566 1.00 . A A . 21 ARG CZ 1 1 24 16316 1 1 21 ARG H H 7.478 1.144 5.362 1.00 . A A . 21 ARG H 1 1 24 16317 1 1 21 ARG HA H 9.499 0.738 3.091 1.00 . A A . 21 ARG HA 1 1 24 16318 1 1 21 ARG HB2 H 7.847 -1.309 4.773 1.00 . A A . 21 ARG HB2 1 1 24 16319 1 1 21 ARG HB3 H 8.940 -1.780 3.486 1.00 . A A . 21 ARG HB3 1 1 24 16320 1 1 21 ARG HD2 H 9.167 -2.712 6.453 1.00 . A A . 21 ARG HD2 1 1 24 16321 1 1 21 ARG HD3 H 10.205 -3.260 5.124 1.00 . A A . 21 ARG HD3 1 1 24 16322 1 1 21 ARG HG2 H 10.908 -0.850 4.688 1.00 . A A . 21 ARG HG2 1 1 24 16323 1 1 21 ARG HG3 H 9.876 -0.316 6.019 1.00 . A A . 21 ARG HG3 1 1 24 16324 1 1 21 ARG HH11 H 10.318 -4.808 7.045 1.00 . A A . 21 ARG HH11 1 1 24 16325 1 1 21 ARG HH12 H 11.589 -5.338 8.258 1.00 . A A . 21 ARG HH12 1 1 24 16326 1 1 21 ARG HH21 H 13.191 -2.282 8.233 1.00 . A A . 21 ARG HH21 1 1 24 16327 1 1 21 ARG HH22 H 13.114 -3.994 8.887 1.00 . A A . 21 ARG HH22 1 1 24 16328 1 1 21 ARG N N 8.157 1.339 4.629 1.00 . A A . 21 ARG N 1 1 24 16329 1 1 21 ARG NE N 11.264 -2.515 6.827 1.00 . A A . 21 ARG NE 1 1 24 16330 1 1 21 ARG NH1 N 11.148 -4.657 7.629 1.00 . A A . 21 ARG NH1 1 1 24 16331 1 1 21 ARG NH2 N 12.780 -3.219 8.304 1.00 . A A . 21 ARG NH2 1 1 24 16332 1 1 21 ARG O O 7.384 -0.795 1.743 1.00 . A A . 21 ARG O 1 1 24 16333 1 1 22 GLY C C 4.570 0.783 1.340 1.00 . A A . 22 GLY C 1 1 24 16334 1 1 22 GLY CA C 5.880 1.517 1.021 1.00 . A A . 22 GLY CA 1 1 24 16335 1 1 22 GLY H H 7.152 2.053 2.816 1.00 . A A . 22 GLY H 1 1 24 16336 1 1 22 GLY HA2 H 5.674 2.590 0.851 1.00 . A A . 22 GLY HA2 1 1 24 16337 1 1 22 GLY HA3 H 6.260 1.150 0.065 1.00 . A A . 22 GLY HA3 1 1 24 16338 1 1 22 GLY N N 6.936 1.393 2.055 1.00 . A A . 22 GLY N 1 1 24 16339 1 1 22 GLY O O 4.158 -0.138 0.629 1.00 . A A . 22 GLY O 1 1 24 16340 1 1 23 ARG C C 1.631 1.546 3.186 1.00 . A A . 23 ARG C 1 1 24 16341 1 1 23 ARG CA C 2.824 0.533 3.075 1.00 . A A . 23 ARG CA 1 1 24 16342 1 1 23 ARG CB C 3.256 0.010 4.471 1.00 . A A . 23 ARG CB 1 1 24 16343 1 1 23 ARG CD C 3.406 -2.543 4.062 1.00 . A A . 23 ARG CD 1 1 24 16344 1 1 23 ARG CG C 4.121 -1.262 4.533 1.00 . A A . 23 ARG CG 1 1 24 16345 1 1 23 ARG CZ C 5.180 -4.248 3.470 1.00 . A A . 23 ARG CZ 1 1 24 16346 1 1 23 ARG H H 4.580 1.879 2.948 1.00 . A A . 23 ARG H 1 1 24 16347 1 1 23 ARG HA H 2.516 -0.337 2.477 1.00 . A A . 23 ARG HA 1 1 24 16348 1 1 23 ARG HB2 H 3.870 0.786 4.941 1.00 . A A . 23 ARG HB2 1 1 24 16349 1 1 23 ARG HB3 H 2.384 -0.118 5.140 1.00 . A A . 23 ARG HB3 1 1 24 16350 1 1 23 ARG HD2 H 2.477 -2.691 4.643 1.00 . A A . 23 ARG HD2 1 1 24 16351 1 1 23 ARG HD3 H 3.087 -2.450 3.008 1.00 . A A . 23 ARG HD3 1 1 24 16352 1 1 23 ARG HG2 H 5.049 -1.096 3.954 1.00 . A A . 23 ARG HG2 1 1 24 16353 1 1 23 ARG HG3 H 4.452 -1.388 5.583 1.00 . A A . 23 ARG HG3 1 1 24 16354 1 1 23 ARG HH11 H 5.054 -2.845 2.037 1.00 . A A . 23 ARG HH11 1 1 24 16355 1 1 23 ARG HH12 H 6.282 -4.186 1.790 1.00 . A A . 23 ARG HH12 1 1 24 16356 1 1 23 ARG HH21 H 5.485 -5.749 4.760 1.00 . A A . 23 ARG HH21 1 1 24 16357 1 1 23 ARG HH22 H 6.510 -5.727 3.237 1.00 . A A . 23 ARG HH22 1 1 24 16358 1 1 23 ARG N N 3.971 1.222 2.444 1.00 . A A . 23 ARG N 1 1 24 16359 1 1 23 ARG NE N 4.276 -3.752 4.221 1.00 . A A . 23 ARG NE 1 1 24 16360 1 1 23 ARG NH1 N 5.543 -3.704 2.313 1.00 . A A . 23 ARG NH1 1 1 24 16361 1 1 23 ARG NH2 N 5.787 -5.353 3.862 1.00 . A A . 23 ARG NH2 1 1 24 16362 1 1 23 ARG O O 1.828 2.649 3.725 1.00 . A A . 23 ARG O 1 1 24 16363 1 1 24 PRO C C -1.424 2.254 4.181 1.00 . A A . 24 PRO C 1 1 24 16364 1 1 24 PRO CA C -0.775 2.145 2.765 1.00 . A A . 24 PRO CA 1 1 24 16365 1 1 24 PRO CB C -1.703 1.538 1.686 1.00 . A A . 24 PRO CB 1 1 24 16366 1 1 24 PRO CD C 0.062 -0.042 2.012 1.00 . A A . 24 PRO CD 1 1 24 16367 1 1 24 PRO CG C -1.437 0.035 1.739 1.00 . A A . 