NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
653576 | 6xth | 34478 | cing | 4-filtered-FRED | STAR | entry | full | 229 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6xth # This FRED archive file contains, for PDB entry <6xth>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_6xth _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6xth _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 2002.28 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 $Felipeptin_A1 A . 1 1 stop_ save_ save_Felipeptin_A1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Felipeptin A1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GSRGWGFEPGVRCLIWCD _Entity.Number_of_monomers 18 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 SER . 1 1 3 ARG . 1 1 4 GLY . 1 1 5 TRP . 1 1 6 GLY . 1 1 7 PHE . 1 1 8 GLU . 1 1 9 PRO . 1 1 10 GLY . 1 1 11 VAL . 1 1 12 ARG . 1 1 13 CYS . 1 1 14 LEU . 1 1 15 ILE . 1 1 16 TRP . 1 1 17 CYS . 1 1 18 ASP . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 SER 2 2 1 1 ARG 3 3 1 1 GLY 4 4 1 1 TRP 5 5 1 1 GLY 6 6 1 1 PHE 7 7 1 1 GLU 8 8 1 1 PRO 9 9 1 1 GLY 10 10 1 1 VAL 11 11 1 1 ARG 12 12 1 1 CYS 13 13 1 1 LEU 14 14 1 1 ILE 15 15 1 1 TRP 16 16 1 1 CYS 17 17 1 1 ASP 18 18 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 GLY CA . 1 . CA 1 1 1 1 2 1 1 8 GLU CD . 8 . CD 1 1 2 1 1 1 1 1 GLY QA . 1 . HA* 1 1 2 1 2 1 1 2 SER H . 2 . HN 1 1 3 1 1 1 1 1 GLY HA2 . 1 . HA2 1 1 3 1 2 1 1 2 SER H . 2 . HN 1 1 4 1 1 1 1 1 GLY HA3 . 1 . HA1 1 1 4 1 2 1 1 2 SER H . 2 . HN 1 1 5 1 1 1 1 1 GLY N . 1 . N 1 1 5 1 2 1 1 8 GLU CD . 8 . CD 1 1 6 1 1 1 1 1 GLY N . 1 . N 1 1 6 1 2 1 1 8 GLU CG . 8 . CG 1 1 7 1 1 1 1 2 SER H . 2 . HN 1 1 7 1 2 1 1 2 SER HA . 2 . HA 1 1 8 1 1 1 1 2 SER H . 2 . HN 1 1 8 1 2 1 1 2 SER QB . 2 . HB1 1 1 9 1 1 1 1 2 SER H . 2 . HN 1 1 9 1 2 1 1 3 ARG H . 3 . HN 1 1 10 1 1 1 1 2 SER HA . 2 . HA 1 1 10 1 2 1 1 2 SER QB . 2 . HB2 1 1 11 1 1 1 1 2 SER QB . 2 . HB1 1 1 11 1 2 1 1 3 ARG H . 3 . HN 1 1 12 1 1 1 1 3 ARG H . 3 . HN 1 1 12 1 2 1 1 3 ARG HA . 3 . HA 1 1 13 1 1 1 1 3 ARG H . 3 . HN 1 1 13 1 2 1 1 3 ARG HB2 . 3 . HB2 1 1 14 1 1 1 1 3 ARG H . 3 . HN 1 1 14 1 2 1 1 3 ARG QB . 3 . HB* 1 1 15 1 1 1 1 3 ARG H . 3 . HN 1 1 15 1 2 1 1 3 ARG HB3 . 3 . HB1 1 1 16 1 1 1 1 3 ARG H . 3 . HN 1 1 16 1 2 1 1 3 ARG QD . 3 . HD2 1 1 17 1 1 1 1 3 ARG H . 3 . HN 1 1 17 1 2 1 1 3 ARG HG2 . 3 . HG2 1 1 18 1 1 1 1 3 ARG H . 3 . HN 1 1 18 1 2 1 1 3 ARG QG . 3 . HG* 1 1 19 1 1 1 1 3 ARG H . 3 . HN 1 1 19 1 2 1 1 3 ARG HG3 . 3 . HG1 1 1 20 1 1 1 1 3 ARG HA . 3 . HA 1 1 20 1 2 1 1 3 ARG HB2 . 3 . HB2 1 1 21 1 1 1 1 3 ARG HA . 3 . HA 1 1 21 1 2 1 1 3 ARG QB . 3 . HB* 1 1 22 1 1 1 1 3 ARG HA . 3 . HA 1 1 22 1 2 1 1 3 ARG HB3 . 3 . HB1 1 1 23 1 1 1 1 3 ARG HA . 3 . HA 1 1 23 1 2 1 1 3 ARG QD . 3 . HD1 1 1 24 1 1 1 1 3 ARG HA . 3 . HA 1 1 24 1 2 1 1 3 ARG HG2 . 3 . HG2 1 1 25 1 1 1 1 3 ARG HA . 3 . HA 1 1 25 1 2 1 1 3 ARG QG . 3 . HG* 1 1 26 1 1 1 1 3 ARG HA . 3 . HA 1 1 26 1 2 1 1 3 ARG HG3 . 3 . HG1 1 1 27 1 1 1 1 3 ARG HA . 3 . HA 1 1 27 1 2 1 1 4 GLY H . 4 . HN 1 1 28 1 1 1 1 3 ARG QB . 3 . HB* 1 1 28 1 2 1 1 3 ARG QD . 3 . HD* 1 1 29 1 1 1 1 3 ARG QB . 3 . HB* 1 1 29 1 2 1 1 3 ARG QG . 3 . HG* 1 1 30 1 1 1 1 3 ARG QB . 3 . HB* 1 1 30 1 2 1 1 4 GLY H . 4 . HN 1 1 31 1 1 1 1 3 ARG HB2 . 3 . HB2 1 1 31 1 2 1 1 3 ARG HG2 . 3 . HG2 1 1 32 1 1 1 1 3 ARG HB2 . 3 . HB2 1 1 32 1 2 1 1 3 ARG HG3 . 3 . HG1 1 1 33 1 1 1 1 3 ARG HB2 . 3 . HB2 1 1 33 1 2 1 1 4 GLY H . 4 . HN 1 1 34 1 1 1 1 3 ARG HB3 . 3 . HB1 1 1 34 1 2 1 1 3 ARG HG2 . 3 . HG2 1 1 35 1 1 1 1 3 ARG HB3 . 3 . HB1 1 1 35 1 2 1 1 3 ARG HG3 . 3 . HG1 1 1 36 1 1 1 1 3 ARG HB3 . 3 . HB1 1 1 36 1 2 1 1 4 GLY H . 4 . HN 1 1 37 1 1 1 1 3 ARG QD . 3 . HD* 1 1 37 1 2 1 1 3 ARG QG . 3 . HG* 1 1 38 1 1 1 1 4 GLY H . 4 . HN 1 1 38 1 2 1 1 4 GLY HA2 . 4 . HA2 1 1 39 1 1 1 1 4 GLY H . 4 . HN 1 1 39 1 2 1 1 4 GLY HA3 . 4 . HA1 1 1 40 1 1 1 1 4 GLY H . 4 . HN 1 1 40 1 2 1 1 5 TRP H . 5 . HN 1 1 41 1 1 1 1 4 GLY QA . 4 . HA* 1 1 41 1 2 1 1 5 TRP H . 5 . HN 1 1 42 1 1 1 1 4 GLY HA2 . 4 . HA2 1 1 42 1 2 1 1 5 TRP H . 5 . HN 1 1 43 1 1 1 1 4 GLY HA3 . 4 . HA1 1 1 43 1 2 1 1 5 TRP H . 5 . HN 1 1 44 1 1 1 1 5 TRP H . 5 . HN 1 1 44 1 2 1 1 5 TRP HA . 5 . HA 1 1 45 1 1 1 1 5 TRP H . 5 . HN 1 1 45 1 2 1 1 5 TRP HB2 . 5 . HB2 1 1 46 1 1 1 1 5 TRP H . 5 . HN 1 1 46 1 2 1 1 5 TRP QB . 5 . HB* 1 1 47 1 1 1 1 5 TRP H . 5 . HN 1 1 47 1 2 1 1 5 TRP HB3 . 5 . HB1 1 1 48 1 1 1 1 5 TRP H . 5 . HN 1 1 48 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 49 1 1 1 1 5 TRP H . 5 . HN 1 1 49 1 2 1 1 5 TRP HE1 . 5 . HE1 1 1 50 1 1 1 1 5 TRP H . 5 . HN 1 1 50 1 2 1 1 5 TRP HE3 . 5 . HE3 1 1 51 1 1 1 1 5 TRP HA . 5 . HA 1 1 51 1 2 1 1 5 TRP HB2 . 5 . HB2 1 1 52 1 1 1 1 5 TRP HA . 5 . HA 1 1 52 1 2 1 1 5 TRP QB . 5 . HB* 1 1 53 1 1 1 1 5 TRP HA . 5 . HA 1 1 53 1 2 1 1 5 TRP HB3 . 5 . HB1 1 1 54 1 1 1 1 5 TRP HA . 5 . HA 1 1 54 1 2 1 1 5 TRP HE3 . 5 . HE3 1 1 55 1 1 1 1 5 TRP HA . 5 . HA 1 1 55 1 2 1 1 5 TRP HZ3 . 5 . HZ3 1 1 56 1 1 1 1 5 TRP HA . 5 . HA 1 1 56 1 2 1 1 6 GLY H . 6 . HN 1 1 57 1 1 1 1 5 TRP HA . 5 . HA 1 1 57 1 2 1 1 11 VAL QG . 11 . HG* 1 1 58 1 1 1 1 5 TRP HA . 5 . HA 1 1 58 1 2 1 1 12 ARG HA . 12 . HA 1 1 59 1 1 1 1 5 TRP QB . 5 . HB* 1 1 59 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 60 1 1 1 1 5 TRP QB . 5 . HB* 1 1 60 1 2 1 1 5 TRP HE3 . 5 . HE3 1 1 61 1 1 1 1 5 TRP QB . 5 . HB* 1 1 61 1 2 1 1 5 TRP HZ3 . 5 . HZ3 1 1 62 1 1 1 1 5 TRP QB . 5 . HB* 1 1 62 1 2 1 1 6 GLY H . 6 . HN 1 1 63 1 1 1 1 5 TRP QB . 5 . HB* 1 1 63 1 2 1 1 11 VAL QG . 11 . HG* 1 1 64 1 1 1 1 5 TRP HB2 . 5 . HB2 1 1 64 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 65 1 1 1 1 5 TRP HB2 . 5 . HB2 1 1 65 1 2 1 1 5 TRP HE1 . 5 . HE1 1 1 66 1 1 1 1 5 TRP HB2 . 5 . HB2 1 1 66 1 2 1 1 6 GLY H . 6 . HN 1 1 67 1 1 1 1 5 TRP HB3 . 5 . HB1 1 1 67 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 68 1 1 1 1 5 TRP HB3 . 5 . HB1 1 1 68 1 2 1 1 5 TRP HE1 . 5 . HE1 1 1 69 1 1 1 1 5 TRP HB3 . 5 . HB1 1 1 69 1 2 1 1 6 GLY H . 6 . HN 1 1 70 1 1 1 1 5 TRP HE3 . 5 . HE3 1 1 70 1 2 1 1 11 VAL QG . 11 . HG* 1 1 71 1 1 1 1 6 GLY H . 6 . HN 1 1 71 1 2 1 1 6 GLY HA2 . 6 . HA2 1 1 72 1 1 1 1 6 GLY H . 6 . HN 1 1 72 1 2 1 1 6 GLY HA3 . 6 . HA1 1 1 73 1 1 1 1 6 GLY H . 6 . HN 1 1 73 1 2 1 1 11 VAL HA . 11 . HA 1 1 74 1 1 1 1 6 GLY H . 6 . HN 1 1 74 1 2 1 1 11 VAL QG . 11 . HG* 1 1 75 1 1 1 1 6 GLY H . 6 . HN 1 1 75 1 2 1 1 12 ARG H . 12 . HN 1 1 76 1 1 1 1 6 GLY H . 6 . HN 1 1 76 1 2 1 1 12 ARG HA . 12 . HA 1 1 77 1 1 1 1 6 GLY QA . 6 . HA* 1 1 77 1 2 1 1 7 PHE H . 7 . HN 1 1 78 1 1 1 1 7 PHE H . 7 . HN 1 1 78 1 2 1 1 7 PHE HA . 7 . HA 1 1 79 1 1 1 1 7 PHE H . 7 . HN 1 1 79 1 2 1 1 7 PHE HB2 . 7 . HB2 1 1 80 1 1 1 1 7 PHE H . 7 . HN 1 1 80 1 2 1 1 7 PHE QB . 7 . HB* 1 1 81 1 1 1 1 7 PHE H . 7 . HN 1 1 81 1 2 1 1 7 PHE HB3 . 7 . HB1 1 1 82 1 1 1 1 7 PHE H . 7 . HN 1 1 82 1 2 1 1 7 PHE QD . 7 . HD1 1 1 83 1 1 1 1 7 PHE HA . 7 . HA 1 1 83 1 2 1 1 7 PHE HB2 . 7 . HB2 1 1 84 1 1 1 1 7 PHE HA . 7 . HA 1 1 84 1 2 1 1 7 PHE QB . 7 . HB* 1 1 85 1 1 1 1 7 PHE HA . 7 . HA 1 1 85 1 2 1 1 7 PHE HB3 . 7 . HB1 1 1 86 1 1 1 1 7 PHE HA . 7 . HA 1 1 86 1 2 1 1 7 PHE QD . 7 . HD1 1 1 87 1 1 1 1 7 PHE HA . 7 . HA 1 1 87 1 2 1 1 8 GLU H . 8 . HN 1 1 88 1 1 1 1 7 PHE QB . 7 . HB* 1 1 88 1 2 1 1 7 PHE QD . 7 . HD1 1 1 89 1 1 1 1 7 PHE QB . 7 . HB* 1 1 89 1 2 1 1 8 GLU H . 8 . HN 1 1 90 1 1 1 1 7 PHE HB2 . 7 . HB2 1 1 90 1 2 1 1 8 GLU H . 8 . HN 1 1 91 1 1 1 1 7 PHE HB3 . 7 . HB1 1 1 91 1 2 1 1 8 GLU H . 8 . HN 1 1 92 1 1 1 1 8 GLU H . 8 . HN 1 1 92 1 2 1 1 8 GLU HA . 8 . HA 1 1 93 1 1 1 1 8 GLU H . 8 . HN 1 1 93 1 2 1 1 8 GLU HB2 . 8 . HB2 1 1 94 1 1 1 1 8 GLU H . 8 . HN 1 1 94 1 2 1 1 8 GLU QB . 8 . HB* 1 1 95 1 1 1 1 8 GLU H . 8 . HN 1 1 95 1 2 1 1 8 GLU HB3 . 8 . HB1 1 1 96 1 1 1 1 8 GLU H . 8 . HN 1 1 96 1 2 1 1 8 GLU HG2 . 8 . HG2 1 1 97 1 1 1 1 8 GLU H . 8 . HN 1 1 97 1 2 1 1 8 GLU QG . 8 . HG* 1 1 98 1 1 1 1 8 GLU H . 8 . HN 1 1 98 1 2 1 1 8 GLU HG3 . 8 . HG1 1 1 99 1 1 1 1 8 GLU HA . 8 . HA 1 1 99 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1 100 1 1 1 1 8 GLU HA . 8 . HA 1 1 100 1 2 1 1 9 PRO QD . 9 . HD* 1 1 101 1 1 1 1 8 GLU HA . 8 . HA 1 1 101 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1 102 1 1 1 1 8 GLU QB . 8 . HB* 1 1 102 1 2 1 1 12 ARG H . 12 . HN 1 1 103 1 1 1 1 8 GLU QG . 8 . HG* 1 1 103 1 2 1 1 9 PRO QD . 9 . HD* 1 1 104 1 1 1 1 9 PRO HA . 9 . HA 1 1 104 1 2 1 1 10 GLY H . 10 . HN 1 1 105 1 1 1 1 9 PRO HA . 9 . HA 1 1 105 1 2 1 1 11 VAL H . 11 . HN 1 1 106 1 1 1 1 10 GLY H . 10 . HN 1 1 106 1 2 1 1 10 GLY HA2 . 10 . HA2 1 1 107 1 1 1 1 10 GLY H . 10 . HN 1 1 107 1 2 1 1 10 GLY QA . 10 . HA* 1 1 108 1 1 1 1 10 GLY H . 10 . HN 1 1 108 1 2 1 1 10 GLY HA3 . 10 . HA1 1 1 109 1 1 1 1 10 GLY H . 10 . HN 1 1 109 1 2 1 1 11 VAL H . 11 . HN 1 1 110 1 1 1 1 10 GLY HA2 . 10 . HA2 1 1 110 1 2 1 1 11 VAL H . 11 . HN 1 1 111 1 1 1 1 10 GLY HA3 . 10 . HA1 1 1 111 1 2 1 1 11 VAL H . 11 . HN 1 1 112 1 1 1 1 11 VAL H . 11 . HN 1 1 112 1 2 1 1 11 VAL MG1 . 11 . HG1* 1 1 113 1 1 1 1 11 VAL H . 11 . HN 1 1 113 1 2 1 1 11 VAL QG . 11 . HG* 1 1 114 1 1 1 1 11 VAL H . 11 . HN 1 1 114 1 2 1 1 11 VAL MG2 . 11 . HG2* 1 1 115 1 1 1 1 11 VAL H . 11 . HN 1 1 115 1 2 1 1 12 ARG H . 12 . HN 1 1 116 1 1 1 1 11 VAL HA . 11 . HA 1 1 116 1 2 1 1 11 VAL HB . 11 . HB 1 1 117 1 1 1 1 11 VAL HA . 11 . HA 1 1 117 1 2 1 1 11 VAL MG1 . 11 . HG1* 1 1 118 1 1 1 1 11 VAL HA . 11 . HA 1 1 118 1 2 1 1 11 VAL QG . 11 . HG* 1 1 119 1 1 1 1 11 VAL HA . 11 . HA 1 1 119 1 2 1 1 11 VAL MG2 . 11 . HG2* 1 1 120 1 1 1 1 11 VAL HA . 11 . HA 1 1 120 1 2 1 1 12 ARG H . 12 . HN 1 1 121 1 1 1 1 11 VAL QG . 11 . HG* 1 1 121 1 2 1 1 12 ARG H . 12 . HN 1 1 122 1 1 1 1 11 VAL MG1 . 11 . HG1* 1 1 122 1 2 1 1 12 ARG H . 12 . HN 1 1 123 1 1 1 1 11 VAL MG2 . 11 . HG2* 1 1 123 1 2 1 1 12 ARG H . 12 . HN 1 1 124 1 1 1 1 12 ARG H . 12 . HN 1 1 124 1 2 1 1 12 ARG HA . 12 . HA 1 1 125 1 1 1 1 12 ARG H . 12 . HN 1 1 125 1 2 1 1 12 ARG HB2 . 12 . HB2 1 1 126 1 1 1 1 12 ARG H . 12 . HN 1 1 126 1 2 1 1 12 ARG QB . 12 . HB* 1 1 127 1 1 1 1 12 ARG H . 12 . HN 1 1 127 1 2 1 1 12 ARG HB3 . 12 . HB1 1 1 128 1 1 1 1 12 ARG H . 12 . HN 1 1 128 1 2 1 1 13 CYS H . 13 . HN 1 1 129 1 1 1 1 12 ARG HA . 12 . HA 1 1 129 1 2 1 1 12 ARG HB2 . 12 . HB2 1 1 130 1 1 1 1 12 ARG HA . 12 . HA 1 1 130 1 2 1 1 12 ARG QB . 12 . HB* 1 1 131 1 1 1 1 12 ARG HA . 12 . HA 1 1 131 1 2 1 1 12 ARG HB3 . 12 . HB1 1 1 132 1 1 1 1 12 ARG HA . 12 . HA 1 1 132 1 2 1 1 12 ARG HD2 . 12 . HD2 1 1 133 1 1 1 1 12 ARG HA . 12 . HA 1 1 133 1 2 1 1 12 ARG QD . 12 . HD* 1 1 134 1 1 1 1 12 ARG HA . 12 . HA 1 1 134 1 2 1 1 12 ARG HD3 . 12 . HD1 1 1 135 1 1 1 1 12 ARG HA . 12 . HA 1 1 135 1 2 1 1 12 ARG HG2 . 12 . HG2 1 1 136 1 1 1 1 12 ARG HA . 12 . HA 1 1 136 1 2 1 1 12 ARG QG . 12 . HG* 1 1 137 1 1 1 1 12 ARG HA . 12 . HA 1 1 137 1 2 1 1 12 ARG HG3 . 12 . HG1 1 1 138 1 1 1 1 12 ARG HA . 12 . HA 1 1 138 1 2 1 1 13 CYS H . 13 . HN 1 1 139 1 1 1 1 12 ARG QB . 12 . HB* 1 1 139 1 2 1 1 12 ARG QD . 12 . HD* 1 1 140 1 1 1 1 12 ARG QB . 12 . HB* 1 1 140 1 2 1 1 12 ARG QG . 12 . HG* 1 1 141 1 1 1 1 12 ARG HB2 . 12 . HB2 1 1 141 1 2 1 1 12 ARG HD2 . 12 . HD2 1 1 142 1 1 1 1 12 ARG HB2 . 12 . HB2 1 1 142 1 2 1 1 12 ARG HD3 . 12 . HD1 1 1 143 1 1 1 1 12 ARG HB2 . 12 . HB2 1 1 143 1 2 1 1 12 ARG HG2 . 12 . HG2 1 1 144 1 1 1 1 12 ARG HB2 . 12 . HB2 1 1 144 1 2 1 1 12 ARG HG3 . 12 . HG1 1 1 145 1 1 1 1 12 ARG HB3 . 12 . HB1 1 1 145 1 2 1 1 12 ARG HD2 . 12 . HD2 1 1 146 1 1 1 1 12 ARG HB3 . 12 . HB1 1 1 146 1 2 1 1 12 ARG HD3 . 12 . HD1 1 1 147 1 1 1 1 12 ARG HB3 . 12 . HB1 1 1 147 1 2 1 1 12 ARG HG2 . 12 . HG2 1 1 148 1 1 1 1 12 ARG HB3 . 12 . HB1 1 1 148 1 2 1 1 12 ARG HG3 . 12 . HG1 1 1 149 1 1 1 1 12 ARG QD . 12 . HD* 1 1 149 1 2 1 1 12 ARG QG . 12 . HG* 1 1 150 1 1 1 1 12 ARG HD2 . 12 . HD2 1 1 150 1 2 1 1 12 ARG HG2 . 12 . HG2 1 1 151 1 1 1 1 12 ARG HD2 . 12 . HD2 1 1 151 1 2 1 1 12 ARG HG3 . 12 . HG1 1 1 152 1 1 1 1 12 ARG HD3 . 12 . HD1 1 1 152 1 2 1 1 12 ARG HG2 . 12 . HG2 1 1 153 1 1 1 1 12 ARG HD3 . 12 . HD1 1 1 153 1 2 1 1 12 ARG HG3 . 12 . HG1 1 1 154 1 1 1 1 13 CYS CB . 13 . CB 1 1 154 1 2 1 1 17 CYS SG . 17 . SG 1 1 155 1 1 1 1 13 CYS H . 13 . HN 1 1 155 1 2 1 1 13 CYS HA . 13 . HA 1 1 156 1 1 1 1 13 CYS H . 13 . HN 1 1 156 1 2 1 1 13 CYS QB . 13 . HB2 1 1 157 1 1 1 1 13 CYS HA . 13 . HA 1 1 157 1 2 1 1 13 CYS QB . 13 . HB2 1 1 158 1 1 1 1 13 CYS QB . 13 . HB2 1 1 158 1 2 1 1 17 CYS HA . 17 . HA 1 1 159 1 1 1 1 13 CYS SG . 13 . SG 1 1 159 1 2 1 1 17 CYS CB . 17 . CB 1 1 160 1 1 1 1 13 CYS SG . 13 . SG 1 1 160 1 2 1 1 17 CYS SG . 17 . SG 1 1 161 1 1 1 1 14 LEU H . 14 . HN 1 1 161 1 2 1 1 14 LEU HA . 14 . HA 1 1 162 1 1 1 1 14 LEU H . 14 . HN 1 1 162 1 2 1 1 14 LEU MD1 . 14 . HD1* 1 1 163 1 1 1 1 14 LEU H . 14 . HN 1 1 163 1 2 1 1 14 LEU QD . 14 . HD* 1 1 164 1 1 1 1 14 LEU H . 14 . HN 1 1 164 1 2 1 1 14 LEU MD2 . 14 . HD2* 1 1 165 1 1 1 1 14 LEU H . 14 . HN 1 1 165 1 2 1 1 14 LEU HG . 14 . HG 1 1 166 1 1 1 1 14 LEU HA . 14 . HA 1 1 166 1 2 1 1 14 LEU MD1 . 14 . HD1* 1 1 167 1 1 1 1 14 LEU HA . 14 . HA 1 1 167 1 2 1 1 14 LEU MD2 . 14 . HD2* 1 1 168 1 1 1 1 14 LEU HA . 14 . HA 1 1 168 1 2 1 1 14 LEU HG . 14 . HG 1 1 169 1 1 1 1 14 LEU QB . 14 . HB* 1 1 169 1 2 1 1 14 LEU QD . 14 . HD* 1 1 170 1 1 1 1 14 LEU QB . 14 . HB* 1 1 170 1 2 1 1 14 LEU HG . 14 . HG 1 1 171 1 1 1 1 14 LEU QB . 14 . HB* 1 1 171 1 2 1 1 15 ILE H . 15 . HN 1 1 172 1 1 1 1 14 LEU HB2 . 14 . HB2 1 1 172 1 2 1 1 14 LEU MD1 . 14 . HD1* 1 1 173 1 1 1 1 14 LEU HB2 . 14 . HB2 1 1 173 1 2 1 1 14 LEU MD2 . 14 . HD2* 1 1 174 1 1 1 1 14 LEU HB2 . 14 . HB2 1 1 174 1 2 1 1 14 LEU HG . 14 . HG 1 1 175 1 1 1 1 14 LEU HB2 . 14 . HB2 1 1 175 1 2 1 1 15 ILE H . 15 . HN 1 1 176 1 1 1 1 14 LEU HB3 . 14 . HB1 1 1 176 1 2 1 1 14 LEU MD1 . 14 . HD1* 1 1 177 1 1 1 1 14 LEU HB3 . 14 . HB1 1 1 177 1 2 1 1 14 LEU MD2 . 14 . HD2* 1 1 178 1 1 1 1 14 LEU HB3 . 14 . HB1 1 1 178 1 2 1 1 14 LEU HG . 14 . HG 1 1 179 1 1 1 1 14 LEU HB3 . 14 . HB1 1 1 179 1 2 1 1 15 ILE H . 15 . HN 1 1 180 1 1 1 1 15 ILE H . 15 . HN 1 1 180 1 2 1 1 15 ILE HA . 15 . HA 1 1 181 1 1 1 1 15 ILE H . 15 . HN 1 1 181 1 2 1 1 15 ILE HB . 15 . HB 1 1 182 1 1 1 1 15 ILE H . 15 . HN 1 1 182 1 2 1 1 15 ILE MD . 15 . HD1* 1 1 183 1 1 1 1 15 ILE H . 15 . HN 1 1 183 1 2 1 1 15 ILE QG . 15 . HG12 1 1 184 1 1 1 1 15 ILE H . 15 . HN 1 1 184 1 2 1 1 15 ILE MG . 15 . HG2* 1 1 185 1 1 1 1 15 ILE HA . 15 . HA 1 1 185 1 2 1 1 15 ILE MD . 15 . HD1* 1 1 186 1 1 1 1 15 ILE HA . 15 . HA 1 1 186 1 2 1 1 15 ILE QG . 15 . HG12 1 1 187 1 1 1 1 15 ILE HB . 15 . HB 1 1 187 1 2 1 1 15 ILE MD . 15 . HD1* 1 1 188 1 1 1 1 15 ILE MD . 15 . HD1* 1 1 188 1 2 1 1 15 ILE MG . 15 . HG2* 1 1 189 1 1 1 1 15 ILE QG . 15 . HG12 1 1 189 1 2 1 1 15 ILE MG . 15 . HG2* 1 1 190 1 1 1 1 15 ILE MG . 15 . HG2* 1 1 190 1 2 1 1 16 TRP H . 16 . HN 1 1 191 1 1 1 1 15 ILE MG . 15 . HG2* 1 1 191 1 2 1 1 16 TRP HD1 . 16 . HD1 1 1 192 1 1 1 1 15 ILE MG . 15 . HG2* 1 1 192 1 2 1 1 16 TRP HE1 . 16 . HE1 1 1 193 1 1 1 1 15 ILE MG . 15 . HG2* 1 1 193 1 2 1 1 16 TRP HE3 . 16 . HE3 1 1 194 1 1 1 1 15 ILE MG . 15 . HG2* 1 1 194 1 2 1 1 16 TRP HZ2 . 16 . HZ2 1 1 195 1 1 1 1 16 TRP H . 16 . HN 1 1 195 1 2 1 1 16 TRP HA . 16 . HA 1 1 196 1 1 1 1 16 TRP H . 16 . HN 1 1 196 1 2 1 1 16 TRP HB2 . 16 . HB2 1 1 197 1 1 1 1 16 TRP H . 16 . HN 1 1 197 1 2 1 1 16 TRP QB . 16 . HB* 1 1 198 1 1 1 1 16 TRP H . 16 . HN 1 1 198 1 2 1 1 16 TRP HB3 . 16 . HB1 1 1 199 1 1 1 1 16 TRP H . 16 . HN 1 1 199 1 2 1 1 16 TRP HD1 . 16 . HD1 1 1 200 1 1 1 1 16 TRP H . 16 . HN 1 1 200 1 2 1 1 16 TRP HE1 . 16 . HE1 1 1 201 1 1 1 1 16 TRP H . 16 . HN 1 1 201 1 2 1 1 16 TRP HE3 . 16 . HE3 1 1 202 1 1 1 1 16 TRP H . 16 . HN 1 1 202 1 2 1 1 16 TRP HZ2 . 16 . HZ2 1 1 203 1 1 1 1 16 TRP H . 16 . HN 1 1 203 1 2 1 1 17 CYS H . 17 . HN 1 1 204 1 1 1 1 16 TRP HA . 16 . HA 1 1 204 1 2 1 1 16 TRP HB2 . 16 . HB2 1 1 205 1 1 1 1 16 TRP HA . 16 . HA 1 1 205 1 2 1 1 16 TRP QB . 16 . HB* 1 1 206 1 1 1 1 16 TRP HA . 16 . HA 1 1 206 1 2 1 1 16 TRP HB3 . 16 . HB1 1 1 207 1 1 1 1 16 TRP HA . 16 . HA 1 1 207 1 2 1 1 16 TRP HE3 . 16 . HE3 1 1 208 1 1 1 1 16 TRP HA . 16 . HA 1 1 208 1 2 1 1 17 CYS H . 17 . HN 1 1 209 1 1 1 1 16 TRP QB . 16 . HB* 1 1 209 1 2 1 1 16 TRP HD1 . 16 . HD1 1 1 210 1 1 1 1 16 TRP HB2 . 16 . HB2 1 1 210 1 2 1 1 16 TRP HD1 . 16 . HD1 1 1 211 1 1 1 1 16 TRP HB3 . 16 . HB1 1 1 211 1 2 1 1 16 TRP HD1 . 16 . HD1 1 1 212 1 1 1 1 17 CYS H . 17 . HN 1 1 212 1 2 1 1 17 CYS HA . 17 . HA 1 1 213 1 1 1 1 17 CYS H . 17 . HN 1 1 213 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 214 1 1 1 1 17 CYS H . 17 . HN 1 1 214 1 2 1 1 17 CYS QB . 17 . HB* 1 1 215 1 1 1 1 17 CYS H . 17 . HN 1 1 215 1 2 1 1 17 CYS HB3 . 17 . HB1 1 1 216 1 1 1 1 17 CYS H . 17 . HN 1 1 216 1 2 1 1 18 ASP H . 18 . HN 1 1 217 1 1 1 1 17 CYS HA . 17 . HA 1 1 217 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 218 1 1 1 1 17 CYS HA . 17 . HA 1 1 218 1 2 1 1 17 CYS QB . 17 . HB* 1 1 219 1 1 1 1 17 CYS HA . 17 . HA 1 1 219 1 2 1 1 17 CYS HB3 . 17 . HB1 1 1 220 1 1 1 1 17 CYS HA . 17 . HA 1 1 220 1 2 1 1 18 ASP H . 18 . HN 1 1 221 1 1 1 1 17 CYS QB . 17 . HB* 1 1 221 1 2 1 1 18 ASP H . 18 . HN 1 1 222 1 1 1 1 17 CYS HB2 . 17 . HB2 1 1 222 1 2 1 1 18 ASP H . 18 . HN 1 1 223 1 1 1 1 17 CYS HB3 . 17 . HB1 1 1 223 1 2 1 1 18 ASP H . 18 . HN 1 1 224 1 1 1 1 18 ASP H . 18 . HN 1 1 224 1 2 1 1 18 ASP HA . 18 . HA 1 1 225 1 1 1 1 18 ASP H . 18 . HN 1 1 225 1 2 1 1 18 ASP HB2 . 18 . HB2 1 1 226 1 1 1 1 18 ASP H . 18 . HN 1 1 226 1 2 1 1 18 ASP QB . 18 . HB* 1 1 227 1 1 1 1 18 ASP H . 18 . HN 1 1 227 1 2 1 1 18 ASP HB3 . 18 . HB1 1 1 228 1 1 1 1 18 ASP HA . 18 . HA 1 1 228 1 2 1 1 18 ASP HB2 . 18 . HB2 1 1 229 1 1 1 1 18 ASP HA . 18 . HA 1 1 229 1 2 1 1 18 ASP HB3 . 18 . HB1 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.4 0.0 2.4 1 1 2 1 . . . . . 2.0 0.0 2.0 1 1 3 1 . . . . . 3.03 0.0 3.03 1 1 4 1 . . . . . 3.03 0.0 3.03 1 1 5 1 . . . . . 1.6 0.0 1.6 1 1 6 1 . . . . . 2.4 0.0 2.4 1 1 7 1 . . . . . 2.82 0.0 2.82 1 1 8 1 . . . . . . 0.0 2.52 1 1 9 1 . . . . . 2.05 0.0 2.05 1 1 10 1 . . . . . . 0.0 2.4 1 1 11 1 . . . . . . 0.0 2.76 1 1 12 1 . . . . . 2.66 0.0 2.66 1 1 13 1 . . . . . 3.53 0.0 3.53 1 1 14 1 . . . . . 2.6 0.0 2.6 1 1 15 1 . . . . . 3.53 0.0 3.53 1 1 16 1 . . . . . . 0.0 2.41 1 1 17 1 . . . . . 3.39 0.0 3.39 1 1 18 1 . . . . . 2.34 0.0 2.34 1 1 19 1 . . . . . 3.39 0.0 3.39 1 1 20 1 . . . . . 2.85 0.0 2.85 1 1 21 1 . . . . . 2.19 0.0 2.19 1 1 22 1 . . . . . 2.85 0.0 2.85 1 1 23 1 . . . . . . 0.0 2.52 1 1 24 1 . . . . . 3.75 0.0 3.75 1 1 25 1 . . . . . 3.15 0.0 3.15 1 1 26 1 . . . . . 3.75 0.0 3.75 1 1 27 1 . . . . . 3.04 0.0 3.04 1 1 28 1 . . . . . 2.35 0.0 2.35 1 1 29 1 . . . . . 1.94 0.0 1.94 1 1 30 1 . . . . . 2.22 0.0 2.22 1 1 31 1 . . . . . 2.95 0.0 2.95 1 1 32 1 . . . . . 2.95 0.0 2.95 1 1 33 1 . . . . . 2.91 0.0 2.91 1 1 34 1 . . . . . 2.95 0.0 2.95 1 1 35 1 . . . . . 2.95 0.0 2.95 1 1 36 1 . . . . . 2.91 0.0 2.91 1 1 37 1 . . . . . 2.11 0.0 2.11 1 1 38 1 . . . . . 2.7 0.0 2.7 1 1 39 1 . . . . . 2.7 0.0 2.7 1 1 40 1 . . . . . 4.49 0.0 4.49 1 1 41 1 . . . . . 2.08 0.0 2.08 1 1 42 1 . . . . . 3.0 0.0 3.0 1 1 43 1 . . . . . 3.0 0.0 3.0 1 1 44 1 . . . . . 2.81 0.0 2.81 1 1 45 1 . . . . . 3.47 0.0 3.47 1 1 46 1 . . . . . 2.79 0.0 2.79 1 1 47 1 . . . . . 3.47 0.0 3.47 1 1 48 1 . . . . . 3.43 0.0 3.43 1 1 49 1 . . . . . 4.22 0.0 4.22 1 1 50 1 . . . . . 3.31 0.0 3.31 1 1 51 1 . . . . . 2.87 0.0 2.87 1 1 52 1 . . . . . 2.1 0.0 2.1 1 1 53 1 . . . . . 2.87 0.0 2.87 1 1 54 1 . . . . . 2.82 0.0 2.82 1 1 55 1 . . . . . 5.06 0.0 5.06 1 1 56 1 . . . . . 2.2 0.0 2.2 1 1 57 1 . . . . . 2.55 0.0 2.55 1 1 58 1 . . . . . 2.49 0.0 2.49 1 1 59 1 . . . . . 2.88 0.0 2.88 1 1 60 1 . . . . . 2.78 0.0 2.78 1 1 61 1 . . . . . 4.99 0.0 4.99 1 1 62 1 . . . . . 2.72 0.0 2.72 1 1 63 1 . . . . . 2.79 0.0 2.79 1 1 64 1 . . . . . 3.5 0.0 3.5 1 1 65 1 . . . . . 5.0 0.0 5.0 1 1 66 1 . . . . . 3.35 0.0 3.35 1 1 67 1 . . . . . 3.5 0.0 3.5 1 1 68 1 . . . . . 5.0 0.0 5.0 1 1 69 1 . . . . . 3.35 0.0 3.35 1 1 70 1 . . . . . 2.5 0.0 2.5 1 1 71 1 . . . . . 2.74 0.0 2.74 1 1 72 1 . . . . . 2.74 0.0 2.74 1 1 73 1 . . . . . 2.86 0.0 2.86 1 1 74 1 . . . . . 2.74 0.0 2.74 1 1 75 1 . . . . . 3.08 0.0 3.08 1 1 76 1 . . . . . 3.26 0.0 3.26 1 1 77 1 . . . . . 2.73 0.0 2.73 1 1 78 1 . . . . . 2.79 0.0 2.79 1 1 79 1 . . . . . 3.72 0.0 3.72 1 1 80 1 . . . . . 3.21 0.0 3.21 1 1 81 1 . . . . . 3.72 0.0 3.72 1 1 82 1 . . . . . 2.85 0.0 2.85 1 1 83 1 . . . . . 2.96 0.0 2.96 1 1 84 1 . . . . . 2.41 0.0 2.41 1 1 85 1 . . . . . 2.96 0.0 2.96 1 1 86 1 . . . . . 2.19 0.0 2.19 1 1 87 1 . . . . . 3.38 0.0 3.38 1 1 88 1 . . . . . 2.85 0.0 2.85 1 1 89 1 . . . . . 3.21 0.0 3.21 1 1 90 1 . . . . . 3.72 0.0 3.72 1 1 91 1 . . . . . 3.72 0.0 3.72 1 1 92 1 . . . . . 2.83 0.0 2.83 1 1 93 1 . . . . . 3.25 0.0 3.25 1 1 94 1 . . . . . 2.82 0.0 2.82 1 1 95 1 . . . . . 3.25 0.0 3.25 1 1 96 1 . . . . . 5.15 0.0 5.15 1 1 97 1 . . . . . 4.37 0.0 4.37 1 1 98 1 . . . . . 5.15 0.0 5.15 1 1 99 1 . . . . . 2.31 0.0 2.31 1 1 100 1 . . . . . 1.97 0.0 1.97 1 1 101 1 . . . . . 2.31 0.0 2.31 1 1 102 1 . . . . . 3.4 0.0 3.4 1 1 103 1 . . . . . 2.99 0.0 2.99 1 1 104 1 . . . . . 2.25 0.0 2.25 1 1 105 1 . . . . . 3.75 0.0 3.75 1 1 106 1 . . . . . 2.81 0.0 2.81 1 1 107 1 . . . . . 2.36 0.0 2.36 1 1 108 1 . . . . . 2.81 0.0 2.81 1 1 109 1 . . . . . 2.01 0.0 2.01 1 1 110 1 . . . . . 3.19 0.0 3.19 1 1 111 1 . . . . . 3.19 0.0 3.19 1 1 112 1 . . . . . 3.89 0.0 3.89 1 1 113 1 . . . . . 2.59 0.0 2.59 1 1 114 1 . . . . . 3.89 0.0 3.89 1 1 115 1 . . . . . 2.8 0.0 2.8 1 1 116 1 . . . . . 2.95 0.0 2.95 1 1 117 1 . . . . . 2.37 0.0 2.37 1 1 118 1 . . . . . 1.93 0.0 1.93 1 1 119 1 . . . . . 2.37 0.0 2.37 1 1 120 1 . . . . . 2.54 0.0 2.54 1 1 121 1 . . . . . 3.64 0.0 3.64 1 1 122 1 . . . . . 4.24 0.0 4.24 1 1 123 1 . . . . . 4.24 0.0 4.24 1 1 124 1 . . . . . 2.84 0.0 2.84 1 1 125 1 . . . . . 3.84 0.0 3.84 1 1 126 1 . . . . . 2.76 0.0 2.76 1 1 127 1 . . . . . 3.84 0.0 3.84 1 1 128 1 . . . . . 3.96 0.0 3.96 1 1 129 1 . . . . . 2.88 0.0 2.88 1 1 130 1 . . . . . 2.39 0.0 2.39 1 1 131 1 . . . . . 2.88 0.0 2.88 1 1 132 1 . . . . . 3.21 0.0 3.21 1 1 133 1 . . . . . 2.17 0.0 2.17 1 1 134 1 . . . . . 3.21 0.0 3.21 1 1 135 1 . . . . . 3.62 0.0 3.62 1 1 136 1 . . . . . 3.0 0.0 3.0 1 1 137 1 . . . . . 