24 PRO CG 1 1 24 16368 1 1 24 PRO HA H -0.480 3.172 2.474 1.00 . A A . 24 PRO HA 1 1 24 16369 1 1 24 PRO HB2 H -2.773 1.779 1.829 1.00 . A A . 24 PRO HB2 1 1 24 16370 1 1 24 PRO HB3 H -1.433 1.935 0.689 1.00 . A A . 24 PRO HB3 1 1 24 16371 1 1 24 PRO HD2 H 0.310 -0.933 2.620 1.00 . A A . 24 PRO HD2 1 1 24 16372 1 1 24 PRO HD3 H 0.624 -0.101 1.061 1.00 . A A . 24 PRO HD3 1 1 24 16373 1 1 24 PRO HG2 H -2.005 -0.425 2.570 1.00 . A A . 24 PRO HG2 1 1 24 16374 1 1 24 PRO HG3 H -1.731 -0.489 0.812 1.00 . A A . 24 PRO HG3 1 1 24 16375 1 1 24 PRO N N 0.386 1.221 2.712 1.00 . A A . 24 PRO N 1 1 24 16376 1 1 24 PRO O O -0.938 1.687 5.169 1.00 . A A . 24 PRO O 1 1 24 16377 1 1 25 CYS C C -4.760 2.913 5.330 1.00 . A A . 25 CYS C 1 1 24 16378 1 1 25 CYS CA C -3.258 3.274 5.509 1.00 . A A . 25 CYS CA 1 1 24 16379 1 1 25 CYS CB C -3.073 4.764 5.902 1.00 . A A . 25 CYS CB 1 1 24 16380 1 1 25 CYS H H -2.810 3.442 3.357 1.00 . A A . 25 CYS H 1 1 24 16381 1 1 25 CYS HA H -2.839 2.653 6.324 1.00 . A A . 25 CYS HA 1 1 24 16382 1 1 25 CYS HB2 H -2.724 5.368 5.058 1.00 . A A . 25 CYS HB2 1 1 24 16383 1 1 25 CYS HB3 H -4.019 5.196 6.278 1.00 . A A . 25 CYS HB3 1 1 24 16384 1 1 25 CYS N N -2.525 3.019 4.247 1.00 . A A . 25 CYS N 1 1 24 16385 1 1 25 CYS O O -5.377 3.066 4.271 1.00 . A A . 25 CYS O 1 1 24 16386 1 1 25 CYS SG S -1.845 4.832 7.193 1.00 . A A . 25 CYS SG 1 1 24 16387 1 1 26 ARG C C -7.104 3.085 7.866 1.00 . A A . 26 ARG C 1 1 24 16388 1 1 26 ARG CA C -6.771 2.201 6.638 1.00 . A A . 26 ARG CA 1 1 24 16389 1 1 26 ARG CB C -7.088 0.697 6.868 1.00 . A A . 26 ARG CB 1 1 24 16390 1 1 26 ARG CD C -9.069 0.241 5.276 1.00 . A A . 26 ARG CD 1 1 24 16391 1 1 26 ARG CG C -8.577 0.301 6.736 1.00 . A A . 26 ARG CG 1 1 24 16392 1 1 26 ARG CZ C -11.198 -0.223 4.043 1.00 . A A . 26 ARG CZ 1 1 24 16393 1 1 26 ARG H H -4.723 2.517 7.281 1.00 . A A . 26 ARG H 1 1 24 16394 1 1 26 ARG HA H -7.324 2.545 5.740 1.00 . A A . 26 ARG HA 1 1 24 16395 1 1 26 ARG HB2 H -6.504 0.075 6.160 1.00 . A A . 26 ARG HB2 1 1 24 16396 1 1 26 ARG HB3 H -6.722 0.385 7.865 1.00 . A A . 26 ARG HB3 1 1 24 16397 1 1 26 ARG HD2 H -8.934 1.224 4.786 1.00 . A A . 26 ARG HD2 1 1 24 16398 1 1 26 ARG HD3 H -8.452 -0.481 4.708 1.00 . A A . 26 ARG HD3 1 1 24 16399 1 1 26 ARG HG2 H -8.712 -0.695 7.200 1.00 . A A . 26 ARG HG2 1 1 24 16400 1 1 26 ARG HG3 H -9.204 0.991 7.332 1.00 . A A . 26 ARG HG3 1 1 24 16401 1 1 26 ARG HH11 H -9.725 0.398 2.819 1.00 . A A . 26 ARG HH11 1 1 24 16402 1 1 26 ARG HH12 H -11.344 0.010 2.048 1.00 . A A . 26 ARG HH12 1 1 24 16403 1 1 26 ARG HH21 H -12.815 -0.856 5.040 1.00 . A A . 26 ARG HH21 1 1 24 16404 1 1 26 ARG HH22 H -12.974 -0.651 3.223 1.00 . A A . 26 ARG HH22 1 1 24 16405 1 1 26 ARG N N -5.321 2.423 6.448 1.00 . A A . 26 ARG N 1 1 24 16406 1 1 26 ARG NE N -10.491 -0.167 5.189 1.00 . A A . 26 ARG NE 1 1 24 16407 1 1 26 ARG NH1 N -10.705 0.095 2.846 1.00 . A A . 26 ARG NH1 1 1 24 16408 1 1 26 ARG NH2 N -12.456 -0.617 4.108 1.00 . A A . 26 ARG NH2 1 1 24 16409 1 1 26 ARG O O -6.519 2.923 8.949 1.00 . A A . 26 ARG O 1 1 24 16410 1 1 27 CYS C C -8.973 4.579 9.993 1.00 . A A . 27 CYS C 1 1 24 16411 1 1 27 CYS CA C -8.196 5.100 8.736 1.00 . A A . 27 CYS CA 1 1 24 16412 1 1 27 CYS CB C -8.960 6.290 8.120 1.00 . A A . 27 CYS CB 1 1 24 16413 1 1 27 CYS H H -8.431 4.127 6.762 1.00 . A A . 27 CYS H 1 1 24 16414 1 1 27 CYS HA H -7.171 5.426 8.981 1.00 . A A . 27 CYS HA 1 1 24 16415 1 1 27 CYS HB2 H -9.990 6.038 7.892 1.00 . A A . 27 CYS HB2 1 1 24 16416 1 1 27 CYS HB3 H -9.028 7.112 8.856 1.00 . A A . 27 CYS HB3 1 1 24 16417 1 1 27 CYS N N -8.020 4.056 7.699 1.00 . A A . 27 CYS N 1 1 24 16418 1 1 27 CYS O O -9.565 3.493 10.016 1.00 . A A . 27 CYS O 1 1 24 16419 1 1 27 CYS SG S -8.107 6.948 6.682 1.00 . A A . 27 CYS SG 1 1 24 16420 1 1 28 SER C C -11.066 5.101 12.407 1.00 . A A . 28 SER C 1 1 24 16421 1 1 28 SER CA C -9.497 5.097 12.390 1.00 . A A . 28 SER CA 1 1 24 16422 1 1 28 SER CB C -8.834 6.154 13.330 1.00 . A A . 28 SER CB 1 1 24 16423 1 1 28 SER H H -8.381 6.261 10.887 1.00 . A A . 28 SER H 1 1 24 16424 1 1 28 SER HA H -9.206 4.095 12.746 1.00 . A A . 28 SER HA 1 1 24 16425 1 1 28 SER HB2 H -7.767 6.323 13.089 1.00 . A A . 28 SER HB2 1 1 24 16426 1 1 28 SER HB3 H -9.342 7.132 13.247 1.00 . A A . 28 SER HB3 1 1 24 16427 1 1 28 SER HG H -8.464 6.427 15.197 1.00 . A A . 28 SER HG 1 1 24 16428 1 1 28 SER N N -8.929 5.409 11.052 1.00 . A A . 28 SER N 1 1 24 16429 1 1 28 SER O O -11.762 5.015 11.389 1.00 . A A . 28 SER O 1 1 24 16430 1 1 28 SER OG O -8.883 5.730 14.687 1.00 . A A . 28 SER OG 1 1 24 16431 1 1 29 MET C C -13.986 6.040 13.474 1.00 . A A . 29 MET C 1 1 24 16432 1 1 29 MET CA C -13.022 4.929 13.985 1.00 . A A . 29 MET CA 1 1 24 16433 1 1 29 MET CB C -13.071 4.838 15.536 1.00 . A A . 29 MET CB 1 1 24 16434 1 1 29 MET CE C -12.218 7.058 18.968 1.00 . A A . 29 MET CE 1 1 24 16435 1 1 29 MET CG C -12.678 6.031 16.433 1.00 . A A . 29 MET CG 1 1 24 16436 1 1 29 MET H H -10.842 5.320 14.316 1.00 . A A . 29 MET H 1 1 24 16437 1 1 29 MET HA H -13.377 3.976 13.546 1.00 . A A . 29 MET HA 1 1 24 16438 1 1 29 MET HB2 H -14.087 4.530 15.824 1.00 . A A . 29 MET HB2 1 1 24 16439 1 1 29 MET HB3 H -12.408 4.017 15.821 1.00 . A A . 29 MET HB3 1 1 24 16440 1 1 29 MET HE1 H -13.013 7.803 18.779 1.00 . A A . 29 MET HE1 1 1 24 16441 1 1 29 MET HE2 H -12.136 6.915 20.060 1.00 . A A . 29 MET HE2 1 1 24 16442 1 1 29 MET HE3 H -11.261 7.472 18.603 1.00 . A A . 29 MET HE3 1 1 24 16443 1 1 29 MET HG2 H -11.703 6.458 16.135 1.00 . A A . 29 MET HG2 1 1 24 16444 1 1 29 MET HG3 H -13.428 6.834 16.353 1.00 . A A . 29 MET HG3 1 1 24 16445 1 1 29 MET N N -11.582 5.130 13.635 1.00 . A A . 29 MET N 1 1 24 16446 1 1 29 MET O O -15.075 5.746 12.975 1.00 . A A . 29 MET O 1 1 24 16447 1 1 29 MET SD S -12.595 5.492 18.153 1.00 . A A . 29 MET SD 1 1 24 16448 1 1 30 ILE C C -14.075 8.518 11.498 1.00 . A A . 30 ILE C 1 1 24 16449 1 1 30 ILE CA C -14.262 8.492 13.056 1.00 . A A . 30 ILE CA 1 1 24 16450 1 1 30 ILE CB C -13.714 9.800 13.765 1.00 . A A . 30 ILE CB 1 1 24 16451 1 1 30 ILE CD1 C -13.327 10.831 16.145 1.00 . A A . 30 ILE CD1 1 1 24 16452 1 1 30 ILE CG1 C -14.106 9.827 15.278 1.00 . A A . 30 ILE CG1 1 1 24 16453 1 1 30 ILE CG2 C -14.304 11.084 13.110 1.00 . A A . 30 ILE CG2 1 1 24 16454 1 1 30 ILE H H -12.595 7.249 14.005 1.00 . A A . 30 ILE H 1 1 24 16455 1 1 30 ILE HA H -15.344 8.399 13.260 1.00 . A A . 30 ILE HA 1 1 24 16456 1 1 30 ILE HB H -12.610 9.834 13.673 1.00 . A A . 30 ILE HB 1 1 24 16457 1 1 30 ILE HD11 H -12.236 10.664 16.080 1.00 . A A . 30 ILE HD11 1 1 24 16458 1 1 30 ILE HD12 H -13.524 11.878 15.852 1.00 . A A . 30 ILE HD12 1 1 24 16459 1 1 30 ILE HD13 H -13.609 10.735 17.209 1.00 . A A . 30 ILE HD13 1 1 24 16460 1 1 30 ILE HG12 H -15.193 9.998 15.399 1.00 . A A . 30 ILE HG12 1 1 24 16461 1 1 30 ILE HG13 H -13.935 8.838 15.732 1.00 . A A . 30 ILE HG13 1 1 24 16462 1 1 30 ILE HG21 H -15.410 11.097 13.138 1.00 . A A . 30 ILE HG21 1 1 24 16463 1 1 30 ILE HG22 H -13.952 12.008 13.605 1.00 . A A . 30 ILE HG22 1 1 24 16464 1 1 30 ILE HG23 H -14.004 11.185 12.051 1.00 . A A . 30 ILE HG23 1 1 24 16465 1 1 30 ILE N N -13.544 7.295 13.599 1.00 . A A . 30 ILE N 1 1 24 16466 1 1 30 ILE O O -15.074 8.527 10.773 1.00 . A A . 30 ILE O 1 1 24 16467 1 1 31 GLY C C -11.249 9.634 9.345 1.00 . A A . 31 GLY C 1 1 24 16468 1 1 31 GLY CA C -12.521 8.799 9.583 1.00 . A A . 31 GLY CA 1 1 24 16469 1 1 31 GLY H H -12.123 8.550 11.768 1.00 . A A . 31 GLY H 1 1 24 16470 1 1 31 GLY HA2 H -12.411 7.822 9.081 1.00 . A A . 31 GLY HA2 1 1 24 16471 1 1 31 GLY HA3 H -13.364 9.299 9.067 1.00 . A A . 