3.62 0.0 3.62 1 1 138 1 . . . . . 3.32 0.0 3.32 1 1 139 1 . . . . . 2.45 0.0 2.45 1 1 140 1 . . . . . 1.88 0.0 1.88 1 1 141 1 . . . . . 3.99 0.0 3.99 1 1 142 1 . . . . . 3.99 0.0 3.99 1 1 143 1 . . . . . 2.96 0.0 2.96 1 1 144 1 . . . . . 2.96 0.0 2.96 1 1 145 1 . . . . . 3.99 0.0 3.99 1 1 146 1 . . . . . 3.99 0.0 3.99 1 1 147 1 . . . . . 2.96 0.0 2.96 1 1 148 1 . . . . . 2.96 0.0 2.96 1 1 149 1 . . . . . 2.16 0.0 2.16 1 1 150 1 . . . . . 3.01 0.0 3.01 1 1 151 1 . . . . . 3.01 0.0 3.01 1 1 152 1 . . . . . 3.01 0.0 3.01 1 1 153 1 . . . . . 3.01 0.0 3.01 1 1 154 1 . . . . . 3.1 0.0 3.1 1 1 155 1 . . . . . 2.77 0.0 2.77 1 1 156 1 . . . . . 2.57 0.0 2.57 1 1 157 1 . . . . . . 0.0 2.41 1 1 158 1 . . . . . 4.88 0.0 4.88 1 1 159 1 . . . . . 3.1 0.0 3.1 1 1 160 1 . . . . . 2.1 0.0 2.1 1 1 161 1 . . . . . 2.94 0.0 2.94 1 1 162 1 . . . . . 4.22 0.0 4.22 1 1 163 1 . . . . . 3.08 0.0 3.08 1 1 164 1 . . . . . 4.22 0.0 4.22 1 1 165 1 . . . . . 4.14 0.0 4.14 1 1 166 1 . . . . . 3.71 0.0 3.71 1 1 167 1 . . . . . 3.71 0.0 3.71 1 1 168 1 . . . . . 3.66 0.0 3.66 1 1 169 1 . . . . . 1.85 0.0 1.85 1 1 170 1 . . . . . 2.08 0.0 2.08 1 1 171 1 . . . . . 2.64 0.0 2.64 1 1 172 1 . . . . . 3.22 0.0 3.22 1 1 173 1 . . . . . 3.22 0.0 3.22 1 1 174 1 . . . . . 2.48 0.0 2.48 1 1 175 1 . . . . . 3.25 0.0 3.25 1 1 176 1 . . . . . 3.22 0.0 3.22 1 1 177 1 . . . . . 3.22 0.0 3.22 1 1 178 1 . . . . . 2.48 0.0 2.48 1 1 179 1 . . . . . 3.25 0.0 3.25 1 1 180 1 . . . . . 2.78 0.0 2.78 1 1 181 1 . . . . . 3.03 0.0 3.03 1 1 182 1 . . . . . 3.89 0.0 3.89 1 1 183 1 . . . . . 3.12 0.0 3.12 1 1 184 1 . . . . . 3.65 0.0 3.65 1 1 185 1 . . . . . 3.73 0.0 3.73 1 1 186 1 . . . . . 2.61 0.0 2.61 1 1 187 1 . . . . . 2.66 0.0 2.66 1 1 188 1 . . . . . 2.05 0.0 2.05 1 1 189 1 . . . . . 2.36 0.0 2.36 1 1 190 1 . . . . . 3.18 0.0 3.18 1 1 191 1 . . . . . 3.12 0.0 3.12 1 1 192 1 . . . . . 2.77 0.0 2.77 1 1 193 1 . . . . . 4.09 0.0 4.09 1 1 194 1 . . . . . 3.45 0.0 3.45 1 1 195 1 . . . . . 2.71 0.0 2.71 1 1 196 1 . . . . . 3.64 0.0 3.64 1 1 197 1 . . . . . 3.1 0.0 3.1 1 1 198 1 . . . . . 3.64 0.0 3.64 1 1 199 1 . . . . . 4.07 0.0 4.07 1 1 200 1 . . . . . 4.94 0.0 4.94 1 1 201 1 . . . . . 3.75 0.0 3.75 1 1 202 1 . . . . . 5.21 0.0 5.21 1 1 203 1 . . . . . 3.5 0.0 3.5 1 1 204 1 . . . . . 2.89 0.0 2.89 1 1 205 1 . . . . . 2.4 0.0 2.4 1 1 206 1 . . . . . 2.89 0.0 2.89 1 1 207 1 . . . . . 2.8 0.0 2.8 1 1 208 1 . . . . . 3.52 0.0 3.52 1 1 209 1 . . . . . 3.14 0.0 3.14 1 1 210 1 . . . . . 3.68 0.0 3.68 1 1 211 1 . . . . . 3.68 0.0 3.68 1 1 212 1 . . . . . 2.61 0.0 2.61 1 1 213 1 . . . . . 3.77 0.0 3.77 1 1 214 1 . . . . . 2.91 0.0 2.91 1 1 215 1 . . . . . 3.77 0.0 3.77 1 1 216 1 . . . . . 4.53 0.0 4.53 1 1 217 1 . . . . . 2.55 0.0 2.55 1 1 218 1 . . . . . 2.09 0.0 2.09 1 1 219 1 . . . . . 2.55 0.0 2.55 1 1 220 1 . . . . . 2.66 0.0 2.66 1 1 221 1 . . . . . 2.39 0.0 2.39 1 1 222 1 . . . . . 3.47 0.0 3.47 1 1 223 1 . . . . . 3.47 0.0 3.47 1 1 224 1 . . . . . 2.68 0.0 2.68 1 1 225 1 . . . . . 2.82 0.0 2.82 1 1 226 1 . . . . . 2.41 0.0 2.41 1 1 227 1 . . . . . 2.82 0.0 2.82 1 1 228 1 . . . . . 2.36 0.0 2.36 1 1 229 1 . . . . . 2.85 0.0 2.85 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C 2.418 0.838 -1.980 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 2.264 -0.667 -1.889 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 2.256 -0.126 0.156 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY HA2 H 3.175 -1.156 -2.234 1.00 . A A . 1 GLY HA2 1 1 1 5 1 1 1 GLY HA3 H 1.401 -1.002 -2.463 1.00 . A A . 1 GLY HA3 1 1 1 6 1 1 1 GLY N N 2.066 -0.897 -0.469 1.00 . A A . 1 GLY N 1 1 1 7 1 1 1 GLY O O 2.519 1.477 -0.934 1.00 . A A . 1 GLY O 1 1 1 8 1 1 2 SER C C 1.735 3.630 -4.230 1.00 . A A . 2 SER C 1 1 1 9 1 1 2 SER CA C 2.651 2.866 -3.279 1.00 . A A . 2 SER CA 1 1 1 10 1 1 2 SER CB C 4.098 3.105 -3.709 1.00 . A A . 2 SER CB 1 1 1 11 1 1 2 SER H H 2.399 0.873 -4.016 1.00 . A A . 2 SER H 1 1 1 12 1 1 2 SER HA H 2.522 3.312 -2.293 1.00 . A A . 2 SER HA 1 1 1 13 1 1 2 SER HB2 H 4.279 2.591 -4.653 1.00 . A A . 2 SER HB2 1 1 1 14 1 1 2 SER HB3 H 4.247 4.173 -3.851 1.00 . A A . 2 SER HB3 1 1 1 15 1 1 2 SER HG H 4.648 2.844 -1.861 1.00 . A A . 2 SER HG 1 1 1 16 1 1 2 SER N N 2.450 1.423 -3.172 1.00 . A A . 2 SER N 1 1 1 17 1 1 2 SER O O 1.724 4.859 -4.229 1.00 . A A . 2 SER O 1 1 1 18 1 1 2 SER OG O 4.992 2.616 -2.723 1.00 . A A . 2 SER OG 1 1 1 19 1 1 3 ARG C C -1.061 4.196 -5.681 1.00 . A A . 3 ARG C 1 1 1 20 1 1 3 ARG CA C 0.223 3.510 -6.147 1.00 . A A . 3 ARG CA 1 1 1 21 1 1 3 ARG CB C -0.039 2.481 -7.253 1.00 . A A . 3 ARG CB 1 1 1 22 1 1 3 ARG CD C 2.358 2.499 -8.081 1.00 . A A . 3 ARG CD 1 1 1 23 1 1 3 ARG CG C 1.166 1.646 -7.674 1.00 . A A . 3 ARG CG 1 1 1 24 1 1 3 ARG CZ C 4.105 2.393 -9.833 1.00 . A A . 3 ARG CZ 1 1 1 25 1 1 3 ARG H H 1.070 1.900 -5.029 1.00 . A A . 3 ARG H 1 1 1 26 1 1 3 ARG HA H 0.824 4.314 -6.570 1.00 . A A . 3 ARG HA 1 1 1 27 1 1 3 ARG HB2 H -0.810 1.788 -6.919 1.00 . A A . 3 ARG HB2 1 1 1 28 1 1 3 ARG HB3 H -0.418 3.009 -8.128 1.00 . A A . 3 ARG HB3 1 1 1 29 1 1 3 ARG HD2 H 1.982 3.421 -8.525 1.00 . A A . 3 ARG HD2 1 1 1 30 1 1 3 ARG HD3 H 2.937 2.755 -7.193 1.00 . A A . 3 ARG HD3 1 1 1 31 1 1 3 ARG HE H 3.107 0.806 -9.124 1.00 . A A . 3 ARG HE 1 1 1 32 1 1 3 ARG HG2 H 1.462 0.992 -6.854 1.00 . A A . 3 ARG HG2 1 1 1 33 1 1 3 ARG HG3 H 0.872 1.023 -8.519 1.00 . A A . 3 ARG HG3 1 1 1 34 1 1 3 ARG HH11 H 3.817 4.272 -9.166 1.00 . A A . 3 ARG HH11 1 1 1 35 1 1 3 ARG HH12 H 5.011 4.087 -10.438 1.00 . A A . 3 ARG HH12 1 1 1 36 1 1 3 ARG HH21 H 4.625 0.660 -10.713 1.00 . A A . 3 ARG HH21 1 1 1 37 1 1 3 ARG HH22 H 5.468 2.090 -11.285 1.00 . A A . 3 ARG HH22 1 1 1 38 1 1 3 ARG N N 1.015 2.905 -5.080 1.00 . A A . 3 ARG N 1 1 1 39 1 1 3 ARG NE N 3.213 1.807 -9.045 1.00 . A A . 3 ARG NE 1 1 1 40 1 1 3 ARG NH1 N 4.327 3.692 -9.813 1.00 . A A . 3 ARG NH1 1 1 1 41 1 1 3 ARG NH2 N 4.792 1.653 -10.679 1.00 . A A . 3 ARG NH2 1 1 1 42 1 1 3 ARG O O -1.043 5.385 -5.375 1.00 . A A . 3 ARG O 1 1 1 43 1 1 4 GLY C C -3.519 3.861 -3.668 1.00 . A A . 4 GLY C 1 1 1 44 1 1 4 GLY CA C -3.426 4.018 -5.172 1.00 . A A . 4 GLY CA 1 1 1 45 1 1 4 GLY H H -2.141 2.503 -5.947 1.00 . A A . 4 GLY H 1 1 1 46 1 1 4 GLY HA2 H -3.469 5.080 -5.415 1.00 . A A . 4 GLY HA2 1 1 1 47 1 1 4 GLY HA3 H -4.264 3.504 -5.643 1.00 . A A . 4 GLY HA3 1 1 1 48 1 1 4 GLY N N -2.172 3.467 -5.655 1.00 . A A . 4 GLY N 1 1 1 49 1 1 4 GLY O O -2.503 3.591 -3.034 1.00 . A A . 4 GLY O 1 1 1 50 1 1 5 TRP C C -5.502 2.732 -1.085 1.00 . A A . 5 TRP C 1 1 1 51 1 1 5 TRP CA C -4.865 4.006 -1.636 1.00 . A A . 5 TRP CA 1 1 1 52 1 1 5 TRP CB C -5.726 5.194 -1.195 1.00 . A A . 5 TRP CB 1 1 1 53 1 1 5 TRP CD1 C -6.620 7.000 -2.779 1.00 . A A . 5 TRP CD1 1 1 1 54 1 1 5 TRP CD2 C -4.442 7.182 -2.354 1.00 . A A . 5 TRP CD2 1 1 1 55 1 1 5 TRP CE2 C -4.822 8.231 -3.224 1.00 . A A . 5 TRP CE2 1 1 1 56 1 1 5 TRP CE3 C -3.090 7.053 -2.012 1.00 . A A . 5 TRP CE3 1 1 1 57 1 1 5 TRP CG C -5.618 6.408 -2.072 1.00 . A A . 5 TRP CG 1 1 1 58 1 1 5 TRP CH2 C -2.588 9.036 -3.336 1.00 . A A . 5 TRP CH2 1 1 1 59 1 1 5 TRP CZ2 C -3.902 9.165 -3.712 1.00 . A A . 5 TRP CZ2 1 1 1 60 1 1 5 TRP CZ3 C -2.174 7.986 -2.494 1.00 . A A . 5 TRP CZ3 1 1 1 61 1 1 5 TRP H H -5.513 4.258 -3.644 1.00 . A A . 5 TRP H 1 1 1 62 1 1 5 TRP HA H -3.881 4.120 -1.184 1.00 . A A . 5 TRP HA 1 1 1 63 1 1 5 TRP HB2 H -6.769 4.878 -1.175 1.00 . A A . 5 TRP HB2 1 1 1 64 1 1 5 TRP HB3 H -5.437 5.472 -0.183 1.00 . A A . 5 TRP HB3 1 1 1 65 1 1 5 TRP HD1 H -7.645 6.658 -2.785 1.00 . A A . 5 TRP HD1 1 1 1 66 1 1 5 TRP HE1 H -6.736 8.670 -4.063 1.00 . A A . 5 TRP HE1 1 1 1 67 1 1 5 TRP HE3 H -2.764 6.227 -1.396 1.00 . A A . 5 TRP HE3 1 1 1 68 1 1 5 TRP HH2 H -1.859 9.746 -3.698 1.00 . A A . 5 TRP HH2 1 1 1 69 1 1 5 TRP HZ2 H -4.214 9.960 -4.373 1.00 . A A . 5 TRP HZ2 1 1 1 70 1 1 5 TRP HZ3 H -1.131 7.897 -2.225 1.00 . A A . 5 TRP HZ3 1 1 1 71 1 1 5 TRP N N -4.703 4.029 -3.088 1.00 . A A . 5 TRP N 1 1 1 72 1 1 5 TRP NE1 N -6.162 8.090 -3.470 1.00 . A A . 5 TRP NE1 1 1 1 73 1 1 5 TRP O O -6.270 2.068 -1.780 1.00 . A A . 5 TRP O 1 1 1 74 1 1 6 GLY C C -5.350 0.768 2.103 1.00 . A A . 6 GLY C 1 1 1 75 1 1 6 GLY CA C -6.000 1.419 0.896 1.00 . A A . 6 GLY CA 1 1 1 76 1 1 6 GLY H H -4.473 2.883 0.663 1.00 . A A . 6 GLY H 1 1 1 77 1 1 6 GLY HA2 H -6.914 1.904 1.241 1.00 . A A . 6 GLY HA2 1 1 1 78 1 1 6 GLY HA3 H -6.294 0.631 0.205 1.00 . A A . 6 GLY HA3 1 1 1 79 1 1 6 GLY N N -5.217 2.406 0.173 1.00 . A A . 6 GLY N 1 1 1 80 1 1 6 GLY O O -5.593 1.177 3.236 1.00 . A A . 6 GLY O 1 1 1 81 1 1 7 PHE C C -2.441 -1.097 2.770 1.00 . A A . 7 PHE C 1 1 1 82 1 1 7 PHE CA C -3.962 -1.101 2.913 1.00 . A A . 7 PHE CA 1 1 1 83 1 1 7 PHE CB C -4.530 -2.518 2.773 1.00 . A A . 7 PHE CB 1 1 1 84 1 1 7 PHE CD1 C -6.573 -2.036 4.157 1.00 . A A . 7 PHE CD1 1 1 1 85 1 1 7 PHE CD2 C -5.392 -4.086 4.536 1.00 . A A . 7 PHE CD2 1 1 1 86 1 1 7 PHE CE1 C -7.497 -2.379 5.140 1.00 . A A . 7 PHE CE1 1 1 1 87 1 1 7 PHE CE2 C -6.324 -4.449 5.505 1.00 . A A . 7 PHE CE2 1 1 1 88 1 1 7 PHE CG C -5.515 -2.884 3.848 1.00 . A A . 7 PHE CG 1 1 1 89 1 1 7 PHE CZ C -7.382 -3.597 5.804 1.00 . A A . 7 PHE CZ 1 1 1 90 1 1 7 PHE H H -4.344 -0.523 0.913 1.00 . A A . 7 PHE H 1 1 1 91 1 1 7 PHE HA H -4.219 -0.701 3.893 1.00 . A A . 7 PHE HA 1 1 1 92 1 1 7 PHE HB2 H -5.029 -2.596 1.808 1.00 . A A . 7 PHE HB2 1 1 1 93 1 1 7 PHE HB3 H -3.716 -3.242 2.782 1.00 . A A . 7 PHE HB3 1 1 1 94 1 1 7 PHE HD1 H -6.672 -1.096 3.633 1.00 . A A . 7 PHE HD1 1 1 1 95 1 1 7 PHE HD2 H -4.572 -4.753 4.313 1.00 . A A . 7 PHE HD2 1 1 1 96 1 1 7 PHE HE1 H -8.298 -1.700 5.393 1.00 . A A . 7 PHE HE1 1 1 1 97 1 1 7 PHE HE2 H -6.228 -5.393 6.021 1.00 . A A . 7 PHE HE2 1 1 1 98 1 1 7 PHE HZ H -8.107 -3.876 6.554 1.00 . A A . 7 PHE HZ 1 1 1 99 1 1 7 PHE N N -4.555 -0.271 1.866 1.00 . A A . 7 PHE N 1 1 1 100 1 1 7 PHE O O -1.912 -0.369 1.936 1.00 . A A . 7 PHE O 1 1 1 101 1 1 8 GLU C C 0.421 -0.741 3.893 1.00 . A A . 8 GLU C 1 1 1 102 1 1 8 GLU CA C -0.265 -2.038 3.476 1.00 . A A . 8 GLU CA 1 1 1 103 1 1 8 GLU CB C 0.133 -2.506 2.051 1.00 . A A . 8 GLU CB 1 1 1 104 1 1 8 GLU CD C 1.632 -2.041 0.080 1.00 . A A . 8 GLU CD 1 1 1 105 1 1 8 GLU CG C 1.499 -1.974 1.579 1.00 . A A . 8 GLU CG 1 1 1 106 1 1 8 GLU H H -2.208 -2.485 4.248 1.00 . A A . 8 GLU H 1 1 1 107 1 1 8 GLU HA H 0.051 -2.796 4.195 1.00 . A A . 8 GLU HA 1 1 1 108 1 1 8 GLU HB2 H 0.136 -3.597 2.019 1.00 . A A . 8 GLU HB2 1 1 1 109 1 1 8 GLU HB3 H -0.625 -2.176 1.339 1.00 . A A . 8 GLU HB3 1 1 1 110 1 1 8 GLU HG2 H 1.611 -0.929 1.870 1.00 . A A . 8 GLU HG2 1 1 1 111 1 1 8 GLU HG3 H 2.308 -2.543 2.042 1.00 . A A . 8 GLU HG3 1 1 1 112 1 1 8 GLU N N -1.728 -1.919 3.567 1.00 . A A . 8 GLU N 1 1 1 113 1 1 8 GLU O O -0.063 0.349 3.665 1.00 . A A . 8 GLU O 1 1 1 114 1 1 8 GLU OE1 O 1.367 -3.022 -0.583 1.00 . A A . 8 GLU OE1 1 1 1 115 1 1 9 PRO C C 2.826 1.056 3.531 1.00 . A A . 9 PRO C 1 1 1 116 1 1 9 PRO CA C 2.374 0.404 4.835 1.00 . A A . 9 PRO CA 1 1 1 117 1 1 9 PRO CB C 3.544 -0.116 5.673 1.00 . A A . 9 PRO CB 1 1 1 118 1 1 9 PRO CD C 2.301 -2.031 4.994 1.00 . A A . 9 PRO CD 1 1 1 119 1 1 9 PRO CG C 3.703 -1.539 5.240 1.00 . A A . 9 PRO CG 1 1 1 120 1 1 9 PRO HA H 1.768 1.107 5.407 1.00 . A A . 9 PRO HA 1 1 1 121 1 1 9 PRO HB2 H 4.449 0.457 5.471 1.00 . A A . 9 PRO HB2 1 1 1 122 1 1 9 PRO HB3 H 3.290 -0.075 6.733 1.00 . A A . 9 PRO HB3 1 1 1 123 1 1 9 PRO HD2 H 2.301 -2.799 4.221 1.00 . A A . 9 PRO HD2 1 1 1 124 1 1 9 PRO HD3 H 1.856 -2.406 5.916 1.00 . A A . 9 PRO HD3 1 1 1 125 1 1 9 PRO HG2 H 4.282 -1.584 4.318 1.00 . A A . 9 PRO HG2 1 1 1 126 1 1 9 PRO HG3 H 4.183 -2.126 6.022 1.00 . A A . 9 PRO HG3 1 1 1 127 1 1 9 PRO N N 1.604 -0.810 4.548 1.00 . A A . 9 PRO N 1 1 1 128 1 1 9 PRO O O 3.545 0.456 2.731 1.00 . A A . 9 PRO O 1 1 1 129 1 1 10 GLY C C 1.037 3.262 1.484 1.00 . A A . 10 GLY C 1 1 1 130 1 1 10 GLY CA C 2.419 2.906 1.998 1.00 . A A . 10 GLY CA 1 1 1 131 1 1 10 GLY H H 1.805 2.739 4.020 1.00 . A A . 10 GLY H 1 1 1 132 1 1 10 GLY HA2 H 3.005 3.821 2.077 1.00 . A A . 10 GLY HA2 1 1 1 133 1 1 10 GLY HA3 H 2.903 2.236 1.288 1.00 . A A . 10 GLY HA3 1 1 1 134 1 1 10 GLY N N 2.339 2.271 3.302 1.00 . A A . 10 GLY N 1 1 1 135 1 1 10 GLY O O 0.893 4.131 0.625 1.00 . A A . 10 GLY O 1 1 1 136 1 1 11 VAL C C -1.742 2.658 0.332 1.00 . A A . 11 VAL C 1 1 1 137 1 1 11 VAL CA C -1.385 2.890 1.797 1.00 . A A . 11 VAL CA 1 1 1 138 1 1 11 VAL CB C -1.804 4.307 2.253 1.00 . A A . 11 VAL CB 1 1 1 139 1 1 11 VAL CG1 C -3.317 4.481 2.140 1.00 . A A . 11 VAL CG1 1 1 1 140 1 1 11 VAL CG2 C -1.384 4.547 3.704 1.00 . A A . 11 VAL CG2 1 1 1 141 1 1 11 VAL H H 0.235 1.868 2.707 1.00 . A A . 11 VAL H 1 1 1 142 1 1 11 VAL HA H -1.965 2.181 2.385 1.00 . A A . 11 VAL HA 1 1 1 143 1 1 11 VAL HB H -1.317 5.051 1.623 1.00 . A A . 11 VAL HB 1 1 1 144 1 1 11 VAL HG11 H -3.609 5.437 2.574 1.00 . A A . 11 VAL HG11 1 1 1 145 1 1 11 VAL HG12 H -3.606 4.472 1.090 1.00 . A A . 11 VAL HG12 1 1 1 146 1 1 11 VAL HG13 H -3.826 3.675 2.669 1.00 . A A . 11 VAL HG13 1 1 1 147 1 1 11 VAL HG21 H -1.780 3.756 4.340 1.00 . A A . 11 VAL HG21 1 1 1 148 1 1 11 VAL HG22 H -0.297 4.561 3.776 1.00 . A A . 11 VAL HG22 1 1 1 149 1 1 11 VAL HG23 H -1.770 5.509 4.042 1.00 . A A . 11 VAL HG23 1 1 1 150 1 1 11 VAL N N 0.027 2.608 2.049 1.00 . A A . 11 VAL N 1 1 1 151 1 1 11 VAL O O -1.809 3.584 -0.473 1.00 . A A . 11 VAL O 1 1 1 152 1 1 12 ARG C C -3.239 -0.320 -1.144 1.00 . A A . 12 ARG C 1 1 1 153 1 1 12 ARG CA C -2.355 0.911 -1.312 1.00 . A A . 12 ARG CA 1 1 1 154 1 1 12 ARG CB C -1.082 0.544 -2.078 1.00 . A A . 12 ARG CB 1 1 1 155 1 1 12 ARG CD C -2.207 -0.284 -4.215 1.00 . A A . 12 ARG CD 1 1 1 156 1 1 12 ARG CG C -1.153 0.624 -3.598 1.00 . A A . 12 ARG CG 1 1 1 157 1 1 12 ARG CZ C -1.344 -1.107 -6.394 1.00 . A A . 12 ARG CZ 1 1 1 158 1 1 12 ARG H H -1.888 0.697 0.750 1.00 . A A . 12 ARG H 1 1 1 159 1 1 12 ARG HA H -2.894 1.693 -1.846 1.00 . A A . 12 ARG HA 1 1 1 160 1 1 12 ARG HB2 H -0.292 1.222 -1.752 1.00 . A A . 12 ARG HB2 1 1 1 161 1 1 12 ARG HB3 H -0.790 -0.467 -1.795 1.00 . A A . 12 ARG HB3 1 1 1 162 1 1 12 ARG HD2 H -2.092 -1.290 -3.810 1.00 . A A . 12 ARG HD2 1 1 1 163 1 1 12 ARG HD3 H -3.191 0.084 -3.926 1.00 . A A . 12 ARG HD3 1 1 1 164 1 1 12 ARG HE H -2.790 0.261 -6.179 1.00 . A A . 12 ARG HE 1 1 1 165 1 1 12 ARG HG2 H -1.360 1.653 -3.886 1.00 . A A . 12 ARG HG2 1 1 1 166 1 1 12 ARG HG3 H -0.179 0.346 -3.999 1.00 . A A . 12 ARG HG3 1 1 1 167 1 1 12 ARG HH11 H -0.378 -1.973 -4.854 1.00 . A A . 12 ARG HH11 1 1 1 168 1 1 12 ARG HH12 H 0.155 -2.450 -6.457 1.00 . A A . 12 ARG HH12 1 1 1 169 1 1 12 ARG HH21 H -2.129 -0.481 -8.136 1.00 . A A . 12 ARG HH21 1 1 1 170 1 1 12 ARG HH22 H -0.826 -1.651 -8.262 1.00 . A A . 12 ARG HH22 1 1 1 171 1 1 12 ARG N N -1.981 1.389 0.017 1.00 . A A . 12 ARG N 1 1 1 172 1 1 12 ARG NE N -2.143 -0.327 -5.676 1.00 . A A . 12 ARG NE 1 1 1 173 1 1 12 ARG NH1 N -0.440 -1.901 -5.857 1.00 . A A . 12 ARG NH1 1 1 1 174 1 1 12 ARG NH2 N -1.434 -1.070 -7.707 1.00 . A A . 12 ARG NH2 1 1 1 175 1 1 12 ARG O O -2.839 -1.279 -0.489 1.00 . A A . 12 ARG O 1 1 1 176 1 1 13 CYS C C -4.615 -2.640 -2.408 1.00 . A A . 13 CYS C 1 1 1 177 1 1 13 CYS CA C -5.302 -1.487 -1.680 1.00 . A A . 13 CYS CA 1 1 1 178 1 1 13 CYS CB C -6.657 -1.182 -2.322 1.00 . A A . 13 CYS CB 1 1 1 179 1 1 13 CYS H H -4.768 0.518 -2.189 1.00 . A A . 13 CYS H 1 1 1 180 1 1 13 CYS HA H -5.459 -1.778 -0.642 1.00 . A A . 13 CYS HA 1 1 1 181 1 1 13 CYS HB2 H -7.066 -0.281 -1.864 1.00 . A A . 13 CYS HB2 1 1 1 182 1 1 13 CYS HB3 H -6.504 -0.995 -3.385 1.00 . A A . 13 CYS HB3 1 1 1 183 1 1 13 CYS N N -4.439 -0.310 -1.714 1.00 . A A . 13 CYS N 1 1 1 184 1 1 13 CYS O O -4.533 -2.647 -3.636 1.00 . A A . 13 CYS O 1 1 1 185 1 1 13 CYS SG S -7.890 -2.510 -2.137 1.00 . A A . 13 CYS SG 1 1 1 186 1 1 14 LEU C C -4.038 -6.022 -1.967 1.00 . A A . 14 LEU C 1 1 1 187 1 1 14 LEU CA C -3.311 -4.697 -2.181 1.00 . A A . 14 LEU CA 1 1 1 188 1 1 14 LEU CB C -1.936 -4.718 -1.504 1.00 . A A . 14 LEU CB 1 1 1 189 1 1 14 LEU CD1 C -0.849 -6.569 -2.858 1.00 . A A . 14 LEU CD1 1 1 1 190 1 1 14 LEU CD2 C -0.406 -4.177 -3.426 1.00 . A A . 14 LEU CD2 1 1 1 191 1 1 14 LEU CG C -0.705 -5.159 -2.300 1.00 . A A . 14 LEU CG 1 1 1 192 1 1 14 LEU H H -4.151 -3.511 -0.635 1.00 . A A . 14 LEU H 1 1 1 193 1 1 14 LEU HA H -3.184 -4.552 -3.254 1.00 . A A . 14 LEU HA 1 1 1 194 1 1 14 LEU HB2 H -1.733 -3.710 -1.141 1.00 . A A . 14 LEU HB2 1 1 1 195 1 1 14 LEU HB3 H -2.001 -5.357 -0.624 1.00 . A A . 14 LEU HB3 1 1 1 196 1 1 14 LEU HD11 H -1.660 -6.602 -3.586 1.00 . A A . 14 LEU HD11 1 1 1 197 1 1 14 LEU HD12 H 0.081 -6.865 -3.342 1.00 . A A . 14 LEU HD12 1 1 1 198 1 1 14 LEU HD13 H -1.063 -7.263 -2.045 1.00 . A A . 14 LEU HD13 1 1 1 199 1 1 14 LEU HD21 H -1.209 -4.197 -4.162 1.00 . A A . 14 LEU HD21 1 1 1 200 1 1 14 LEU HD22 H -0.311 -3.173 -3.012 1.00 . A A . 14 LEU HD22 1 1 1 201 1 1 14 LEU HD23 H 0.532 -4.455 -3.907 1.00 . A A . 14 LEU HD23 1 1 1 202 1 1 14 LEU HG H 0.141 -5.153 -1.616 1.00 . A A . 14 LEU HG 1 1 1 203 1 1 14 LEU N N -4.078 -3.581 -1.639 1.00 . A A . 14 LEU N 1 1 1 204 1 1 14 LEU O O -4.213 -6.802 -2.902 1.00 . A A . 14 LEU O 1 1 1 205 1 1 15 ILE C C -6.492 -7.062 0.314 1.00 . A A . 15 ILE C 1 1 1 206 1 1 15 ILE CA C -5.200 -7.478 -0.383 1.00 . A A . 15 ILE CA 1 1 1 207 1 1 15 ILE CB C -4.395 -8.413 0.547 1.00 . A A . 15 ILE CB 1 1 1 208 1 1 15 ILE CD1 C -2.085 -9.518 0.812 1.00 . A A . 15 ILE CD1 1 1 1 209 1 1 15 ILE CG1 C -3.030 -8.730 -0.075 1.00 . A A . 15 ILE CG1 1 1 1 210 1 1 15 ILE CG2 C -5.195 -9.688 0.810 1.00 . A A . 15 ILE CG2 1 1 1 211 1 1 15 ILE H H -4.251 -5.617 0.008 1.00 . A A . 15 ILE H 1 1 1 212 1 1 15 ILE HA H -5.447 -8.017 -1.297 1.00 . A A . 15 ILE HA 1 1 1 213 1 1 15 ILE HB H -4.229 -7.903 1.496 1.00 . A A . 15 ILE HB 1 1 1 214 1 1 15 ILE HD11 H -2.467 -10.528 0.958 1.00 . A A . 15 ILE HD11 1 1 1 215 1 1 15 ILE HD12 H -1.106 -9.570 0.336 1.00 . A A . 15 ILE HD12 1 1 1 216 1 1 15 ILE HD13 H -1.989 -9.019 1.777 1.00 . A A . 15 ILE HD13 1 1 1 217 1 1 15 ILE HG12 H -3.191 -9.279 -1.001 1.00 . A A . 15 ILE HG12 1 1 1 218 1 1 15 ILE HG13 H -2.532 -7.794 -0.326 1.00 . A A . 15 ILE HG13 1 1 1 219 1 1 15 ILE HG21 H -4.639 -10.349 1.475 1.00 . A A . 15 ILE HG21 1 1 1 220 1 1 15 ILE HG22 H -6.140 -9.430 1.288 1.00 . A A . 15 ILE HG22 1 1 1 221 1 1 15 ILE HG23 H -5.396 -10.203 -0.130 1.00 . A A . 15 ILE HG23 1 1 1 222 1 1 15 ILE N N -4.456 -6.272 -0.731 1.00 . A A . 15 ILE N 1 1 1 223 1 1 15 ILE O O -6.447 -6.461 1.387 1.00 . A A . 15 ILE O 1 1 1 224 1 1 16 TRP C C -9.022 -5.927 1.170 1.00 . A A . 16 TRP C 1 1 1 225 1 1 16 TRP CA C -8.963 -7.058 0.144 1.00 . A A . 16 TRP CA 1 1 1 226 1 1 16 TRP CB C -9.662 -8.312 0.682 1.00 . A A . 16 TRP CB 1 1 1 227 1 1 16 TRP CD1 C -8.546 -10.616 0.773 1.00 . A A . 16 TRP CD1 1 1 1 228 1 1 16 TRP CD2 C -9.241 -10.049 -1.264 1.00 . A A . 16 TRP CD2 1 1 1 229 1 1 16 TRP CE2 C -8.585 -11.301 -1.340 1.00 . A A . 16 TRP CE2 1 1 1 230 1 1 16 TRP CE3 C -9.735 -9.480 -2.446 1.00 . A A . 16 TRP CE3 1 1 1 231 1 1 16 TRP CG C -9.170 -9.609 0.102 1.00 . A A . 16 TRP CG 1 1 1 232 1 1 16 TRP CH2 C -8.907 -11.404 -3.693 1.00 . A A . 16 TRP CH2 1 1 1 233 1 1 16 TRP CZ2 C -8.406 -11.977 -2.551 1.00 . A A . 16 TRP CZ2 1 1 1 234 1 1 16 TRP CZ3 C -9.571 -10.163 -3.651 1.00 . A A . 16 TRP CZ3 1 1 1 235 1 1 16 TRP H H -7.546 -7.867 -1.205 1.00 . A A . 16 TRP H 1 1 1 236 1 1 16 TRP HA H -9.536 -6.722 -0.720 1.00 . A A . 16 TRP HA 1 1 1 237 1 1 16 TRP HB2 H -9.529 -8.359 1.762 1.00 . A A . 16 TRP HB2 1 1 1 238 1 1 16 TRP HB3 H -10.730 -8.221 0.479 1.00 . A A . 16 TRP HB3 1 1 1 239 1 1 16 TRP HD1 H -8.348 -10.604 1.835 1.00 . A A . 16 TRP HD1 1 1 1 240 1 1 16 TRP HE1 H -7.711 -12.474 0.217 1.00 . A A . 16 TRP HE1 1 1 1 241 1 1 16 TRP HE3 H -10.229 -8.520 -2.423 1.00 . A A . 16 TRP HE3 1 1 1 242 1 1 16 TRP HH2 H -8.783 -11.908 -4.640 1.00 . A A . 16 TRP HH2 1 1 1 243 1 1 16 TRP HZ2 H -7.879 -12.919 -2.586 1.00 . A A . 16 TRP HZ2 1 1 1 244 1 1 16 TRP HZ3 H -9.951 -9.730 -4.565 1.00 . A A . 16 TRP HZ3 1 1 1 245 1 1 16 TRP N N -7.615 -7.371 -0.328 1.00 . A A . 16 TRP N 1 1 1 246 1 1 16 TRP NE1 N -8.191 -11.634 -0.072 1.00 . A A . 16 TRP NE1 1 1 1 247 1 1 16 TRP O O -9.223 -6.147 2.365 1.00 . A A . 16 TRP O 1 1 1 248 1 1 17 CYS C C -10.203 -3.165 2.069 1.00 . A A . 17 CYS C 1 1 1 249 1 1 17 CYS CA C -8.807 -3.544 1.582 1.00 . A A . 17 CYS CA 1 1 1 250 1 1 17 CYS CB C -8.166 -2.354 0.867 1.00 . A A . 17 CYS CB 1 1 1 251 1 1 17 CYS H H -8.684 -4.554 -0.291 1.00 . A A . 17 CYS H 1 1 1 252 1 1 17 CYS HA H -8.197 -3.790 2.450 1.00 . A A . 17 CYS HA 1 1 1 253 1 1 17 CYS HB2 H -8.112 -1.515 1.559 1.00 . A A . 17 CYS HB2 1 1 1 254 1 1 17 CYS HB3 H -7.152 -2.636 0.586 1.00 . A A . 17 CYS HB3 1 1 1 255 1 1 17 CYS N N -8.828 -4.702 0.697 1.00 . A A . 17 CYS N 1 1 1 256 1 1 17 CYS O O -11.223 -3.571 1.514 1.00 . A A . 17 CYS O 1 1 1 257 1 1 17 CYS SG S -9.062 -1.826 -0.628 1.00 . A A . 17 CYS SG 1 1 1 258 1 1 18 ASP C C -12.594 -1.644 2.721 1.00 . A A . 18 ASP C 1 1 1 259 1 1 18 ASP CA C -11.485 -1.850 3.734 1.00 . A A . 18 ASP CA 1 1 1 260 1 1 18 ASP CB C -11.223 -0.549 4.505 1.00 . A A . 18 ASP CB 1 1 1 261 1 1 18 ASP CG C -12.488 -0.044 5.149 1.00 . A A . 18 ASP CG 1 1 1 262 1 1 18 ASP H H -9.367 -2.058 3.554 1.00 . A A . 18 ASP H 1 1 1 263 1 1 18 ASP HA H -11.869 -2.603 4.426 1.00 . A A . 18 ASP HA 1 1 1 264 1 1 18 ASP HB2 H -10.472 -0.720 5.279 1.00 . A A . 18 ASP HB2 1 1 1 265 1 1 18 ASP HB3 H -10.842 0.214 3.824 1.00 . A A . 18 ASP HB3 1 1 1 266 1 1 18 ASP N N -10.238 -2.346 3.135 1.00 . A A . 18 ASP N 1 1 1 267 1 1 18 ASP O O -13.745 -1.792 3.079 1.00 . A A . 18 ASP O 1 1 1 268 1 1 18 ASP OD1 O -13.038 0.922 4.661 1.00 . A A . 18 ASP OD1 1 1 1 269 1 1 18 ASP OD2 O -12.901 -0.610 6.139 1.00 . A A . 18 ASP OD2 1 1 2 270 1 1 1 GLY C C 2.736 1.055 -1.707 1.00 . A A . 1 GLY C 1 1 2 271 1 1 1 GLY CA C 2.972 -0.438 -1.849 1.00 . A A . 1 GLY CA 1 1 2 272 1 1 1 GLY H1 H 3.421 -1.892 -0.349 1.00 . A A . 1 GLY H1 1 1 2 273 1 1 1 GLY HA2 H 4.005 -0.585 -2.162 1.00 . A A . 1 GLY HA2 1 1 2 274 1 1 1 GLY HA3 H 2.321 -0.806 -2.642 1.00 . A A . 1 GLY HA3 1 1 2 275 1 1 1 GLY N N 2.726 -1.225 -0.649 1.00 . A A . 1 GLY N 1 1 2 276 1 1 1 GLY O O 2.765 1.575 -0.596 1.00 . A A . 1 GLY O 1 1 2 277 1 1 2 SER C C 1.469 3.756 -3.946 1.00 . A A . 