31 GLY HA3 1 1 24 16472 1 1 31 GLY N N -12.823 8.554 11.015 1.00 . A A . 31 GLY N 1 1 24 16473 1 1 31 GLY O O -10.394 9.238 8.550 1.00 . A A . 31 GLY O 1 1 24 16474 1 1 32 THR C C -8.936 11.114 11.131 1.00 . A A . 32 THR C 1 1 24 16475 1 1 32 THR CA C -9.905 11.621 10.018 1.00 . A A . 32 THR CA 1 1 24 16476 1 1 32 THR CB C -10.224 13.129 10.274 1.00 . A A . 32 THR CB 1 1 24 16477 1 1 32 THR CG2 C -11.040 13.765 9.132 1.00 . A A . 32 THR CG2 1 1 24 16478 1 1 32 THR H H -11.868 10.883 10.745 1.00 . A A . 32 THR H 1 1 24 16479 1 1 32 THR HA H -9.405 11.538 9.030 1.00 . A A . 32 THR HA 1 1 24 16480 1 1 32 THR HB H -9.252 13.656 10.361 1.00 . A A . 32 THR HB 1 1 24 16481 1 1 32 THR HG1 H -11.801 12.815 11.338 1.00 . A A . 32 THR HG1 1 1 24 16482 1 1 32 THR HG21 H -10.519 13.675 8.161 1.00 . A A . 32 THR HG21 1 1 24 16483 1 1 32 THR HG22 H -12.036 13.298 9.018 1.00 . A A . 32 THR HG22 1 1 24 16484 1 1 32 THR HG23 H -11.205 14.843 9.312 1.00 . A A . 32 THR HG23 1 1 24 16485 1 1 32 THR N N -11.144 10.790 10.024 1.00 . A A . 32 THR N 1 1 24 16486 1 1 32 THR O O -9.334 10.487 12.120 1.00 . A A . 32 THR O 1 1 24 16487 1 1 32 THR OG1 O -10.980 13.294 11.474 1.00 . A A . 32 THR OG1 1 1 24 16488 1 1 33 ASN C C -6.406 9.323 11.444 1.00 . A A . 33 ASN C 1 1 24 16489 1 1 33 ASN CA C -6.471 10.863 11.691 1.00 . A A . 33 ASN CA 1 1 24 16490 1 1 33 ASN CB C -6.571 11.188 13.220 1.00 . A A . 33 ASN CB 1 1 24 16491 1 1 33 ASN CG C -6.479 12.685 13.577 1.00 . A A . 33 ASN CG 1 1 24 16492 1 1 33 ASN H H -7.467 11.835 9.998 1.00 . A A . 33 ASN H 1 1 24 16493 1 1 33 ASN HA H -5.541 11.319 11.297 1.00 . A A . 33 ASN HA 1 1 24 16494 1 1 33 ASN HB2 H -7.496 10.779 13.666 1.00 . A A . 33 ASN HB2 1 1 24 16495 1 1 33 ASN HB3 H -5.774 10.637 13.757 1.00 . A A . 33 ASN HB3 1 1 24 16496 1 1 33 ASN HD21 H -4.483 12.560 13.737 1.00 . A A . 33 ASN HD21 1 1 24 16497 1 1 33 ASN HD22 H -5.249 14.199 14.045 1.00 . A A . 33 ASN HD22 1 1 24 16498 1 1 33 ASN N N -7.633 11.402 10.913 1.00 . A A . 33 ASN N 1 1 24 16499 1 1 33 ASN ND2 N -5.281 13.201 13.810 1.00 . A A . 33 ASN ND2 1 1 24 16500 1 1 33 ASN O O -6.730 8.503 12.308 1.00 . A A . 33 ASN O 1 1 24 16501 1 1 33 ASN OD1 O -7.488 13.387 13.644 1.00 . A A . 33 ASN OD1 1 1 24 16502 1 1 34 CYS C C -4.797 6.740 10.534 1.00 . A A . 34 CYS C 1 1 24 16503 1 1 34 CYS CA C -5.894 7.545 9.767 1.00 . A A . 34 CYS CA 1 1 24 16504 1 1 34 CYS CB C -5.581 7.541 8.254 1.00 . A A . 34 CYS CB 1 1 24 16505 1 1 34 CYS H H -5.907 9.769 9.582 1.00 . A A . 34 CYS H 1 1 24 16506 1 1 34 CYS HA H -6.878 7.081 9.921 1.00 . A A . 34 CYS HA 1 1 24 16507 1 1 34 CYS HB2 H -4.606 7.985 8.069 1.00 . A A . 34 CYS HB2 1 1 24 16508 1 1 34 CYS HB3 H -5.511 6.504 7.878 1.00 . A A . 34 CYS HB3 1 1 24 16509 1 1 34 CYS N N -5.971 8.963 10.220 1.00 . A A . 34 CYS N 1 1 24 16510 1 1 34 CYS O O -3.964 7.319 11.241 1.00 . A A . 34 CYS O 1 1 24 16511 1 1 34 CYS SG S -6.896 8.375 7.357 1.00 . A A . 34 CYS SG 1 1 24 16512 1 1 35 GLU C C -3.157 3.603 9.768 1.00 . A A . 35 GLU C 1 1 24 16513 1 1 35 GLU CA C -3.653 4.564 10.899 1.00 . A A . 35 GLU CA 1 1 24 16514 1 1 35 GLU CB C -4.041 3.712 12.146 1.00 . A A . 35 GLU CB 1 1 24 16515 1 1 35 GLU CD C -5.192 3.354 14.394 1.00 . A A . 35 GLU CD 1 1 24 16516 1 1 35 GLU CG C -4.999 4.299 13.206 1.00 . A A . 35 GLU CG 1 1 24 16517 1 1 35 GLU H H -5.539 5.041 9.758 1.00 . A A . 35 GLU H 1 1 24 16518 1 1 35 GLU HA H -2.813 5.228 11.187 1.00 . A A . 35 GLU HA 1 1 24 16519 1 1 35 GLU HB2 H -4.346 2.701 11.825 1.00 . A A . 35 GLU HB2 1 1 24 16520 1 1 35 GLU HB3 H -3.089 3.505 12.671 1.00 . A A . 35 GLU HB3 1 1 24 16521 1 1 35 GLU HE2 H -6.427 1.978 15.004 1.00 . A A . 35 GLU HE2 1 1 24 16522 1 1 35 GLU HG2 H -4.601 5.265 13.571 1.00 . A A . 35 GLU HG2 1 1 24 16523 1 1 35 GLU HG3 H -5.979 4.532 12.751 1.00 . A A . 35 GLU HG3 1 1 24 16524 1 1 35 GLU N N -4.797 5.395 10.390 1.00 . A A . 35 GLU N 1 1 24 16525 1 1 35 GLU O O -3.753 3.474 8.699 1.00 . A A . 35 GLU O 1 1 24 16526 1 1 35 GLU OE1 O -4.420 3.303 15.351 1.00 . A A . 35 GLU OE1 1 1 24 16527 1 1 35 GLU OE2 O -6.311 2.572 14.259 1.00 . A A . 35 GLU OE2 1 1 24 16528 1 1 36 CYS C C -1.831 0.666 8.991 1.00 . A A . 36 CYS C 1 1 24 16529 1 1 36 CYS CA C -1.274 2.116 9.023 1.00 . A A . 36 CYS CA 1 1 24 16530 1 1 36 CYS CB C 0.249 2.166 9.393 1.00 . A A . 36 CYS CB 1 1 24 16531 1 1 36 CYS H H -1.771 3.026 11.021 1.00 . A A . 36 CYS H 1 1 24 16532 1 1 36 CYS HA H -1.397 2.571 8.012 1.00 . A A . 36 CYS HA 1 1 24 16533 1 1 36 CYS HB2 H 0.442 2.198 10.485 1.00 . A A . 36 CYS HB2 1 1 24 16534 1 1 36 CYS HB3 H 0.829 1.253 9.150 1.00 . A A . 36 CYS HB3 1 1 24 16535 1 1 36 CYS N N -2.027 2.925 10.032 1.00 . A A . 36 CYS N 1 1 24 16536 1 1 36 CYS O O -2.582 0.225 9.871 1.00 . A A . 36 CYS O 1 1 24 16537 1 1 36 CYS SG S 0.985 3.487 8.442 1.00 . A A . 36 CYS SG 1 1 24 16538 1 1 37 THR C C -0.863 -2.318 7.025 1.00 . A A . 37 THR C 1 1 24 16539 1 1 37 THR CA C -1.973 -1.471 7.751 1.00 . A A . 37 THR CA 1 1 24 16540 1 1 37 THR CB C -3.334 -1.493 6.972 1.00 . A A . 37 THR CB 1 1 24 16541 1 1 37 THR CG2 C -3.334 -0.817 5.584 1.00 . A A . 37 THR CG2 1 1 24 16542 1 1 37 THR H H -0.963 0.426 7.191 1.00 . A A . 37 THR H 1 1 24 16543 1 1 37 THR HA H -2.139 -1.905 8.754 1.00 . A A . 37 THR HA 1 1 24 16544 1 1 37 THR HB H -4.068 -1.036 7.654 1.00 . A A . 37 THR HB 1 1 24 16545 1 1 37 THR HG1 H -4.596 -2.783 6.306 1.00 . A A . 37 THR HG1 1 1 24 16546 1 1 37 THR HG21 H -2.608 -1.278 4.890 1.00 . A A . 37 THR HG21 1 1 24 16547 1 1 37 THR HG22 H -4.331 -0.884 5.113 1.00 . A A . 37 THR HG22 1 1 24 16548 1 1 37 THR HG23 H -3.096 0.257 5.656 1.00 . A A . 37 THR HG23 1 1 24 16549 1 1 37 THR N N -1.504 -0.067 7.912 1.00 . A A . 37 THR N 1 1 24 16550 1 1 37 THR O O -0.209 -1.819 6.099 1.00 . A A . 37 THR O 1 1 24 16551 1 1 37 THR OG1 O -3.738 -2.837 6.733 1.00 . A A . 37 THR OG1 1 1 24 16552 1 1 38 PRO C C -0.018 -4.947 5.308 1.00 . A A . 38 PRO C 1 1 24 16553 1 1 38 PRO CA C 0.347 -4.514 6.762 1.00 . A A . 38 PRO CA 1 1 24 16554 1 1 38 PRO CB C 0.406 -5.704 7.747 1.00 . A A . 38 PRO CB 1 1 24 16555 1 1 38 PRO CD C -1.369 -4.267 8.517 1.00 . A A . 38 PRO CD 1 1 24 16556 1 1 38 PRO CG C -0.930 -5.726 8.488 1.00 . A A . 38 PRO CG 1 1 24 16557 1 1 38 PRO HA H 1.332 -4.007 6.717 1.00 . A A . 38 PRO HA 1 1 24 16558 1 1 38 PRO HB2 H 0.606 -6.676 7.266 1.00 . A A . 38 PRO HB2 1 1 24 16559 1 1 38 PRO HB3 H 1.228 -5.551 8.469 1.00 . A A . 38 PRO HB3 1 1 24 16560 1 1 38 PRO HD2 H -2.458 -4.163 8.433 1.00 . A A . 38 PRO HD2 1 1 24 16561 1 1 38 PRO HD3 H -1.130 -3.759 9.460 1.00 . A A . 38 PRO HD3 1 1 24 16562 1 1 38 PRO HG2 H -1.665 -6.332 7.924 1.00 . A A . 38 PRO HG2 1 1 24 16563 1 1 38 PRO HG3 H -0.850 -6.165 9.500 1.00 . A A . 38 PRO HG3 1 1 24 16564 1 1 38 PRO N N -0.657 -3.620 7.397 1.00 . A A . 38 PRO N 1 1 24 16565 1 1 38 PRO O O -1.185 -4.913 4.904 1.00 . A A . 38 PRO O 1 1 24 16566 1 1 39 ARG C C 0.743 -4.478 2.224 1.00 . A A . 39 ARG C 1 1 24 16567 1 1 39 ARG CA C 0.956 -5.760 3.096 1.00 . A A . 39 ARG CA 1 1 24 16568 1 1 39 ARG CB C -0.190 -6.802 2.841 1.00 . A A . 39 ARG CB 1 1 24 16569 1 1 39 ARG CD C -0.095 -7.281 0.268 1.00 . A A . 39 ARG CD 1 1 24 16570 1 1 39 ARG CG C 0.030 -7.827 1.703 1.00 . A A . 39 ARG CG 1 1 24 16571 1 1 39 ARG CZ C 0.025 -8.200 -2.061 1.00 . A A . 39 ARG CZ 1 1 24 16572 1 1 39 ARG H H 1.925 -5.322 5.028 1.00 . A A . 39 ARG H 1 1 24 16573 1 1 39 ARG HA H 1.935 -6.215 2.847 1.00 . A A . 39 ARG HA 1 1 24 16574 1 1 39 ARG HB2 H -0.322 -7.414 3.755 1.00 . A A . 39 ARG HB2 1 1 24 16575 1 1 39 ARG HB3 H -1.170 -6.305 2.709 1.00 . A A . 