2 SER C 1 1 2 278 1 1 2 SER CA C 2.318 3.198 -2.805 1.00 . A A . 2 SER CA 1 1 2 279 1 1 2 SER CB C 3.676 3.891 -2.891 1.00 . A A . 2 SER CB 1 1 2 280 1 1 2 SER H H 2.557 1.289 -3.717 1.00 . A A . 2 SER H 1 1 2 281 1 1 2 SER HA H 1.846 3.477 -1.862 1.00 . A A . 2 SER HA 1 1 2 282 1 1 2 SER HB2 H 4.158 3.579 -3.816 1.00 . A A . 2 SER HB2 1 1 2 283 1 1 2 SER HB3 H 3.507 4.965 -2.921 1.00 . A A . 2 SER HB3 1 1 2 284 1 1 2 SER HG H 4.934 4.361 -1.486 1.00 . A A . 2 SER HG 1 1 2 285 1 1 2 SER N N 2.531 1.751 -2.822 1.00 . A A . 2 SER N 1 1 2 286 1 1 2 SER O O 1.506 4.951 -4.241 1.00 . A A . 2 SER O 1 1 2 287 1 1 2 SER OG O 4.503 3.567 -1.787 1.00 . A A . 2 SER OG 1 1 2 288 1 1 3 ARG C C -1.539 3.669 -5.156 1.00 . A A . 3 ARG C 1 1 2 289 1 1 3 ARG CA C -0.166 3.280 -5.705 1.00 . A A . 3 ARG CA 1 1 2 290 1 1 3 ARG CB C -0.226 2.183 -6.775 1.00 . A A . 3 ARG CB 1 1 2 291 1 1 3 ARG CD C 2.068 2.716 -7.722 1.00 . A A . 3 ARG CD 1 1 2 292 1 1 3 ARG CG C 1.123 1.628 -7.231 1.00 . A A . 3 ARG CG 1 1 2 293 1 1 3 ARG CZ C 3.620 3.040 -9.626 1.00 . A A . 3 ARG CZ 1 1 2 294 1 1 3 ARG H H 0.819 1.907 -4.391 1.00 . A A . 3 ARG H 1 1 2 295 1 1 3 ARG HA H 0.241 4.184 -6.157 1.00 . A A . 3 ARG HA 1 1 2 296 1 1 3 ARG HB2 H -0.814 1.351 -6.391 1.00 . A A . 3 ARG HB2 1 1 2 297 1 1 3 ARG HB3 H -0.740 2.584 -7.648 1.00 . A A . 3 ARG HB3 1 1 2 298 1 1 3 ARG HD2 H 1.468 3.553 -8.076 1.00 . A A . 3 ARG HD2 1 1 2 299 1 1 3 ARG HD3 H 2.669 3.061 -6.879 1.00 . A A . 3 ARG HD3 1 1 2 300 1 1 3 ARG HE H 3.032 1.256 -8.927 1.00 . A A . 3 ARG HE 1 1 2 301 1 1 3 ARG HG2 H 1.595 1.091 -6.408 1.00 . A A . 3 ARG HG2 1 1 2 302 1 1 3 ARG HG3 H 0.944 0.922 -8.040 1.00 . A A . 3 ARG HG3 1 1 2 303 1 1 3 ARG HH11 H 3.013 4.791 -8.832 1.00 . A A . 3 ARG HH11 1 1 2 304 1 1 3 ARG HH12 H 4.082 4.909 -10.220 1.00 . A A . 3 ARG HH12 1 1 2 305 1 1 3 ARG HH21 H 4.418 1.494 -10.638 1.00 . A A . 3 ARG HH21 1 1 2 306 1 1 3 ARG HH22 H 4.886 3.092 -11.192 1.00 . A A . 3 ARG HH22 1 1 2 307 1 1 3 ARG N N 0.735 2.883 -4.625 1.00 . A A . 3 ARG N 1 1 2 308 1 1 3 ARG NE N 2.943 2.253 -8.800 1.00 . A A . 3 ARG NE 1 1 2 309 1 1 3 ARG NH1 N 3.565 4.355 -9.555 1.00 . A A . 3 ARG NH1 1 1 2 310 1 1 3 ARG NH2 N 4.368 2.499 -10.565 1.00 . A A . 3 ARG NH2 1 1 2 311 1 1 3 ARG O O -1.618 4.383 -4.159 1.00 . A A . 3 ARG O 1 1 2 312 1 1 4 GLY C C -4.325 3.122 -3.973 1.00 . A A . 4 GLY C 1 1 2 313 1 1 4 GLY CA C -3.953 3.613 -5.359 1.00 . A A . 4 GLY CA 1 1 2 314 1 1 4 GLY H H -2.525 2.625 -6.594 1.00 . A A . 4 GLY H 1 1 2 315 1 1 4 GLY HA2 H -4.008 4.702 -5.358 1.00 . A A . 4 GLY HA2 1 1 2 316 1 1 4 GLY HA3 H -4.687 3.233 -6.068 1.00 . A A . 4 GLY HA3 1 1 2 317 1 1 4 GLY N N -2.620 3.230 -5.792 1.00 . A A . 4 GLY N 1 1 2 318 1 1 4 GLY O O -4.189 1.940 -3.662 1.00 . A A . 4 GLY O 1 1 2 319 1 1 5 TRP C C -5.561 2.752 -1.091 1.00 . A A . 5 TRP C 1 1 2 320 1 1 5 TRP CA C -4.814 3.940 -1.694 1.00 . A A . 5 TRP CA 1 1 2 321 1 1 5 TRP CB C -5.430 5.219 -1.119 1.00 . A A . 5 TRP CB 1 1 2 322 1 1 5 TRP CD1 C -5.855 7.328 -2.514 1.00 . A A . 5 TRP CD1 1 1 2 323 1 1 5 TRP CD2 C -3.718 7.039 -1.957 1.00 . A A . 5 TRP CD2 1 1 2 324 1 1 5 TRP CE2 C -3.830 8.225 -2.720 1.00 . A A . 5 TRP CE2 1 1 2 325 1 1 5 TRP CE3 C -2.447 6.634 -1.533 1.00 . A A . 5 TRP CE3 1 1 2 326 1 1 5 TRP CG C -5.035 6.474 -1.840 1.00 . A A . 5 TRP CG 1 1 2 327 1 1 5 TRP CH2 C -1.485 8.596 -2.606 1.00 . A A . 5 TRP CH2 1 1 2 328 1 1 5 TRP CZ2 C -2.717 9.010 -3.044 1.00 . A A . 5 TRP CZ2 1 1 2 329 1 1 5 TRP CZ3 C -1.339 7.415 -1.854 1.00 . A A . 5 TRP CZ3 1 1 2 330 1 1 5 TRP H H -5.141 4.920 -3.535 1.00 . A A . 5 TRP H 1 1 2 331 1 1 5 TRP HA H -3.777 3.882 -1.365 1.00 . A A . 5 TRP HA 1 1 2 332 1 1 5 TRP HB2 H -6.515 5.124 -1.160 1.00 . A A . 5 TRP HB2 1 1 2 333 1 1 5 TRP HB3 H -5.140 5.310 -0.074 1.00 . A A . 5 TRP HB3 1 1 2 334 1 1 5 TRP HD1 H -6.923 7.195 -2.609 1.00 . A A . 5 TRP HD1 1 1 2 335 1 1 5 TRP HE1 H -5.565 9.133 -3.570 1.00 . A A . 5 TRP HE1 1 1 2 336 1 1 5 TRP HE3 H -2.328 5.717 -0.975 1.00 . A A . 5 TRP HE3 1 1 2 337 1 1 5 TRP HH2 H -0.609 9.180 -2.849 1.00 . A A . 5 TRP HH2 1 1 2 338 1 1 5 TRP HZ2 H -2.825 9.911 -3.629 1.00 . A A . 5 TRP HZ2 1 1 2 339 1 1 5 TRP HZ3 H -0.357 7.105 -1.529 1.00 . A A . 5 TRP HZ3 1 1 2 340 1 1 5 TRP N N -4.808 4.048 -3.152 1.00 . A A . 5 TRP N 1 1 2 341 1 1 5 TRP NE1 N -5.152 8.380 -3.040 1.00 . A A . 5 TRP NE1 1 1 2 342 1 1 5 TRP O O -6.537 2.263 -1.660 1.00 . A A . 5 TRP O 1 1 2 343 1 1 6 GLY C C -5.033 0.688 1.989 1.00 . A A . 6 GLY C 1 1 2 344 1 1 6 GLY CA C -5.794 1.237 0.796 1.00 . A A . 6 GLY CA 1 1 2 345 1 1 6 GLY H H -4.284 2.701 0.493 1.00 . A A . 6 GLY H 1 1 2 346 1 1 6 GLY HA2 H -6.759 1.608 1.142 1.00 . A A . 6 GLY HA2 1 1 2 347 1 1 6 GLY HA3 H -5.979 0.419 0.101 1.00 . A A . 6 GLY HA3 1 1 2 348 1 1 6 GLY N N -5.113 2.300 0.077 1.00 . A A . 6 GLY N 1 1 2 349 1 1 6 GLY O O -4.636 1.433 2.884 1.00 . A A . 6 GLY O 1 1 2 350 1 1 7 PHE C C -2.602 -1.176 2.781 1.00 . A A . 7 PHE C 1 1 2 351 1 1 7 PHE CA C -4.101 -1.326 3.050 1.00 . A A . 7 PHE CA 1 1 2 352 1 1 7 PHE CB C -4.570 -2.786 3.078 1.00 . A A . 7 PHE CB 1 1 2 353 1 1 7 PHE CD1 C -6.687 -2.245 4.329 1.00 . A A . 7 PHE CD1 1 1 2 354 1 1 7 PHE CD2 C -5.432 -4.177 4.986 1.00 . A A . 7 PHE CD2 1 1 2 355 1 1 7 PHE CE1 C -7.628 -2.511 5.320 1.00 . A A . 7 PHE CE1 1 1 2 356 1 1 7 PHE CE2 C -6.367 -4.452 5.981 1.00 . A A . 7 PHE CE2 1 1 2 357 1 1 7 PHE CG C -5.586 -3.075 4.150 1.00 . A A . 7 PHE CG 1 1 2 358 1 1 7 PHE CZ C -7.470 -3.620 6.145 1.00 . A A . 7 PHE CZ 1 1 2 359 1 1 7 PHE H H -5.183 -1.181 1.230 1.00 . A A . 7 PHE H 1 1 2 360 1 1 7 PHE HA H -4.320 -0.861 4.012 1.00 . A A . 7 PHE HA 1 1 2 361 1 1 7 PHE HB2 H -5.011 -3.027 2.111 1.00 . A A . 7 PHE HB2 1 1 2 362 1 1 7 PHE HB3 H -3.722 -3.453 3.226 1.00 . A A . 7 PHE HB3 1 1 2 363 1 1 7 PHE HD1 H -6.813 -1.376 3.701 1.00 . A A . 7 PHE HD1 1 1 2 364 1 1 7 PHE HD2 H -4.583 -4.833 4.861 1.00 . A A . 7 PHE HD2 1 1 2 365 1 1 7 PHE HE1 H -8.474 -1.853 5.456 1.00 . A A . 7 PHE HE1 1 1 2 366 1 1 7 PHE HE2 H -6.241 -5.314 6.619 1.00 . A A . 7 PHE HE2 1 1 2 367 1 1 7 PHE HZ H -8.197 -3.830 6.916 1.00 . A A . 7 PHE HZ 1 1 2 368 1 1 7 PHE N N -4.841 -0.627 2.001 1.00 . A A . 7 PHE N 1 1 2 369 1 1 7 PHE O O -2.205 -0.267 2.057 1.00 . A A . 7 PHE O 1 1 2 370 1 1 8 GLU C C 0.354 -0.817 3.697 1.00 . A A . 8 GLU C 1 1 2 371 1 1 8 GLU CA C -0.308 -2.070 3.141 1.00 . A A . 8 GLU CA 1 1 2 372 1 1 8 GLU CB C 0.004 -2.284 1.639 1.00 . A A . 8 GLU CB 1 1 2 373 1 1 8 GLU CD C 1.609 -1.102 0.090 1.00 . A A . 8 GLU CD 1 1 2 374 1 1 8 GLU CG C 1.485 -2.063 1.251 1.00 . A A . 8 GLU CG 1 1 2 375 1 1 8 GLU H H -2.146 -2.759 3.978 1.00 . A A . 8 GLU H 1 1 2 376 1 1 8 GLU HA H 0.098 -2.914 3.700 1.00 . A A . 8 GLU HA 1 1 2 377 1 1 8 GLU HB2 H -0.289 -3.298 1.358 1.00 . A A . 8 GLU HB2 1 1 2 378 1 1 8 GLU HB3 H -0.620 -1.611 1.052 1.00 . A A . 8 GLU HB3 1 1 2 379 1 1 8 GLU HG2 H 2.058 -1.667 2.087 1.00 . A A . 8 GLU HG2 1 1 2 380 1 1 8 GLU HG3 H 1.933 -3.020 0.972 1.00 . A A . 8 GLU HG3 1 1 2 381 1 1 8 GLU N N -1.763 -2.059 3.363 1.00 . A A . 8 GLU N 1 1 2 382 1 1 8 GLU O O -0.108 0.294 3.535 1.00 . A A . 8 GLU O 1 1 2 383 1 1 8 GLU OE1 O 0.748 -0.304 -0.199 1.00 . A A . 8 GLU OE1 1 1 2 384 1 1 9 PRO C C 2.775 0.952 3.538 1.00 . A A . 9 PRO C 1 1 2 385 1 1 9 PRO CA C 2.271 0.235 4.789 1.00 . A A . 9 PRO CA 1 1 2 386 1 1 9 PRO CB C 3.396 -0.346 5.648 1.00 . A A . 9 PRO CB 1 1 2 387 1 1 9 PRO CD C 2.172 -2.206 4.786 1.00 . A A . 9 PRO CD 1 1 2 388 1 1 9 PRO CG C 3.559 -1.746 5.148 1.00 . A A . 9 PRO CG 1 1 2 389 1 1 9 PRO HA H 1.648 0.910 5.376 1.00 . A A . 9 PRO HA 1 1 2 390 1 1 9 PRO HB2 H 4.316 0.224 5.518 1.00 . A A . 9 PRO HB2 1 1 2 391 1 1 9 PRO HB3 H 3.096 -0.358 6.696 1.00 . A A . 9 PRO HB3 1 1 2 392 1 1 9 PRO HD2 H 2.217 -2.909 3.954 1.00 . A A . 9 PRO HD2 1 1 2 393 1 1 9 PRO HD3 H 1.674 -2.651 5.648 1.00 . A A . 9 PRO HD3 1 1 2 394 1 1 9 PRO HG2 H 4.196 -1.752 4.264 1.00 . A A . 9 PRO HG2 1 1 2 395 1 1 9 PRO HG3 H 3.982 -2.383 5.926 1.00 . A A . 9 PRO HG3 1 1 2 396 1 1 9 PRO N N 1.503 -0.951 4.399 1.00 . A A . 9 PRO N 1 1 2 397 1 1 9 PRO O O 3.433 0.356 2.683 1.00 . A A . 9 PRO O 1 1 2 398 1 1 10 GLY C C 1.289 3.250 1.483 1.00 . A A . 10 GLY C 1 1 2 399 1 1 10 GLY CA C 2.599 2.981 2.200 1.00 . A A . 10 GLY CA 1 1 2 400 1 1 10 GLY H H 1.905 2.668 4.180 1.00 . A A . 10 GLY H 1 1 2 401 1 1 10 GLY HA2 H 3.053 3.939 2.444 1.00 . A A . 10 GLY HA2 1 1 2 402 1 1 10 GLY HA3 H 3.268 2.440 1.531 1.00 . A A . 10 GLY HA3 1 1 2 403 1 1 10 GLY N N 2.407 2.223 3.426 1.00 . A A . 10 GLY N 1 1 2 404 1 1 10 GLY O O 1.237 4.068 0.565 1.00 . A A . 10 GLY O 1 1 2 405 1 1 11 VAL C C -1.500 2.602 0.149 1.00 . A A . 11 VAL C 1 1 2 406 1 1 11 VAL CA C -1.155 2.913 1.604 1.00 . A A . 11 VAL CA 1 1 2 407 1 1 11 VAL CB C -1.535 4.372 1.956 1.00 . A A . 11 VAL CB 1 1 2 408 1 1 11 VAL CG1 C -3.044 4.568 1.860 1.00 . A A . 11 VAL CG1 1 1 2 409 1 1 11 VAL CG2 C -1.085 4.727 3.375 1.00 . A A . 11 VAL CG2 1 1 2 410 1 1 11 VAL H H 0.373 1.860 2.626 1.00 . A A . 11 VAL H 1 1 2 411 1 1 11 VAL HA H -1.786 2.268 2.216 1.00 . A A . 11 VAL HA 1 1 2 412 1 1 11 VAL HB H -1.048 5.052 1.258 1.00 . A A . 11 VAL HB 1 1 2 413 1 1 11 VAL HG11 H -3.371 4.363 0.841 1.00 . A A . 11 VAL HG11 1 1 2 414 1 1 11 VAL HG12 H -3.552 3.892 2.548 1.00 . A A . 11 VAL HG12 1 1 2 415 1 1 11 VAL HG13 H -3.297 5.599 2.111 1.00 . A A . 11 VAL HG13 1 1 2 416 1 1 11 VAL HG21 H -1.453 3.980 4.078 1.00 . A A . 11 VAL HG21 1 1 2 417 1 1 11 VAL HG22 H 0.004 4.763 3.419 1.00 . A A . 11 VAL HG22 1 1 2 418 1 1 11 VAL HG23 H -1.477 5.707 3.650 1.00 . A A . 11 VAL HG23 1 1 2 419 1 1 11 VAL N N 0.229 2.602 1.954 1.00 . A A . 11 VAL N 1 1 2 420 1 1 11 VAL O O -1.517 3.473 -0.720 1.00 . A A . 11 VAL O 1 1 2 421 1 1 12 ARG C C -3.222 -0.329 -1.191 1.00 . A A . 12 ARG C 1 1 2 422 1 1 12 ARG CA C -2.283 0.852 -1.398 1.00 . A A . 12 ARG CA 1 1 2 423 1 1 12 ARG CB C -1.087 0.420 -2.250 1.00 . A A . 12 ARG CB 1 1 2 424 1 1 12 ARG CD C -2.067 -0.840 -4.243 1.00 . A A . 12 ARG CD 1 1 2 425 1 1 12 ARG CG C -1.312 0.384 -3.751 1.00 . A A . 12 ARG CG 1 1 2 426 1 1 12 ARG CZ C -1.891 -2.378 -6.186 1.00 . A A . 12 ARG CZ 1 1 2 427 1 1 12 ARG H H -1.742 0.664 0.654 1.00 . A A . 12 ARG H 1 1 2 428 1 1 12 ARG HA H -2.812 1.652 -1.910 1.00 . A A . 12 ARG HA 1 1 2 429 1 1 12 ARG HB2 H -0.272 1.118 -2.055 1.00 . A A . 12 ARG HB2 1 1 2 430 1 1 12 ARG HB3 H -0.768 -0.570 -1.926 1.00 . A A . 12 ARG HB3 1 1 2 431 1 1 12 ARG HD2 H -2.047 -1.607 -3.469 1.00 . A A . 12 ARG HD2 1 1 2 432 1 1 12 ARG HD3 H -3.104 -0.559 -4.432 1.00 . A A . 12 ARG HD3 1 1 2 433 1 1 12 ARG HE H -0.616 -0.888 -5.788 1.00 . A A . 12 ARG HE 1 1 2 434 1 1 12 ARG HG2 H -1.851 1.282 -4.050 1.00 . A A . 12 ARG HG2 1 1 2 435 1 1 12 ARG HG3 H -0.335 0.394 -4.231 1.00 . A A . 12 ARG HG3 1 1 2 436 1 1 12 ARG HH11 H -3.512 -2.830 -5.068 1.00 . A A . 12 ARG HH11 1 1 2 437 1 1 12 ARG HH12 H -3.251 -3.833 -6.481 1.00 . A A . 12 ARG HH12 1 1 2 438 1 1 12 ARG HH21 H -0.377 -2.212 -7.502 1.00 . A A . 12 ARG HH21 1 1 2 439 1 1 12 ARG HH22 H -1.529 -3.500 -7.816 1.00 . A A . 12 ARG HH22 1 1 2 440 1 1 12 ARG N N -1.817 1.336 -0.099 1.00 . A A . 12 ARG N 1 1 2 441 1 1 12 ARG NE N -1.452 -1.351 -5.468 1.00 . A A . 12 ARG NE 1 1 2 442 1 1 12 ARG NH1 N -2.970 -3.070 -5.886 1.00 . A A . 12 ARG NH1 1 1 2 443 1 1 12 ARG NH2 N -1.210 -2.724 -7.259 1.00 . A A . 12 ARG NH2 1 1 2 444 1 1 12 ARG O O -2.948 -1.218 -0.386 1.00 . A A . 12 ARG O 1 1 2 445 1 1 13 CYS C C -4.595 -2.726 -2.521 1.00 . A A . 13 CYS C 1 1 2 446 1 1 13 CYS CA C -5.238 -1.495 -1.887 1.00 . A A . 13 CYS CA 1 1 2 447 1 1 13 CYS CB C -6.554 -1.149 -2.586 1.00 . A A . 13 CYS CB 1 1 2 448 1 1 13 CYS H H -4.528 0.413 -2.551 1.00 . A A . 13 CYS H 1 1 2 449 1 1 13 CYS HA H -5.449 -1.725 -0.844 1.00 . A A . 13 CYS HA 1 1 2 450 1 1 13 CYS HB2 H -6.913 -0.193 -2.202 1.00 . A A . 13 CYS HB2 1 1 2 451 1 1 13 CYS HB3 H -6.375 -1.055 -3.656 1.00 . A A . 13 CYS HB3 1 1 2 452 1 1 13 CYS N N -4.323 -0.359 -1.933 1.00 . A A . 13 CYS N 1 1 2 453 1 1 13 CYS O O -4.777 -2.997 -3.707 1.00 . A A . 13 CYS O 1 1 2 454 1 1 13 CYS SG S -7.858 -2.390 -2.310 1.00 . A A . 13 CYS SG 1 1 2 455 1 1 14 LEU C C -3.893 -5.909 -1.871 1.00 . A A . 14 LEU C 1 1 2 456 1 1 14 LEU CA C -3.103 -4.640 -2.180 1.00 . A A . 14 LEU CA 1 1 2 457 1 1 14 LEU CB C -1.733 -4.681 -1.495 1.00 . A A . 14 LEU CB 1 1 2 458 1 1 14 LEU CD1 C -0.672 -6.703 -2.608 1.00 . A A . 14 LEU CD1 1 1 2 459 1 1 14 LEU CD2 C -0.200 -4.412 -3.485 1.00 . A A . 14 LEU CD2 1 1 2 460 1 1 14 LEU CG C -0.513 -5.234 -2.240 1.00 . A A . 14 LEU CG 1 1 2 461 1 1 14 LEU H H -3.635 -3.126 -0.785 1.00 . A A . 14 LEU H 1 1 2 462 1 1 14 LEU HA H -2.967 -4.582 -3.261 1.00 . A A . 14 LEU HA 1 1 2 463 1 1 14 LEU HB2 H -1.486 -3.660 -1.202 1.00 . A A . 14 LEU HB2 1 1 2 464 1 1 14 LEU HB3 H -1.837 -5.251 -0.572 1.00 . A A . 14 LEU HB3 1 1 2 465 1 1 14 LEU HD11 H -1.496 -6.824 -3.312 1.00 . A A . 14 LEU HD11 1 1 2 466 1 1 14 LEU HD12 H 0.247 -7.065 -3.067 1.00 . A A . 14 LEU HD12 1 1 2 467 1 1 14 LEU HD13 H -0.875 -7.286 -1.710 1.00 . A A . 14 LEU HD13 1 1 2 468 1 1 14 LEU HD21 H -0.983 -4.551 -4.231 1.00 . A A . 14 LEU HD21 1 1 2 469 1 1 14 LEU HD22 H -0.133 -3.357 -3.220 1.00 . A A . 14 LEU HD22 1 1 2 470 1 1 14 LEU HD23 H 0.753 -4.738 -3.903 1.00 . A A . 14 LEU HD23 1 1 2 471 1 1 14 LEU HG H 0.339 -5.148 -1.567 1.00 . A A . 14 LEU HG 1 1 2 472 1 1 14 LEU N N -3.805 -3.443 -1.730 1.00 . A A . 14 LEU N 1 1 2 473 1 1 14 LEU O O -4.020 -6.791 -2.719 1.00 . A A . 14 LEU O 1 1 2 474 1 1 15 ILE C C -6.498 -6.709 0.410 1.00 . A A . 15 ILE C 1 1 2 475 1 1 15 ILE CA C -5.181 -7.163 -0.211 1.00 . A A . 15 ILE CA 1 1 2 476 1 1 15 ILE CB C -4.409 -8.007 0.831 1.00 . A A . 15 ILE CB 1 1 2 477 1 1 15 ILE CD1 C -2.112 -9.079 1.278 1.00 . A A . 15 ILE CD1 1 1 2 478 1 1 15 ILE CG1 C -3.032 -8.398 0.283 1.00 . A A . 15 ILE CG1 1 1 2 479 1 1 15 ILE CG2 C -5.227 -9.242 1.204 1.00 . A A . 15 ILE CG2 1 1 2 480 1 1 15 ILE H H -4.260 -5.258 0.013 1.00 . A A . 15 ILE H 1 1 2 481 1 1 15 ILE HA H -5.396 -7.789 -1.075 1.00 . A A . 15 ILE HA 1 1 2 482 1 1 15 ILE HB H -4.263 -7.404 1.728 1.00 . A A . 15 ILE HB 1 1 2 483 1 1 15 ILE HD11 H -2.026 -8.466 2.175 1.00 . A A . 15 ILE HD11 1 1 2 484 1 1 15 ILE HD12 H -2.507 -10.060 1.542 1.00 . A A . 15 ILE HD12 1 1 2 485 1 1 15 ILE HD13 H -1.125 -9.200 0.831 1.00 . A A . 15 ILE HD13 1 1 2 486 1 1 15 ILE HG12 H -3.176 -9.052 -0.576 1.00 . A A . 15 ILE HG12 1 1 2 487 1 1 15 ILE HG13 H -2.522 -7.501 -0.064 1.00 . A A . 15 ILE HG13 1 1 2 488 1 1 15 ILE HG21 H -6.178 -8.931 1.635 1.00 . A A . 15 ILE HG21 1 1 2 489 1 1 15 ILE HG22 H -5.417 -9.844 0.314 1.00 . A A . 15 ILE HG22 1 1 2 490 1 1 15 ILE HG23 H -4.690 -9.840 1.939 1.00 . A A . 15 ILE HG23 1 1 2 491 1 1 15 ILE N N -4.411 -6.003 -0.650 1.00 . A A . 15 ILE N 1 1 2 492 1 1 15 ILE O O -6.496 -6.067 1.462 1.00 . A A . 15 ILE O 1 1 2 493 1 1 16 TRP C C -9.108 -5.586 1.136 1.00 . A A . 16 TRP C 1 1 2 494 1 1 16 TRP CA C -8.962 -6.792 0.208 1.00 . A A . 16 TRP CA 1 1 2 495 1 1 16 TRP CB C -9.532 -8.043 0.886 1.00 . A A . 16 TRP CB 1 1 2 496 1 1 16 TRP CD1 C -8.403 -10.343 0.829 1.00 . A A . 16 TRP CD1 1 1 2 497 1 1 16 TRP CD2 C -9.385 -9.789 -1.090 1.00 . A A . 16 TRP CD2 1 1 2 498 1 1 16 TRP CE2 C -8.726 -11.031 -1.259 1.00 . A A . 16 TRP CE2 1 1 2 499 1 1 16 TRP CE3 C -10.067 -9.240 -2.184 1.00 . A A . 16 TRP CE3 1 1 2 500 1 1 16 TRP CG C -9.122 -9.341 0.249 1.00 . A A . 16 TRP CG 1 1 2 501 1 1 16 TRP CH2 C -9.387 -11.150 -3.539 1.00 . A A . 16 TRP CH2 1 1 2 502 1 1 16 TRP CZ2 C -8.710 -11.706 -2.483 1.00 . A A . 16 TRP CZ2 1 1 2 503 1 1 16 TRP CZ3 C -10.070 -9.926 -3.398 1.00 . A A . 16 TRP CZ3 1 1 2 504 1 1 16 TRP H H -7.501 -7.548 -1.127 1.00 . A A . 16 TRP H 1 1 2 505 1 1 16 TRP HA H -9.579 -6.593 -0.668 1.00 . A A . 16 TRP HA 1 1 2 506 1 1 16 TRP HB2 H -9.206 -8.059 1.926 1.00 . A A . 16 TRP HB2 1 1 2 507 1 1 16 TRP HB3 H -10.620 -7.974 0.872 1.00 . A A . 16 TRP HB3 1 1 2 508 1 1 16 TRP HD1 H -8.062 -10.329 1.854 1.00 . A A . 16 TRP HD1 1 1 2 509 1 1 16 TRP HE1 H -7.633 -12.193 0.163 1.00 . A A . 16 TRP HE1 1 1 2 510 1 1 16 TRP HE3 H -10.576 -8.294 -2.088 1.00 . A A . 16 TRP HE3 1 1 2 511 1 1 16 TRP HH2 H -9.392 -11.655 -4.493 1.00 . A A . 16 TRP HH2 1 1 2 512 1 1 16 TRP HZ2 H -8.171 -12.635 -2.593 1.00 . A A . 16 TRP HZ2 1 1 2 513 1 1 16 TRP HZ3 H -10.596 -9.510 -4.246 1.00 . A A . 16 TRP HZ3 1 1 2 514 1 1 16 TRP N N -7.598 -7.050 -0.255 1.00 . A A . 16 TRP N 1 1 2 515 1 1 16 TRP NE1 N -8.157 -11.358 -0.057 1.00 . A A . 16 TRP NE1 1 1 2 516 1 1 16 TRP O O -9.471 -5.719 2.305 1.00 . A A . 16 TRP O 1 1 2 517 1 1 17 CYS C C -10.218 -2.728 1.819 1.00 . A A . 17 CYS C 1 1 2 518 1 1 17 CYS CA C -8.817 -3.195 1.434 1.00 . A A . 17 CYS CA 1 1 2 519 1 1 17 CYS CB C -8.105 -2.061 0.696 1.00 . A A . 17 CYS CB 1 1 2 520 1 1 17 CYS H H -8.575 -4.316 -0.362 1.00 . A A . 17 CYS H 1 1 2 521 1 1 17 CYS HA H -8.264 -3.409 2.347 1.00 . A A . 17 CYS HA 1 1 2 522 1 1 17 CYS HB2 H -8.038 -1.200 1.362 1.00 . A A . 17 CYS HB2 1 1 2 523 1 1 17 CYS HB3 H -7.098 -2.391 0.449 1.00 . A A . 17 CYS HB3 1 1 2 524 1 1 17 CYS N N -8.815 -4.400 0.615 1.00 . A A . 17 CYS N 1 1 2 525 1 1 17 CYS O O -11.226 -3.086 1.211 1.00 . A A . 17 CYS O 1 1 2 526 1 1 17 CYS SG S -8.957 -1.545 -0.829 1.00 . A A . 17 CYS SG 1 1 2 527 1 1 18 ASP C C -11.878 -0.072 2.308 1.00 . A A . 18 ASP C 1 1 2 528 1 1 18 ASP CA C -11.519 -1.205 3.249 1.00 . A A . 18 ASP CA 1 1 2 529 1 1 18 ASP CB C -11.445 -0.688 4.694 1.00 . A A . 18 ASP CB 1 1 2 530 1 1 18 ASP CG C -12.768 -0.092 5.106 1.00 . A A . 18 ASP CG 1 1 2 531 1 1 18 ASP H H -9.433 -1.654 3.362 1.00 . A A . 18 ASP H 1 1 2 532 1 1 18 ASP HA H -12.335 -1.926 3.174 1.00 . A A . 18 ASP HA 1 1 2 533 1 1 18 ASP HB2 H -11.190 -1.505 5.371 1.00 . A A . 18 ASP HB2 1 1 2 534 1 1 18 ASP HB3 H -10.669 0.076 4.772 1.00 . A A . 18 ASP HB3 1 1 2 535 1 1 18 ASP N N -10.274 -1.874 2.854 1.00 . A A . 18 ASP N 1 1 2 536 1 1 18 ASP O O -11.066 0.815 2.122 1.00 . A A . 18 ASP O 1 1 2 537 1 1 18 ASP OD1 O -12.897 0.301 6.246 1.00 . A A . 18 ASP OD1 1 1 2 538 1 1 18 ASP OD2 O -13.661 -0.038 4.285 1.00 . A A . 18 ASP OD2 1 1 3 539 1 1 1 GLY C C 2.555 0.744 -1.886 1.00 . A A . 1 GLY C 1 1 3 540 1 1 1 GLY CA C 2.225 -0.728 -1.733 1.00 . A A . 1 GLY CA 1 1 3 541 1 1 1 GLY H1 H 2.305 -0.355 0.359 1.00 . A A . 1 GLY H1 1 1 3 542 1 1 1 GLY HA2 H 3.050 -1.321 -2.126 1.00 . A A . 1 GLY HA2 1 1 3 543 1 1 1 GLY HA3 H 1.319 -0.957 -2.295 1.00 . A A . 1 GLY HA3 1 1 3 544 1 1 1 GLY N N 2.025 -1.041 -0.328 1.00 . A A . 1 GLY N 1 1 3 545 1 1 1 GLY O O 2.929 1.382 -0.904 1.00 . A A . 1 GLY O 1 1 3 546 1 1 2 SER C C 1.931 3.450 -4.330 1.00 . A A . 2 SER C 1 1 3 547 1 1 2 SER CA C 2.792 2.688 -3.326 1.00 . A A . 2 SER CA 1 1 3 548 1 1 2 SER CB C 4.235 2.735 -3.829 1.00 . A A . 2 SER CB 1 1 3 549 1 1 2 SER H H 2.158 0.727 -3.880 1.00 . A A . 2 SER H 1 1 3 550 1 1 2 SER HA H 2.743 3.227 -2.379 1.00 . A A . 2 SER HA 1 1 3 551 1 1 2 SER HB2 H 4.307 2.150 -4.745 1.00 . A A . 2 SER HB2 1 1 3 552 1 1 2 SER HB3 H 4.491 3.770 -4.047 1.00 . A A . 2 SER HB3 1 1 3 553 1 1 2 SER HG H 4.753 2.370 -1.990 1.00 . A A . 2 SER HG 1 1 3 554 1 1 2 SER N N 2.442 1.290 -3.093 1.00 . A A . 2 SER N 1 1 3 555 1 1 2 SER O O 2.137 4.642 -4.558 1.00 . A A . 2 SER O 1 1 3 556 1 1 2 SER OG O 5.123 2.209 -2.857 1.00 . A A . 2 SER OG 1 1 3 557 1 1 3 ARG C C -1.060 4.063 -5.394 1.00 . A A . 3 ARG C 1 1 3 558 1 1 3 ARG CA C 0.140 3.329 -5.996 1.00 . A A . 3 ARG CA 1 1 3 559 1 1 3 ARG CB C -0.260 2.246 -7.005 1.00 . A A . 3 ARG CB 1 1 3 560 1 1 3 ARG CD C 2.024 2.177 -8.096 1.00 . A A . 3 ARG CD 1 1 3 561 1 1 3 ARG CG C 0.879 1.364 -7.511 1.00 . A A . 3 ARG CG 1 1 3 562 1 1 3 ARG CZ C 3.811 1.872 -9.783 1.00 . A A . 3 ARG CZ 1 1 3 563 1 1 3 ARG H H 0.914 1.766 -4.767 1.00 . A A . 3 ARG H 1 1 3 564 1 1 3 ARG HA H 0.717 4.092 -6.518 1.00 . A A . 3 ARG HA 1 1 3 565 1 1 3 ARG HB2 H -0.997 1.590 -6.546 1.00 . A A . 3 ARG HB2 1 1 3 566 1 1 3 ARG HB3 H -0.725 2.731 -7.863 1.00 . A A . 3 ARG HB3 1 1 3 567 1 1 3 ARG HD2 H 1.602 3.029 -8.628 1.00 . A A . 3 ARG HD2 1 1 3 568 1 1 3 ARG HD3 H 2.644 2.553 -7.281 1.00 . A A . 3 ARG HD3 1 1 3 569 1 1 3 ARG HE H 2.654 0.398 -9.071 1.00 . A A . 3 ARG HE 1 1 3 570 1 1 3 ARG HG2 H 1.260 0.753 -6.694 1.00 . A A . 3 ARG HG2 1 1 3 571 1 1 3 ARG HG3 H 0.484 0.702 -8.281 1.00 . A A . 3 ARG HG3 1 1 3 572 1 1 3 ARG HH11 H 3.649 3.791 -9.187 1.00 . A A . 3 ARG HH11 1 1 3 573 1 1 3 ARG HH12 H 4.870 3.469 -10.405 1.00 . A A . 3 ARG HH12 1 1 3 574 1 1 3 ARG HH21 H 4.229 0.074 -10.583 1.00 . A A . 3 ARG HH21 1 1 3 575 1 1 3 ARG HH22 H 5.207 1.412 -11.160 1.00 . A A . 3 ARG HH22 1 1 3 576 1 1 3 ARG N N 1.003 2.748 -4.971 1.00 . A A . 3 ARG N 1 1 3 577 1 1 3 ARG NE N 2.845 1.387 -9.013 1.00 . A A . 3 ARG NE 1 1 3 578 1 1 3 ARG NH1 N 4.134 3.150 -9.794 1.00 . A A . 3 ARG NH1 1 1 3 579 1 1 3 ARG NH2 N 4.472 1.052 -10.573 1.00 . A A . 3 ARG NH2 1 1 3 580 1 1 3 ARG O O -0.882 4.952 -4.566 1.00 . A A . 3 ARG O 1 1 3 581 1 1 4 GLY C C -3.653 3.859 -3.793 1.00 . A A . 4 GLY C 1 1 3 582 1 1 4 GLY CA C -3.467 4.310 -5.229 1.00 . A A . 4 GLY CA 1 1 3 583 1 1 4 GLY H H -2.381 3.007 -6.519 1.00 . A A . 4 GLY H 1 1 3 584 1 1 4 GLY HA2 H -3.367 5.396 -5.240 1.00 . A A . 4 GLY HA2 1 1 3 585 1 1 4 GLY HA3 H -4.341 4.026 -5.813 1.00 . A A . 4 GLY HA3 1 1 3 586 1 1 4 GLY N N -2.275 3.716 -5.810 1.00 . A A . 4 GLY N 1 1 3 587 1 1 4 GLY O O -2.846 3.084 -3.288 1.00 . A A . 4 GLY O 1 1 3 588 1 1 5 TRP C C -5.376 2.982 -1.080 1.00 . A A . 5 TRP C 1 1 3 589 1 1 5 TRP CA C -4.788 4.264 -1.670 1.00 . A A . 5 TRP CA 1 1 3 590 1 1 5 TRP CB C -5.613 5.449 -1.159 1.00 . A A . 5 TRP CB 1 1 3 591 1 1 5 TRP CD1 C -6.521 7.341 -2.633 1.00 . A A . 5 TRP CD1 1 1 3 592 1 1 5 TRP CD2 C -4.319 7.436 -2.310 1.00 . A A . 5 TRP CD2 1 1 3 593 1 1 5 TRP CE2 C -4.704 8.525 -3.129 1.00 . A A . 5 TRP CE2 1 1 3 594 1 1 5 TRP CE3 C -2.958 7.257 -2.032 1.00 . A A . 5 TRP CE3 1 1 3 595 1 1 5 TRP CG C -5.507 6.691 -1.997 1.00 . A A . 5 TRP CG 1 1 3 596 1 1 5 TRP CH2 C -2.451 9.256 -3.330 1.00 . A A . 5 TRP CH2 1 1 3 597 1 1 5 TRP CZ2 C -3.777 9.440 -3.637 1.00 . A A . 5 TRP CZ2 1 1 3 598 1 1 5 TRP CZ3 C -2.034 8.169 -2.537 1.00 . A A . 5 TRP CZ3 1 1 3 599 1 1 5 TRP H H -5.391 4.895 -3.606 1.00 . A A . 5 TRP H 1 1 3 600 1 1 5 TRP HA H -3.776 4.365 -1.280 1.00 . A A . 5 TRP HA 1 1 3 601 1 1 5 TRP HB2 H -6.659 5.147 -1.124 1.00 . A A . 