39 ARG HB3 1 1 24 16576 1 1 39 ARG HD2 H -1.041 -6.719 0.155 1.00 . A A . 39 ARG HD2 1 1 24 16577 1 1 39 ARG HD3 H 0.724 -6.569 0.067 1.00 . A A . 39 ARG HD3 1 1 24 16578 1 1 39 ARG HG2 H 1.012 -8.320 1.836 1.00 . A A . 39 ARG HG2 1 1 24 16579 1 1 39 ARG HG3 H -0.716 -8.633 1.841 1.00 . A A . 39 ARG HG3 1 1 24 16580 1 1 39 ARG HH11 H 0.066 -6.190 -2.033 1.00 . A A . 39 ARG HH11 1 1 24 16581 1 1 39 ARG HH12 H 0.139 -7.006 -3.675 1.00 . A A . 39 ARG HH12 1 1 24 16582 1 1 39 ARG HH21 H 0.002 -10.181 -2.354 1.00 . A A . 39 ARG HH21 1 1 24 16583 1 1 39 ARG HH22 H 0.105 -9.112 -3.842 1.00 . A A . 39 ARG HH22 1 1 24 16584 1 1 39 ARG N N 1.023 -5.349 4.539 1.00 . A A . 39 ARG N 1 1 24 16585 1 1 39 ARG NE N -0.052 -8.378 -0.728 1.00 . A A . 39 ARG NE 1 1 24 16586 1 1 39 ARG NH1 N 0.083 -7.009 -2.651 1.00 . A A . 39 ARG NH1 1 1 24 16587 1 1 39 ARG NH2 N 0.046 -9.273 -2.830 1.00 . A A . 39 ARG NH2 1 1 24 16588 1 1 39 ARG O O -0.190 -3.694 2.440 1.00 . A A . 39 ARG O 1 1 24 16589 1 1 40 LEU C C 0.290 -3.205 -0.672 1.00 . A A . 40 LEU C 1 1 24 16590 1 1 40 LEU CA C 1.548 -3.140 0.266 1.00 . A A . 40 LEU CA 1 1 24 16591 1 1 40 LEU CB C 2.900 -3.142 -0.525 1.00 . A A . 40 LEU CB 1 1 24 16592 1 1 40 LEU CD1 C 2.649 -4.436 -2.767 1.00 . A A . 40 LEU CD1 1 1 24 16593 1 1 40 LEU CD2 C 4.870 -4.361 -1.600 1.00 . A A . 40 LEU CD2 1 1 24 16594 1 1 40 LEU CG C 3.341 -4.368 -1.391 1.00 . A A . 40 LEU CG 1 1 24 16595 1 1 40 LEU H H 2.336 -5.018 1.131 1.00 . A A . 40 LEU H 1 1 24 16596 1 1 40 LEU HA H 1.466 -2.198 0.837 1.00 . A A . 40 LEU HA 1 1 24 16597 1 1 40 LEU HB2 H 2.940 -2.232 -1.155 1.00 . A A . 40 LEU HB2 1 1 24 16598 1 1 40 LEU HB3 H 3.687 -2.945 0.228 1.00 . A A . 40 LEU HB3 1 1 24 16599 1 1 40 LEU HD11 H 2.821 -3.522 -3.367 1.00 . A A . 40 LEU HD11 1 1 24 16600 1 1 40 LEU HD12 H 3.006 -5.295 -3.365 1.00 . A A . 40 LEU HD12 1 1 24 16601 1 1 40 LEU HD13 H 1.557 -4.562 -2.673 1.00 . A A . 40 LEU HD13 1 1 24 16602 1 1 40 LEU HD21 H 5.413 -4.390 -0.637 1.00 . A A . 40 LEU HD21 1 1 24 16603 1 1 40 LEU HD22 H 5.210 -5.242 -2.177 1.00 . A A . 40 LEU HD22 1 1 24 16604 1 1 40 LEU HD23 H 5.213 -3.460 -2.142 1.00 . A A . 40 LEU HD23 1 1 24 16605 1 1 40 LEU HG H 3.100 -5.298 -0.845 1.00 . A A . 40 LEU HG 1 1 24 16606 1 1 40 LEU N N 1.613 -4.294 1.212 1.00 . A A . 40 LEU N 1 1 24 16607 1 1 40 LEU O O -0.516 -4.142 -0.613 1.00 . A A . 40 LEU O 1 1 24 16608 1 1 41 ILE C C -1.246 -3.149 -3.408 1.00 . A A . 41 ILE C 1 1 24 16609 1 1 41 ILE CA C -1.137 -1.997 -2.348 1.00 . A A . 41 ILE CA 1 1 24 16610 1 1 41 ILE CB C -1.151 -0.601 -3.098 1.00 . A A . 41 ILE CB 1 1 24 16611 1 1 41 ILE CD1 C 0.078 0.907 -4.852 1.00 . A A . 41 ILE CD1 1 1 24 16612 1 1 41 ILE CG1 C 0.187 -0.237 -3.831 1.00 . A A . 41 ILE CG1 1 1 24 16613 1 1 41 ILE CG2 C -1.463 0.502 -2.052 1.00 . A A . 41 ILE CG2 1 1 24 16614 1 1 41 ILE H H 0.830 -1.448 -1.482 1.00 . A A . 41 ILE H 1 1 24 16615 1 1 41 ILE HA H -2.017 -2.047 -1.671 1.00 . A A . 41 ILE HA 1 1 24 16616 1 1 41 ILE HB H -1.954 -0.601 -3.861 1.00 . A A . 41 ILE HB 1 1 24 16617 1 1 41 ILE HD11 H -0.671 0.683 -5.635 1.00 . A A . 41 ILE HD11 1 1 24 16618 1 1 41 ILE HD12 H -0.208 1.863 -4.378 1.00 . A A . 41 ILE HD12 1 1 24 16619 1 1 41 ILE HD13 H 1.043 1.074 -5.363 1.00 . A A . 41 ILE HD13 1 1 24 16620 1 1 41 ILE HG12 H 0.983 0.003 -3.100 1.00 . A A . 41 ILE HG12 1 1 24 16621 1 1 41 ILE HG13 H 0.572 -1.112 -4.382 1.00 . A A . 41 ILE HG13 1 1 24 16622 1 1 41 ILE HG21 H -2.409 0.301 -1.518 1.00 . A A . 41 ILE HG21 1 1 24 16623 1 1 41 ILE HG22 H -0.668 0.597 -1.288 1.00 . A A . 41 ILE HG22 1 1 24 16624 1 1 41 ILE HG23 H -1.583 1.496 -2.520 1.00 . A A . 41 ILE HG23 1 1 24 16625 1 1 41 ILE N N 0.104 -2.172 -1.522 1.00 . A A . 41 ILE N 1 1 24 16626 1 1 41 ILE O O -0.361 -3.355 -4.245 1.00 . A A . 41 ILE O 1 1 24 16627 1 1 42 MET C C -3.563 -4.463 -5.400 1.00 . A A . 42 MET C 1 1 24 16628 1 1 42 MET CA C -2.657 -5.015 -4.265 1.00 . A A . 42 MET CA 1 1 24 16629 1 1 42 MET CB C -3.367 -6.160 -3.492 1.00 . A A . 42 MET CB 1 1 24 16630 1 1 42 MET CE C -6.144 -8.360 -4.015 1.00 . A A . 42 MET CE 1 1 24 16631 1 1 42 MET CG C -3.505 -7.474 -4.284 1.00 . A A . 42 MET CG 1 1 24 16632 1 1 42 MET H H -3.010 -3.633 -2.583 1.00 . A A . 42 MET H 1 1 24 16633 1 1 42 MET HA H -1.716 -5.421 -4.691 1.00 . A A . 42 MET HA 1 1 24 16634 1 1 42 MET HB2 H -2.813 -6.392 -2.563 1.00 . A A . 42 MET HB2 1 1 24 16635 1 1 42 MET HB3 H -4.367 -5.833 -3.151 1.00 . A A . 42 MET HB3 1 1 24 16636 1 1 42 MET HE1 H -6.431 -7.300 -3.908 1.00 . A A . 42 MET HE1 1 1 24 16637 1 1 42 MET HE2 H -6.184 -8.619 -5.089 1.00 . A A . 42 MET HE2 1 1 24 16638 1 1 42 MET HE3 H -6.895 -8.973 -3.486 1.00 . A A . 42 MET HE3 1 1 24 16639 1 1 42 MET HG2 H -3.966 -7.307 -5.275 1.00 . A A . 42 MET HG2 1 1 24 16640 1 1 42 MET HG3 H -2.508 -7.912 -4.475 1.00 . A A . 42 MET HG3 1 1 24 16641 1 1 42 MET N N -2.358 -3.903 -3.327 1.00 . A A . 42 MET N 1 1 24 16642 1 1 42 MET O O -4.646 -3.928 -5.141 1.00 . A A . 42 MET O 1 1 24 16643 1 1 42 MET SD S -4.494 -8.657 -3.342 1.00 . A A . 42 MET SD 1 1 24 16644 1 1 43 GLU C C -5.102 -5.102 -8.081 1.00 . A A . 43 GLU C 1 1 24 16645 1 1 43 GLU CA C -3.892 -4.146 -7.844 1.00 . A A . 43 GLU CA 1 1 24 16646 1 1 43 GLU CB C -2.999 -4.123 -9.113 1.00 . A A . 43 GLU CB 1 1 24 16647 1 1 43 GLU CD C -0.694 -3.235 -8.257 1.00 . A A . 43 GLU CD 1 1 24 16648 1 1 43 GLU CG C -1.899 -3.035 -9.186 1.00 . A A . 43 GLU CG 1 1 24 16649 1 1 43 GLU H H -2.218 -5.099 -6.752 1.00 . A A . 43 GLU H 1 1 24 16650 1 1 43 GLU HA H -4.246 -3.111 -7.652 1.00 . A A . 43 GLU HA 1 1 24 16651 1 1 43 GLU HB2 H -2.580 -5.125 -9.294 1.00 . A A . 43 GLU HB2 1 1 24 16652 1 1 43 GLU HB3 H -3.654 -3.946 -9.989 1.00 . A A . 43 GLU HB3 1 1 24 16653 1 1 43 GLU HE2 H 0.027 -2.526 -6.592 1.00 . A A . 43 GLU HE2 1 1 24 16654 1 1 43 GLU HG2 H -1.516 -2.993 -10.222 1.00 . A A . 43 GLU HG2 1 1 24 16655 1 1 43 GLU HG3 H -2.350 -2.039 -9.015 1.00 . A A . 43 GLU HG3 1 1 24 16656 1 1 43 GLU N N -3.127 -4.630 -6.662 1.00 . A A . 43 GLU N 1 1 24 16657 1 1 43 GLU O O -4.977 -6.332 -8.094 1.00 . A A . 43 GLU O 1 1 24 16658 1 1 43 GLU OE1 O 0.195 -4.059 -8.469 1.00 . A A . 43 GLU OE1 1 1 24 16659 1 1 43 GLU OE2 O -0.728 -2.396 -7.171 1.00 . A A . 43 GLU OE2 1 1 24 16660 1 1 44 GLY C C -8.304 -4.540 -6.776 1.00 . A A . 44 GLY C 1 1 24 16661 1 1 44 GLY CA C -7.576 -5.154 -7.986 1.00 . A A . 44 GLY CA 1 1 24 16662 1 1 44 GLY H H -6.175 -3.460 -8.263 1.00 . A A . 44 GLY H 1 1 24 16663 1 1 44 GLY HA2 H -8.195 -5.021 -8.893 1.00 . A A . 44 GLY HA2 1 1 24 16664 1 1 44 GLY HA3 H -7.474 -6.252 -7.867 1.00 . A A . 44 GLY HA3 1 1 24 16665 1 1 44 GLY N N -6.278 -4.477 -8.196 1.00 . A A . 44 GLY N 1 1 24 16666 1 1 44 GLY O O -9.127 -3.637 -6.954 1.00 . A A . 44 GLY O 1 1 24 16667 1 1 45 LEU C C -7.382 -4.119 -3.355 1.00 . A A . 45 LEU C 1 1 24 16668 1 1 45 LEU CA C -8.562 -4.495 -4.294 1.00 . A A . 45 LEU CA 1 1 24 16669 1 1 45 LEU CB C -9.484 -5.559 -3.623 1.00 . A A . 45 LEU CB 1 1 24 16670 1 1 45 LEU CD1 C -11.479 -7.140 -3.665 1.00 . A A . 45 LEU CD1 1 1 24 16671 1 1 45 LEU CD2 C -11.793 -4.776 -4.492 1.00 . A A . 45 LEU CD2 1 1 24 16672 1 1 45 LEU CG C -10.797 -5.947 -4.364 1.00 . A A . 45 LEU CG 1 1 24 16673 1 1 45 LEU H H -7.288 -5.779 -5.565 1.00 . A A . 45 LEU H 1 1 24 16674 1 1 45 LEU HA H -9.177 -3.592 -4.483 1.00 . A A . 45 LEU HA 1 1 24 16675 1 1 45 LEU HB2 H -8.892 -6.479 -3.443 1.00 . A A . 45 LEU HB2 1 1 24 16676 1 1 45 LEU HB3 H -9.755 -5.205 -2.609 1.00 . A A . 45 LEU HB3 1 1 24 16677 1 1 45 LEU HD11 H -10.810 -8.019 -3.612 1.00 . A A . 45 LEU HD11 1 1 24 16678 1 1 45 LEU HD12 H -11.784 -6.898 -2.630 1.00 . A A . 