5 TRP HB2 1 1 3 602 1 1 5 TRP HB3 H -5.292 5.685 -0.145 1.00 . A A . 5 TRP HB3 1 1 3 603 1 1 5 TRP HD1 H -7.556 7.031 -2.602 1.00 . A A . 5 TRP HD1 1 1 3 604 1 1 5 TRP HE1 H -6.643 9.066 -3.843 1.00 . A A . 5 TRP HE1 1 1 3 605 1 1 5 TRP HE3 H -2.630 6.412 -1.445 1.00 . A A . 5 TRP HE3 1 1 3 606 1 1 5 TRP HH2 H -1.715 9.949 -3.710 1.00 . A A . 5 TRP HH2 1 1 3 607 1 1 5 TRP HZ2 H -4.092 10.264 -4.260 1.00 . A A . 5 TRP HZ2 1 1 3 608 1 1 5 TRP HZ3 H -0.984 8.037 -2.322 1.00 . A A . 5 TRP HZ3 1 1 3 609 1 1 5 TRP N N -4.694 4.344 -3.126 1.00 . A A . 5 TRP N 1 1 3 610 1 1 5 TRP NE1 N -6.059 8.440 -3.308 1.00 . A A . 5 TRP NE1 1 1 3 611 1 1 5 TRP O O -6.141 2.275 -1.736 1.00 . A A . 5 TRP O 1 1 3 612 1 1 6 GLY C C -4.920 1.083 2.101 1.00 . A A . 6 GLY C 1 1 3 613 1 1 6 GLY CA C -5.711 1.666 0.944 1.00 . A A . 6 GLY CA 1 1 3 614 1 1 6 GLY H H -4.308 3.227 0.633 1.00 . A A . 6 GLY H 1 1 3 615 1 1 6 GLY HA2 H -6.633 2.086 1.348 1.00 . A A . 6 GLY HA2 1 1 3 616 1 1 6 GLY HA3 H -5.984 0.854 0.271 1.00 . A A . 6 GLY HA3 1 1 3 617 1 1 6 GLY N N -5.040 2.701 0.176 1.00 . A A . 6 GLY N 1 1 3 618 1 1 6 GLY O O -4.392 1.813 2.940 1.00 . A A . 6 GLY O 1 1 3 619 1 1 7 PHE C C -2.661 -0.939 2.968 1.00 . A A . 7 PHE C 1 1 3 620 1 1 7 PHE CA C -4.171 -0.998 3.195 1.00 . A A . 7 PHE CA 1 1 3 621 1 1 7 PHE CB C -4.695 -2.439 3.156 1.00 . A A . 7 PHE CB 1 1 3 622 1 1 7 PHE CD1 C -6.792 -1.849 4.433 1.00 . A A . 7 PHE CD1 1 1 3 623 1 1 7 PHE CD2 C -5.691 -3.919 4.922 1.00 . A A . 7 PHE CD2 1 1 3 624 1 1 7 PHE CE1 C -7.761 -2.132 5.392 1.00 . A A . 7 PHE CE1 1 1 3 625 1 1 7 PHE CE2 C -6.665 -4.221 5.869 1.00 . A A . 7 PHE CE2 1 1 3 626 1 1 7 PHE CG C -5.746 -2.736 4.192 1.00 . A A . 7 PHE CG 1 1 3 627 1 1 7 PHE CZ C -7.702 -3.325 6.106 1.00 . A A . 7 PHE CZ 1 1 3 628 1 1 7 PHE H H -5.300 -0.777 1.414 1.00 . A A . 7 PHE H 1 1 3 629 1 1 7 PHE HA H -4.389 -0.559 4.169 1.00 . A A . 7 PHE HA 1 1 3 630 1 1 7 PHE HB2 H -5.116 -2.629 2.169 1.00 . A A . 7 PHE HB2 1 1 3 631 1 1 7 PHE HB3 H -3.870 -3.136 3.299 1.00 . A A . 7 PHE HB3 1 1 3 632 1 1 7 PHE HD1 H -6.852 -0.923 3.881 1.00 . A A . 7 PHE HD1 1 1 3 633 1 1 7 PHE HD2 H -4.887 -4.621 4.748 1.00 . A A . 7 PHE HD2 1 1 3 634 1 1 7 PHE HE1 H -8.552 -1.424 5.587 1.00 . A A . 7 PHE HE1 1 1 3 635 1 1 7 PHE HE2 H -6.614 -5.147 6.422 1.00 . A A . 7 PHE HE2 1 1 3 636 1 1 7 PHE HZ H -8.454 -3.551 6.848 1.00 . A A . 7 PHE HZ 1 1 3 637 1 1 7 PHE N N -4.863 -0.244 2.151 1.00 . A A . 7 PHE N 1 1 3 638 1 1 7 PHE O O -2.208 -0.163 2.133 1.00 . A A . 7 PHE O 1 1 3 639 1 1 8 GLU C C 0.318 -0.616 3.856 1.00 . A A . 8 GLU C 1 1 3 640 1 1 8 GLU CA C -0.424 -1.891 3.474 1.00 . A A . 8 GLU CA 1 1 3 641 1 1 8 GLU CB C -0.159 -2.280 2.001 1.00 . A A . 8 GLU CB 1 1 3 642 1 1 8 GLU CD C 1.473 -2.185 0.115 1.00 . A A . 8 GLU CD 1 1 3 643 1 1 8 GLU CG C 1.330 -2.277 1.613 1.00 . A A . 8 GLU CG 1 1 3 644 1 1 8 GLU H H -2.293 -2.332 4.413 1.00 . A A . 8 GLU H 1 1 3 645 1 1 8 GLU HA H -0.053 -2.684 4.124 1.00 . A A . 8 GLU HA 1 1 3 646 1 1 8 GLU HB2 H -0.590 -3.262 1.797 1.00 . A A . 8 GLU HB2 1 1 3 647 1 1 8 GLU HB3 H -0.669 -1.569 1.350 1.00 . A A . 8 GLU HB3 1 1 3 648 1 1 8 GLU HG2 H 1.828 -1.412 2.053 1.00 . A A . 8 GLU HG2 1 1 3 649 1 1 8 GLU HG3 H 1.824 -3.178 1.981 1.00 . A A . 8 GLU HG3 1 1 3 650 1 1 8 GLU N N -1.875 -1.762 3.695 1.00 . A A . 8 GLU N 1 1 3 651 1 1 8 GLU O O -0.099 0.486 3.565 1.00 . A A . 8 GLU O 1 1 3 652 1 1 8 GLU OE1 O 1.105 -3.059 -0.644 1.00 . A A . 8 GLU OE1 1 1 3 653 1 1 9 PRO C C 2.762 1.061 3.434 1.00 . A A . 9 PRO C 1 1 3 654 1 1 9 PRO CA C 2.307 0.477 4.768 1.00 . A A . 9 PRO CA 1 1 3 655 1 1 9 PRO CB C 3.466 -0.058 5.612 1.00 . A A . 9 PRO CB 1 1 3 656 1 1 9 PRO CD C 2.132 -1.944 5.027 1.00 . A A . 9 PRO CD 1 1 3 657 1 1 9 PRO CG C 3.557 -1.504 5.238 1.00 . A A . 9 PRO CG 1 1 3 658 1 1 9 PRO HA H 1.735 1.222 5.322 1.00 . A A . 9 PRO HA 1 1 3 659 1 1 9 PRO HB2 H 4.392 0.465 5.374 1.00 . A A . 9 PRO HB2 1 1 3 660 1 1 9 PRO HB3 H 3.231 0.038 6.672 1.00 . A A . 9 PRO HB3 1 1 3 661 1 1 9 PRO HD2 H 2.094 -2.746 4.290 1.00 . A A . 9 PRO HD2 1 1 3 662 1 1 9 PRO HD3 H 1.680 -2.256 5.969 1.00 . A A . 9 PRO HD3 1 1 3 663 1 1 9 PRO HG2 H 4.124 -1.613 4.314 1.00 . A A . 9 PRO HG2 1 1 3 664 1 1 9 PRO HG3 H 4.022 -2.079 6.041 1.00 . A A . 9 PRO HG3 1 1 3 665 1 1 9 PRO N N 1.489 -0.716 4.528 1.00 . A A . 9 PRO N 1 1 3 666 1 1 9 PRO O O 3.370 0.376 2.611 1.00 . A A . 9 PRO O 1 1 3 667 1 1 10 GLY C C 1.192 3.169 1.238 1.00 . A A . 10 GLY C 1 1 3 668 1 1 10 GLY CA C 2.538 2.938 1.899 1.00 . A A . 10 GLY CA 1 1 3 669 1 1 10 GLY H H 1.954 2.854 3.937 1.00 . A A . 10 GLY H 1 1 3 670 1 1 10 GLY HA2 H 3.029 3.904 2.011 1.00 . A A . 10 GLY HA2 1 1 3 671 1 1 10 GLY HA3 H 3.151 2.310 1.254 1.00 . A A . 10 GLY HA3 1 1 3 672 1 1 10 GLY N N 2.406 2.321 3.208 1.00 . A A . 10 GLY N 1 1 3 673 1 1 10 GLY O O 1.110 3.823 0.198 1.00 . A A . 10 GLY O 1 1 3 674 1 1 11 VAL C C -1.674 2.669 0.193 1.00 . A A . 11 VAL C 1 1 3 675 1 1 11 VAL CA C -1.243 3.058 1.605 1.00 . A A . 11 VAL CA 1 1 3 676 1 1 11 VAL CB C -1.484 4.563 1.874 1.00 . A A . 11 VAL CB 1 1 3 677 1 1 11 VAL CG1 C -2.971 4.900 1.808 1.00 . A A . 11 VAL CG1 1 1 3 678 1 1 11 VAL CG2 C -0.957 4.953 3.256 1.00 . A A . 11 VAL CG2 1 1 3 679 1 1 11 VAL H H 0.289 1.986 2.608 1.00 . A A . 11 VAL H 1 1 3 680 1 1 11 VAL HA H -1.877 2.502 2.297 1.00 . A A . 11 VAL HA 1 1 3 681 1 1 11 VAL HB H -0.958 5.153 1.124 1.00 . A A . 11 VAL HB 1 1 3 682 1 1 11 VAL HG11 H -3.530 4.257 2.491 1.00 . A A . 11 VAL HG11 1 1 3 683 1 1 11 VAL HG12 H -3.124 5.942 2.090 1.00 . A A . 11 VAL HG12 1 1 3 684 1 1 11 VAL HG13 H -3.331 4.756 0.792 1.00 . A A . 11 VAL HG13 1 1 3 685 1 1 11 VAL HG21 H -1.230 5.986 3.475 1.00 . A A . 11 VAL HG21 1 1 3 686 1 1 11 VAL HG22 H -1.387 4.299 4.015 1.00 . A A . 11 VAL HG22 1 1 3 687 1 1 11 VAL HG23 H 0.129 4.868 3.276 1.00 . A A . 11 VAL HG23 1 1 3 688 1 1 11 VAL N N 0.138 2.664 1.872 1.00 . A A . 11 VAL N 1 1 3 689 1 1 11 VAL O O -1.753 3.495 -0.713 1.00 . A A . 11 VAL O 1 1 3 690 1 1 12 ARG C C -3.365 -0.406 -0.942 1.00 . A A . 12 ARG C 1 1 3 691 1 1 12 ARG CA C -2.467 0.797 -1.207 1.00 . A A . 12 ARG CA 1 1 3 692 1 1 12 ARG CB C -1.286 0.367 -2.081 1.00 . A A . 12 ARG CB 1 1 3 693 1 1 12 ARG CD C -2.445 0.366 -4.340 1.00 . A A . 12 ARG CD 1 1 3 694 1 1 12 ARG CG C -1.643 -0.436 -3.328 1.00 . A A . 12 ARG CG 1 1 3 695 1 1 12 ARG CZ C -3.609 -0.054 -6.485 1.00 . A A . 12 ARG CZ 1 1 3 696 1 1 12 ARG H H -1.871 0.769 0.835 1.00 . A A . 12 ARG H 1 1 3 697 1 1 12 ARG HA H -3.047 1.553 -1.735 1.00 . A A . 12 ARG HA 1 1 3 698 1 1 12 ARG HB2 H -0.738 1.261 -2.379 1.00 . A A . 12 ARG HB2 1 1 3 699 1 1 12 ARG HB3 H -0.625 -0.245 -1.469 1.00 . A A . 12 ARG HB3 1 1 3 700 1 1 12 ARG HD2 H -3.387 0.664 -3.878 1.00 . A A . 12 ARG HD2 1 1 3 701 1 1 12 ARG HD3 H -1.887 1.266 -4.597 1.00 . A A . 12 ARG HD3 1 1 3 702 1 1 12 ARG HE H -2.241 -1.274 -5.674 1.00 . A A . 12 ARG HE 1 1 3 703 1 1 12 ARG HG2 H -0.721 -0.777 -3.797 1.00 . A A . 12 ARG HG2 1 1 3 704 1 1 12 ARG HG3 H -2.224 -1.311 -3.036 1.00 . A A . 12 ARG HG3 1 1 3 705 1 1 12 ARG HH11 H -4.197 1.664 -5.617 1.00 . A A . 12 ARG HH11 1 1 3 706 1 1 12 ARG HH12 H -4.958 1.284 -7.157 1.00 . A A . 12 ARG HH12 1 1 3 707 1 1 12 ARG HH21 H -3.265 -1.699 -7.589 1.00 . A A . 12 ARG HH21 1 1 3 708 1 1 12 ARG HH22 H -4.440 -0.572 -8.247 1.00 . A A . 12 ARG HH22 1 1 3 709 1 1 12 ARG N N -1.971 1.383 0.036 1.00 . A A . 12 ARG N 1 1 3 710 1 1 12 ARG NE N -2.732 -0.401 -5.552 1.00 . A A . 12 ARG NE 1 1 3 711 1 1 12 ARG NH1 N -4.307 1.063 -6.418 1.00 . A A . 12 ARG NH1 1 1 3 712 1 1 12 ARG NH2 N -3.781 -0.835 -7.531 1.00 . A A . 12 ARG NH2 1 1 3 713 1 1 12 ARG O O -2.975 -1.348 -0.256 1.00 . A A . 12 ARG O 1 1 3 714 1 1 13 CYS C C -4.774 -2.659 -2.354 1.00 . A A . 13 CYS C 1 1 3 715 1 1 13 CYS CA C -5.425 -1.567 -1.509 1.00 . A A . 13 CYS CA 1 1 3 716 1 1 13 CYS CB C -6.815 -1.220 -2.048 1.00 . A A . 13 CYS CB 1 1 3 717 1 1 13 CYS H H -4.876 0.436 -2.006 1.00 . A A . 13 CYS H 1 1 3 718 1 1 13 CYS HA H -5.518 -1.928 -0.486 1.00 . A A . 13 CYS HA 1 1 3 719 1 1 13 CYS HB2 H -7.198 -0.358 -1.501 1.00 . A A . 13 CYS HB2 1 1 3 720 1 1 13 CYS HB3 H -6.722 -0.953 -3.102 1.00 . A A . 13 CYS HB3 1 1 3 721 1 1 13 CYS N N -4.561 -0.391 -1.521 1.00 . A A . 13 CYS N 1 1 3 722 1 1 13 CYS O O -4.833 -2.625 -3.583 1.00 . A A . 13 CYS O 1 1 3 723 1 1 13 CYS SG S -8.026 -2.571 -1.894 1.00 . A A . 13 CYS SG 1 1 3 724 1 1 14 LEU C C -4.039 -6.011 -2.151 1.00 . A A . 14 LEU C 1 1 3 725 1 1 14 LEU CA C -3.360 -4.657 -2.344 1.00 . A A . 14 LEU CA 1 1 3 726 1 1 14 LEU CB C -1.937 -4.664 -1.773 1.00 . A A . 14 LEU CB 1 1 3 727 1 1 14 LEU CD1 C -0.876 -6.635 -2.975 1.00 . A A . 14 LEU CD1 1 1 3 728 1 1 14 LEU CD2 C -0.596 -4.327 -3.887 1.00 . A A . 14 LEU CD2 1 1 3 729 1 1 14 LEU CG C -0.760 -5.159 -2.621 1.00 . A A . 14 LEU CG 1 1 3 730 1 1 14 LEU H H -4.059 -3.544 -0.676 1.00 . A A . 14 LEU H 1 1 3 731 1 1 14 LEU HA H -3.319 -4.446 -3.413 1.00 . A A . 14 LEU HA 1 1 3 732 1 1 14 LEU HB2 H -1.701 -3.640 -1.486 1.00 . A A . 14 LEU HB2 1 1 3 733 1 1 14 LEU HB3 H -1.946 -5.246 -0.852 1.00 . A A . 14 LEU HB3 1 1 3 734 1 1 14 LEU HD11 H 0.015 -6.949 -3.520 1.00 . A A . 14 LEU HD11 1 1 3 735 1 1 14 LEU HD12 H -0.959 -7.224 -2.063 1.00 . A A . 14 LEU HD12 1 1 3 736 1 1 14 LEU HD13 H -1.754 -6.802 -3.599 1.00 . A A . 14 LEU HD13 1 1 3 737 1 1 14 LEU HD21 H -1.443 -4.490 -4.555 1.00 . A A . 14 LEU HD21 1 1 3 738 1 1 14 LEU HD22 H -0.536 -3.272 -3.623 1.00 . A A . 14 LEU HD22 1 1 3 739 1 1 14 LEU HD23 H 0.323 -4.621 -4.395 1.00 . A A . 14 LEU HD23 1 1 3 740 1 1 14 LEU HG H 0.139 -5.033 -2.022 1.00 . A A . 14 LEU HG 1 1 3 741 1 1 14 LEU N N -4.107 -3.593 -1.683 1.00 . A A . 14 LEU N 1 1 3 742 1 1 14 LEU O O -4.249 -6.753 -3.109 1.00 . A A . 14 LEU O 1 1 3 743 1 1 15 ILE C C -6.409 -7.162 0.128 1.00 . A A . 15 ILE C 1 1 3 744 1 1 15 ILE CA C -5.110 -7.546 -0.575 1.00 . A A . 15 ILE CA 1 1 3 745 1 1 15 ILE CB C -4.294 -8.479 0.350 1.00 . A A . 15 ILE CB 1 1 3 746 1 1 15 ILE CD1 C -1.968 -9.553 0.611 1.00 . A A . 15 ILE CD1 1 1 3 747 1 1 15 ILE CG1 C -2.923 -8.770 -0.271 1.00 . A A . 15 ILE CG1 1 1 3 748 1 1 15 ILE CG2 C -5.074 -9.768 0.601 1.00 . A A . 15 ILE CG2 1 1 3 749 1 1 15 ILE H H -4.160 -5.692 -0.154 1.00 . A A . 15 ILE H 1 1 3 750 1 1 15 ILE HA H -5.347 -8.080 -1.495 1.00 . A A . 15 ILE HA 1 1 3 751 1 1 15 ILE HB H -4.138 -7.975 1.304 1.00 . A A . 15 ILE HB 1 1 3 752 1 1 15 ILE HD11 H -1.877 -9.060 1.579 1.00 . A A . 15 ILE HD11 1 1 3 753 1 1 15 ILE HD12 H -2.339 -10.569 0.752 1.00 . A A . 15 ILE HD12 1 1 3 754 1 1 15 ILE HD13 H -0.989 -9.593 0.134 1.00 . A A . 15 ILE HD13 1 1 3 755 1 1 15 ILE HG12 H -3.073 -9.312 -1.203 1.00 . A A . 15 ILE HG12 1 1 3 756 1 1 15 ILE HG13 H -2.440 -7.824 -0.510 1.00 . A A . 15 ILE HG13 1 1 3 757 1 1 15 ILE HG21 H -6.028 -9.530 1.072 1.00 . A A . 15 ILE HG21 1 1 3 758 1 1 15 ILE HG22 H -5.259 -10.282 -0.342 1.00 . A A . 15 ILE HG22 1 1 3 759 1 1 15 ILE HG23 H -4.513 -10.423 1.267 1.00 . A A . 15 ILE HG23 1 1 3 760 1 1 15 ILE N N -4.388 -6.322 -0.907 1.00 . A A . 15 ILE N 1 1 3 761 1 1 15 ILE O O -6.370 -6.556 1.198 1.00 . A A . 15 ILE O 1 1 3 762 1 1 16 TRP C C -8.961 -6.195 1.098 1.00 . A A . 16 TRP C 1 1 3 763 1 1 16 TRP CA C -8.884 -7.220 -0.031 1.00 . A A . 16 TRP CA 1 1 3 764 1 1 16 TRP CB C -9.613 -8.510 0.366 1.00 . A A . 16 TRP CB 1 1 3 765 1 1 16 TRP CD1 C -8.430 -10.781 0.489 1.00 . A A . 16 TRP CD1 1 1 3 766 1 1 16 TRP CD2 C -9.017 -10.196 -1.578 1.00 . A A . 16 TRP CD2 1 1 3 767 1 1 16 TRP CE2 C -8.335 -11.434 -1.633 1.00 . A A . 16 TRP CE2 1 1 3 768 1 1 16 TRP CE3 C -9.460 -9.622 -2.776 1.00 . A A . 16 TRP CE3 1 1 3 769 1 1 16 TRP CG C -9.037 -9.777 -0.204 1.00 . A A . 16 TRP CG 1 1 3 770 1 1 16 TRP CH2 C -8.533 -11.515 -4.001 1.00 . A A . 16 TRP CH2 1 1 3 771 1 1 16 TRP CZ2 C -8.081 -12.093 -2.841 1.00 . A A . 16 TRP CZ2 1 1 3 772 1 1 16 TRP CZ3 C -9.222 -10.287 -3.979 1.00 . A A . 16 TRP CZ3 1 1 3 773 1 1 16 TRP H H -7.450 -7.996 -1.382 1.00 . A A . 16 TRP H 1 1 3 774 1 1 16 TRP HA H -9.432 -6.797 -0.872 1.00 . A A . 16 TRP HA 1 1 3 775 1 1 16 TRP HB2 H -9.608 -8.603 1.453 1.00 . A A . 16 TRP HB2 1 1 3 776 1 1 16 TRP HB3 H -10.650 -8.427 0.044 1.00 . A A . 16 TRP HB3 1 1 3 777 1 1 16 TRP HD1 H -8.294 -10.782 1.560 1.00 . A A . 16 TRP HD1 1 1 3 778 1 1 16 TRP HE1 H -7.525 -12.612 -0.046 1.00 . A A . 16 TRP HE1 1 1 3 779 1 1 16 TRP HE3 H -9.971 -8.671 -2.769 1.00 . A A . 16 TRP HE3 1 1 3 780 1 1 16 TRP HH2 H -8.351 -12.006 -4.945 1.00 . A A . 16 TRP HH2 1 1 3 781 1 1 16 TRP HZ2 H -7.537 -13.025 -2.859 1.00 . A A . 16 TRP HZ2 1 1 3 782 1 1 16 TRP HZ3 H -9.563 -9.851 -4.907 1.00 . A A . 16 TRP HZ3 1 1 3 783 1 1 16 TRP N N -7.528 -7.506 -0.502 1.00 . A A . 16 TRP N 1 1 3 784 1 1 16 TRP NE1 N -8.005 -11.777 -0.349 1.00 . A A . 16 TRP NE1 1 1 3 785 1 1 16 TRP O O -9.101 -6.533 2.274 1.00 . A A . 16 TRP O 1 1 3 786 1 1 17 CYS C C -10.266 -3.579 2.272 1.00 . A A . 17 CYS C 1 1 3 787 1 1 17 CYS CA C -8.866 -3.852 1.726 1.00 . A A . 17 CYS CA 1 1 3 788 1 1 17 CYS CB C -8.283 -2.575 1.121 1.00 . A A . 17 CYS CB 1 1 3 789 1 1 17 CYS H H -8.752 -4.675 -0.237 1.00 . A A . 17 CYS H 1 1 3 790 1 1 17 CYS HA H -8.231 -4.156 2.557 1.00 . A A . 17 CYS HA 1 1 3 791 1 1 17 CYS HB2 H -8.286 -1.796 1.884 1.00 . A A . 17 CYS HB2 1 1 3 792 1 1 17 CYS HB3 H -7.251 -2.777 0.836 1.00 . A A . 17 CYS HB3 1 1 3 793 1 1 17 CYS N N -8.855 -4.922 0.736 1.00 . A A . 17 CYS N 1 1 3 794 1 1 17 CYS O O -11.281 -3.898 1.655 1.00 . A A . 17 CYS O 1 1 3 795 1 1 17 CYS SG S -9.185 -1.970 -0.341 1.00 . A A . 17 CYS SG 1 1 3 796 1 1 18 ASP C C -12.791 -3.216 3.621 1.00 . A A . 18 ASP C 1 1 3 797 1 1 18 ASP CA C -11.539 -2.537 4.141 1.00 . A A . 18 ASP CA 1 1 3 798 1 1 18 ASP CB C -11.690 -1.013 4.061 1.00 . A A . 18 ASP CB 1 1 3 799 1 1 18 ASP CG C -12.835 -0.548 4.923 1.00 . A A . 18 ASP CG 1 1 3 800 1 1 18 ASP H H -9.431 -2.749 3.925 1.00 . A A . 18 ASP H 1 1 3 801 1 1 18 ASP HA H -11.477 -2.826 5.193 1.00 . A A . 18 ASP HA 1 1 3 802 1 1 18 ASP HB2 H -10.771 -0.531 4.399 1.00 . A A . 18 ASP HB2 1 1 3 803 1 1 18 ASP HB3 H -11.867 -0.717 3.027 1.00 . A A . 18 ASP HB3 1 1 3 804 1 1 18 ASP N N -10.303 -2.956 3.464 1.00 . A A . 18 ASP N 1 1 3 805 1 1 18 ASP O O -13.611 -3.615 4.423 1.00 . A A . 18 ASP O 1 1 3 806 1 1 18 ASP OD1 O -13.735 0.077 4.403 1.00 . A A . 18 ASP OD1 1 1 3 807 1 1 18 ASP OD2 O -12.810 -0.809 6.107 1.00 . A A . 18 ASP OD2 1 1 4 808 1 1 1 GLY C C 2.634 0.670 -1.975 1.00 . A A . 1 GLY C 1 1 4 809 1 1 1 GLY CA C 2.185 -0.768 -1.816 1.00 . A A . 1 GLY CA 1 1 4 810 1 1 1 GLY H1 H 2.103 -0.252 0.243 1.00 . A A . 1 GLY H1 1 1 4 811 1 1 1 GLY HA2 H 2.972 -1.435 -2.172 1.00 . A A . 1 GLY HA2 1 1 4 812 1 1 1 GLY HA3 H 1.276 -0.936 -2.393 1.00 . A A . 1 GLY HA3 1 1 4 813 1 1 1 GLY N N 1.934 -1.008 -0.406 1.00 . A A . 1 GLY N 1 1 4 814 1 1 1 GLY O O 3.105 1.263 -1.007 1.00 . A A . 1 GLY O 1 1 4 815 1 1 2 SER C C 1.930 3.445 -4.260 1.00 . A A . 2 SER C 1 1 4 816 1 1 2 SER CA C 2.875 2.636 -3.377 1.00 . A A . 2 SER CA 1 1 4 817 1 1 2 SER CB C 4.274 2.674 -3.993 1.00 . A A . 2 SER CB 1 1 4 818 1 1 2 SER H H 2.122 0.712 -3.940 1.00 . A A . 2 SER H 1 1 4 819 1 1 2 SER HA H 2.921 3.132 -2.407 1.00 . A A . 2 SER HA 1 1 4 820 1 1 2 SER HB2 H 4.871 1.875 -3.556 1.00 . A A . 2 SER HB2 1 1 4 821 1 1 2 SER HB3 H 4.192 2.511 -5.068 1.00 . A A . 2 SER HB3 1 1 4 822 1 1 2 SER HG H 4.264 4.618 -3.907 1.00 . A A . 2 SER HG 1 1 4 823 1 1 2 SER N N 2.490 1.242 -3.166 1.00 . A A . 2 SER N 1 1 4 824 1 1 2 SER O O 2.039 4.668 -4.336 1.00 . A A . 2 SER O 1 1 4 825 1 1 2 SER OG O 4.899 3.921 -3.744 1.00 . A A . 2 SER OG 1 1 4 826 1 1 3 ARG C C -1.033 4.083 -5.322 1.00 . A A . 3 ARG C 1 1 4 827 1 1 3 ARG CA C 0.159 3.363 -5.956 1.00 . A A . 3 ARG CA 1 1 4 828 1 1 3 ARG CB C -0.254 2.314 -6.996 1.00 . A A . 3 ARG CB 1 1 4 829 1 1 3 ARG CD C 2.055 2.174 -8.036 1.00 . A A . 3 ARG CD 1 1 4 830 1 1 3 ARG CG C 0.861 1.400 -7.501 1.00 . A A . 3 ARG CG 1 1 4 831 1 1 3 ARG CZ C 3.788 1.885 -9.781 1.00 . A A . 3 ARG CZ 1 1 4 832 1 1 3 ARG H H 1.002 1.752 -4.839 1.00 . A A . 3 ARG H 1 1 4 833 1 1 3 ARG HA H 0.730 4.141 -6.461 1.00 . A A . 3 ARG HA 1 1 4 834 1 1 3 ARG HB2 H -1.023 1.675 -6.566 1.00 . A A . 3 ARG HB2 1 1 4 835 1 1 3 ARG HB3 H -0.684 2.834 -7.852 1.00 . A A . 3 ARG HB3 1 1 4 836 1 1 3 ARG HD2 H 1.689 3.080 -8.519 1.00 . A A . 3 ARG HD2 1 1 4 837 1 1 3 ARG HD3 H 2.694 2.466 -7.200 1.00 . A A . 3 ARG HD3 1 1 4 838 1 1 3 ARG HE H 2.620 0.413 -9.081 1.00 . A A . 3 ARG HE 1 1 4 839 1 1 3 ARG HG2 H 1.193 0.747 -6.695 1.00 . A A . 3 ARG HG2 1 1 4 840 1 1 3 ARG HG3 H 0.456 0.778 -8.299 1.00 . A A . 3 ARG HG3 1 1 4 841 1 1 3 ARG HH11 H 3.695 3.783 -9.108 1.00 . A A . 3 ARG HH11 1 1 4 842 1 1 3 ARG HH12 H 4.868 3.477 -10.377 1.00 . A A . 3 ARG HH12 1 1 4 843 1 1 3 ARG HH21 H 4.140 0.109 -10.656 1.00 . A A . 3 ARG HH21 1 1 4 844 1 1 3 ARG HH22 H 5.137 1.444 -11.210 1.00 . A A . 3 ARG HH22 1 1 4 845 1 1 3 ARG N N 1.042 2.751 -4.965 1.00 . A A . 3 ARG N 1 1 4 846 1 1 3 ARG NE N 2.834 1.396 -8.998 1.00 . A A . 3 ARG NE 1 1 4 847 1 1 3 ARG NH1 N 4.145 3.154 -9.755 1.00 . A A . 3 ARG NH1 1 1 4 848 1 1 3 ARG NH2 N 4.405 1.080 -10.618 1.00 . A A . 3 ARG NH2 1 1 4 849 1 1 3 ARG O O -0.850 4.925 -4.448 1.00 . A A . 3 ARG O 1 1 4 850 1 1 4 GLY C C -3.654 3.921 -3.767 1.00 . A A . 4 GLY C 1 1 4 851 1 1 4 GLY CA C -3.435 4.391 -5.192 1.00 . A A . 4 GLY CA 1 1 4 852 1 1 4 GLY H H -2.361 3.109 -6.512 1.00 . A A . 4 GLY H 1 1 4 853 1 1 4 GLY HA2 H -3.317 5.474 -5.186 1.00 . A A . 4 GLY HA2 1 1 4 854 1 1 4 GLY HA3 H -4.308 4.131 -5.790 1.00 . A A . 4 GLY HA3 1 1 4 855 1 1 4 GLY N N -2.248 3.784 -5.771 1.00 . A A . 4 GLY N 1 1 4 856 1 1 4 GLY O O -2.874 3.115 -3.270 1.00 . A A . 4 GLY O 1 1 4 857 1 1 5 TRP C C -5.387 3.018 -1.084 1.00 . A A . 5 TRP C 1 1 4 858 1 1 5 TRP CA C -4.807 4.313 -1.650 1.00 . A A . 5 TRP CA 1 1 4 859 1 1 5 TRP CB C -5.659 5.477 -1.137 1.00 . A A . 5 TRP CB 1 1 4 860 1 1 5 TRP CD1 C -6.576 7.394 -2.570 1.00 . A A . 5 TRP CD1 1 1 4 861 1 1 5 TRP CD2 C -4.376 7.502 -2.243 1.00 . A A . 5 TRP CD2 1 1 4 862 1 1 5 TRP CE2 C -4.771 8.609 -3.030 1.00 . A A . 5 TRP CE2 1 1 4 863 1 1 5 TRP CE3 C -3.013 7.331 -1.966 1.00 . A A . 5 TRP CE3 1 1 4 864 1 1 5 TRP CG C -5.557 6.736 -1.950 1.00 . A A . 5 TRP CG 1 1 4 865 1 1 5 TRP CH2 C -2.526 9.371 -3.206 1.00 . A A . 5 TRP CH2 1 1 4 866 1 1 5 TRP CZ2 C -3.853 9.549 -3.510 1.00 . A A . 5 TRP CZ2 1 1 4 867 1 1 5 TRP CZ3 C -2.098 8.266 -2.444 1.00 . A A . 5 TRP CZ3 1 1 4 868 1 1 5 TRP H H -5.361 5.004 -3.579 1.00 . A A . 5 TRP H 1 1 4 869 1 1 5 TRP HA H -3.803 4.425 -1.239 1.00 . A A . 5 TRP HA 1 1 4 870 1 1 5 TRP HB2 H -6.701 5.159 -1.127 1.00 . A A . 5 TRP HB2 1 1 4 871 1 1 5 TRP HB3 H -5.361 5.701 -0.114 1.00 . A A . 5 TRP HB3 1 1 4 872 1 1 5 TRP HD1 H -7.609 7.076 -2.544 1.00 . A A . 5 TRP HD1 1 1 4 873 1 1 5 TRP HE1 H -6.714 9.150 -3.733 1.00 . A A . 5 TRP HE1 1 1 4 874 1 1 5 TRP HE3 H -2.676 6.475 -1.399 1.00 . A A . 5 TRP HE3 1 1 4 875 1 1 5 TRP HH2 H -1.797 10.081 -3.566 1.00 . A A . 5 TRP HH2 1 1 4 876 1 1 5 TRP HZ2 H -4.176 10.388 -4.108 1.00 . A A . 5 TRP HZ2 1 1 4 877 1 1 5 TRP HZ3 H -1.046 8.138 -2.234 1.00 . A A . 5 TRP HZ3 1 1 4 878 1 1 5 TRP N N -4.689 4.422 -3.102 1.00 . A A . 5 TRP N 1 1 4 879 1 1 5 TRP NE1 N -6.125 8.514 -3.216 1.00 . A A . 5 TRP NE1 1 1 4 880 1 1 5 TRP O O -6.131 2.309 -1.762 1.00 . A A . 5 TRP O 1 1 4 881 1 1 6 GLY C C -4.940 1.096 2.078 1.00 . A A . 6 GLY C 1 1 4 882 1 1 6 GLY CA C -5.740 1.686 0.931 1.00 . A A . 6 GLY CA 1 1 4 883 1 1 6 GLY H H -4.347 3.260 0.645 1.00 . A A . 6 GLY H 1 1 4 884 1 1 6 GLY HA2 H -6.662 2.099 1.339 1.00 . A A . 6 GLY HA2 1 1 4 885 1 1 6 GLY HA3 H -6.012 0.881 0.249 1.00 . A A . 6 GLY HA3 1 1 4 886 1 1 6 GLY N N -5.067 2.730 0.174 1.00 . A A . 6 GLY N 1 1 4 887 1 1 6 GLY O O -4.390 1.822 2.904 1.00 . A A . 6 GLY O 1 1 4 888 1 1 7 PHE C C -2.690 -0.929 2.941 1.00 . A A . 7 PHE C 1 1 4 889 1 1 7 PHE CA C -4.200 -0.991 3.170 1.00 . A A . 7 PHE CA 1 1 4 890 1 1 7 PHE CB C -4.723 -2.432 3.129 1.00 . A A . 7 PHE CB 1 1 4 891 1 1 7 PHE CD1 C -6.801 -1.875 4.445 1.00 . A A . 7 PHE CD1 1 1 4 892 1 1 7 PHE CD2 C -5.645 -3.915 4.932 1.00 . A A . 7 PHE CD2 1 1 4 893 1 1 7 PHE CE1 C -7.745 -2.169 5.425 1.00 . A A . 7 PHE CE1 1 1 4 894 1 1 7 PHE CE2 C -6.596 -4.229 5.899 1.00 . A A . 7 PHE CE2 1 1 4 895 1 1 7 PHE CG C -5.743 -2.741 4.191 1.00 . A A . 7 PHE CG 1 1 4 896 1 1 7 PHE CZ C -7.648 -3.353 6.149 1.00 . A A . 7 PHE CZ 1 1 4 897 1 1 7 PHE H H -5.365 -0.761 1.412 1.00 . A A . 7 PHE H 1 1 4 898 1 1 7 PHE HA H -4.414 -0.555 4.146 1.00 . A A . 7 PHE HA 1 1 4 899 1 1 7 PHE HB2 H -5.173 -2.610 2.154 1.00 . A A . 7 PHE HB2 1 1 4 900 1 1 7 PHE HB3 H -3.895 -3.131 3.238 1.00 . A A . 7 PHE HB3 1 1 4 901 1 1 7 PHE HD1 H -6.892 -0.957 3.883 1.00 . A A . 7 PHE HD1 1 1 4 902 1 1 7 PHE HD2 H -4.828 -4.599 4.752 1.00 . A A . 7 PHE HD2 1 1 4 903 1 1 7 PHE HE1 H -8.545 -1.474 5.630 1.00 . A A . 7 PHE HE1 1 1 4 904 1 1 7 PHE HE2 H -6.514 -5.149 6.460 1.00 . A A . 7 PHE HE2 1 1 4 905 1 1 7 PHE HZ H -8.382 -3.589 6.905 1.00 . A A . 7 PHE HZ 1 1 4 906 1 1 7 PHE N N -4.902 -0.232 2.136 1.00 . A A . 7 PHE N 1 1 4 907 1 1 7 PHE O O -2.238 -0.138 2.120 1.00 . A A . 7 PHE O 1 1 4 908 1 1 8 GLU C C 0.286 -0.612 3.850 1.00 . A A . 8 GLU C 1 1 4 909 1 1 8 GLU CA C -0.451 -1.880 3.432 1.00 . A A . 8 GLU CA 1 1 4 910 1 1 8 GLU CB C -0.174 -2.229 1.951 1.00 . A A . 8 GLU CB 1 1 4 911 1 1 8 GLU CD C 1.499 -2.178 0.090 1.00 . A A . 8 GLU CD 1 1 4 912 1 1 8 GLU CG C 1.320 -2.195 1.586 1.00 . A A . 8 GLU CG 1 1 4 913 1 1 8 GLU H H -2.321 -2.353 4.354 1.00 . A A . 8 GLU H 1 1 4 914 1 1 8 GLU HA H -0.079 -2.687 4.065 1.00 . A A . 8 GLU HA 1 1 4 915 1 1 8 GLU HB2 H -0.588 -3.213 1.721 1.00 . A A . 8 GLU HB2 1 1 4 916 1 1 8 GLU HB3 H -0.687 -1.511 1.311 1.00 . A A . 8 GLU HB3 1 1 4 917 1 1 8 GLU HG2 H 1.779 -1.292 1.991 1.00 . A A . 8 GLU HG2 1 1 4 918 1 1 8 GLU HG3 H 1.837 -3.059 2.011 1.00 . A A . 8 GLU HG3 1 1 4 919 1 1 8 GLU N N -1.903 -1.765 3.652 1.00 . A A . 8 GLU N 1 1 4 920 1 1 8 GLU O O -0.124 0.495 3.568 1.00 . A A . 8 GLU O 1 1 4 921 1 1 8 GLU OE1 O 1.263 -3.131 -0.624 1.00 . A A . 8 GLU OE1 1 1 4 922 1 1 9 PRO C C 2.768 1.036 3.472 1.00 . A A . 9 PRO C 1 1 4 923 1 1 9 PRO CA C 2.267 0.467 4.798 1.00 . A A . 9 PRO CA 1 1 4 924 1 1 9 PRO CB C 3.396 -0.072 5.680 1.00 . A A . 