45 LEU HD12 1 1 24 16679 1 1 45 LEU HD13 H -12.387 -7.467 -4.207 1.00 . A A . 45 LEU HD13 1 1 24 16680 1 1 45 LEU HD21 H -12.085 -4.368 -3.505 1.00 . A A . 45 LEU HD21 1 1 24 16681 1 1 45 LEU HD22 H -11.371 -3.941 -5.080 1.00 . A A . 45 LEU HD22 1 1 24 16682 1 1 45 LEU HD23 H -12.721 -5.083 -5.009 1.00 . A A . 45 LEU HD23 1 1 24 16683 1 1 45 LEU HG H -10.536 -6.280 -5.386 1.00 . A A . 45 LEU HG 1 1 24 16684 1 1 45 LEU N N -7.989 -5.030 -5.560 1.00 . A A . 45 LEU N 1 1 24 16685 1 1 45 LEU O O -6.765 -4.988 -2.728 1.00 . A A . 45 LEU O 1 1 24 16686 1 1 46 SER C C -6.417 -2.070 -0.980 1.00 . A A . 46 SER C 1 1 24 16687 1 1 46 SER CA C -5.943 -2.301 -2.443 1.00 . A A . 46 SER CA 1 1 24 16688 1 1 46 SER CB C -5.429 -0.968 -3.037 1.00 . A A . 46 SER CB 1 1 24 16689 1 1 46 SER H H -7.659 -2.187 -3.833 1.00 . A A . 46 SER H 1 1 24 16690 1 1 46 SER HA H -5.102 -3.025 -2.458 1.00 . A A . 46 SER HA 1 1 24 16691 1 1 46 SER HB2 H -6.234 -0.212 -3.104 1.00 . A A . 46 SER HB2 1 1 24 16692 1 1 46 SER HB3 H -4.655 -0.528 -2.381 1.00 . A A . 46 SER HB3 1 1 24 16693 1 1 46 SER HG H -4.559 -0.292 -4.614 1.00 . A A . 46 SER HG 1 1 24 16694 1 1 46 SER N N -7.074 -2.810 -3.265 1.00 . A A . 46 SER N 1 1 24 16695 1 1 46 SER O O -7.394 -1.350 -0.746 1.00 . A A . 46 SER O 1 1 24 16696 1 1 46 SER OG O -4.852 -1.159 -4.324 1.00 . A A . 46 SER OG 1 1 24 16697 1 1 47 PHE C C -7.439 -2.785 1.839 1.00 . A A . 47 PHE C 1 1 24 16698 1 1 47 PHE CA C -5.919 -2.622 1.472 1.00 . A A . 47 PHE CA 1 1 24 16699 1 1 47 PHE CB C -5.313 -1.285 2.040 1.00 . A A . 47 PHE CB 1 1 24 16700 1 1 47 PHE CD1 C -5.050 0.676 0.422 1.00 . A A . 47 PHE CD1 1 1 24 16701 1 1 47 PHE CD2 C -6.739 0.847 2.134 1.00 . A A . 47 PHE CD2 1 1 24 16702 1 1 47 PHE CE1 C -5.438 1.912 -0.086 1.00 . A A . 47 PHE CE1 1 1 24 16703 1 1 47 PHE CE2 C -7.129 2.083 1.626 1.00 . A A . 47 PHE CE2 1 1 24 16704 1 1 47 PHE CG C -5.717 0.117 1.518 1.00 . A A . 47 PHE CG 1 1 24 16705 1 1 47 PHE CZ C -6.485 2.609 0.510 1.00 . A A . 47 PHE CZ 1 1 24 16706 1 1 47 PHE H H -4.907 -3.232 -0.390 1.00 . A A . 47 PHE H 1 1 24 16707 1 1 47 PHE HA H -5.389 -3.470 1.948 1.00 . A A . 47 PHE HA 1 1 24 16708 1 1 47 PHE HB2 H -5.466 -1.300 3.136 1.00 . A A . 47 PHE HB2 1 1 24 16709 1 1 47 PHE HB3 H -4.212 -1.370 1.959 1.00 . A A . 47 PHE HB3 1 1 24 16710 1 1 47 PHE HD1 H -4.242 0.140 -0.055 1.00 . A A . 47 PHE HD1 1 1 24 16711 1 1 47 PHE HD2 H -7.245 0.454 3.001 1.00 . A A . 47 PHE HD2 1 1 24 16712 1 1 47 PHE HE1 H -4.927 2.329 -0.942 1.00 . A A . 47 PHE HE1 1 1 24 16713 1 1 47 PHE HE2 H -7.927 2.635 2.101 1.00 . A A . 47 PHE HE2 1 1 24 16714 1 1 47 PHE HZ H -6.785 3.570 0.118 1.00 . A A . 47 PHE HZ 1 1 24 16715 1 1 47 PHE N N -5.686 -2.680 -0.015 1.00 . A A . 47 PHE N 1 1 24 16716 1 1 47 PHE O O -8.186 -1.814 1.984 1.00 . A A . 47 PHE O 1 1 24 16717 1 1 48 ALA C C -10.237 -3.974 1.102 1.00 . A A . 48 ALA C 1 1 24 16718 1 1 48 ALA CA C -9.289 -4.488 2.221 1.00 . A A . 48 ALA CA 1 1 24 16719 1 1 48 ALA CB C -9.747 -3.974 3.610 1.00 . A A . 48 ALA CB 1 1 24 16720 1 1 48 ALA H H -7.145 -4.763 1.804 1.00 . A A . 48 ALA H 1 1 24 16721 1 1 48 ALA HXT H -10.949 -4.572 -0.609 1.00 . A A . 48 ALA HXT 1 1 24 16722 1 1 48 ALA HA H -9.332 -5.593 2.218 1.00 . A A . 48 ALA HA 1 1 24 16723 1 1 48 ALA HB1 H -9.089 -4.344 4.417 1.00 . A A . 48 ALA HB1 1 1 24 16724 1 1 48 ALA HB2 H -9.766 -2.871 3.685 1.00 . A A . 48 ALA HB2 1 1 24 16725 1 1 48 ALA HB3 H -10.767 -4.327 3.850 1.00 . A A . 48 ALA HB3 1 1 24 16726 1 1 48 ALA N N -7.879 -4.062 1.954 1.00 . A A . 48 ALA N 1 1 24 16727 1 1 48 ALA O O -10.800 -2.877 1.111 1.00 . A A . 48 ALA O 1 1 24 16728 1 1 48 ALA OXT O -10.367 -4.887 0.086 1.00 . A A . 48 ALA OXT 1 1 stop_ save_
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