9 PRO CB 1 1 4 925 1 1 9 PRO CD C 2.081 -1.956 5.035 1.00 . A A . 9 PRO CD 1 1 4 926 1 1 9 PRO CG C 3.497 -1.515 5.304 1.00 . A A . 9 PRO CG 1 1 4 927 1 1 9 PRO HA H 1.683 1.219 5.328 1.00 . A A . 9 PRO HA 1 1 4 928 1 1 9 PRO HB2 H 4.330 0.451 5.475 1.00 . A A . 9 PRO HB2 1 1 4 929 1 1 9 PRO HB3 H 3.126 0.022 6.732 1.00 . A A . 9 PRO HB3 1 1 4 930 1 1 9 PRO HD2 H 2.070 -2.742 4.281 1.00 . A A . 9 PRO HD2 1 1 4 931 1 1 9 PRO HD3 H 1.597 -2.287 5.953 1.00 . A A . 9 PRO HD3 1 1 4 932 1 1 9 PRO HG2 H 4.099 -1.623 4.402 1.00 . A A . 9 PRO HG2 1 1 4 933 1 1 9 PRO HG3 H 3.929 -2.095 6.121 1.00 . A A . 9 PRO HG3 1 1 4 934 1 1 9 PRO N N 1.448 -0.721 4.537 1.00 . A A . 9 PRO N 1 1 4 935 1 1 9 PRO O O 3.441 0.353 2.699 1.00 . A A . 9 PRO O 1 1 4 936 1 1 10 GLY C C 1.172 3.142 1.233 1.00 . A A . 10 GLY C 1 1 4 937 1 1 10 GLY CA C 2.519 2.848 1.865 1.00 . A A . 10 GLY CA 1 1 4 938 1 1 10 GLY H H 1.890 2.818 3.891 1.00 . A A . 10 GLY H 1 1 4 939 1 1 10 GLY HA2 H 3.071 3.785 1.937 1.00 . A A . 10 GLY HA2 1 1 4 940 1 1 10 GLY HA3 H 3.073 2.166 1.222 1.00 . A A . 10 GLY HA3 1 1 4 941 1 1 10 GLY N N 2.380 2.276 3.194 1.00 . A A . 10 GLY N 1 1 4 942 1 1 10 GLY O O 1.095 3.821 0.209 1.00 . A A . 10 GLY O 1 1 4 943 1 1 11 VAL C C -1.695 2.690 0.191 1.00 . A A . 11 VAL C 1 1 4 944 1 1 11 VAL CA C -1.267 3.070 1.605 1.00 . A A . 11 VAL CA 1 1 4 945 1 1 11 VAL CB C -1.497 4.576 1.877 1.00 . A A . 11 VAL CB 1 1 4 946 1 1 11 VAL CG1 C -2.983 4.917 1.833 1.00 . A A . 11 VAL CG1 1 1 4 947 1 1 11 VAL CG2 C -0.948 4.967 3.250 1.00 . A A . 11 VAL CG2 1 1 4 948 1 1 11 VAL H H 0.253 1.986 2.615 1.00 . A A . 11 VAL H 1 1 4 949 1 1 11 VAL HA H -1.908 2.518 2.293 1.00 . A A . 11 VAL HA 1 1 4 950 1 1 11 VAL HB H -0.979 5.162 1.118 1.00 . A A . 11 VAL HB 1 1 4 951 1 1 11 VAL HG11 H -3.128 5.961 2.110 1.00 . A A . 11 VAL HG11 1 1 4 952 1 1 11 VAL HG12 H -3.361 4.769 0.823 1.00 . A A . 11 VAL HG12 1 1 4 953 1 1 11 VAL HG13 H -3.532 4.280 2.528 1.00 . A A . 11 VAL HG13 1 1 4 954 1 1 11 VAL HG21 H 0.139 4.890 3.249 1.00 . A A . 11 VAL HG21 1 1 4 955 1 1 11 VAL HG22 H -1.225 5.997 3.476 1.00 . A A . 11 VAL HG22 1 1 4 956 1 1 11 VAL HG23 H -1.359 4.307 4.015 1.00 . A A . 11 VAL HG23 1 1 4 957 1 1 11 VAL N N 0.112 2.662 1.875 1.00 . A A . 11 VAL N 1 1 4 958 1 1 11 VAL O O -1.778 3.524 -0.709 1.00 . A A . 11 VAL O 1 1 4 959 1 1 12 ARG C C -3.367 -0.387 -0.962 1.00 . A A . 12 ARG C 1 1 4 960 1 1 12 ARG CA C -2.484 0.828 -1.223 1.00 . A A . 12 ARG CA 1 1 4 961 1 1 12 ARG CB C -1.310 0.421 -2.117 1.00 . A A . 12 ARG CB 1 1 4 962 1 1 12 ARG CD C -2.498 0.427 -4.364 1.00 . A A . 12 ARG CD 1 1 4 963 1 1 12 ARG CG C -1.674 -0.375 -3.368 1.00 . A A . 12 ARG CG 1 1 4 964 1 1 12 ARG CZ C -3.691 0.028 -6.498 1.00 . A A . 12 ARG CZ 1 1 4 965 1 1 12 ARG H H -1.883 0.785 0.818 1.00 . A A . 12 ARG H 1 1 4 966 1 1 12 ARG HA H -3.080 1.583 -1.733 1.00 . A A . 12 ARG HA 1 1 4 967 1 1 12 ARG HB2 H -0.772 1.323 -2.411 1.00 . A A . 12 ARG HB2 1 1 4 968 1 1 12 ARG HB3 H -0.635 -0.191 -1.519 1.00 . A A . 12 ARG HB3 1 1 4 969 1 1 12 ARG HD2 H -3.434 0.718 -3.885 1.00 . A A . 12 ARG HD2 1 1 4 970 1 1 12 ARG HD3 H -1.950 1.333 -4.624 1.00 . A A . 12 ARG HD3 1 1 4 971 1 1 12 ARG HE H -2.315 -1.202 -5.712 1.00 . A A . 12 ARG HE 1 1 4 972 1 1 12 ARG HG2 H -0.754 -0.700 -3.854 1.00 . A A . 12 ARG HG2 1 1 4 973 1 1 12 ARG HG3 H -2.239 -1.261 -3.080 1.00 . A A . 12 ARG HG3 1 1 4 974 1 1 12 ARG HH11 H -4.265 1.742 -5.613 1.00 . A A . 12 ARG HH11 1 1 4 975 1 1 12 ARG HH12 H -5.041 1.373 -7.147 1.00 . A A . 12 ARG HH12 1 1 4 976 1 1 12 ARG HH21 H -3.366 -1.611 -7.615 1.00 . A A . 12 ARG HH21 1 1 4 977 1 1 12 ARG HH22 H -4.545 -0.476 -8.251 1.00 . A A . 12 ARG HH22 1 1 4 978 1 1 12 ARG N N -1.985 1.404 0.023 1.00 . A A . 12 ARG N 1 1 4 979 1 1 12 ARG NE N -2.803 -0.328 -5.579 1.00 . A A . 12 ARG NE 1 1 4 980 1 1 12 ARG NH1 N -4.385 1.146 -6.417 1.00 . A A . 12 ARG NH1 1 1 4 981 1 1 12 ARG NH2 N -3.879 -0.746 -7.546 1.00 . A A . 12 ARG NH2 1 1 4 982 1 1 12 ARG O O -2.953 -1.341 -0.305 1.00 . A A . 12 ARG O 1 1 4 983 1 1 13 CYS C C -4.729 -2.634 -2.373 1.00 . A A . 13 CYS C 1 1 4 984 1 1 13 CYS CA C -5.417 -1.558 -1.539 1.00 . A A . 13 CYS CA 1 1 4 985 1 1 13 CYS CB C -6.795 -1.229 -2.119 1.00 . A A . 13 CYS CB 1 1 4 986 1 1 13 CYS H H -4.911 0.474 -1.960 1.00 . A A . 13 CYS H 1 1 4 987 1 1 13 CYS HA H -5.535 -1.927 -0.521 1.00 . A A . 13 CYS HA 1 1 4 988 1 1 13 CYS HB2 H -7.223 -0.396 -1.562 1.00 . A A . 13 CYS HB2 1 1 4 989 1 1 13 CYS HB3 H -6.673 -0.929 -3.160 1.00 . A A . 13 CYS HB3 1 1 4 990 1 1 13 CYS N N -4.574 -0.368 -1.517 1.00 . A A . 13 CYS N 1 1 4 991 1 1 13 CYS O O -4.699 -2.556 -3.602 1.00 . A A . 13 CYS O 1 1 4 992 1 1 13 CYS SG S -7.964 -2.624 -2.048 1.00 . A A . 13 CYS SG 1 1 4 993 1 1 14 LEU C C -4.038 -6.032 -2.125 1.00 . A A . 14 LEU C 1 1 4 994 1 1 14 LEU CA C -3.377 -4.673 -2.344 1.00 . A A . 14 LEU CA 1 1 4 995 1 1 14 LEU CB C -1.950 -4.654 -1.785 1.00 . A A . 14 LEU CB 1 1 4 996 1 1 14 LEU CD1 C -0.889 -6.589 -3.040 1.00 . A A . 14 LEU CD1 1 1 4 997 1 1 14 LEU CD2 C -0.618 -4.258 -3.896 1.00 . A A . 14 LEU CD2 1 1 4 998 1 1 14 LEU CG C -0.775 -5.122 -2.649 1.00 . A A . 14 LEU CG 1 1 4 999 1 1 14 LEU H H -4.160 -3.602 -0.685 1.00 . A A . 14 LEU H 1 1 4 1000 1 1 14 LEU HA H -3.348 -4.478 -3.417 1.00 . A A . 14 LEU HA 1 1 4 1001 1 1 14 LEU HB2 H -1.732 -3.627 -1.493 1.00 . A A . 14 LEU HB2 1 1 4 1002 1 1 14 LEU HB3 H -1.939 -5.244 -0.870 1.00 . A A . 14 LEU HB3 1 1 4 1003 1 1 14 LEU HD11 H 0.002 -6.887 -3.594 1.00 . A A . 14 LEU HD11 1 1 4 1004 1 1 14 LEU HD12 H -0.969 -7.201 -2.143 1.00 . A A . 14 LEU HD12 1 1 4 1005 1 1 14 LEU HD13 H -1.768 -6.742 -3.667 1.00 . A A . 14 LEU HD13 1 1 4 1006 1 1 14 LEU HD21 H -0.555 -3.209 -3.605 1.00 . A A . 14 LEU HD21 1 1 4 1007 1 1 14 LEU HD22 H 0.295 -4.540 -4.418 1.00 . A A . 14 LEU HD22 1 1 4 1008 1 1 14 LEU HD23 H -1.471 -4.402 -4.560 1.00 . A A . 14 LEU HD23 1 1 4 1009 1 1 14 LEU HG H 0.126 -5.007 -2.051 1.00 . A A . 14 LEU HG 1 1 4 1010 1 1 14 LEU N N -4.137 -3.610 -1.694 1.00 . A A . 14 LEU N 1 1 4 1011 1 1 14 LEU O O -4.246 -6.789 -3.071 1.00 . A A . 14 LEU O 1 1 4 1012 1 1 15 ILE C C -6.365 -7.210 0.210 1.00 . A A . 15 ILE C 1 1 4 1013 1 1 15 ILE CA C -5.077 -7.562 -0.527 1.00 . A A . 15 ILE CA 1 1 4 1014 1 1 15 ILE CB C -4.222 -8.490 0.366 1.00 . A A . 15 ILE CB 1 1 4 1015 1 1 15 ILE CD1 C -1.877 -9.538 0.547 1.00 . A A . 15 ILE CD1 1 1 4 1016 1 1 15 ILE CG1 C -2.866 -8.757 -0.298 1.00 . A A . 15 ILE CG1 1 1 4 1017 1 1 15 ILE CG2 C -4.978 -9.793 0.625 1.00 . A A . 15 ILE CG2 1 1 4 1018 1 1 15 ILE H H -4.150 -5.689 -0.130 1.00 . A A . 15 ILE H 1 1 4 1019 1 1 15 ILE HA H -5.328 -8.094 -1.444 1.00 . A A . 15 ILE HA 1 1 4 1020 1 1 15 ILE HB H -4.046 -7.992 1.320 1.00 . A A . 15 ILE HB 1 1 4 1021 1 1 15 ILE HD11 H -1.767 -9.056 1.518 1.00 . A A . 15 ILE HD11 1 1 4 1022 1 1 15 ILE HD12 H -2.230 -10.560 0.684 1.00 . A A . 15 ILE HD12 1 1 4 1023 1 1 15 ILE HD13 H -0.911 -9.557 0.043 1.00 . A A . 15 ILE HD13 1 1 4 1024 1 1 15 ILE HG12 H -3.036 -9.291 -1.232 1.00 . A A . 15 ILE HG12 1 1 4 1025 1 1 15 ILE HG13 H -2.400 -7.803 -0.538 1.00 . A A . 15 ILE HG13 1 1 4 1026 1 1 15 ILE HG21 H -5.920 -9.572 1.127 1.00 . A A . 15 ILE HG21 1 1 4 1027 1 1 15 ILE HG22 H -5.184 -10.298 -0.319 1.00 . A A . 15 ILE HG22 1 1 4 1028 1 1 15 ILE HG23 H -4.388 -10.447 1.267 1.00 . A A . 15 ILE HG23 1 1 4 1029 1 1 15 ILE N N -4.377 -6.329 -0.875 1.00 . A A . 15 ILE N 1 1 4 1030 1 1 15 ILE O O -6.318 -6.637 1.298 1.00 . A A . 15 ILE O 1 1 4 1031 1 1 16 TRP C C -8.931 -6.229 1.174 1.00 . A A . 16 TRP C 1 1 4 1032 1 1 16 TRP CA C -8.838 -7.318 0.107 1.00 . A A . 16 TRP CA 1 1 4 1033 1 1 16 TRP CB C -9.458 -8.624 0.617 1.00 . A A . 16 TRP CB 1 1 4 1034 1 1 16 TRP CD1 C -8.262 -10.888 0.559 1.00 . A A . 16 TRP CD1 1 1 4 1035 1 1 16 TRP CD2 C -9.042 -10.248 -1.425 1.00 . A A . 16 TRP CD2 1 1 4 1036 1 1 16 TRP CE2 C -8.347 -11.470 -1.583 1.00 . A A . 16 TRP CE2 1 1 4 1037 1 1 16 TRP CE3 C -9.596 -9.642 -2.561 1.00 . A A . 16 TRP CE3 1 1 4 1038 1 1 16 TRP CG C -8.942 -9.873 -0.043 1.00 . A A . 16 TRP CG 1 1 4 1039 1 1 16 TRP CH2 C -8.739 -11.468 -3.928 1.00 . A A . 16 TRP CH2 1 1 4 1040 1 1 16 TRP CZ2 C -8.183 -12.078 -2.832 1.00 . A A . 16 TRP CZ2 1 1 4 1041 1 1 16 TRP CZ3 C -9.447 -10.257 -3.803 1.00 . A A . 16 TRP CZ3 1 1 4 1042 1 1 16 TRP H H -7.423 -8.007 -1.309 1.00 . A A . 16 TRP H 1 1 4 1043 1 1 16 TRP HA H -9.451 -6.982 -0.730 1.00 . A A . 16 TRP HA 1 1 4 1044 1 1 16 TRP HB2 H -9.274 -8.711 1.688 1.00 . A A . 16 TRP HB2 1 1 4 1045 1 1 16 TRP HB3 H -10.537 -8.572 0.467 1.00 . A A . 16 TRP HB3 1 1 4 1046 1 1 16 TRP HD1 H -8.030 -10.921 1.613 1.00 . A A . 16 TRP HD1 1 1 4 1047 1 1 16 TRP HE1 H -7.386 -12.688 -0.115 1.00 . A A . 16 TRP HE1 1 1 4 1048 1 1 16 TRP HE3 H -10.123 -8.703 -2.475 1.00 . A A . 16 TRP HE3 1 1 4 1049 1 1 16 TRP HH2 H -8.626 -11.919 -4.904 1.00 . A A . 16 TRP HH2 1 1 4 1050 1 1 16 TRP HZ2 H -7.625 -12.997 -2.931 1.00 . A A . 16 TRP HZ2 1 1 4 1051 1 1 16 TRP HZ3 H -9.872 -9.795 -4.682 1.00 . A A . 16 TRP HZ3 1 1 4 1052 1 1 16 TRP N N -7.491 -7.548 -0.412 1.00 . A A . 16 TRP N 1 1 4 1053 1 1 16 TRP NE1 N -7.902 -11.851 -0.346 1.00 . A A . 16 TRP NE1 1 1 4 1054 1 1 16 TRP O O -9.097 -6.500 2.364 1.00 . A A . 16 TRP O 1 1 4 1055 1 1 17 CYS C C -10.237 -3.532 2.161 1.00 . A A . 17 CYS C 1 1 4 1056 1 1 17 CYS CA C -8.831 -3.848 1.660 1.00 . A A . 17 CYS CA 1 1 4 1057 1 1 17 CYS CB C -8.258 -2.610 0.968 1.00 . A A . 17 CYS CB 1 1 4 1058 1 1 17 CYS H H -8.685 -4.791 -0.244 1.00 . A A . 17 CYS H 1 1 4 1059 1 1 17 CYS HA H -8.204 -4.087 2.518 1.00 . A A . 17 CYS HA 1 1 4 1060 1 1 17 CYS HB2 H -8.259 -1.782 1.678 1.00 . A A . 17 CYS HB2 1 1 4 1061 1 1 17 CYS HB3 H -7.230 -2.826 0.682 1.00 . A A . 17 CYS HB3 1 1 4 1062 1 1 17 CYS N N -8.808 -4.979 0.741 1.00 . A A . 17 CYS N 1 1 4 1063 1 1 17 CYS O O -11.248 -3.935 1.586 1.00 . A A . 17 CYS O 1 1 4 1064 1 1 17 CYS SG S -9.190 -2.108 -0.515 1.00 . A A . 17 CYS SG 1 1 4 1065 1 1 18 ASP C C -11.945 -0.938 2.931 1.00 . A A . 18 ASP C 1 1 4 1066 1 1 18 ASP CA C -11.563 -2.171 3.724 1.00 . A A . 18 ASP CA 1 1 4 1067 1 1 18 ASP CB C -11.512 -1.837 5.223 1.00 . A A . 18 ASP CB 1 1 4 1068 1 1 18 ASP CG C -12.855 -1.341 5.697 1.00 . A A . 18 ASP CG 1 1 4 1069 1 1 18 ASP H H -9.455 -2.525 3.751 1.00 . A A . 18 ASP H 1 1 4 1070 1 1 18 ASP HA H -12.362 -2.896 3.554 1.00 . A A . 18 ASP HA 1 1 4 1071 1 1 18 ASP HB2 H -11.232 -2.725 5.795 1.00 . A A . 18 ASP HB2 1 1 4 1072 1 1 18 ASP HB3 H -10.764 -1.063 5.402 1.00 . A A . 18 ASP HB3 1 1 4 1073 1 1 18 ASP N N -10.302 -2.755 3.254 1.00 . A A . 18 ASP N 1 1 4 1074 1 1 18 ASP O O -11.107 -0.073 2.752 1.00 . A A . 18 ASP O 1 1 4 1075 1 1 18 ASP OD1 O -13.011 -1.129 6.880 1.00 . A A . 18 ASP OD1 1 1 4 1076 1 1 18 ASP OD2 O -13.737 -1.180 4.877 1.00 . A A . 18 ASP OD2 1 1 5 1077 1 1 1 GLY C C 2.642 0.866 -1.861 1.00 . A A . 1 GLY C 1 1 5 1078 1 1 1 GLY CA C 2.178 -0.570 -1.715 1.00 . A A . 1 GLY CA 1 1 5 1079 1 1 1 GLY H1 H 2.341 -0.243 0.380 1.00 . A A . 1 GLY H1 1 1 5 1080 1 1 1 GLY HA2 H 2.922 -1.231 -2.158 1.00 . A A . 1 GLY HA2 1 1 5 1081 1 1 1 GLY HA3 H 1.232 -0.696 -2.240 1.00 . A A . 1 GLY HA3 1 1 5 1082 1 1 1 GLY N N 2.008 -0.901 -0.310 1.00 . A A . 1 GLY N 1 1 5 1083 1 1 1 GLY O O 3.204 1.418 -0.919 1.00 . A A . 1 GLY O 1 1 5 1084 1 1 2 SER C C 1.971 3.666 -4.190 1.00 . A A . 2 SER C 1 1 5 1085 1 1 2 SER CA C 2.857 2.848 -3.252 1.00 . A A . 2 SER CA 1 1 5 1086 1 1 2 SER CB C 4.276 2.838 -3.821 1.00 . A A . 2 SER CB 1 1 5 1087 1 1 2 SER H H 1.981 0.969 -3.778 1.00 . A A . 2 SER H 1 1 5 1088 1 1 2 SER HA H 2.881 3.362 -2.291 1.00 . A A . 2 SER HA 1 1 5 1089 1 1 2 SER HB2 H 4.835 2.027 -3.354 1.00 . A A . 2 SER HB2 1 1 5 1090 1 1 2 SER HB3 H 4.227 2.659 -4.896 1.00 . A A . 2 SER HB3 1 1 5 1091 1 1 2 SER HG H 4.340 4.783 -3.808 1.00 . A A . 2 SER HG 1 1 5 1092 1 1 2 SER N N 2.430 1.469 -3.027 1.00 . A A . 2 SER N 1 1 5 1093 1 1 2 SER O O 2.095 4.887 -4.258 1.00 . A A . 2 SER O 1 1 5 1094 1 1 2 SER OG O 4.931 4.068 -3.571 1.00 . A A . 2 SER OG 1 1 5 1095 1 1 3 ARG C C -1.015 4.218 -5.357 1.00 . A A . 3 ARG C 1 1 5 1096 1 1 3 ARG CA C 0.267 3.633 -5.948 1.00 . A A . 3 ARG CA 1 1 5 1097 1 1 3 ARG CB C -0.004 2.657 -7.100 1.00 . A A . 3 ARG CB 1 1 5 1098 1 1 3 ARG CD C 2.350 2.844 -8.034 1.00 . A A . 3 ARG CD 1 1 5 1099 1 1 3 ARG CG C 1.215 1.913 -7.635 1.00 . A A . 3 ARG CG 1 1 5 1100 1 1 3 ARG CZ C 2.970 2.284 -10.370 1.00 . A A . 3 ARG CZ 1 1 5 1101 1 1 3 ARG H H 1.077 1.985 -4.862 1.00 . A A . 3 ARG H 1 1 5 1102 1 1 3 ARG HA H 0.820 4.486 -6.341 1.00 . A A . 3 ARG HA 1 1 5 1103 1 1 3 ARG HB2 H -0.718 1.906 -6.765 1.00 . A A . 3 ARG HB2 1 1 5 1104 1 1 3 ARG HB3 H -0.457 3.214 -7.921 1.00 . A A . 3 ARG HB3 1 1 5 1105 1 1 3 ARG HD2 H 1.931 3.782 -8.399 1.00 . A A . 3 ARG HD2 1 1 5 1106 1 1 3 ARG HD3 H 2.951 3.064 -7.151 1.00 . A A . 3 ARG HD3 1 1 5 1107 1 1 3 ARG HE H 4.039 1.778 -8.752 1.00 . A A . 3 ARG HE 1 1 5 1108 1 1 3 ARG HG2 H 1.580 1.219 -6.880 1.00 . A A . 3 ARG HG2 1 1 5 1109 1 1 3 ARG HG3 H 0.906 1.336 -8.507 1.00 . A A . 3 ARG HG3 1 1 5 1110 1 1 3 ARG HH11 H 1.245 3.324 -10.280 1.00 . A A . 3 ARG HH11 1 1 5 1111 1 1 3 ARG HH12 H 1.772 2.852 -11.887 1.00 . A A . 3 ARG HH12 1 1 5 1112 1 1 3 ARG HH21 H 4.648 1.266 -10.809 1.00 . A A . 3 ARG HH21 1 1 5 1113 1 1 3 ARG HH22 H 3.652 1.724 -12.180 1.00 . A A . 3 ARG HH22 1 1 5 1114 1 1 3 ARG N N 1.115 2.988 -4.948 1.00 . A A . 3 ARG N 1 1 5 1115 1 1 3 ARG NE N 3.202 2.248 -9.063 1.00 . A A . 3 ARG NE 1 1 5 1116 1 1 3 ARG NH1 N 1.905 2.866 -10.888 1.00 . A A . 3 ARG NH1 1 1 5 1117 1 1 3 ARG NH2 N 3.825 1.709 -11.188 1.00 . A A . 3 ARG NH2 1 1 5 1118 1 1 3 ARG O O -0.951 5.122 -4.527 1.00 . A A . 3 ARG O 1 1 5 1119 1 1 4 GLY C C -3.595 3.754 -3.800 1.00 . A A . 4 GLY C 1 1 5 1120 1 1 4 GLY CA C -3.441 4.190 -5.244 1.00 . A A . 4 GLY CA 1 1 5 1121 1 1 4 GLY H H -2.185 3.010 -6.494 1.00 . A A . 4 GLY H 1 1 5 1122 1 1 4 GLY HA2 H -3.474 5.279 -5.283 1.00 . A A . 4 GLY HA2 1 1 5 1123 1 1 4 GLY HA3 H -4.263 3.783 -5.832 1.00 . A A . 4 GLY HA3 1 1 5 1124 1 1 4 GLY N N -2.174 3.730 -5.788 1.00 . A A . 4 GLY N 1 1 5 1125 1 1 4 GLY O O -2.718 3.075 -3.276 1.00 . A A . 4 GLY O 1 1 5 1126 1 1 5 TRP C C -5.473 2.837 -1.113 1.00 . A A . 5 TRP C 1 1 5 1127 1 1 5 TRP CA C -4.794 4.076 -1.696 1.00 . A A . 5 TRP CA 1 1 5 1128 1 1 5 TRP CB C -5.549 5.312 -1.199 1.00 . A A . 5 TRP CB 1 1 5 1129 1 1 5 TRP CD1 C -6.303 7.229 -2.728 1.00 . A A . 5 TRP CD1 1 1 5 1130 1 1 5 TRP CD2 C -4.120 7.239 -2.291 1.00 . A A . 5 TRP CD2 1 1 5 1131 1 1 5 TRP CE2 C -4.421 8.349 -3.115 1.00 . A A . 5 TRP CE2 1 1 5 1132 1 1 5 TRP CE3 C -2.782 7.000 -1.953 1.00 . A A . 5 TRP CE3 1 1 5 1133 1 1 5 TRP CG C -5.350 6.542 -2.038 1.00 . A A . 5 TRP CG 1 1 5 1134 1 1 5 TRP CH2 C -2.138 9.007 -3.174 1.00 . A A . 5 TRP CH2 1 1 5 1135 1 1 5 TRP CZ2 C -3.437 9.241 -3.552 1.00 . A A . 5 TRP CZ2 1 1 5 1136 1 1 5 TRP CZ3 C -1.800 7.890 -2.386 1.00 . A A . 5 TRP CZ3 1 1 5 1137 1 1 5 TRP H H -5.426 4.618 -3.648 1.00 . A A . 5 TRP H 1 1 5 1138 1 1 5 TRP HA H -3.781 4.116 -1.298 1.00 . A A . 5 TRP HA 1 1 5 1139 1 1 5 TRP HB2 H -6.613 5.082 -1.174 1.00 . A A . 5 TRP HB2 1 1 5 1140 1 1 5 TRP HB3 H -5.227 5.532 -0.182 1.00 . A A . 5 TRP HB3 1 1 5 1141 1 1 5 TRP HD1 H -7.349 6.959 -2.752 1.00 . A A . 5 TRP HD1 1 1 5 1142 1 1 5 TRP HE1 H -6.294 8.954 -3.944 1.00 . A A . 5 TRP HE1 1 1 5 1143 1 1 5 TRP HE3 H -2.517 6.125 -1.377 1.00 . A A . 5 TRP HE3 1 1 5 1144 1 1 5 TRP HH2 H -1.360 9.684 -3.495 1.00 . A A . 5 TRP HH2 1 1 5 1145 1 1 5 TRP HZ2 H -3.688 10.087 -4.175 1.00 . A A . 5 TRP HZ2 1 1 5 1146 1 1 5 TRP HZ3 H -0.769 7.714 -2.121 1.00 . A A . 5 TRP HZ3 1 1 5 1147 1 1 5 TRP N N -4.687 4.145 -3.151 1.00 . A A . 5 TRP N 1 1 5 1148 1 1 5 TRP NE1 N -5.765 8.309 -3.376 1.00 . A A . 5 TRP NE1 1 1 5 1149 1 1 5 TRP O O -6.299 2.204 -1.768 1.00 . A A . 5 TRP O 1 1 5 1150 1 1 6 GLY C C -5.210 0.954 2.126 1.00 . A A . 6 GLY C 1 1 5 1151 1 1 6 GLY CA C -5.881 1.502 0.881 1.00 . A A . 6 GLY CA 1 1 5 1152 1 1 6 GLY H H -4.376 2.975 0.594 1.00 . A A . 6 GLY H 1 1 5 1153 1 1 6 GLY HA2 H -6.838 1.931 1.179 1.00 . A A . 6 GLY HA2 1 1 5 1154 1 1 6 GLY HA3 H -6.093 0.666 0.216 1.00 . A A . 6 GLY HA3 1 1 5 1155 1 1 6 GLY N N -5.144 2.507 0.134 1.00 . A A . 6 GLY N 1 1 5 1156 1 1 6 GLY O O -5.194 1.596 3.174 1.00 . A A . 6 GLY O 1 1 5 1157 1 1 7 PHE C C -2.542 -1.003 2.917 1.00 . A A . 7 PHE C 1 1 5 1158 1 1 7 PHE CA C -4.058 -1.002 3.108 1.00 . A A . 7 PHE CA 1 1 5 1159 1 1 7 PHE CB C -4.624 -2.426 3.090 1.00 . A A . 7 PHE CB 1 1 5 1160 1 1 7 PHE CD1 C -6.709 -1.770 4.335 1.00 . A A . 7 PHE CD1 1 1 5 1161 1 1 7 PHE CD2 C -5.617 -3.818 4.931 1.00 . A A . 7 PHE CD2 1 1 5 1162 1 1 7 PHE CE1 C -7.670 -1.990 5.317 1.00 . A A . 7 PHE CE1 1 1 5 1163 1 1 7 PHE CE2 C -6.588 -4.059 5.900 1.00 . A A . 7 PHE CE2 1 1 5 1164 1 1 7 PHE CG C -5.671 -2.675 4.140 1.00 . A A . 7 PHE CG 1 1 5 1165 1 1 7 PHE CZ C -7.616 -3.141 6.095 1.00 . A A . 7 PHE CZ 1 1 5 1166 1 1 7 PHE H H -4.674 -0.707 1.108 1.00 . A A . 7 PHE H 1 1 5 1167 1 1 7 PHE HA H -4.291 -0.524 4.059 1.00 . A A . 7 PHE HA 1 1 5 1168 1 1 7 PHE HB2 H -5.068 -2.610 2.111 1.00 . A A . 7 PHE HB2 1 1 5 1169 1 1 7 PHE HB3 H -3.819 -3.147 3.226 1.00 . A A . 7 PHE HB3 1 1 5 1170 1 1 7 PHE HD1 H -6.762 -0.879 3.725 1.00 . A A . 7 PHE HD1 1 1 5 1171 1 1 7 PHE HD2 H -4.821 -4.535 4.789 1.00 . A A . 7 PHE HD2 1 1 5 1172 1 1 7 PHE HE1 H -8.452 -1.263 5.481 1.00 . A A . 7 PHE HE1 1 1 5 1173 1 1 7 PHE HE2 H -6.543 -4.956 6.500 1.00 . A A . 7 PHE HE2 1 1 5 1174 1 1 7 PHE HZ H -8.363 -3.320 6.854 1.00 . A A . 7 PHE HZ 1 1 5 1175 1 1 7 PHE N N -4.678 -0.260 2.012 1.00 . A A . 7 PHE N 1 1 5 1176 1 1 7 PHE O O -2.043 -0.287 2.054 1.00 . A A . 7 PHE O 1 1 5 1177 1 1 8 GLU C C 0.381 -0.672 3.889 1.00 . A A . 8 GLU C 1 1 5 1178 1 1 8 GLU CA C -0.348 -1.964 3.540 1.00 . A A . 8 GLU CA 1 1 5 1179 1 1 8 GLU CB C -0.041 -2.464 2.105 1.00 . A A . 8 GLU CB 1 1 5 1180 1 1 8 GLU CD C 1.443 -2.040 0.126 1.00 . A A . 8 GLU CD 1 1 5 1181 1 1 8 GLU CG C 1.395 -2.180 1.627 1.00 . A A . 8 GLU CG 1 1 5 1182 1 1 8 GLU H H -2.257 -2.350 4.422 1.00 . A A . 8 GLU H 1 1 5 1183 1 1 8 GLU HA H -0.009 -2.716 4.256 1.00 . A A . 8 GLU HA 1 1 5 1184 1 1 8 GLU HB2 H -0.236 -3.537 2.049 1.00 . A A . 8 GLU HB2 1 1 5 1185 1 1 8 GLU HB3 H -0.728 -1.988 1.404 1.00 . A A . 8 GLU HB3 1 1 5 1186 1 1 8 GLU HG2 H 1.759 -1.248 2.055 1.00 . A A . 8 GLU HG2 1 1 5 1187 1 1 8 GLU HG3 H 2.064 -2.982 1.944 1.00 . A A . 8 GLU HG3 1 1 5 1188 1 1 8 GLU N N -1.802 -1.812 3.703 1.00 . A A . 8 GLU N 1 1 5 1189 1 1 8 GLU O O -0.061 0.421 3.599 1.00 . A A . 8 GLU O 1 1 5 1190 1 1 8 GLU OE1 O 1.020 -2.882 -0.641 1.00 . A A . 8 GLU OE1 1 1 5 1191 1 1 9 PRO C C 2.797 1.061 3.430 1.00 . A A . 9 PRO C 1 1 5 1192 1 1 9 PRO CA C 2.363 0.466 4.769 1.00 . A A . 9 PRO CA 1 1 5 1193 1 1 9 PRO CB C 3.541 -0.046 5.602 1.00 . A A . 9 PRO CB 1 1 5 1194 1 1 9 PRO CD C 2.242 -1.961 5.024 1.00 . A A . 9 PRO CD 1 1 5 1195 1 1 9 PRO CG C 3.658 -1.489 5.224 1.00 . A A . 9 PRO CG 1 1 5 1196 1 1 9 PRO HA H 1.788 1.201 5.331 1.00 . A A . 9 PRO HA 1 1 5 1197 1 1 9 PRO HB2 H 4.453 0.497 5.355 1.00 . A A . 9 PRO HB2 1 1 5 1198 1 1 9 PRO HB3 H 3.313 0.044 6.664 1.00 . A A . 9 PRO HB3 1 1 5 1199 1 1 9 PRO HD2 H 2.213 -2.756 4.281 1.00 . A A . 9 PRO HD2 1 1 5 1200 1 1 9 PRO HD3 H 1.806 -2.290 5.968 1.00 . A A . 9 PRO HD3 1 1 5 1201 1 1 9 PRO HG2 H 4.219 -1.585 4.294 1.00 . A A . 9 PRO HG2 1 1 5 1202 1 1 9 PRO HG3 H 4.141 -2.055 6.021 1.00 . A A . 9 PRO HG3 1 1 5 1203 1 1 9 PRO N N 1.565 -0.743 4.541 1.00 . A A . 9 PRO N 1 1 5 1204 1 1 9 PRO O O 3.415 0.388 2.605 1.00 . A A . 9 PRO O 1 1 5 1205 1 1 10 GLY C C 1.204 3.069 1.191 1.00 . A A . 10 GLY C 1 1 5 1206 1 1 10 GLY CA C 2.540 2.932 1.896 1.00 . A A . 10 GLY CA 1 1 5 1207 1 1 10 GLY H H 1.935 2.829 3.928 1.00 . A A . 10 GLY H 1 1 5 1208 1 1 10 GLY HA2 H 2.960 3.930 2.019 1.00 . A A . 10 GLY HA2 1 1 5 1209 1 1 10 GLY HA3 H 3.215 2.345 1.274 1.00 . A A . 10 GLY HA3 1 1 5 1210 1 1 10 GLY N N 2.408 2.310 3.203 1.00 . A A . 10 GLY N 1 1 5 1211 1 1 10 GLY O O 1.111 3.700 0.139 1.00 . A A . 10 GLY O 1 1 5 1212 1 1 11 VAL C C -1.663 2.496 0.113 1.00 . A A . 11 VAL C 1 1 5 1213 1 1 11 VAL CA C -1.230 2.852 1.533 1.00 . A A . 11 VAL CA 1 1 5 1214 1 1 11 VAL CB C -1.528 4.338 1.847 1.00 . A A . 11 VAL CB 1 1 5 1215 1 1 11 VAL CG1 C -3.027 4.612 1.789 1.00 . A A . 11 VAL CG1 1 1 5 1216 1 1 11 VAL CG2 C -1.019 4.708 3.241 1.00 . A A . 11 VAL CG2 1 1 5 1217 1 1 11 VAL H H 0.335 1.823 2.528 1.00 . A A . 11 VAL H 1 1 5 1218 1 1 11 VAL HA H -1.840 2.256 2.210 1.00 . A A . 11 VAL HA 1 1 5 1219 1 1 11 VAL HB H -1.026 4.970 1.115 1.00 . A A . 11 VAL HB 1 1 5 1220 1 1 11 VAL HG11 H -3.559 3.920 2.443 1.00 . A A . 11 VAL HG11 1 1 5 1221 1 1 11 VAL HG12 H -3.226 5.636 2.108 1.00 . A A . 11 VAL HG12 1 1 5 1222 1 1 11 VAL HG13 H -3.377 4.492 0.765 1.00 . A A . 11 VAL HG13 1 1 5 1223 1 1 11 VAL HG21 H -1.420 4.013 3.978 1.00 . A A . 11 VAL HG21 1 1 5 1224 1 1 11 VAL HG22 H 0.071 4.670 3.260 1.00 . A A . 11 VAL HG22 1 1 5 1225 1 1 11 VAL HG23 H -1.337 5.721 3.490 1.00 . A A . 11 VAL HG23 1 1 5 1226 1 1 11 VAL N N 0.164 2.505 1.800 1.00 . A A . 11 VAL N 1 1 5 1227 1 1 11 VAL O O -1.699 3.338 -0.783 1.00 . A A . 11 VAL O 1 1 5 1228 1 1 12 ARG C C -3.522 -0.475 -1.012 1.00 . A A . 12 ARG C 1 1 5 1229 1 1 12 ARG CA C -2.563 0.674 -1.303 1.00 . A A . 12 ARG CA 1 1 5 1230 1 1 12 ARG CB C -1.423 0.158 -2.186 1.00 . A A . 12 ARG CB 1 1 5 1231 1 1 12 ARG CD C -2.480 0.334 -4.495 1.00 . A A . 12 ARG CD 1 1 5 1232 1 1 12 ARG CG C -1.854 -0.578 -3.451 1.00 . A A . 12 ARG CG 1 1 5 1233 1 1 12 ARG CZ C -2.375 -0.928 -6.639 1.00 . A A . 12 ARG CZ 1 1 5 1234 1 1 12 ARG H H -1.930 0.598 0.725 1.00 . A A . 12 ARG H 1 1 5 1235 1 1 12 ARG HA H -3.102 1.459 -1.831 1.00 . A A . 12 ARG HA 1 1 5 1236 1 1 12 ARG HB2 H -0.788 1.001 -2.461 1.00 . A A . 12 ARG HB2 1 1 5 1237 1 1 12 ARG HB3 H -0.830 -0.533 -1.587 1.00 . A A . 12 ARG HB3 1 1 5 1238 1 1 12 ARG HD2 H -3.284 0.900 -4.026 1.00 . A A . 12 ARG HD2 1 1 5 1239 1 1 12 ARG HD3 H -1.730 1.040 -4.851 1.00 . A A . 12 ARG HD3 1 1 5 1240 1 1 12 ARG HE H -4.047 -0.557 -5.608 1.00 . A A . 12 ARG HE 1 1 5 1241 1 1 12 ARG HG2 H -0.980 -1.064 -3.884 1.00 . A A . 12 ARG HG2 1 1 5 1242 1 1 12 ARG HG3 H -2.573 -1.352 -3.185 1.00 . A A . 12 ARG HG3 1 1 5 1243 1 1 12 ARG HH11 H -0.543 -0.355 -6.036 1.00 . A A . 12 ARG HH11 1 1 5 1244 1 1 12 ARG HH12 H -0.613 -1.221 -7.565 1.00 . A A . 12 ARG HH12 1 1 5 1245 1 1 12 ARG HH21 H -4.037 -1.663 -7.497 1.00 . A A . 12 ARG HH21 1 1 5 1246 1 1 12 ARG HH22 H -2.539 -1.962 -8.362 1.00 . A A . 12 ARG HH22 1 1 5 1247 1 1 12 ARG N N -2.020 1.227 -0.064 1.00 . A A . 12 ARG N 1 1 5 1248 1 1 12 ARG NE N -3.048 -0.413 -5.618 1.00 . A A . 12 ARG NE 1 1 5 1249 1 1 12 ARG NH1 N -1.067 -0.818 -6.760 1.00 . A A . 12 ARG NH1 1 1 5 1250 1 1 12 ARG NH2 N -3.037 -1.566 -7.580 1.00 . A A . 12 ARG NH2 1 1 5 1251 1 1 12 ARG O O -3.221 -1.357 -0.210 1.00 . A A . 12 ARG O 1 1 5 1252 1 1 13 CYS C C -4.911 -2.799 -2.419 1.00 . A A . 13 CYS C 1 1 5 1253 1 1 13 CYS CA C -5.554 -1.648 -1.649 1.00 . A A . 13 CYS CA 1 1 5 1254 1 1 13 CYS CB C -6.922 -1.293 -2.236 1.00 . A A . 13 CYS CB 1 1 5 1255 1 1 13 CYS H H -4.926 0.302 -2.253 1.00 . A A . 13 CYS H 1 1 5 1256 1 1 13 CYS HA H -5.687 -1.960 -0.613 1.00 . A A . 13 CYS HA 1 1 5 1257 1 1 13 CYS HB2 H -7.277 -0.375 -1.768 1.00 . A A . 13 CYS HB2 1 1 5 1258 1 1 13 CYS HB3 H -6.810 -1.122 -3.307 1.00 . A A . 13 CYS HB3 1 1 5 1259 1 1 13 CYS N N -4.668 -0.489 -1.683 1.00 . A A . 13 CYS N 1 1 5 1260 1 1 13 CYS O O -5.139 -2.969 -3.616 1.00 . A A . 13 CYS O 1 1 5 1261 1 1 13 CYS SG S -8.184 -2.581 -1.978 1.00 . A A . 13 CYS SG 1 1 5 1262 1 1 14 LEU C C -4.027 -5.995 -2.081 1.00 . A A . 14 LEU C 1 1 5 1263 1 1 14 LEU CA C -3.322 -4.662 -2.319 1.00 . A A . 14 LEU CA 1 1 5 1264 1 1 14 LEU CB C -1.913 -4.672 -1.715 1.00 . A A . 14 LEU CB 1 1 5 1265 1 1 14 LEU CD1 C -0.864 -6.617 -2.966 1.00 . A A . 14 LEU CD1 1 1 5 1266 1 1 14 LEU CD2 C -0.480 -4.279 -3.756 1.00 . A A . 14 LEU CD2 1 1 5 1267 1 1 14 LEU CG C -0.717 -5.164 -2.538 1.00 . A A . 14 LEU CG 1 1 5 1268 1 1 14 LEU H H -3.880 -3.332 -0.759 1.00 . A A . 14 LEU H 1 1 5 1269 1 1 14 LEU HA H -3.254 -4.501 -3.396 1.00 . A A . 14 LEU HA 1 1 5 1270 1 1 14 LEU HB2 H -1.683 -3.652 -1.411 1.00 . A A . 14 LEU HB2 1 1 5 1271 1 1 14 LEU HB3 H -1.945 -5.265 -0.801 1.00 . A A . 14 LEU HB3 1 1 5 1272 1 1 14 LEU HD11 H -1.021 -7.243 -2.089 1.00 . A A . 14 LEU HD11 1 1 5 1273 1 1 14 LEU HD12 H -1.710 -6.722 -3.644 1.00 . A A . 14 LEU HD12 1 1 5 1274 1 1 14 LEU HD13 H 0.045 -6.939 -3.474 1.00 . A A . 14 LEU HD13 1 1 5 1275 1 1 14 LEU HD21 H -0.347 -3.247 -3.431 1.00 . A A . 14 LEU HD21 1 1 5 1276 1 1 14 LEU HD22 H 0.423 -4.609 -4.270 1.00 . A A . 14 LEU HD22 1 1 5 1277 1 1 14 LEU HD23 H -1.327 -4.344 -4.438 1.00 . A A . 14 LEU HD23 1 1 5 1278 1 1 14 LEU HG H 0.163 -5.094 -1.900 1.00 . A A . 14 LEU HG 1 1 5 1279 1 1 14 LEU N N -4.064 -3.553 -1.727 1.00 . A A . 14 LEU N 1 1 5 1280 1 1 14 LEU O O -4.200 -6.788 -3.004 1.00 . A A . 14 LEU O 1 1 5 1281 1 1 15 ILE C C -6.435 -7.051 0.249 1.00 . A A . 15 ILE C 1 1 5 1282 1 1 15 ILE CA C -5.146 -7.451 -0.463 1.00 . A A . 15 ILE CA 1 1 5 1283 1 1 15 ILE CB C -4.321 -8.364 0.472 1.00 . A A . 15 ILE CB 1 1 5 1284 1 1 15 ILE CD1 C -2.001 -9.450 0.725 1.00 . A A . 15 ILE CD1 1 1 5 1285 1 1 15 ILE CG1 C -2.959 -8.674 -0.159 1.00 . A A . 15 ILE CG1 1 1 5 1286 1 1 15 ILE CG2 C -5.102 -9.645 0.763 1.00 . A A . 15 ILE CG2 1 1 5 1287 1 1 15 ILE H H -4.223 -5.569 -0.110 1.00 . A A . 15 ILE H 1 1 5 1288 1 1 15 ILE HA H -5.396 -8.007 -1.366 1.00 . A A . 15 ILE HA 1 1 5 1289 1 1 15 ILE HB H -4.151 -7.838 1.413 1.00 . A A . 15 ILE HB 1 1 5 1290 1 1 15 ILE HD11 H -2.371 -10.464 0.873 1.00 . A A . 15 ILE HD11 1 1 5 1291 1 1 15 ILE HD12 H -1.024 -9.493 0.243 1.00 . A A . 15 ILE HD12 1 1 5 1292 1 1 15 ILE HD13 H -1.905 -8.950 1.688 1.00 . A A . 15 ILE HD13 1 1 5 1293 1 1 15 ILE HG12 H -3.124 -9.230 -1.081 1.00 . A A . 15 ILE HG12 1 1 5 1294 1 1 15 ILE HG13 H -2.470 -7.735 -0.418 1.00 . A A . 15 ILE HG13 1 1 5 1295 1 1 15 ILE HG21 H -6.048 -9.392 1.244 1.00 . A A . 15 ILE HG21 1 1 5 1296 1 1 15 ILE HG22 H -5.304 -10.177 -0.166 1.00 . A A . 15 ILE HG22 1 1 5 1297 1 1 15 ILE HG23 H -4.533 -10.286 1.435 1.00 . A A . 15 ILE HG23 1 1 5 1298 1 1 15 ILE N N -4.424 -6.239 -0.837 1.00 . A A . 15 ILE N 1 1 5 1299 1 1 15 ILE O O -6.381 -6.417 1.303 1.00 . A A . 15 ILE O 1 1 5 1300 1 1 16 TRP C C -8.974 -6.043 1.210 1.00 . A A . 16 TRP C 1 1 5 1301 1 1 16 TRP CA C -8.911 -7.125 0.133 1.00 . A A . 16 TRP CA 1 1 5 1302 1 1 16 TRP CB C -9.606 -8.402 0.621 1.00 . A A . 16 TRP CB 1 1 5 1303 1 1 16 TRP CD1 C -8.429 -10.675 0.730 1.00 . A A . 16 TRP CD1 1 1 5 1304 1 1 16 TRP CD2 C -9.121 -10.134 -1.315 1.00 . A A . 16 TRP CD2 1 1 5 1305 1 1 16 TRP CE2 C -8.446 -11.375 -1.379 1.00 . A A . 16 TRP CE2 1 1 5 1306 1 1 16 TRP CE3 C -9.624 -9.583 -2.502 1.00 . A A . 16 TRP CE3 1 1 5 1307 1 1 16 TRP CG C -9.068 -9.684 0.049 1.00 . A A . 16 TRP CG 1 1 5 1308 1 1 16 TRP CH2 C -8.769 -11.507 -3.730 1.00 . A A . 16 TRP CH2 1 1 5 1309 1 1 16 TRP CZ2 C -8.258 -12.061 -2.583 1.00 . A A . 16 TRP CZ2 1 1 5 1310 1 1 16 TRP CZ3 C -9.451 -10.276 -3.700 1.00 . A A . 16 TRP CZ3 1 1 5 1311 1 1 16 TRP H H -7.497 -7.935 -1.217 1.00 . A A . 16 TRP H 1 1 5 1312 1 1 16 TRP HA H -9.486 -6.755 -0.715 1.00 . A A . 16 TRP HA 1 1 5 1313 1 1 16 TRP HB2 H -9.523 -8.463 1.706 1.00 . A A . 16 TRP HB2 1 1 5 1314 1 1 16 TRP HB3 H -10.664 -8.329 0.370 1.00 . A A . 16 TRP HB3 1 1 5 1315 1 1 16 TRP HD1 H -8.237 -10.654 1.793 1.00 . A A . 16 TRP HD1 1 1 5 1316 1 1 16 TRP HE1 H -7.558 -12.521 0.190 1.00 . A A . 16 TRP HE1 1 1 5 1317 1 1 16 TRP HE3 H -10.131 -8.631 -2.488 1.00 . A A . 16 TRP HE3 1 1 5 1318 1 1 16 TRP HH2 H -8.639 -12.020 -4.672 1.00 . A A . 16 TRP HH2 1 1 5 1319 1 1 16 TRP HZ2 H -7.717 -12.995 -2.610 1.00 . A A . 16 TRP HZ2 1 1 5 1320 1 1 16 TRP HZ3 H -9.839 -9.859 -4.617 1.00 . A A . 16 TRP HZ3 1 1 5 1321 1 1 16 TRP N N -7.562 -7.416 -0.354 1.00 . A A . 16 TRP N 1 1 5 1322 1 1 16 TRP NE1 N -8.051 -11.692 -0.107 1.00 . A A . 16 TRP NE1 1 1 5 1323 1 1 16 TRP O O -9.104 -6.321 2.402 1.00 . A A . 16 TRP O 1 1 5 1324 1 1 17 CYS C C -10.280 -3.388 2.243 1.00 . A A . 17 CYS C 1 1 5 1325 1 1 17 CYS CA C -8.875 -3.671 1.716 1.00 . A A . 17 CYS CA 1 1 5 1326 1 1 17 CYS CB C -8.305 -2.421 1.044 1.00 . A A . 17 CYS CB 1 1 5 1327 1 1 17 CYS H H -8.765 -4.594 -0.203 1.00 . A A . 17 CYS H 1 1 5 1328 1 1 17 CYS HA H -8.237 -3.926 2.560 1.00 . A A . 17 CYS HA 1 1 5 1329 1 1 17 CYS HB2 H -8.279 -1.613 1.774 1.00 . A A . 17 CYS HB2 1 1 5 1330 1 1 17 CYS HB3 H -7.285 -2.640 0.734 1.00 . A A . 17 CYS HB3 1 1 5 1331 1 1 17 CYS N N -8.866 -4.789 0.782 1.00 . A A . 17 CYS N 1 1 5 1332 1 1 17 CYS O O -11.285 -3.813 1.676 1.00 . A A . 17 CYS O 1 1 5 1333 1 1 17 CYS SG S -9.252 -1.863 -0.408 1.00 . A A . 17 CYS SG 1 1 5 1334 1 1 18 ASP C C -12.824 -2.393 3.153 1.00 . A A . 18 ASP C 1 1 5 1335 1 1 18 ASP CA C -11.587 -2.217 4.012 1.00 . A A . 18 ASP CA 1 1 5 1336 1 1 18 ASP CB C -11.478 -0.760 4.483 1.00 . A A . 18 ASP CB 1 1 5 1337 1 1 18 ASP CG C -12.771 -0.308 5.110 1.00 . A A . 18 ASP CG 1 1 5 1338 1 1 18 ASP H H -9.470 -2.339 3.781 1.00 . A A . 18 ASP H 1 1 5 1339 1 1 18 ASP HA H -11.759 -2.856 4.882 1.00 . A A . 18 ASP HA 1 1 5 1340 1 1 18 ASP HB2 H -10.671 -0.663 5.210 1.00 . A A . 18 ASP HB2 1 1 5 1341 1 1 18 ASP HB3 H -11.251 -0.114 3.633 1.00 . A A . 18 ASP HB3 1 1 5 1342 1 1 18 ASP N N -10.335 -2.634 3.358 1.00 . A A . 18 ASP N 1 1 5 1343 1 1 18 ASP O O -13.827 -2.840 3.674 1.00 . A A . 18 ASP O 1 1 5 1344 1 1 18 ASP OD1 O -12.941 -0.504 6.295 1.00 . A A . 18 ASP OD1 1 1 5 1345 1 1 18 ASP OD2 O -13.590 0.245 4.406 1.00 . A A . 18 ASP OD2 1 1 6 1346 1 1 1 GLY C C 2.566 0.813 -1.976 1.00 . A A . 1 GLY C 1 1 6 1347 1 1 1 GLY CA C 2.280 -0.674 -1.915 1.00 . A A . 1 GLY CA 1 1 6 1348 1 1 1 GLY H1 H 2.147 -0.334 0.178 1.00 . A A . 1 GLY H1 1 1 6 1349 1 1 1 GLY HA2 H 3.155 -1.227 -2.256 1.00 . A A . 1 GLY HA2 1 1 6 1350 1 1 1 GLY HA3 H 1.428 -0.908 -2.553 1.00 . A A . 1 GLY HA3 1 1 6 1351 1 1 1 GLY N N 1.976 -1.025 -0.539 1.00 . A A . 1 GLY N 1 1 6 1352 1 1 1 GLY O O 2.903 1.405 -0.952 1.00 . A A . 1 GLY O 1 1 6 1353 1 1 2 SER C C 1.822 3.616 -4.247 1.00 . A A . 2 SER C 1 1 6 1354 1 1 2 SER CA C 2.734 2.838 -3.302 1.00 . A A . 2 SER CA 1 1 6 1355 1 1 2 SER CB C 4.176 2.980 -3.794 1.00 . A A . 2 SER CB 1 1 6 1356 1 1 2 SER H H 2.169 0.883 -3.967 1.00 . A A . 2 SER H 1 1 6 1357 1 1 2 SER HA H 2.664 3.308 -2.321 1.00 . A A . 2 SER HA 1 1 6 1358 1 1 2 SER HB2 H 4.771 2.175 -3.365 1.00 . A A . 2 SER HB2 1 1 6 1359 1 1 2 SER HB3 H 4.194 2.890 -4.880 1.00 . A A . 2 SER HB3 1 1 6 1360 1 1 2 SER HG H 4.093 4.912 -3.592 1.00 . A A . 2 SER HG 1 1 6 1361 1 1 2 SER N N 2.440 1.415 -3.154 1.00 . A A . 2 SER N 1 1 6 1362 1 1 2 SER O O 1.805 4.846 -4.221 1.00 . A A . 2 SER O 1 1 6 1363 1 1 2 SER OG O 4.731 4.227 -3.415 1.00 . A A . 2 SER OG 1 1 6 1364 1 1 3 ARG C C -0.939 4.215 -5.786 1.00 . A A . 3 ARG C 1 1 6 1365 1 1 3 ARG CA C 0.371 3.550 -6.207 1.00 . A A . 3 ARG CA 1 1 6 1366 1 1 3 ARG CB C 0.171 2.571 -7.370 1.00 . A A . 3 ARG CB 1 1 6 1367 1 1 3 ARG CD C 2.624 2.613 -8.024 1.00 . A A . 3 ARG CD 1 1 6 1368 1 1 3 ARG CG C 1.398 1.749 -7.762 1.00 . A A . 3 ARG CG 1 1 6 1369 1 1 3 ARG CZ C 4.352 2.676 -9.797 1.00 . A A . 3 ARG CZ 1 1 6 1370 1 1 3 ARG H H 1.139 1.904 -5.081 1.00 . A A . 3 ARG H 1 1 6 1371 1 1 3 ARG HA H 0.988 4.373 -6.564 1.00 . A A . 3 ARG HA 1 1 6 1372 1 1 3 ARG HB2 H -0.620 1.870 -7.113 1.00 . A A . 3 ARG HB2 1 1 6 1373 1 1 3 ARG HB3 H -0.157 3.140 -8.239 1.00 . A A . 3 ARG HB3 1 1 6 1374 1 1 3 ARG HD2 H 2.285 3.581 -8.389 1.00 . A A . 3 ARG HD2 1 1 6 1375 1 1 3 ARG HD3 H 3.158 2.769 -7.085 1.00 . A A . 3 ARG HD3 1 1 6 1376 1 1 3 ARG HE H 3.506 1.002 -9.090 1.00 . A A . 3 ARG HE 1 1 6 1377 1 1 3 ARG HG2 H 1.629 1.040 -6.968 1.00 . A A . 3 ARG HG2 1 1 6 1378 1 1 3 ARG HG3 H 1.161 1.188 -8.665 1.00 . A A . 3 ARG HG3 1 1 6 1379 1 1 3 ARG HH11 H 3.889 4.523 -9.134 1.00 . A A . 3 ARG HH11 1 1 6 1380 1 1 3 ARG HH12 H 5.085 4.448 -10.415 1.00 . A A . 3 ARG HH12 1 1 6 1381 1 1 3 ARG HH21 H 5.034 0.999 -10.677 1.00 . A A . 3 ARG HH21 1 1 6 1382 1 1 3 ARG HH22 H 5.736 2.503 -11.251 1.00 . A A . 3 ARG HH22 1 1 6 1383 1 1 3 ARG N N 1.113 2.911 -5.123 1.00 . A A . 3 ARG N 1 1 6 1384 1 1 3 ARG NE N 3.524 2.007 -9.004 1.00 . A A . 3 ARG NE 1 1 6 1385 1 1 3 ARG NH1 N 4.448 3.991 -9.781 1.00 . A A . 3 ARG NH1 1 1 6 1386 1 1 3 ARG NH2 N 5.105 2.005 -10.643 1.00 . A A . 3 ARG NH2 1 1 6 1387 1 1 3 ARG O O -0.973 5.428 -5.586 1.00 . A A . 3 ARG O 1 1 6 1388 1 1 4 GLY C C -3.402 3.833 -3.726 1.00 . A A . 4 GLY C 1 1 6 1389 1 1 4 GLY CA C -3.290 3.968 -5.231 1.00 . A A . 4 GLY CA 1 1 6 1390 1 1 4 GLY H H -1.940 2.457 -5.892 1.00 . A A . 4 GLY H 1 1 6 1391 1 1 4 GLY HA2 H -3.360 5.023 -5.496 1.00 . A A . 4 GLY HA2 1 1 6 1392 1 1 4 GLY HA3 H -4.107 3.422 -5.704 1.00 . A A . 4 GLY HA3 1 1 6 1393 1 1 4 GLY N N -2.013 3.441 -5.682 1.00 . A A . 4 GLY N 1 1 6 1394 1 1 4 GLY O O -2.402 3.523 -3.085 1.00 . A A . 4 GLY O 1 1 6 1395 1 1 5 TRP C C -5.372 2.879 -1.059 1.00 . A A . 5 TRP C 1 1 6 1396 1 1 5 TRP CA C -4.750 4.115 -1.706 1.00 . A A . 5 TRP CA 1 1 6 1397 1 1 5 TRP CB C -5.623 5.319 -1.343 1.00 . A A . 5 TRP CB 1 1 6 1398 1 1 5 TRP CD1 C -6.433 7.047 -3.057 1.00 . A A . 5 TRP CD1 1 1 6 1399 1 1 5 TRP CD2 C -4.291 7.276 -2.494 1.00 . A A . 5 TRP CD2 1 1 6 1400 1 1 5 TRP CE2 C -4.630 8.304 -3.404 1.00 . A A . 5 TRP CE2 1 1 6 1401 1 1 5 TRP CE3 C -2.962 7.174 -2.064 1.00 . A A . 5 TRP CE3 1 1 6 1402 1 1 5 TRP CG C -5.472 6.494 -2.263 1.00 . A A . 5 TRP CG 1 1 6 1403 1 1 5 TRP CH2 C -2.412 9.155 -3.374 1.00 . A A . 5 TRP CH2 1 1 6 1404 1 1 5 TRP CZ2 C -3.699 9.254 -3.838 1.00 . A A . 5 TRP CZ2 1 1 6 1405 1 1 5 TRP CZ3 C -2.034 8.121 -2.495 1.00 . A A . 5 TRP CZ3 1 1 6 1406 1 1 5 TRP H H -5.380 4.298 -3.725 1.00 . A A . 5 TRP H 1 1 6 1407 1 1 5 TRP HA H -3.767 4.268 -1.262 1.00 . A A . 5 TRP HA 1 1 6 1408 1 1 5 TRP HB2 H -6.667 5.006 -1.350 1.00 . A A . 5 TRP HB2 1 1 6 1409 1 1 5 TRP HB3 H -5.371 5.636 -0.332 1.00 . A A . 5 TRP HB3 1 1 6 1410 1 1 5 TRP HD1 H -7.447 6.684 -3.127 1.00 . A A . 5 TRP HD1 1 1 6 1411 1 1 5 TRP HE1 H -6.486 8.679 -4.392 1.00 . A A . 5 TRP HE1 1 1 6 1412 1 1 5 TRP HE3 H -2.662 6.360 -1.422 1.00 . A A . 5 TRP HE3 1 1 6 1413 1 1 5 TRP HH2 H -1.673 9.875 -3.694 1.00 . A A . 5 TRP HH2 1 1 6 1414 1 1 5 TRP HZ2 H -3.982 10.036 -4.527 1.00 . A A . 5 TRP HZ2 1 1 6 1415 1 1 5 TRP HZ3 H -1.009 8.053 -2.159 1.00 . A A . 5 TRP HZ3 1 1 6 1416 1 1 5 TRP N N -4.581 4.064 -3.156 1.00 . A A . 5 TRP N 1 1 6 1417 1 1 5 TRP NE1 N -5.945 8.126 -3.745 1.00 . A A . 5 TRP NE1 1 1 6 1418 1 1 5 TRP O O -6.119 2.141 -1.703 1.00 . A A . 5 TRP O 1 1 6 1419 1 1 6 GLY C C -5.032 1.076 2.168 1.00 . A A . 6 GLY C 1 1 6 1420 1 1 6 GLY CA C -5.813 1.686 1.019 1.00 . A A . 6 GLY CA 1 1 6 1421 1 1 6 GLY H H -4.371 3.206 0.680 1.00 . A A . 6 GLY H 1 1 6 1422 1 1 6 GLY HA2 H -6.700 2.164 1.431 1.00 . A A . 6 GLY HA2 1 1 6 1423 1 1 6 GLY HA3 H -6.144 0.880 0.364 1.00 . A A . 6 GLY HA3 1 1 6 1424 1 1 6 GLY N N -5.091 2.665 0.223 1.00 . A A . 6 GLY N 1 1 6 1425 1 1 6 GLY O O -4.471 1.789 2.997 1.00 . A A . 6 GLY O 1 1 6 1426 1 1 7 PHE C C -2.780 -0.915 2.897 1.00 . A A . 7 PHE C 1 1 6 1427 1 1 7 PHE CA C -4.272 -1.014 3.225 1.00 . A A . 7 PHE CA 1 1 6 1428 1 1 7 PHE CB C -4.791 -2.458 3.216 1.00 . A A . 7 PHE CB 1 1 6 1429 1 1 7 PHE CD1 C -6.856 -1.803 4.533 1.00 . A A . 7 PHE CD1 1 1 6 1430 1 1 7 PHE CD2 C -5.892 -3.965 4.890 1.00 . A A . 7 PHE CD2 1 1 6 1431 1 1 7 PHE CE1 C -7.842 -2.081 5.477 1.00 . A A . 7 PHE CE1 1 1 6 1432 1 1 7 PHE CE2 C -6.888 -4.262 5.818 1.00 . A A . 7 PHE CE2 1 1 6 1433 1 1 7 PHE CG C -5.867 -2.738 4.234 1.00 . A A . 7 PHE CG 1 1 6 1434 1 1 7 PHE CZ C -7.862 -3.316 6.117 1.00 . A A . 7 PHE CZ 1 1 6 1435 1 1 7 PHE H H -5.496 -0.777 1.507 1.00 . A A . 7 PHE H 1 1 6 1436 1 1 7 PHE HA H -4.433 -0.574 4.210 1.00 . A A . 7 PHE HA 1 1 6 1437 1 1 7 PHE HB2 H -5.183 -2.680 2.225 1.00 . A A . 7 PHE HB2 1 1 6 1438 1 1 7 PHE HB3 H -3.969 -3.148 3.404 1.00 . A A . 7 PHE HB3 1 1 6 1439 1 1 7 PHE HD1 H -6.861 -0.844 4.037 1.00 . A A . 7 PHE HD1 1 1 6 1440 1 1 7 PHE HD2 H -5.135 -4.705 4.673 1.00 . A A . 7 PHE HD2 1 1 6 1441 1 1 7 PHE HE1 H -8.585 -1.336 5.718 1.00 . A A . 7 PHE HE1 1 1 6 1442 1 1 7 PHE HE2 H -6.902 -5.225 6.307 1.00 . A A . 7 PHE HE2 1 1 6 1443 1 1 7 PHE HZ H -8.627 -3.536 6.848 1.00 . A A . 7 PHE HZ 1 1 6 1444 1 1 7 PHE N N -5.010 -0.252 2.219 1.00 . A A . 7 PHE N 1 1 6 1445 1 1 7 PHE O O -2.385 -0.035 2.139 1.00 . A A . 7 PHE O 1 1 6 1446 1 1 8 GLU C C 0.222 -0.638 3.719 1.00 . A A . 8 GLU C 1 1 6 1447 1 1 8 GLU CA C -0.500 -1.860 3.165 1.00 . A A . 8 GLU CA 1 1 6 1448 1 1 8 GLU CB C -0.250 -1.990 1.646 1.00 . A A . 8 GLU CB 1 1 6 1449 1 1 8 GLU CD C 1.471 -2.211 -0.162 1.00 . A A . 8 GLU CD 1 1 6 1450 1 1 8 GLU CG C 1.211 -2.341 1.318 1.00 . A A . 8 GLU CG 1 1 6 1451 1 1 8 GLU H H -2.315 -2.508 4.080 1.00 . A A . 8 GLU H 1 1 6 1452 1 1 8 GLU HA H -0.093 -2.740 3.665 1.00 . A A . 8 GLU HA 1 1 6 1453 1 1 8 GLU HB2 H -0.907 -2.757 1.231 1.00 . A A . 8 GLU HB2 1 1 6 1454 1 1 8 GLU HB3 H -0.507 -1.046 1.164 1.00 . A A . 8 GLU HB3 1 1 6 1455 1 1 8 GLU HG2 H 1.882 -1.666 1.850 1.00 . A A . 8 GLU HG2 1 1 6 1456 1 1 8 GLU HG3 H 1.432 -3.361 1.640 1.00 . A A . 8 GLU HG3 1 1 6 1457 1 1 8 GLU N N -1.943 -1.817 3.449 1.00 . A A . 8 GLU N 1 1 6 1458 1 1 8 GLU O O -0.199 0.489 3.559 1.00 . A A . 8 GLU O 1 1 6 1459 1 1 8 GLU OE1 O 1.241 -3.095 -0.962 1.00 . A A . 8 GLU OE1 1 1 6 1460 1 1 9 PRO C C 2.722 0.978 3.426 1.00 . A A . 9 PRO C 1 1 6 1461 1 1 9 PRO CA C 2.221 0.345 4.721 1.00 . A A . 9 PRO CA 1 1 6 1462 1 1 9 PRO CB C 3.339 -0.261 5.571 1.00 . A A . 9 PRO CB 1 1 6 1463 1 1 9 PRO CD C 1.994 -2.085 4.811 1.00 . A A . 9 PRO CD 1 1 6 1464 1 1 9 PRO CG C 3.413 -1.686 5.123 1.00 . A A . 9 PRO CG 1 1 6 1465 1 1 9 PRO HA H 1.651 1.076 5.296 1.00 . A A . 9 PRO HA 1 1 6 1466 1 1 9 PRO HB2 H 4.284 0.253 5.392 1.00 . A A . 9 PRO HB2 1 1 6 1467 1 1 9 PRO HB3 H 3.071 -0.215 6.627 1.00 . A A . 9 PRO HB3 1 1 6 1468 1 1 9 PRO HD2 H 1.983 -2.820 4.007 1.00 . A A . 9 PRO HD2 1 1 6 1469 1 1 9 PRO HD3 H 1.495 -2.471 5.701 1.00 . A A . 9 PRO HD3 1 1 6 1470 1 1 9 PRO HG2 H 4.025 -1.761 4.225 1.00 . A A . 9 PRO HG2 1 1 6 1471 1 1 9 PRO HG3 H 3.820 -2.314 5.915 1.00 . A A . 9 PRO HG3 1 1 6 1472 1 1 9 PRO N N 1.383 -0.811 4.392 1.00 . A A . 9 PRO N 1 1 6 1473 1 1 9 PRO O O 3.327 0.310 2.586 1.00 . A A . 9 PRO O 1 1 6 1474 1 1 10 GLY C C 1.167 3.261 1.371 1.00 . A A . 10 GLY C 1 1 6 1475 1 1 10 GLY CA C 2.523 2.908 1.955 1.00 . A A . 10 GLY CA 1 1 6 1476 1 1 10 GLY H H 1.971 2.774 3.998 1.00 . A A . 10 GLY H 1 1 6 1477 1 1 10 GLY HA2 H 3.091 3.829 2.072 1.00 . A A . 10 GLY HA2 1 1 6 1478 1 1 10 GLY HA3 H 3.052 2.259 1.259 1.00 . A A . 10 GLY HA3 1 1 6 1479 1 1 10 GLY N N 2.401 2.255 3.246 1.00 . A A . 10 GLY N 1 1 6 1480 1 1 10 GLY O O 1.081 4.011 0.400 1.00 . A A . 10 GLY O 1 1 6 1481 1 1 11 VAL C C -1.657 2.763 0.278 1.00 . A A . 11 VAL C 1 1 6 1482 1 1 11 VAL CA C -1.272 3.114 1.711 1.00 . A A . 11 VAL CA 1 1 6 1483 1 1 11 VAL CB C -1.561 4.606 2.006 1.00 . A A . 11 VAL CB 1 1 6 1484 1 1 11 VAL CG1 C -3.057 4.898 1.924 1.00 . A A . 11 VAL CG1 1 1 6 1485 1 1 11 VAL CG2 C -1.061 4.988 3.401 1.00 . A A . 11 VAL CG2 1 1 6 1486 1 1 11 VAL H H 0.265 2.059 2.723 1.00 . A A . 11 VAL H 1 1 6 1487 1 1 11 VAL HA H -1.909 2.525 2.370 1.00 . A A . 11 VAL HA 1 1 6 1488 1 1 11 VAL HB H -1.043 5.225 1.274 1.00 . A A . 11 VAL HB 1 1 6 1489 1 1 11 VAL HG11 H -3.246 5.932 2.212 1.00 . A A . 11 VAL HG11 1 1 6 1490 1 1 11 VAL HG12 H -3.402 4.753 0.902 1.00 . A A . 11 VAL HG12 1 1 6 1491 1 1 11 VAL HG13 H -3.603 4.234 2.594 1.00 . A A . 11 VAL HG13 1 1 6 1492 1 1 11 VAL HG21 H -1.474 4.304 4.142 1.00 . A A . 11 VAL HG21 1 1 6 1493 1 1 11 VAL HG22 H 0.028 4.939 3.429 1.00 . A A . 11 VAL HG22 1 1 6 1494 1 1 11 VAL HG23 H -1.370 6.006 3.636 1.00 . A A . 11 VAL HG23 1 1 6 1495 1 1 11 VAL N N 0.113 2.744 1.995 1.00 . A A . 11 VAL N 1 1 6 1496 1 1 11 VAL O O -1.715 3.623 -0.596 1.00 . A A . 11 VAL O 1 1 6 1497 1 1 12 ARG C C -3.265 -0.312 -0.927 1.00 . A A . 12 ARG C 1 1 6 1498 1 1 12 ARG CA C -2.405 0.918 -1.198 1.00 . A A . 12 ARG CA 1 1 6 1499 1 1 12 ARG CB C -1.207 0.525 -2.068 1.00 . A A . 12 ARG CB 1 1 6 1500 1 1 12 ARG CD C -2.489 0.297 -4.260 1.00 . A A . 12 ARG CD 1 1 6 1501 1 1 12 ARG CG C -1.520 -0.350 -3.280 1.00 . A A . 12 ARG CG 1 1 6 1502 1 1 12 ARG CZ C -2.524 -0.993 -6.384 1.00 . A A . 12 ARG CZ 1 1 6 1503 1 1 12 ARG H H -1.848 0.848 0.851 1.00 . A A . 12 ARG H 1 1 6 1504 1 1 12 ARG HA H -2.996 1.667 -1.725 1.00 . A A . 12 ARG HA 1 1 6 1505 1 1 12 ARG HB2 H -0.714 1.437 -2.407 1.00 . A A . 12 ARG HB2 1 1 6 1506 1 1 12 ARG HB3 H -0.505 -0.020 -1.438 1.00 . A A . 12 ARG HB3 1 1 6 1507 1 1 12 ARG HD2 H -3.495 -0.077 -4.064 1.00 . A A . 12 ARG HD2 1 1 6 1508 1 1 12 ARG HD3 H -2.489 1.371 -4.083 1.00 . A A . 12 ARG HD3 1 1 6 1509 1 1 12 ARG HE H -1.556 0.738 -6.114 1.00 . A A . 12 ARG HE 1 1 6 1510 1 1 12 ARG HG2 H -0.586 -0.563 -3.799 1.00 . A A . 12 ARG HG2 1 1 6 1511 1 1 12 ARG HG3 H -1.945 -1.294 -2.939 1.00 . A A . 12 ARG HG3 1 1 6 1512 1 1 12 ARG HH11 H -3.591 -1.948 -4.960 1.00 . A A . 12 ARG HH11 1 1 6 1513 1 1 12 ARG HH12 H -3.512 -2.743 -6.518 1.00 . A A . 12 ARG HH12 1 1 6 1514 1 1 12 ARG HH21 H -1.595 -0.306 -8.035 1.00 . A A . 12 ARG HH21 1 1 6 1515 1 1 12 ARG HH22 H -2.424 -1.846 -8.203 1.00 . A A . 12 ARG HH22 1 1 6 1516 1 1 12 ARG N N -1.936 1.480 0.067 1.00 . A A . 12 ARG N 1 1 6 1517 1 1 12 ARG NE N -2.136 0.050 -5.660 1.00 . A A . 12 ARG NE 1 1 6 1518 1 1 12 ARG NH1 N -3.267 -1.974 -5.915 1.00 . A A . 12 ARG NH1 1 1 6 1519 1 1 12 ARG NH2 N -2.146 -1.054 -7.644 1.00 . A A . 12 ARG NH2 1 1 6 1520 1 1 12 ARG O O -2.794 -1.288 -0.345 1.00 . A A . 12 ARG O 1 1 6 1521 1 1 13 CYS C C -4.676 -2.545 -2.220 1.00 . A A . 13 CYS C 1 1 6 1522 1 1 13 CYS CA C -5.347 -1.492 -1.341 1.00 . A A . 13 CYS CA 1 1 6 1523 1 1 13 CYS CB C -6.760 -1.189 -1.845 1.00 . A A . 13 CYS CB 1 1 6 1524 1 1 13 CYS H H -4.896 0.550 -1.779 1.00 . A A . 13 CYS H 1 1 6 1525 1 1 13 CYS HA H -5.393 -1.865 -0.318 1.00 . A A . 13 CYS HA 1 1 6 1526 1 1 13 CYS HB2 H -7.181 -0.379 -1.250 1.00 . A A . 13 CYS HB2 1 1 6 1527 1 1 13 CYS HB3 H -6.695 -0.859 -2.881 1.00 . A A . 13 CYS HB3 1 1 6 1528 1 1 13 CYS N N -4.514 -0.294 -1.380 1.00 . A A . 13 CYS N 1 1 6 1529 1 1 13 CYS O O -4.556 -2.354 -3.430 1.00 . A A . 13 CYS O 1 1 6 1530 1 1 13 CYS SG S -7.903 -2.606 -1.770 1.00 . A A . 13 CYS SG 1 1 6 1531 1 1 14 LEU C C -4.119 -6.017 -2.124 1.00 . A A . 14 LEU C 1 1 6 1532 1 1 14 LEU CA C -3.451 -4.657 -2.310 1.00 . A A . 14 LEU CA 1 1 6 1533 1 1 14 LEU CB C -2.011 -4.659 -1.786 1.00 . A A . 14 LEU CB 1 1 6 1534 1 1 14 LEU CD1 C -0.996 -6.688 -2.938 1.00 . A A . 14 LEU CD1 1 1 6 1535 1 1 14 LEU CD2 C -0.746 -4.424 -3.959 1.00 . A A . 14 LEU CD2 1 1 6 1536 1 1 14 LEU CG C -0.867 -5.199 -2.651 1.00 . A A . 14 LEU CG 1 1 6 1537 1 1 14 LEU H H -4.306 -3.720 -0.607 1.00 . A A . 14 LEU H 1 1 6 1538 1 1 14 LEU HA H -3.446 -4.425 -3.376 1.00 . A A . 14 LEU HA 1 1 6 1539 1 1 14 LEU HB2 H -1.757 -3.627 -1.547 1.00 . A A . 14 LEU HB2 1 1 6 1540 1 1 14 LEU HB3 H -1.995 -5.206 -0.844 1.00 . A A . 14 LEU HB3 1 1 6 1541 1 1 14 LEU HD11 H -1.903 -6.881 -3.512 1.00 . A A . 14 LEU HD11 1 1 6 1542 1 1 14 LEU HD12 H -0.132 -7.023 -3.510 1.00 . A A . 14 LEU HD12 1 1 6 1543 1 1 14 LEU HD13 H -1.034 -7.238 -1.999 1.00 . A A . 14 LEU HD13 1 1 6 1544 1 1 14 LEU HD21 H -1.610 -4.622 -4.592 1.00 . A A . 14 LEU HD21 1 1 6 1545 1 1 14 LEU HD22 H -0.685 -3.357 -3.746 1.00 . A A . 14 LEU HD22 1 1 6 1546 1 1 14 LEU HD23 H 0.159 -4.736 -4.479 1.00 . A A . 14 LEU HD23 1 1 6 1547 1 1 14 LEU HG H 0.053 -5.050 -2.089 1.00 . A A . 14 LEU HG 1 1 6 1548 1 1 14 LEU N N -4.197 -3.621 -1.605 1.00 . A A . 14 LEU N 1 1 6 1549 1 1 14 LEU O O -4.400 -6.721 -3.094 1.00 . A A . 14 LEU O 1 1 6 1550 1 1 15 ILE C C -6.413 -7.188 0.164 1.00 . A A . 15 ILE C 1 1 6 1551 1 1 15 ILE CA C -5.122 -7.590 -0.539 1.00 . A A . 15 ILE CA 1 1 6 1552 1 1 15 ILE CB C -4.315 -8.529 0.386 1.00 . A A . 15 ILE CB 1 1 6 1553 1 1 15 ILE CD1 C -2.001 -9.621 0.659 1.00 . A A . 15 ILE CD1 1 1 6 1554 1 1 15 ILE CG1 C -2.942 -8.826 -0.227 1.00 . A A . 15 ILE CG1 1 1 6 1555 1 1 15 ILE CG2 C -5.104 -9.815 0.628 1.00 . A A . 15 ILE CG2 1 1 6 1556 1 1 15 ILE H H -4.089 -5.781 -0.111 1.00 . A A . 15 ILE H 1 1 6 1557 1 1 15 ILE HA H -5.363 -8.123 -1.459 1.00 . A A . 15 ILE HA 1 1 6 1558 1 1 15 ILE HB H -4.162 -8.028 1.342 1.00 . A A . 15 ILE HB 1 1 6 1559 1 1 15 ILE HD11 H -2.375 -10.637 0.781 1.00 . A A . 15 ILE HD11 1 1 6 1560 1 1 15 ILE HD12 H -1.015 -9.657 0.194 1.00 . A A . 15 ILE HD12 1 1 6 1561 1 1 15 ILE HD13 H -1.922 -9.139 1.633 1.00 . A A . 15 ILE HD13 1 1 6 1562 1 1 15 ILE HG12 H -3.088 -9.363 -1.163 1.00 . A A . 15 ILE HG12 1 1 6 1563 1 1 15 ILE HG13 H -2.451 -7.882 -0.457 1.00 . A A . 15 ILE HG13 1 1 6 1564 1 1 15 ILE HG21 H -5.273 -10.332 -0.317 1.00 . A A . 15 ILE HG21 1 1 6 1565 1 1 15 ILE HG22 H -4.556 -10.468 1.307 1.00 . A A . 15 ILE HG22 1 1 6 1566 1 1 15 ILE HG23 H -6.064 -9.572 1.082 1.00 . A A . 15 ILE HG23 1 1 6 1567 1 1 15 ILE N N -4.389 -6.372 -0.872 1.00 . A A . 15 ILE N 1 1 6 1568 1 1 15 ILE O O -6.365 -6.575 1.230 1.00 . A A . 15 ILE O 1 1 6 1569 1 1 16 TRP C C -8.959 -6.227 1.166 1.00 . A A . 16 TRP C 1 1 6 1570 1 1 16 TRP CA C -8.889 -7.228 0.014 1.00 . A A . 16 TRP CA 1 1 6 1571 1 1 16 TRP CB C -9.645 -8.515 0.372 1.00 . A A . 16 TRP CB 1 1 6 1572 1 1 16 TRP CD1 C -8.485 -10.794 0.546 1.00 . A A . 16 TRP CD1 1 1 6 1573 1 1 16 TRP CD2 C -8.976 -10.206 -1.544 1.00 . A A . 16 TRP CD2 1 1 6 1574 1 1 16 TRP CE2 C -8.302 -11.449 -1.569 1.00 . A A . 16 TRP CE2 1 1 6 1575 1 1 16 TRP CE3 C -9.360 -9.628 -2.762 1.00 . A A . 16 TRP CE3 1 1 6 1576 1 1 16 TRP CG C -9.054 -9.786 -0.172 1.00 . A A . 16 TRP CG 1 1 6 1577 1 1 16 TRP CH2 C -8.388 -11.525 -3.944 1.00 . A A . 16 TRP CH2 1 1 6 1578 1 1 16 TRP CZ2 C -7.996 -12.108 -2.765 1.00 . A A . 16 TRP CZ2 1 1 6 1579 1 1 16 TRP CZ3 C -9.069 -10.293 -3.953 1.00 . A A . 16 TRP CZ3 1 1 6 1580 1 1 16 TRP H H -7.468 -8.019 -1.339 1.00 . A A . 16 TRP H 1 1 6 1581 1 1 16 TRP HA H -9.428 -6.774 -0.817 1.00 . A A . 16 TRP HA 1 1 6 1582 1 1 16 TRP HB2 H -9.699 -8.610 1.455 1.00 . A A . 16 TRP HB2 1 1 6 1583 1 1 16 TRP HB3 H -10.665 -8.423 -0.003 1.00 . A A . 16 TRP HB3 1 1 6 1584 1 1 16 TRP HD1 H -8.396 -10.795 1.622 1.00 . A A . 16 TRP HD1 1 1 6 1585 1 1 16 TRP HE1 H -7.570 -12.632 0.052 1.00 . A A . 16 TRP HE1 1 1 6 1586 1 1 16 TRP HE3 H -9.866 -8.674 -2.777 1.00 . A A . 16 TRP HE3 1 1 6 1587 1 1 16 TRP HH2 H -8.165 -12.016 -4.881 1.00 . A A . 16 TRP HH2 1 1 6 1588 1 1 16 TRP HZ2 H -7.458 -13.044 -2.760 1.00 . A A . 16 TRP HZ2 1 1 6 1589 1 1 16 TRP HZ3 H -9.363 -9.854 -4.895 1.00 . A A . 16 TRP HZ3 1 1 6 1590 1 1 16 TRP N N -7.538 -7.523 -0.461 1.00 . A A . 16 TRP N 1 1 6 1591 1 1 16 TRP NE1 N -8.032 -11.794 -0.272 1.00 . A A . 16 TRP NE1 1 1 6 1592 1 1 16 TRP O O -9.092 -6.587 2.337 1.00 . A A . 16 TRP O 1 1 6 1593 1 1 17 CYS C C -10.320 -3.694 2.366 1.00 . A A . 17 CYS C 1 1 6 1594 1 1 17 CYS CA C -8.908 -3.882 1.816 1.00 . A A . 17 CYS CA 1 1 6 1595 1 1 17 CYS CB C -8.387 -2.580 1.206 1.00 . A A . 17 CYS CB 1 1 6 1596 1 1 17 CYS H H -8.746 -4.691 -0.146 1.00 . A A . 17 CYS H 1 1 6 1597 1 1 17 CYS HA H -8.258 -4.150 2.648 1.00 . A A . 17 CYS HA 1 1 6 1598 1 1 17 CYS HB2 H -8.486 -1.783 1.943 1.00 . A A . 17 CYS HB2 1 1 6 1599 1 1 17 CYS HB3 H -7.330 -2.715 0.984 1.00 . A A . 17 CYS HB3 1 1 6 1600 1 1 17 CYS N N -8.856 -4.948 0.824 1.00 . A A . 17 CYS N 1 1 6 1601 1 1 17 CYS O O -11.303 -4.186 1.813 1.00 . A A . 17 CYS O 1 1 6 1602 1 1 17 CYS SG S -9.227 -2.070 -0.327 1.00 . A A . 17 CYS SG 1 1 6 1603 1 1 18 ASP C C -12.918 -3.056 3.436 1.00 . A A . 18 ASP C 1 1 6 1604 1 1 18 ASP CA C -11.661 -2.674 4.204 1.00 . A A . 18 ASP CA 1 1 6 1605 1 1 18 ASP CB C -11.706 -1.194 4.626 1.00 . A A . 18 ASP CB 1 1 6 1606 1 1 18 ASP CG C -12.896 -0.936 5.514 1.00 . A A . 18 ASP CG 1 1 6 1607 1 1 18 ASP H H -9.557 -2.583 3.884 1.00 . A A . 18 ASP H 1 1 6 1608 1 1 18 ASP HA H -11.687 -3.288 5.106 1.00 . A A . 18 ASP HA 1 1 6 1609 1 1 18 ASP HB2 H -10.794 -0.932 5.165 1.00 . A A . 18 ASP HB2 1 1 6 1610 1 1 18 ASP HB3 H -11.773 -0.562 3.740 1.00 . A A . 18 ASP HB3 1 1 6 1611 1 1 18 ASP N N -10.405 -2.966 3.495 1.00 . A A . 18 ASP N 1 1 6 1612 1 1 18 ASP O O -13.601 -2.189 2.925 1.00 . A A . 18 ASP O 1 1 6 1613 1 1 18 ASP OD1 O -13.374 -1.871 6.124 1.00 . A A . 18 ASP OD1 1 1 6 1614 1 1 18 ASP OD2 O -13.322 0.196 5.603 1.00 . A A . 18 ASP OD2 1 1 7 1615 1 1 1 GLY C C 2.142 0.852 -2.162 1.00 . A A . 1 GLY C 1 1 7 1616 1 1 1 GLY CA C 2.280 -0.627 -1.860 1.00 . A A . 1 GLY CA 1 1 7 1617 1 1 1 GLY H1 H 2.472 -0.054 0.177 1.00 . A A . 1 GLY H1 1 1 7 1618 1 1 1 GLY HA2 H 3.230 -0.987 -2.257 1.00 . A A . 1 GLY HA2 1 1 7 1619 1 1 1 GLY HA3 H 1.462 -1.171 -2.333 1.00 . A A . 1 GLY HA3 1 1 7 1620 1 1 1 GLY N N 2.242 -0.834 -0.421 1.00 . A A . 1 GLY N 1 1 7 1621 1 1 1 GLY O O 2.231 1.656 -1.236 1.00 . A A . 1 GLY O 1 1 7 1622 1 1 2 SER C C 0.922 3.032 -4.911 1.00 . A A . 2 SER C 1 1 7 1623 1 1 2 SER CA C 1.882 2.639 -3.790 1.00 . A A . 2 SER CA 1 1 7 1624 1 1 2 SER CB C 3.281 3.069 -4.225 1.00 . A A . 2 SER CB 1 1 7 1625 1 1 2 SER H H 1.898 0.537 -4.157 1.00 . A A . 2 SER H 1 1 7 1626 1 1 2 SER HA H 1.611 3.219 -2.907 1.00 . A A . 2 SER HA 1 1 7 1627 1 1 2 SER HB2 H 3.559 2.490 -5.106 1.00 . A A . 2 SER HB2 1 1 7 1628 1 1 2 SER HB3 H 3.252 4.124 -4.486 1.00 . A A . 2 SER HB3 1 1 7 1629 1 1 2 SER HG H 5.030 3.320 -3.411 1.00 . A A . 2 SER HG 1 1 7 1630 1 1 2 SER N N 1.945 1.226 -3.422 1.00 . A A . 2 SER N 1 1 7 1631 1 1 2 SER O O 1.017 4.132 -5.453 1.00 . A A . 2 SER O 1 1 7 1632 1 1 2 SER OG O 4.229 2.852 -3.194 1.00 . A A . 2 SER OG 1 1 7 1633 1 1 3 ARG C C -2.233 3.139 -5.660 1.00 . A A . 3 ARG C 1 1 7 1634 1 1 3 ARG CA C -1.019 2.441 -6.269 1.00 . A A . 3 ARG CA 1 1 7 1635 1 1 3 ARG CB C -1.412 1.182 -7.051 1.00 . A A . 3 ARG CB 1 1 7 1636 1 1 3 ARG CD C 0.667 1.254 -8.498 1.00 . A A . 3 ARG CD 1 1 7 1637 1 1 3 ARG CG C -0.254 0.392 -7.648 1.00 . A A . 3 ARG CG 1 1 7 1638 1 1 3 ARG CZ C 1.107 0.076 -10.639 1.00 . A A . 3 ARG CZ 1 1 7 1639 1 1 3 ARG H H 0.066 1.205 -4.900 1.00 . A A . 3 ARG H 1 1 7 1640 1 1 3 ARG HA H -0.600 3.163 -6.968 1.00 . A A . 3 ARG HA 1 1 7 1641 1 1 3 ARG HB2 H -1.960 0.511 -6.390 1.00 . A A . 3 ARG HB2 1 1 7 1642 1 1 3 ARG HB3 H -2.081 1.479 -7.858 1.00 . A A . 3 ARG HB3 1 1 7 1643 1 1 3 ARG HD2 H 0.066 1.973 -9.053 1.00 . A A . 3 ARG HD2 1 1 7 1644 1 1 3 ARG HD3 H 1.329 1.811 -7.833 1.00 . A A . 3 ARG HD3 1 1 7 1645 1 1 3 ARG HE H 2.388 0.171 -9.103 1.00 . A A . 3 ARG HE 1 1 7 1646 1 1 3 ARG HG2 H 0.331 -0.060 -6.846 1.00 . A A . 3 ARG HG2 1 1 7 1647 1 1 3 ARG HG3 H -0.664 -0.408 -8.263 1.00 . A A . 3 ARG HG3 1 1 7 1648 1 1 3 ARG HH11 H -0.707 0.953 -10.637 1.00 . A A . 3 ARG HH11 1 1 7 1649 1 1 3 ARG HH12 H -0.280 0.080 -12.099 1.00 . A A . 3 ARG HH12 1 1 7 1650 1 1 3 ARG HH21 H 2.832 -0.906 -10.969 1.00 . A A . 3 ARG HH21 1 1 7 1651 1 1 3 ARG HH22 H 1.666 -0.950 -12.281 1.00 . A A . 3 ARG HH22 1 1 7 1652 1 1 3 ARG N N 0.020 2.132 -5.289 1.00 . A A . 3 ARG N 1 1 7 1653 1 1 3 ARG NE N 1.473 0.453 -9.420 1.00 . A A . 3 ARG NE 1 1 7 1654 1 1 3 ARG NH1 N -0.058 0.394 -11.167 1.00 . A A . 3 ARG NH1 1 1 7 1655 1 1 3 ARG NH2 N 1.935 -0.657 -11.355 1.00 . A A . 3 ARG NH2 1 1 7 1656 1 1 3 ARG O O -2.246 4.364 -5.563 1.00 . A A . 3 ARG O 1 1 7 1657 1 1 4 GLY C C -4.208 3.038 -3.131 1.00 . A A . 4 GLY C 1 1 7 1658 1 1 4 GLY CA C -4.423 2.955 -4.630 1.00 . A A . 4 GLY CA 1 1 7 1659 1 1 4 GLY H H -3.215 1.380 -5.396 1.00 . A A . 4 GLY H 1 1 7 1660 1 1 4 GLY HA2 H -4.591 3.958 -5.018 1.00 . A A . 4 GLY HA2 1 1 7 1661 1 1 4 GLY HA3 H -5.299 2.339 -4.833 1.00 . A A . 4 GLY HA3 1 1 7 1662 1 1 4 GLY N N -3.254 2.381 -5.273 1.00 . A A . 4 GLY N 1 1 7 1663 1 1 4 GLY O O -3.074 2.911 -2.677 1.00 . A A . 4 GLY O 1 1 7 1664 1 1 5 TRP C C -5.605 2.274 -0.067 1.00 . A A . 5 TRP C 1 1 7 1665 1 1 5 TRP CA C -5.161 3.457 -0.921 1.00 . A A . 5 TRP CA 1 1 7 1666 1 1 5 TRP CB C -5.994 4.675 -0.515 1.00 . A A . 5 TRP CB 1 1 7 1667 1 1 5 TRP CD1 C -6.903 6.315 -2.260 1.00 . A A . 5 TRP CD1 1 1 7 1668 1 1 5 TRP CD2 C -4.740 6.588 -1.817 1.00 . A A . 5 TRP CD2 1 1 7 1669 1 1 5 TRP CE2 C -5.135 7.569 -2.755 1.00 . A A . 5 TRP CE2 1 1 7 1670 1 1 5 TRP CE3 C -3.388 6.507 -1.461 1.00 . A A . 5 TRP CE3 1 1 7 1671 1 1 5 TRP CG C -5.903 5.816 -1.484 1.00 . A A . 5 TRP CG 1 1 7 1672 1 1 5 TRP CH2 C -2.927 8.441 -2.868 1.00 . A A . 5 TRP CH2 1 1 7 1673 1 1 5 TRP CZ2 C -4.236 8.507 -3.274 1.00 . A A . 5 TRP CZ2 1 1 7 1674 1 1 5 TRP CZ3 C -2.492 7.446 -1.971 1.00 . A A . 5 TRP CZ3 1 1 7 1675 1 1 5 TRP H H -6.178 3.390 -2.787 1.00 . A A . 5 TRP H 1 1 7 1676 1 1 5 TRP HA H -4.117 3.668 -0.692 1.00 . A A . 5 TRP HA 1 1 7 1677 1 1 5 TRP HB2 H -7.037 4.372 -0.433 1.00 . A A . 5 TRP HB2 1 1 7 1678 1 1 5 TRP HB3 H -5.659 5.019 0.463 1.00 . A A . 5 TRP HB3 1 1 7 1679 1 1 5 TRP HD1 H -7.911 5.926 -2.276 1.00 . A A . 5 TRP HD1 1 1 7 1680 1 1 5 TRP HE1 H -7.037 7.868 -3.680 1.00 . A A . 5 TRP HE1 1 1 7 1681 1 1 5 TRP HE3 H -3.046 5.711 -0.815 1.00 . A A . 5 TRP HE3 1 1 7 1682 1 1 5 TRP HH2 H -2.214 9.159 -3.249 1.00 . A A . 5 TRP HH2 1 1 7 1683 1 1 5 TRP HZ2 H -4.561 9.255 -3.982 1.00 . A A . 5 TRP HZ2 1 1 7 1684 1 1 5 TRP HZ3 H -1.452 7.401 -1.684 1.00 . A A . 5 TRP HZ3 1 1 7 1685 1 1 5 TRP N N -5.270 3.266 -2.365 1.00 . A A . 5 TRP N 1 1 7 1686 1 1 5 TRP NE1 N -6.461 7.361 -3.026 1.00 . A A . 5 TRP NE1 1 1 7 1687 1 1 5 TRP O O -6.469 1.489 -0.462 1.00 . A A . 5 TRP O 1 1 7 1688 1 1 6 GLY C C -4.406 0.909 3.166 1.00 . A A . 6 GLY C 1 1 7 1689 1 1 6 GLY CA C -5.450 1.173 2.099 1.00 . A A . 6 GLY CA 1 1 7 1690 1 1 6 GLY H H -4.267 2.780 1.378 1.00 . A A . 6 GLY H 1 1 7 1691 1 1 6 GLY HA2 H -6.370 1.506 2.581 1.00 . A A . 6 GLY HA2 1 1 7 1692 1 1 6 GLY HA3 H -5.655 0.240 1.577 1.00 . A A . 6 GLY HA3 1 1 7 1693 1 1 6 GLY N N -5.030 2.166 1.127 1.00 . A A . 6 GLY N 1 1 7 1694 1 1 6 GLY O O -3.756 1.834 3.653 1.00 . A A . 6 GLY O 1 1 7 1695 1 1 7 PHE C C -1.846 -0.672 3.781 1.00 . A A . 7 PHE C 1 1 7 1696 1 1 7 PHE CA C -3.213 -0.802 4.456 1.00 . A A . 7 PHE CA 1 1 7 1697 1 1 7 PHE CB C -3.504 -2.240 4.896 1.00 . A A . 7 PHE CB 1 1 7 1698 1 1 7 PHE CD1 C -5.973 -2.330 5.352 1.00 . A A . 7 PHE CD1 1 1 7 1699 1 1 7 PHE CD2 C -4.465 -2.476 7.207 1.00 . A A . 7 PHE CD2 1 1 7 1700 1 1 7 PHE CE1 C -7.059 -2.454 6.214 1.00 . A A . 7 PHE CE1 1 1 7 1701 1 1 7 PHE CE2 C -5.544 -2.596 8.081 1.00 . A A . 7 PHE CE2 1 1 7 1702 1 1 7 PHE CG C -4.671 -2.356 5.837 1.00 . A A . 7 PHE CG 1 1 7 1703 1 1 7 PHE CZ C -6.844 -2.592 7.582 1.00 . A A . 7 PHE CZ 1 1 7 1704 1 1 7 PHE H H -4.828 -1.070 3.097 1.00 . A A . 7 PHE H 1 1 7 1705 1 1 7 PHE HA H -3.237 -0.157 5.332 1.00 . A A . 7 PHE HA 1 1 7 1706 1 1 7 PHE HB2 H -3.700 -2.844 4.010 1.00 . A A . 7 PHE HB2 1 1 7 1707 1 1 7 PHE HB3 H -2.632 -2.654 5.401 1.00 . A A . 7 PHE HB3 1 1 7 1708 1 1 7 PHE HD1 H -6.140 -2.196 4.294 1.00 . A A . 7 PHE HD1 1 1 7 1709 1 1 7 PHE HD2 H -3.460 -2.476 7.602 1.00 . A A . 7 PHE HD2 1 1 7 1710 1 1 7 PHE HE1 H -8.066 -2.435 5.823 1.00 . A A . 7 PHE HE1 1 1 7 1711 1 1 7 PHE HE2 H -5.373 -2.694 9.143 1.00 . A A . 7 PHE HE2 1 1 7 1712 1 1 7 PHE HZ H -7.683 -2.696 8.254 1.00 . A A . 7 PHE HZ 1 1 7 1713 1 1 7 PHE N N -4.243 -0.364 3.516 1.00 . A A . 7 PHE N 1 1 7 1714 1 1 7 PHE O O -1.719 0.051 2.797 1.00 . A A . 7 PHE O 1 1 7 1715 1 1 8 GLU C C 1.201 -0.014 3.937 1.00 . A A . 8 GLU C 1 1 7 1716 1 1 8 GLU CA C 0.537 -1.370 3.742 1.00 . A A . 8 GLU CA 1 1 7 1717 1 1 8 GLU CB C 0.522 -1.756 2.248 1.00 . A A . 8 GLU CB 1 1 7 1718 1 1 8 GLU CD C 1.895 -1.995 0.162 1.00 . A A . 8 GLU CD 1 1 7 1719 1 1 8 GLU CG C 1.931 -1.976 1.670 1.00 . A A . 8 GLU CG 1 1 7 1720 1 1 8 GLU H H -0.993 -1.962 5.103 1.00 . A A . 8 GLU H 1 1 7 1721 1 1 8 GLU HA H 1.124 -2.105 4.293 1.00 . A A . 8 GLU HA 1 1 7 1722 1 1 8 GLU HB2 H -0.075 -2.660 2.106 1.00 . A A . 8 GLU HB2 1 1 7 1723 1 1 8 GLU HB3 H 0.040 -0.954 1.687 1.00 . A A . 8 GLU HB3 1 1 7 1724 1 1 8 GLU HG2 H 2.592 -1.167 1.986 1.00 . A A . 8 GLU HG2 1 1 7 1725 1 1 8 GLU HG3 H 2.349 -2.915 2.040 1.00 . A A . 8 GLU HG3 1 1 7 1726 1 1 8 GLU N N -0.824 -1.383 4.297 1.00 . A A . 8 GLU N 1 1 7 1727 1 1 8 GLU O O 0.626 1.029 3.699 1.00 . A A . 8 GLU O 1 1 7 1728 1 1 8 GLU OE1 O 1.596 -2.977 -0.486 1.00 . A A . 8 GLU OE1 1 1 7 1729 1 1 9 PRO C C 3.359 1.787 2.932 1.00 . A A . 9 PRO C 1 1 7 1730 1 1 9 PRO CA C 3.218 1.295 4.370 1.00 . A A . 9 PRO CA 1 1 7 1731 1 1 9 PRO CB C 4.556 0.920 5.012 1.00 . A A . 9 PRO CB 1 1 7 1732 1 1 9 PRO CD C 3.313 -1.104 4.816 1.00 . A A . 9 PRO CD 1 1 7 1733 1 1 9 PRO CG C 4.705 -0.540 4.728 1.00 . A A . 9 PRO CG 1 1 7 1734 1 1 9 PRO HA H 2.692 2.038 4.968 1.00 . A A . 9 PRO HA 1 1 7 1735 1 1 9 PRO HB2 H 5.371 1.490 4.566 1.00 . A A . 9 PRO HB2 1 1 7 1736 1 1 9 PRO HB3 H 4.512 1.089 6.088 1.00 . A A . 9 PRO HB3 1 1 7 1737 1 1 9 PRO HD2 H 3.217 -1.962 4.149 1.00 . A A . 9 PRO HD2 1 1 7 1738 1 1 9 PRO HD3 H 3.068 -1.377 5.842 1.00 . A A . 9 PRO HD3 1 1 7 1739 1 1 9 PRO HG2 H 5.104 -0.684 3.724 1.00 . A A . 9 PRO HG2 1 1 7 1740 1 1 9 PRO HG3 H 5.355 -1.009 5.468 1.00 . A A . 9 PRO HG3 1 1 7 1741 1 1 9 PRO N N 2.480 0.028 4.372 1.00 . A A . 9 PRO N 1 1 7 1742 1 1 9 PRO O O 3.736 1.032 2.035 1.00 . A A . 9 PRO O 1 1 7 1743 1 1 10 GLY C C 1.328 3.720 1.033 1.00 . A A . 10 GLY C 1 1 7 1744 1 1 10 GLY CA C 2.800 3.570 1.375 1.00 . A A . 10 GLY CA 1 1 7 1745 1 1 10 GLY H H 2.747 3.640 3.495 1.00 . A A . 10 GLY H 1 1 7 1746 1 1 10 GLY HA2 H 3.265 4.553 1.308 1.00 . A A . 10 GLY HA2 1 1 7 1747 1 1 10 GLY HA3 H 3.268 2.910 0.645 1.00 . A A . 10 GLY HA3 1 1 7 1748 1 1 10 GLY N N 2.989 3.045 2.716 1.00 . A A . 10 GLY N 1 1 7 1749 1 1 10 GLY O O 0.983 4.354 0.038 1.00 . A A . 10 GLY O 1 1 7 1750 1 1 11 VAL C C -1.525 2.735 0.521 1.00 . A A . 11 VAL C 1 1 7 1751 1 1 11 VAL CA C -0.977 3.320 1.818 1.00 . A A . 11 VAL CA 1 1 7 1752 1 1 11 VAL CB C -1.432 4.789 1.984 1.00 . A A . 11 VAL CB 1 1 7 1753 1 1 11 VAL CG1 C -2.947 4.867 2.158 1.00 . A A . 11 VAL CG1 1 1 7 1754 1 1 11 VAL CG2 C -0.763 5.430 3.202 1.00 . A A . 11 VAL CG2 1 1 7 1755 1 1 11 VAL H H 0.840 2.597 2.641 1.00 . A A . 11 VAL H 1 1 7 1756 1 1 11 VAL HA H -1.411 2.748 2.639 1.00 . A A . 11 VAL HA 1 1 7 1757 1 1 11 VAL HB H -1.152 5.357 1.098 1.00 . A A . 11 VAL HB 1 1 7 1758 1 1 11 VAL HG11 H -3.248 5.909 2.275 1.00 . A A . 11 VAL HG11 1 1 7 1759 1 1 11 VAL HG12 H -3.438 4.456 1.277 1.00 . A A . 11 VAL HG12 1 1 7 1760 1 1 11 VAL HG13 H -3.250 4.304 3.040 1.00 . A A . 11 VAL HG13 1 1 7 1761 1 1 11 VAL HG21 H 0.309 5.523 3.026 1.00 . A A . 11 VAL HG21 1 1 7 1762 1 1 11 VAL HG22 H -1.178 6.423 3.368 1.00 . A A . 11 VAL HG22 1 1 7 1763 1 1 11 VAL HG23 H -0.934 4.813 4.084 1.00 . A A . 11 VAL HG23 1 1 7 1764 1 1 11 VAL N N 0.475 3.168 1.890 1.00 . A A . 11 VAL N 1 1 7 1765 1 1 11 VAL O O -1.817 3.454 -0.432 1.00 . A A . 11 VAL O 1 1 7 1766 1 1 12 ARG C C -2.754 -0.673 -0.104 1.00 . A A . 12 ARG C 1 1 7 1767 1 1 12 ARG CA C -2.184 0.644 -0.616 1.00 . A A . 12 ARG CA 1 1 7 1768 1 1 12 ARG CB C -1.045 0.350 -1.593 1.00 . A A . 12 ARG CB 1 1 7 1769 1 1 12 ARG CD C -2.370 -1.097 -3.254 1.00 . A A . 12 ARG CD 1 1 7 1770 1 1 12 ARG CG C -1.438 0.086 -3.041 1.00 . A A . 12 ARG CG 1 1 7 1771 1 1 12 ARG CZ C -3.264 -2.338 -5.205 1.00 . A A . 12 ARG CZ 1 1 7 1772 1 1 12 ARG H H -1.409 0.904 1.351 1.00 . A A . 12 ARG H 1 1 7 1773 1 1 12 ARG HA H -2.958 1.217 -1.124 1.00 . A A . 12 ARG HA 1 1 7 1774 1 1 12 ARG HB2 H -0.377 1.211 -1.589 1.00 . A A . 12 ARG HB2 1 1 7 1775 1 1 12 ARG HB3 H -0.490 -0.509 -1.221 1.00 . A A . 12 ARG HB3 1 1 7 1776 1 1 12 ARG HD2 H -2.010 -1.948 -2.677 1.00 . A A . 12 ARG HD2 1 1 7 1777 1 1 12 ARG HD3 H -3.368 -0.828 -2.904 1.00 . A A . 12 ARG HD3 1 1 7 1778 1 1 12 ARG HE H -1.801 -0.972 -5.296 1.00 . A A . 12 ARG HE 1 1 7 1779 1 1 12 ARG HG2 H -1.915 0.979 -3.439 1.00 . A A . 12 ARG HG2 1 1 7 1780 1 1 12 ARG HG3 H -0.528 -0.096 -3.609 1.00 . A A . 12 ARG HG3 1 1 7 1781 1 1 12 ARG HH11 H -4.117 -2.973 -3.490 1.00 . A A . 12 ARG HH11 1 1 7 1782 1 1 12 ARG HH12 H -4.773 -3.654 -4.963 1.00 . A A . 12 ARG HH12 1 1 7 1783 1 1 12 ARG HH21 H -2.563 -2.018 -7.064 1.00 . A A . 12 ARG HH21 1 1 7 1784 1 1 12 ARG HH22 H -3.850 -3.206 -6.920 1.00 . A A . 12 ARG HH22 1 1 7 1785 1 1 12 ARG N N -1.665 1.414 0.514 1.00 . A A . 12 ARG N 1 1 7 1786 1 1 12 ARG NE N -2.434 -1.449 -4.673 1.00 . A A . 12 ARG NE 1 1 7 1787 1 1 12 ARG NH1 N -4.122 -3.043 -4.497 1.00 . A A . 12 ARG NH1 1 1 7 1788 1 1 12 ARG NH2 N -3.224 -2.534 -6.506 1.00 . A A . 12 ARG NH2 1 1 7 1789 1 1 12 ARG O O -2.025 -1.505 0.433 1.00 . A A . 12 ARG O 1 1 7 1790 1 1 13 CYS C C -4.018 -3.334 -0.474 1.00 . A A . 13 CYS C 1 1 7 1791 1 1 13 CYS CA C -4.665 -2.122 0.192 1.00 . A A . 13 CYS CA 1 1 7 1792 1 1 13 CYS CB C -6.164 -2.126 -0.107 1.00 . A A . 13 CYS CB 1 1 7 1793 1 1 13 CYS H H -4.622 -0.206 -0.760 1.00 . A A . 13 CYS H 1 1 7 1794 1 1 13 CYS HA H -4.514 -2.197 1.268 1.00 . A A . 13 CYS HA 1 1 7 1795 1 1 13 CYS HB2 H -6.416 -1.220 -0.657 1.00 . A A . 13 CYS HB2 1 1 7 1796 1 1 13 CYS HB3 H -6.380 -2.980 -0.749 1.00 . A A . 13 CYS HB3 1 1 7 1797 1 1 13 CYS N N -4.052 -0.888 -0.282 1.00 . A A . 13 CYS N 1 1 7 1798 1 1 13 CYS O O -3.928 -3.396 -1.699 1.00 . A A . 13 CYS O 1 1 7 1799 1 1 13 CYS SG S -7.218 -2.217 1.376 1.00 . A A . 13 CYS SG 1 1 7 1800 1 1 14 LEU C C -4.181 -6.431 -0.671 1.00 . A A . 14 LEU C 1 1 7 1801 1 1 14 LEU CA C -3.037 -5.546 -0.182 1.00 . A A . 14 LEU CA 1 1 7 1802 1 1 14 LEU CB C -2.255 -6.254 0.929 1.00 . A A . 14 LEU CB 1 1 7 1803 1 1 14 LEU CD1 C -1.317 -8.261 -0.308 1.00 . A A . 14 LEU CD1 1 1 7 1804 1 1 14 LEU CD2 C 0.072 -6.199 -0.068 1.00 . A A . 14 LEU CD2 1 1 7 1805 1 1 14 LEU CG C -1.002 -7.064 0.579 1.00 . A A . 14 LEU CG 1 1 7 1806 1 1 14 LEU H H -3.560 -4.141 1.332 1.00 . A A . 14 LEU H 1 1 7 1807 1 1 14 LEU HA H -2.375 -5.340 -1.024 1.00 . A A . 14 LEU HA 1 1 7 1808 1 1 14 LEU HB2 H -1.951 -5.495 1.649 1.00 . A A . 14 LEU HB2 1 1 7 1809 1 1 14 LEU HB3 H -2.945 -6.922 1.444 1.00 . A A . 14 LEU HB3 1 1 7 1810 1 1 14 LEU HD11 H -1.639 -7.920 -1.290 1.00 . A A . 14 LEU HD11 1 1 7 1811 1 1 14 LEU HD12 H -0.424 -8.877 -0.416 1.00 . A A . 14 LEU HD12 1 1 7 1812 1 1 14 LEU HD13 H -2.109 -8.856 0.146 1.00 . A A . 14 LEU HD13 1 1 7 1813 1 1 14 LEU HD21 H -0.248 -5.884 -1.060 1.00 . A A . 14 LEU HD21 1 1 7 1814 1 1 14 LEU HD22 H 0.255 -5.319 0.548 1.00 . A A . 14 LEU HD22 1 1 7 1815 1 1 14 LEU HD23 H 0.995 -6.771 -0.155 1.00 . A A . 14 LEU HD23 1 1 7 1816 1 1 14 LEU HG H -0.597 -7.444 1.517 1.00 . A A . 14 LEU HG 1 1 7 1817 1 1 14 LEU N N -3.561 -4.284 0.333 1.00 . A A . 14 LEU N 1 1 7 1818 1 1 14 LEU O O -4.051 -7.171 -1.645 1.00 . A A . 14 LEU O 1 1 7 1819 1 1 15 ILE C C -7.178 -6.324 -1.524 1.00 . A A . 15 ILE C 1 1 7 1820 1 1 15 ILE CA C -6.529 -7.051 -0.347 1.00 . A A . 15 ILE CA 1 1 7 1821 1 1 15 ILE CB C -7.545 -7.185 0.816 1.00 . A A . 15 ILE CB 1 1 7 1822 1 1 15 ILE CD1 C -7.859 -6.897 3.353 1.00 . A A . 15 ILE CD1 1 1 7 1823 1 1 15 ILE CG1 C -6.897 -6.914 2.181 1.00 . A A . 15 ILE CG1 1 1 7 1824 1 1 15 ILE CG2 C -8.163 -8.585 0.798 1.00 . A A . 15 ILE CG2 1 1 7 1825 1 1 15 ILE H H -5.347 -5.698 0.805 1.00 . A A . 15 ILE H 1 1 7 1826 1 1 15 ILE HA H -6.246 -8.051 -0.671 1.00 . A A . 15 ILE HA 1 1 7 1827 1 1 15 ILE HB H -8.342 -6.457 0.668 1.00 . A A . 15 ILE HB 1 1 7 1828 1 1 15 ILE HD11 H -8.249 -7.900 3.529 1.00 . A A . 15 ILE HD11 1 1 7 1829 1 1 15 ILE HD12 H -7.333 -6.558 4.245 1.00 . A A . 15 ILE HD12 1 1 7 1830 1 1 15 ILE HD13 H -8.683 -6.216 3.142 1.00 . A A . 15 ILE HD13 1 1 7 1831 1 1 15 ILE HG12 H -6.139 -7.677 2.361 1.00 . A A . 15 ILE HG12 1 1 7 1832 1 1 15 ILE HG13 H -6.409 -5.940 2.154 1.00 . A A . 15 ILE HG13 1 1 7 1833 1 1 15 ILE HG21 H -8.537 -8.813 -0.201 1.00 . A A . 15 ILE HG21 1 1 7 1834 1 1 15 ILE HG22 H -7.414 -9.327 1.075 1.00 . A A . 15 ILE HG22 1 1 7 1835 1 1 15 ILE HG23 H -8.996 -8.633 1.499 1.00 . A A . 15 ILE HG23 1 1 7 1836 1 1 15 ILE N N -5.313 -6.330 0.018 1.00 . A A . 15 ILE N 1 1 7 1837 1 1 15 ILE O O -6.693 -5.280 -1.957 1.00 . A A . 15 ILE O 1 1 7 1838 1 1 16 TRP C C -9.547 -4.925 -3.042 1.00 . A A . 16 TRP C 1 1 7 1839 1 1 16 TRP CA C -8.957 -6.325 -3.216 1.00 . A A . 16 TRP CA 1 1 7 1840 1 1 16 TRP CB C -10.071 -7.274 -3.674 1.00 . A A . 16 TRP CB 1 1 7 1841 1 1 16 TRP CD1 C -11.121 -8.800 -1.895 1.00 . A A . 16 TRP CD1 1 1 7 1842 1 1 16 TRP CD2 C -9.398 -9.720 -2.965 1.00 . A A . 16 TRP CD2 1 1 7 1843 1 1 16 TRP CE2 C -9.882 -10.644 -2.010 1.00 . A A . 16 TRP CE2 1 1 7 1844 1 1 16 TRP CE3 C -8.268 -10.065 -3.719 1.00 . A A . 16 TRP CE3 1 1 7 1845 1 1 16 TRP CG C -10.203 -8.535 -2.867 1.00 . A A . 16 TRP CG 1 1 7 1846 1 1 16 TRP CH2 C -8.186 -12.213 -2.570 1.00 . A A . 16 TRP CH2 1 1 7 1847 1 1 16 TRP CZ2 C -9.279 -11.889 -1.805 1.00 . A A . 16 TRP CZ2 1 1 7 1848 1 1 16 TRP CZ3 C -7.675 -11.313 -3.525 1.00 . A A . 16 TRP CZ3 1 1 7 1849 1 1 16 TRP H H -8.665 -7.700 -1.626 1.00 . A A . 16 TRP H 1 1 7 1850 1 1 16 TRP HA H -8.223 -6.264 -4.020 1.00 . A A . 16 TRP HA 1 1 7 1851 1 1 16 TRP HB2 H -11.021 -6.740 -3.638 1.00 . A A . 16 TRP HB2 1 1 7 1852 1 1 16 TRP HB3 H -9.883 -7.548 -4.712 1.00 . A A . 16 TRP HB3 1 1 7 1853 1 1 16 TRP HD1 H -11.889 -8.109 -1.579 1.00 . A A . 16 TRP HD1 1 1 7 1854 1 1 16 TRP HE1 H -11.510 -10.455 -0.640 1.00 . A A . 16 TRP HE1 1 1 7 1855 1 1 16 TRP HE3 H -7.858 -9.368 -4.435 1.00 . A A . 16 TRP HE3 1 1 7 1856 1 1 16 TRP HH2 H -7.704 -13.170 -2.432 1.00 . A A . 16 TRP HH2 1 1 7 1857 1 1 16 TRP HZ2 H -9.657 -12.574 -1.061 1.00 . A A . 16 TRP HZ2 1 1 7 1858 1 1 16 TRP HZ3 H -6.808 -11.587 -4.107 1.00 . A A . 16 TRP HZ3 1 1 7 1859 1 1 16 TRP N N -8.280 -6.863 -2.038 1.00 . A A . 16 TRP N 1 1 7 1860 1 1 16 TRP NE1 N -10.944 -10.056 -1.376 1.00 . A A . 16 TRP NE1 1 1 7 1861 1 1 16 TRP O O -10.074 -4.348 -3.992 1.00 . A A . 16 TRP O 1 1 7 1862 1 1 17 CYS C C -8.889 -2.035 -2.302 1.00 . A A . 17 CYS C 1 1 7 1863 1 1 17 CYS CA C -9.845 -2.989 -1.587 1.00 . A A . 17 CYS CA 1 1 7 1864 1 1 17 CYS CB C -9.866 -2.718 -0.079 1.00 . A A . 17 CYS CB 1 1 7 1865 1 1 17 CYS H H -9.023 -4.887 -1.086 1.00 . A A . 17 CYS H 1 1 7 1866 1 1 17 CYS HA H -10.845 -2.832 -1.990 1.00 . A A . 17 CYS HA 1 1 7 1867 1 1 17 CYS HB2 H -9.747 -1.649 0.091 1.00 . A A . 17 CYS HB2 1 1 7 1868 1 1 17 CYS HB3 H -10.844 -3.012 0.300 1.00 . A A . 17 CYS HB3 1 1 7 1869 1 1 17 CYS N N -9.450 -4.369 -1.840 1.00 . A A . 17 CYS N 1 1 7 1870 1 1 17 CYS O O -7.780 -2.396 -2.690 1.00 . A A . 17 CYS O 1 1 7 1871 1 1 17 CYS SG S -8.604 -3.616 0.882 1.00 . A A . 17 CYS SG 1 1 7 1872 1 1 18 ASP C C -7.076 0.238 -2.790 1.00 . A A . 18 ASP C 1 1 7 1873 1 1 18 ASP CA C -8.527 0.216 -3.224 1.00 . A A . 18 ASP CA 1 1 7 1874 1 1 18 ASP CB C -9.136 1.620 -3.100 1.00 . A A . 18 ASP CB 1 1 7 1875 1 1 18 ASP CG C -8.373 2.598 -3.953 1.00 . A A . 18 ASP CG 1 1 7 1876 1 1 18 ASP H H -10.223 -0.501 -2.128 1.00 . A A . 18 ASP H 1 1 7 1877 1 1 18 ASP HA H -8.504 -0.069 -4.280 1.00 . A A . 18 ASP HA 1 1 7 1878 1 1 18 ASP HB2 H -10.181 1.602 -3.416 1.00 . A A . 18 ASP HB2 1 1 7 1879 1 1 18 ASP HB3 H -9.098 1.946 -2.059 1.00 . A A . 18 ASP HB3 1 1 7 1880 1 1 18 ASP N N -9.323 -0.777 -2.489 1.00 . A A . 18 ASP N 1 1 7 1881 1 1 18 ASP O O -6.217 0.505 -3.608 1.00 . A A . 18 ASP O 1 1 7 1882 1 1 18 ASP OD1 O -8.247 2.365 -5.137 1.00 . A A . 18 ASP OD1 1 1 7 1883 1 1 18 ASP OD2 O -7.920 3.592 -3.426 1.00 . A A . 18 ASP OD2 1 1 8 1884 1 1 1 GLY C C 2.136 0.921 -2.101 1.00 . A A . 1 GLY C 1 1 8 1885 1 1 1 GLY CA C 2.339 -0.554 -1.810 1.00 . A A . 1 GLY CA 1 1 8 1886 1 1 1 GLY H1 H 2.545 -0.039 0.244 1.00 . A A . 1 GLY H1 1 1 8 1887 1 1 1 GLY HA2 H 3.304 -0.864 -2.209 1.00 . A A . 1 GLY HA2 1 1 8 1888 1 1 1 GLY HA3 H 1.550 -1.127 -2.298 1.00 . A A . 1 GLY HA3 1 1 8 1889 1 1 1 GLY N N 2.303 -0.799 -0.376 1.00 . A A . 1 GLY N 1 1 8 1890 1 1 1 GLY O O 2.216 1.727 -1.176 1.00 . A A . 1 GLY O 1 1 8 1891 1 1 2 SER C C 0.852 3.079 -4.882 1.00 . A A . 2 SER C 1 1 8 1892 1 1 2 SER CA C 1.731 2.713 -3.686 1.00 . A A . 2 SER CA 1 1 8 1893 1 1 2 SER CB C 3.119 3.290 -3.957 1.00 . A A . 2 SER CB 1 1 8 1894 1 1 2 SER H H 1.855 0.620 -4.096 1.00 . A A . 2 SER H 1 1 8 1895 1 1 2 SER HA H 1.319 3.226 -2.816 1.00 . A A . 2 SER HA 1 1 8 1896 1 1 2 SER HB2 H 3.545 2.771 -4.815 1.00 . A A . 2 SER HB2 1 1 8 1897 1 1 2 SER HB3 H 3.011 4.346 -4.193 1.00 . A A . 2 SER HB3 1 1 8 1898 1 1 2 SER HG H 3.412 3.071 -2.044 1.00 . A A . 2 SER HG 1 1 8 1899 1 1 2 SER N N 1.890 1.300 -3.352 1.00 . A A . 2 SER N 1 1 8 1900 1 1 2 SER O O 0.974 4.171 -5.438 1.00 . A A . 2 SER O 1 1 8 1901 1 1 2 SER OG O 3.964 3.133 -2.830 1.00 . A A . 2 SER OG 1 1 8 1902 1 1 3 ARG C C -2.277 3.127 -5.769 1.00 . A A . 3 ARG C 1 1 8 1903 1 1 3 ARG CA C -1.015 2.474 -6.330 1.00 . A A . 3 ARG CA 1 1 8 1904 1 1 3 ARG CB C -1.337 1.228 -7.162 1.00 . A A . 3 ARG CB 1 1 8 1905 1 1 3 ARG CD C 0.769 1.458 -8.536 1.00 . A A . 3 ARG CD 1 1 8 1906 1 1 3 ARG CG C -0.126 0.511 -7.750 1.00 . A A . 3 ARG CG 1 1 8 1907 1 1 3 ARG CZ C 2.353 1.358 -10.438 1.00 . A A . 3 ARG CZ 1 1 8 1908 1 1 3 ARG H H 0.026 1.240 -4.926 1.00 . A A . 3 ARG H 1 1 8 1909 1 1 3 ARG HA H -0.586 3.226 -6.990 1.00 . A A . 3 ARG HA 1 1 8 1910 1 1 3 ARG HB2 H -1.876 0.514 -6.540 1.00 . A A . 3 ARG HB2 1 1 8 1911 1 1 3 ARG HB3 H -1.994 1.525 -7.979 1.00 . A A . 3 ARG HB3 1 1 8 1912 1 1 3 ARG HD2 H 0.134 2.183 -9.043 1.00 . A A . 3 ARG HD2 1 1 8 1913 1 1 3 ARG HD3 H 1.407 1.997 -7.833 1.00 . A A . 3 ARG HD3 1 1 8 1914 1 1 3 ARG HE H 1.590 -0.245 -9.505 1.00 . A A . 3 ARG HE 1 1 8 1915 1 1 3 ARG HG2 H 0.457 0.060 -6.947 1.00 . A A . 3 ARG HG2 1 1 8 1916 1 1 3 ARG HG3 H -0.479 -0.280 -8.409 1.00 . A A . 3 ARG HG3 1 1 8 1917 1 1 3 ARG HH11 H 1.915 3.254 -9.912 1.00 . A A . 3 ARG HH11 1 1 8 1918 1 1 3 ARG HH12 H 3.008 3.070 -11.274 1.00 . A A . 3 ARG HH12 1 1 8 1919 1 1 3 ARG HH21 H 2.988 -0.387 -11.213 1.00 . A A . 3 ARG HH21 1 1 8 1920 1 1 3 ARG HH22 H 3.617 1.065 -11.978 1.00 . A A . 3 ARG HH22 1 1 8 1921 1 1 3 ARG N N -0.017 2.170 -5.307 1.00 . A A . 3 ARG N 1 1 8 1922 1 1 3 ARG NE N 1.600 0.763 -9.520 1.00 . A A . 3 ARG NE 1 1 8 1923 1 1 3 ARG NH1 N 2.429 2.669 -10.553 1.00 . A A . 3 ARG NH1 1 1 8 1924 1 1 3 ARG NH2 N 3.046 0.618 -11.279 1.00 . A A . 3 ARG NH2 1 1 8 1925 1 1 3 ARG O O -2.384 4.351 -5.782 1.00 . A A . 3 ARG O 1 1 8 1926 1 1 4 GLY C C -4.191 3.016 -3.163 1.00 . A A . 4 GLY C 1 1 8 1927 1 1 4 GLY CA C -4.415 2.867 -4.656 1.00 . A A . 4 GLY CA 1 1 8 1928 1 1 4 GLY H H -3.117 1.326 -5.343 1.00 . A A . 4 GLY H 1 1 8 1929 1 1 4 GLY HA2 H -4.635 3.847 -5.076 1.00 . A A . 4 GLY HA2 1 1 8 1930 1 1 4 GLY HA3 H -5.263 2.205 -4.828 1.00 . A A . 4 GLY HA3 1 1 8 1931 1 1 4 GLY N N -3.227 2.328 -5.296 1.00 . A A . 4 GLY N 1 1 8 1932 1 1 4 GLY O O -3.048 2.960 -2.716 1.00 . A A . 4 GLY O 1 1 8 1933 1 1 5 TRP C C -5.563 2.259 -0.079 1.00 . A A . 5 TRP C 1 1 8 1934 1 1 5 TRP CA C -5.143 3.440 -0.952 1.00 . A A . 5 TRP CA 1 1 8 1935 1 1 5 TRP CB C -6.004 4.648 -0.571 1.00 . A A . 5 TRP CB 1 1 8 1936 1 1 5 TRP CD1 C -6.845 6.263 -2.373 1.00 . A A . 5 TRP CD1 1 1 8 1937 1 1 5 TRP CD2 C -4.733 6.617 -1.768 1.00 . A A . 5 TRP CD2 1 1 8 1938 1 1 5 TRP CE2 C -5.103 7.606 -2.708 1.00 . A A . 5 TRP CE2 1 1 8 1939 1 1 5 TRP CE3 C -3.408 6.588 -1.315 1.00 . A A . 5 TRP CE3 1 1 8 1940 1 1 5 TRP CG C -5.885 5.796 -1.527 1.00 . A A . 5 TRP CG 1 1 8 1941 1 1 5 TRP CH2 C -2.942 8.592 -2.618 1.00 . A A . 5 TRP CH2 1 1 8 1942 1 1 5 TRP CZ2 C -4.218 8.605 -3.125 1.00 . A A . 5 TRP CZ2 1 1 8 1943 1 1 5 TRP CZ3 C -2.527 7.587 -1.723 1.00 . A A . 5 TRP CZ3 1 1 8 1944 1 1 5 TRP H H -6.169 3.297 -2.807 1.00 . A A . 5 TRP H 1 1 8 1945 1 1 5 TRP HA H -4.105 3.678 -0.726 1.00 . A A . 5 TRP HA 1 1 8 1946 1 1 5 TRP HB2 H -7.047 4.331 -0.534 1.00 . A A . 5 TRP HB2 1 1 8 1947 1 1 5 TRP HB3 H -5.713 4.987 0.422 1.00 . A A . 5 TRP HB3 1 1 8 1948 1 1 5 TRP HD1 H -7.830 5.832 -2.470 1.00 . A A . 5 TRP HD1 1 1 8 1949 1 1 5 TRP HE1 H -6.938 7.830 -3.781 1.00 . A A . 5 TRP HE1 1 1 8 1950 1 1 5 TRP HE3 H -3.078 5.786 -0.671 1.00 . A A . 5 TRP HE3 1 1 8 1951 1 1 5 TRP HH2 H -2.243 9.358 -2.917 1.00 . A A . 5 TRP HH2 1 1 8 1952 1 1 5 TRP HZ2 H -4.525 9.360 -3.834 1.00 . A A . 5 TRP HZ2 1 1 8 1953 1 1 5 TRP HZ3 H -1.511 7.583 -1.357 1.00 . A A . 5 TRP HZ3 1 1 8 1954 1 1 5 TRP N N -5.253 3.219 -2.390 1.00 . A A . 5 TRP N 1 1 8 1955 1 1 5 TRP NE1 N -6.392 7.341 -3.088 1.00 . A A . 5 TRP NE1 1 1 8 1956 1 1 5 TRP O O -6.399 1.445 -0.472 1.00 . A A . 5 TRP O 1 1 8 1957 1 1 6 GLY C C -4.314 0.909 3.134 1.00 . A A . 6 GLY C 1 1 8 1958 1 1 6 GLY CA C -5.386 1.175 2.095 1.00 . A A . 6 GLY CA 1 1 8 1959 1 1 6 GLY H H -4.263 2.826 1.378 1.00 . A A . 6 GLY H 1 1 8 1960 1 1 6 GLY HA2 H -6.296 1.495 2.603 1.00 . A A . 6 GLY HA2 1 1 8 1961 1 1 6 GLY HA3 H -5.595 0.245 1.570 1.00 . A A . 6 GLY HA3 1 1 8 1962 1 1 6 GLY N N -4.997 2.180 1.122 1.00 . A A . 6 GLY N 1 1 8 1963 1 1 6 GLY O O -3.557 1.811 3.494 1.00 . A A . 6 GLY O 1 1 8 1964 1 1 7 PHE C C -1.817 -0.717 3.768 1.00 . A A . 7 PHE C 1 1 8 1965 1 1 7 PHE CA C -3.166 -0.791 4.481 1.00 . A A . 7 PHE CA 1 1 8 1966 1 1 7 PHE CB C -3.472 -2.226 4.923 1.00 . A A . 7 PHE CB 1 1 8 1967 1 1 7 PHE CD1 C -5.755 -3.288 4.971 1.00 . A A . 7 PHE CD1 1 1 8 1968 1 1 7 PHE CD2 C -5.217 -1.648 6.632 1.00 . A A . 7 PHE CD2 1 1 8 1969 1 1 7 PHE CE1 C -7.018 -3.449 5.534 1.00 . A A . 7 PHE CE1 1 1 8 1970 1 1 7 PHE CE2 C -6.470 -1.815 7.215 1.00 . A A . 7 PHE CE2 1 1 8 1971 1 1 7 PHE CG C -4.842 -2.395 5.521 1.00 . A A . 7 PHE CG 1 1 8 1972 1 1 7 PHE CZ C -7.373 -2.720 6.666 1.00 . A A . 7 PHE CZ 1 1 8 1973 1 1 7 PHE H H -4.942 -1.008 3.341 1.00 . A A . 7 PHE H 1 1 8 1974 1 1 7 PHE HA H -3.123 -0.146 5.359 1.00 . A A . 7 PHE HA 1 1 8 1975 1 1 7 PHE HB2 H -3.384 -2.882 4.058 1.00 . A A . 7 PHE HB2 1 1 8 1976 1 1 7 PHE HB3 H -2.735 -2.532 5.665 1.00 . A A . 7 PHE HB3 1 1 8 1977 1 1 7 PHE HD1 H -5.485 -3.866 4.098 1.00 . A A . 7 PHE HD1 1 1 8 1978 1 1 7 PHE HD2 H -4.531 -0.919 7.037 1.00 . A A . 7 PHE HD2 1 1 8 1979 1 1 7 PHE HE1 H -7.722 -4.142 5.096 1.00 . A A . 7 PHE HE1 1 1 8 1980 1 1 7 PHE HE2 H -6.744 -1.237 8.085 1.00 . A A . 7 PHE HE2 1 1 8 1981 1 1 7 PHE HZ H -8.348 -2.852 7.112 1.00 . A A . 7 PHE HZ 1 1 8 1982 1 1 7 PHE N N -4.242 -0.332 3.606 1.00 . A A . 7 PHE N 1 1 8 1983 1 1 7 PHE O O -1.702 -0.054 2.742 1.00 . A A . 7 PHE O 1 1 8 1984 1 1 8 GLU C C 1.230 -0.043 3.935 1.00 . A A . 8 GLU C 1 1 8 1985 1 1 8 GLU CA C 0.573 -1.405 3.755 1.00 . A A . 8 GLU CA 1 1 8 1986 1 1 8 GLU CB C 0.567 -1.808 2.264 1.00 . A A . 8 GLU CB 1 1 8 1987 1 1 8 GLU CD C 1.943 -1.973 0.175 1.00 . A A . 8 GLU CD 1 1 8 1988 1 1 8 GLU CG C 1.979 -2.000 1.684 1.00 . A A . 8 GLU CG 1 1 8 1989 1 1 8 GLU H H -0.956 -1.958 5.133 1.00 . A A . 8 GLU H 1 1 8 1990 1 1 8 GLU HA H 1.159 -2.130 4.320 1.00 . A A . 8 GLU HA 1 1 8 1991 1 1 8 GLU HB2 H -0.009 -2.727 2.133 1.00 . A A . 8 GLU HB2 1 1 8 1992 1 1 8 GLU HB3 H 0.068 -1.025 1.694 1.00 . A A . 8 GLU HB3 1 1 8 1993 1 1 8 GLU HG2 H 2.631 -1.195 2.023 1.00 . A A . 8 GLU HG2 1 1 8 1994 1 1 8 GLU HG3 H 2.404 -2.946 2.025 1.00 . A A . 8 GLU HG3 1 1 8 1995 1 1 8 GLU N N -0.791 -1.411 4.306 1.00 . A A . 8 GLU N 1 1 8 1996 1 1 8 GLU O O 0.648 0.993 3.686 1.00 . A A . 8 GLU O 1 1 8 1997 1 1 8 GLU OE1 O 1.630 -2.930 -0.502 1.00 . A A . 8 GLU OE1 1 1 8 1998 1 1 9 PRO C C 3.354 1.787 2.935 1.00 . A A . 9 PRO C 1 1 8 1999 1 1 9 PRO CA C 3.231 1.288 4.372 1.00 . A A . 9 PRO CA 1 1 8 2000 1 1 9 PRO CB C 4.578 0.927 5.002 1.00 . A A . 9 PRO CB 1 1 8 2001 1 1 9 PRO CD C 3.353 -1.110 4.817 1.00 . A A . 9 PRO CD 1 1 8 2002 1 1 9 PRO CG C 4.740 -0.532 4.719 1.00 . A A . 9 PRO CG 1 1 8 2003 1 1 9 PRO HA H 2.701 2.023 4.977 1.00 . A A . 9 PRO HA 1 1 8 2004 1 1 9 PRO HB2 H 5.384 1.504 4.548 1.00 . A A . 9 PRO HB2 1 1 8 2005 1 1 9 PRO HB3 H 4.544 1.096 6.078 1.00 . A A . 9 PRO HB3 1 1 8 2006 1 1 9 PRO HD2 H 3.261 -1.971 4.155 1.00 . A A . 9 PRO HD2 1 1 8 2007 1 1 9 PRO HD3 H 3.118 -1.381 5.846 1.00 . A A . 9 PRO HD3 1 1 8 2008 1 1 9 PRO HG2 H 5.134 -0.674 3.712 1.00 . A A . 9 PRO HG2 1 1 8 2009 1 1 9 PRO HG3 H 5.400 -0.994 5.453 1.00 . A A . 9 PRO HG3 1 1 8 2010 1 1 9 PRO N N 2.508 0.013 4.374 1.00 . A A . 9 PRO N 1 1 8 2011 1 1 9 PRO O O 3.693 1.029 2.025 1.00 . A A . 9 PRO O 1 1 8 2012 1 1 10 GLY C C 1.358 3.720 1.035 1.00 . A A . 10 GLY C 1 1 8 2013 1 1 10 GLY CA C 2.826 3.594 1.397 1.00 . A A . 10 GLY CA 1 1 8 2014 1 1 10 GLY H H 2.792 3.649 3.519 1.00 . A A . 10 GLY H 1 1 8 2015 1 1 10 GLY HA2 H 3.274 4.586 1.349 1.00 . A A . 10 GLY HA2 1 1 8 2016 1 1 10 GLY HA3 H 3.318 2.953 0.666 1.00 . A A . 10 GLY HA3 1 1 8 2017 1 1 10 GLY N N 3.012 3.055 2.734 1.00 . A A . 10 GLY N 1 1 8 2018 1 1 10 GLY O O 1.020 4.346 0.031 1.00 . A A . 10 GLY O 1 1 8 2019 1 1 11 VAL C C -1.506 2.722 0.508 1.00 . A A . 11 VAL C 1 1 8 2020 1 1 11 VAL CA C -0.953 3.314 1.800 1.00 . A A . 11 VAL CA 1 1 8 2021 1 1 11 VAL CB C -1.405 4.786 1.956 1.00 . A A . 11 VAL CB 1 1 8 2022 1 1 11 VAL CG1 C -2.918 4.873 2.133 1.00 . A A . 11 VAL CG1 1 1 8 2023 1 1 11 VAL CG2 C -0.730 5.437 3.163 1.00 . A A . 11 VAL CG2 1 1 8 2024 1 1 11 VAL H H 0.858 2.592 2.636 1.00 . A A . 11 VAL H 1 1 8 2025 1 1 11 VAL HA H -1.390 2.751 2.626 1.00 . A A . 11 VAL HA 1 1 8 2026 1 1 11 VAL HB H -1.124 5.346 1.064 1.00 . A A . 11 VAL HB 1 1 8 2027 1 1 11 VAL HG11 H -3.415 4.449 1.262 1.00 . A A . 11 VAL HG11 1 1 8 2028 1 1 11 VAL HG12 H -3.220 4.326 3.027 1.00 . A A . 11 VAL HG12 1 1 8 2029 1 1 11 VAL HG13 H -3.215 5.918 2.234 1.00 . A A . 11 VAL HG13 1 1 8 2030 1 1 11 VAL HG21 H -0.901 4.831 4.054 1.00 . A A . 11 VAL HG21 1 1 8 2031 1 1 11 VAL HG22 H 0.341 5.527 2.985 1.00 . A A . 11 VAL HG22 1 1 8 2032 1 1 11 VAL HG23 H -1.143 6.433 3.321 1.00 . A A . 11 VAL HG23 1 1 8 2033 1 1 11 VAL N N 0.498 3.159 1.880 1.00 . A A . 11 VAL N 1 1 8 2034 1 1 11 VAL O O -1.797 3.436 -0.449 1.00 . A A . 11 VAL O 1 1 8 2035 1 1 12 ARG C C -2.757 -0.686 -0.114 1.00 . A A . 12 ARG C 1 1 8 2036 1 1 12 ARG CA C -2.185 0.633 -0.621 1.00 . A A . 12 ARG CA 1 1 8 2037 1 1 12 ARG CB C -1.058 0.335 -1.611 1.00 . A A . 12 ARG CB 1 1 8 2038 1 1 12 ARG CD C -2.460 -1.030 -3.276 1.00 . A A . 12 ARG CD 1 1 8 2039 1 1 12 ARG CG C -1.471 0.103 -3.058 1.00 . A A . 12 ARG CG 1 1 8 2040 1 1 12 ARG CZ C -3.495 -2.178 -5.211 1.00 . A A . 12 ARG CZ 1 1 8 2041 1 1 12 ARG H H -1.402 0.890 1.343 1.00 . A A . 12 ARG H 1 1 8 2042 1 1 12 ARG HA H -2.960 1.212 -1.122 1.00 . A A . 12 ARG HA 1 1 8 2043 1 1 12 ARG HB2 H -0.373 1.183 -1.595 1.00 . A A . 12 ARG HB2 1 1 8 2044 1 1 12 ARG HB3 H -0.515 -0.541 -1.259 1.00 . A A . 12 ARG HB3 1 1 8 2045 1 1 12 ARG HD2 H -2.114 -1.915 -2.742 1.00 . A A . 12 ARG HD2 1 1 8 2046 1 1 12 ARG HD3 H -3.430 -0.734 -2.875 1.00 . A A . 12 ARG HD3 1 1 8 2047 1 1 12 ARG HE H -1.986 -0.862 -5.340 1.00 . A A . 12 ARG HE 1 1 8 2048 1 1 12 ARG HG2 H -1.909 1.022 -3.443 1.00 . A A . 12 ARG HG2 1 1 8 2049 1 1 12 ARG HG3 H -0.572 -0.113 -3.635 1.00 . A A . 12 ARG HG3 1 1 8 2050 1 1 12 ARG HH11 H -4.265 -2.846 -3.471 1.00 . A A . 12 ARG HH11 1 1 8 2051 1 1 12 ARG HH12 H -5.042 -3.439 -4.926 1.00 . A A . 12 ARG HH12 1 1 8 2052 1 1 12 ARG HH21 H -2.891 -1.816 -7.099 1.00 . A A . 12 ARG HH21 1 1 8 2053 1 1 12 ARG HH22 H -4.204 -2.971 -6.917 1.00 . A A . 12 ARG HH22 1 1 8 2054 1 1 12 ARG N N -1.655 1.400 0.505 1.00 . A A . 12 ARG N 1 1 8 2055 1 1 12 ARG NE N -2.605 -1.336 -4.699 1.00 . A A . 12 ARG NE 1 1 8 2056 1 1 12 ARG NH1 N -4.338 -2.874 -4.478 1.00 . A A . 12 ARG NH1 1 1 8 2057 1 1 12 ARG NH2 N -3.530 -2.335 -6.519 1.00 . A A . 12 ARG NH2 1 1 8 2058 1 1 12 ARG O O -2.024 -1.528 0.401 1.00 . A A . 12 ARG O 1 1 8 2059 1 1 13 CYS C C -4.036 -3.340 -0.479 1.00 . A A . 13 CYS C 1 1 8 2060 1 1 13 CYS CA C -4.677 -2.127 0.190 1.00 . A A . 13 CYS CA 1 1 8 2061 1 1 13 CYS CB C -6.174 -2.124 -0.118 1.00 . A A . 13 CYS CB 1 1 8 2062 1 1 13 CYS H H -4.632 -0.197 -0.731 1.00 . A A . 13 CYS H 1 1 8 2063 1 1 13 CYS HA H -4.530 -2.208 1.266 1.00 . A A . 13 CYS HA 1 1 8 2064 1 1 13 CYS HB2 H -6.419 -1.219 -0.672 1.00 . A A . 13 CYS HB2 1 1 8 2065 1 1 13 CYS HB3 H -6.391 -2.978 -0.761 1.00 . A A . 13 CYS HB3 1 1 8 2066 1 1 13 CYS N N -4.059 -0.891 -0.275 1.00 . A A . 13 CYS N 1 1 8 2067 1 1 13 CYS O O -3.940 -3.400 -1.704 1.00 . A A . 13 CYS O 1 1 8 2068 1 1 13 CYS SG S -7.236 -2.209 1.359 1.00 . A A . 13 CYS SG 1 1 8 2069 1 1 14 LEU C C -4.230 -6.446 -0.668 1.00 . A A . 14 LEU C 1 1 8 2070 1 1 14 LEU CA C -3.080 -5.565 -0.184 1.00 . A A . 14 LEU CA 1 1 8 2071 1 1 14 LEU CB C -2.300 -6.268 0.933 1.00 . A A . 14 LEU CB 1 1 8 2072 1 1 14 LEU CD1 C -1.501 -8.394 -0.207 1.00 . A A . 14 LEU CD1 1 1 8 2073 1 1 14 LEU CD2 C -0.014 -6.389 -0.145 1.00 . A A . 14 LEU CD2 1 1 8 2074 1 1 14 LEU CG C -1.102 -7.161 0.591 1.00 . A A . 14 LEU CG 1 1 8 2075 1 1 14 LEU H H -3.602 -4.159 1.328 1.00 . A A . 14 LEU H 1 1 8 2076 1 1 14 LEU HA H -2.417 -5.366 -1.026 1.00 . A A . 14 LEU HA 1 1 8 2077 1 1 14 LEU HB2 H -1.934 -5.494 1.605 1.00 . A A . 14 LEU HB2 1 1 8 2078 1 1 14 LEU HB3 H -3.007 -6.871 1.502 1.00 . A A . 14 LEU HB3 1 1 8 2079 1 1 14 LEU HD11 H -2.317 -8.911 0.299 1.00 . A A . 14 LEU HD11 1 1 8 2080 1 1 14 LEU HD12 H -1.824 -8.100 -1.206 1.00 . A A . 14 LEU HD12 1 1 8 2081 1 1 14 LEU HD13 H -0.647 -9.065 -0.290 1.00 . A A . 14 LEU HD13 1 1 8 2082 1 1 14 LEU HD21 H 0.880 -7.008 -0.224 1.00 . A A . 14 LEU HD21 1 1 8 2083 1 1 14 LEU HD22 H -0.354 -6.124 -1.146 1.00 . A A . 14 LEU HD22 1 1 8 2084 1 1 14 LEU HD23 H 0.230 -5.480 0.406 1.00 . A A . 14 LEU HD23 1 1 8 2085 1 1 14 LEU HG H -0.681 -7.501 1.536 1.00 . A A . 14 LEU HG 1 1 8 2086 1 1 14 LEU N N -3.595 -4.299 0.328 1.00 . A A . 14 LEU N 1 1 8 2087 1 1 14 LEU O O -4.108 -7.185 -1.643 1.00 . A A . 14 LEU O 1 1 8 2088 1 1 15 ILE C C -7.211 -6.326 -1.524 1.00 . A A . 15 ILE C 1 1 8 2089 1 1 15 ILE CA C -6.580 -7.051 -0.336 1.00 . A A . 15 ILE CA 1 1 8 2090 1 1 15 ILE CB C -7.606 -7.156 0.822 1.00 . A A . 15 ILE CB 1 1 8 2091 1 1 15 ILE CD1 C -7.924 -6.850 3.357 1.00 . A A . 15 ILE CD1 1 1 8 2092 1 1 15 ILE CG1 C -6.957 -6.896 2.188 1.00 . A A . 15 ILE CG1 1 1 8 2093 1 1 15 ILE CG2 C -8.260 -8.540 0.805 1.00 . A A . 15 ILE CG2 1 1 8 2094 1 1 15 ILE H H -5.383 -5.712 0.816 1.00 . A A . 15 ILE H 1 1 8 2095 1 1 15 ILE HA H -6.309 -8.059 -0.648 1.00 . A A . 15 ILE HA 1 1 8 2096 1 1 15 ILE HB H -8.384 -6.409 0.667 1.00 . A A . 15 ILE HB 1 1 8 2097 1 1 15 ILE HD11 H -8.351 -7.837 3.527 1.00 . A A . 15 ILE HD11 1 1 8 2098 1 1 15 ILE HD12 H -7.388 -6.534 4.253 1.00 . A A . 15 ILE HD12 1 1 8 2099 1 1 15 ILE HD13 H -8.721 -6.136 3.145 1.00 . A A . 15 ILE HD13 1 1 8 2100 1 1 15 ILE HG12 H -6.220 -7.678 2.375 1.00 . A A . 15 ILE HG12 1 1 8 2101 1 1 15 ILE HG13 H -6.445 -5.936 2.161 1.00 . A A . 15 ILE HG13 1 1 8 2102 1 1 15 ILE HG21 H -8.640 -8.759 -0.192 1.00 . A A . 15 ILE HG21 1 1 8 2103 1 1 15 ILE HG22 H -7.530 -9.300 1.084 1.00 . A A . 15 ILE HG22 1 1 8 2104 1 1 15 ILE HG23 H -9.095 -8.566 1.507 1.00 . A A . 15 ILE HG23 1 1 8 2105 1 1 15 ILE N N -5.357 -6.341 0.027 1.00 . A A . 15 ILE N 1 1 8 2106 1 1 15 ILE O O -6.719 -5.283 -1.952 1.00 . A A . 15 ILE O 1 1 8 2107 1 1 16 TRP C C -9.574 -4.927 -3.056 1.00 . A A . 16 TRP C 1 1 8 2108 1 1 16 TRP CA C -8.971 -6.320 -3.236 1.00 . A A . 16 TRP CA 1 1 8 2109 1 1 16 TRP CB C -10.065 -7.277 -3.723 1.00 . A A . 16 TRP CB 1 1 8 2110 1 1 16 TRP CD1 C -11.177 -8.772 -1.955 1.00 . A A . 16 TRP CD1 1 1 8 2111 1 1 16 TRP CD2 C -9.428 -9.717 -2.960 1.00 . A A . 16 TRP CD2 1 1 8 2112 1 1 16 TRP CE2 C -9.950 -10.626 -2.010 1.00 . A A . 16 TRP CE2 1 1 8 2113 1 1 16 TRP CE3 C -8.278 -10.079 -3.674 1.00 . A A . 16 TRP CE3 1 1 8 2114 1 1 16 TRP CG C -10.229 -8.526 -2.902 1.00 . A A . 16 TRP CG 1 1 8 2115 1 1 16 TRP CH2 C -8.252 -12.215 -2.501 1.00 . A A . 16 TRP CH2 1 1 8 2116 1 1 16 TRP CZ2 C -9.366 -11.875 -1.775 1.00 . A A . 16 TRP CZ2 1 1 8 2117 1 1 16 TRP CZ3 C -7.703 -11.328 -3.447 1.00 . A A . 16 TRP CZ3 1 1 8 2118 1 1 16 TRP H H -8.696 -7.701 -1.648 1.00 . A A . 16 TRP H 1 1 8 2119 1 1 16 TRP HA H -8.224 -6.244 -4.026 1.00 . A A . 16 TRP HA 1 1 8 2120 1 1 16 TRP HB2 H -11.016 -6.744 -3.735 1.00 . A A . 16 TRP HB2 1 1 8 2121 1 1 16 TRP HB3 H -9.834 -7.567 -4.748 1.00 . A A . 16 TRP HB3 1 1 8 2122 1 1 16 TRP HD1 H -11.947 -8.070 -1.670 1.00 . A A . 16 TRP HD1 1 1 8 2123 1 1 16 TRP HE1 H -11.616 -10.407 -0.692 1.00 . A A . 16 TRP HE1 1 1 8 2124 1 1 16 TRP HE3 H -7.839 -9.391 -4.382 1.00 . A A . 16 TRP HE3 1 1 8 2125 1 1 16 TRP HH2 H -7.782 -13.174 -2.337 1.00 . A A . 16 TRP HH2 1 1 8 2126 1 1 16 TRP HZ2 H -9.773 -12.549 -1.036 1.00 . A A . 16 TRP HZ2 1 1 8 2127 1 1 16 TRP HZ3 H -6.819 -11.616 -3.999 1.00 . A A . 16 TRP HZ3 1 1 8 2128 1 1 16 TRP N N -8.306 -6.862 -2.053 1.00 . A A . 16 TRP N 1 1 8 2129 1 1 16 TRP NE1 N -11.026 -10.022 -1.416 1.00 . A A . 16 TRP NE1 1 1 8 2130 1 1 16 TRP O O -10.128 -4.361 -3.998 1.00 . A A . 16 TRP O 1 1 8 2131 1 1 17 CYS C C -8.928 -2.026 -2.323 1.00 . A A . 17 CYS C 1 1 8 2132 1 1 17 CYS CA C -9.871 -2.988 -1.604 1.00 . A A . 17 CYS CA 1 1 8 2133 1 1 17 CYS CB C -9.886 -2.713 -0.096 1.00 . A A . 17 CYS CB 1 1 8 2134 1 1 17 CYS H H -9.017 -4.874 -1.109 1.00 . A A . 17 CYS H 1 1 8 2135 1 1 17 CYS HA H -10.875 -2.844 -2.002 1.00 . A A . 17 CYS HA 1 1 8 2136 1 1 17 CYS HB2 H -9.765 -1.642 0.068 1.00 . A A . 17 CYS HB2 1 1 8 2137 1 1 17 CYS HB3 H -10.865 -3.002 0.288 1.00 . A A . 17 CYS HB3 1 1 8 2138 1 1 17 CYS N N -9.464 -4.366 -1.857 1.00 . A A . 17 CYS N 1 1 8 2139 1 1 17 CYS O O -7.809 -2.369 -2.700 1.00 . A A . 17 CYS O 1 1 8 2140 1 1 17 CYS SG S -8.623 -3.607 0.867 1.00 . A A . 17 CYS SG 1 1 8 2141 1 1 18 ASP C C -7.161 0.290 -2.803 1.00 . A A . 18 ASP C 1 1 8 2142 1 1 18 ASP CA C -8.603 0.225 -3.260 1.00 . A A . 18 ASP CA 1 1 8 2143 1 1 18 ASP CB C -9.252 1.613 -3.166 1.00 . A A . 18 ASP CB 1 1 8 2144 1 1 18 ASP CG C -8.475 2.606 -3.991 1.00 . A A . 18 ASP CG 1 1 8 2145 1 1 18 ASP H H -10.294 -0.517 -2.175 1.00 . A A . 18 ASP H 1 1 8 2146 1 1 18 ASP HA H -8.555 -0.072 -4.311 1.00 . A A . 18 ASP HA 1 1 8 2147 1 1 18 ASP HB2 H -10.280 1.570 -3.527 1.00 . A A . 18 ASP HB2 1 1 8 2148 1 1 18 ASP HB3 H -9.266 1.945 -2.127 1.00 . A A . 18 ASP HB3 1 1 8 2149 1 1 18 ASP N N -9.385 -0.778 -2.525 1.00 . A A . 18 ASP N 1 1 8 2150 1 1 18 ASP O O -6.293 0.516 -3.623 1.00 . A A . 18 ASP O 1 1 8 2151 1 1 18 ASP OD1 O -7.909 3.515 -3.418 1.00 . A A . 18 ASP OD1 1 1 8 2152 1 1 18 ASP OD2 O -8.434 2.459 -5.194 1.00 . A A . 18 ASP OD2 1 1 9 2153 1 1 1 GLY C C 2.673 -0.149 -2.635 1.00 . A A . 1 GLY C 1 1 9 2154 1 1 1 GLY CA C 2.313 -0.958 -1.405 1.00 . A A . 1 GLY CA 1 1 9 2155 1 1 1 GLY H1 H 1.917 0.890 -0.462 1.00 . A A . 1 GLY H1 1 1 9 2156 1 1 1 GLY HA2 H 3.196 -1.505 -1.080 1.00 . A A . 1 GLY HA2 1 1 9 2157 1 1 1 GLY HA3 H 1.533 -1.668 -1.679 1.00 . A A . 1 GLY HA3 1 1 9 2158 1 1 1 GLY N N 1.833 -0.106 -0.328 1.00 . A A . 1 GLY N 1 1 9 2159 1 1 1 GLY O O 3.831 0.221 -2.817 1.00 . A A . 1 GLY O 1 1 9 2160 1 1 2 SER C C 0.724 1.589 -5.294 1.00 . A A . 2 SER C 1 1 9 2161 1 1 2 SER CA C 1.935 0.851 -4.729 1.00 . A A . 2 SER CA 1 1 9 2162 1 1 2 SER CB C 2.432 -0.128 -5.793 1.00 . A A . 2 SER CB 1 1 9 2163 1 1 2 SER H H 0.750 -0.179 -3.277 1.00 . A A . 2 SER H 1 1 9 2164 1 1 2 SER HA H 2.721 1.585 -4.551 1.00 . A A . 2 SER HA 1 1 9 2165 1 1 2 SER HB2 H 3.248 -0.719 -5.380 1.00 . A A . 2 SER HB2 1 1 9 2166 1 1 2 SER HB3 H 1.618 -0.797 -6.073 1.00 . A A . 2 SER HB3 1 1 9 2167 1 1 2 SER HG H 2.304 1.314 -7.099 1.00 . A A . 2 SER HG 1 1 9 2168 1 1 2 SER N N 1.690 0.126 -3.486 1.00 . A A . 2 SER N 1 1 9 2169 1 1 2 SER O O 0.839 2.739 -5.715 1.00 . A A . 2 SER O 1 1 9 2170 1 1 2 SER OG O 2.887 0.571 -6.939 1.00 . A A . 2 SER OG 1 1 9 2171 1 1 3 ARG C C -2.292 2.573 -5.320 1.00 . A A . 3 ARG C 1 1 9 2172 1 1 3 ARG CA C -1.611 1.408 -6.038 1.00 . A A . 3 ARG CA 1 1 9 2173 1 1 3 ARG CB C -2.606 0.260 -6.246 1.00 . A A . 3 ARG CB 1 1 9 2174 1 1 3 ARG CD C -1.231 -0.934 -8.020 1.00 . A A . 3 ARG CD 1 1 9 2175 1 1 3 ARG CG C -2.030 -1.067 -6.732 1.00 . A A . 3 ARG CG 1 1 9 2176 1 1 3 ARG CZ C -0.148 -2.442 -9.657 1.00 . A A . 3 ARG CZ 1 1 9 2177 1 1 3 ARG H H -0.451 -0.026 -4.974 1.00 . A A . 3 ARG H 1 1 9 2178 1 1 3 ARG HA H -1.306 1.782 -7.015 1.00 . A A . 3 ARG HA 1 1 9 2179 1 1 3 ARG HB2 H -3.114 0.076 -5.300 1.00 . A A . 3 ARG HB2 1 1 9 2180 1 1 3 ARG HB3 H -3.356 0.583 -6.969 1.00 . A A . 3 ARG HB3 1 1 9 2181 1 1 3 ARG HD2 H -1.814 -0.353 -8.734 1.00 . A A . 3 ARG HD2 1 1 9 2182 1 1 3 ARG HD3 H -0.303 -0.401 -7.808 1.00 . A A . 3 ARG HD3 1 1 9 2183 1 1 3 ARG HE H -1.313 -3.052 -8.145 1.00 . A A . 3 ARG HE 1 1 9 2184 1 1 3 ARG HG2 H -1.385 -1.485 -5.959 1.00 . A A . 3 ARG HG2 1 1 9 2185 1 1 3 ARG HG3 H -2.854 -1.759 -6.900 1.00 . A A . 3 ARG HG3 1 1 9 2186 1 1 3 ARG HH11 H 0.268 -0.500 -10.007 1.00 . A A . 3 ARG HH11 1 1 9 2187 1 1 3 ARG HH12 H 0.983 -1.650 -11.124 1.00 . A A . 3 ARG HH12 1 1 9 2188 1 1 3 ARG HH21 H -0.357 -4.441 -9.575 1.00 . A A . 3 ARG HH21 1 1 9 2189 1 1 3 ARG HH22 H 0.659 -3.832 -10.872 1.00 . A A . 3 ARG HH22 1 1 9 2190 1 1 3 ARG N N -0.416 0.907 -5.358 1.00 . A A . 3 ARG N 1 1 9 2191 1 1 3 ARG NE N -0.914 -2.242 -8.593 1.00 . A A . 3 ARG NE 1 1 9 2192 1 1 3 ARG NH1 N 0.413 -1.448 -10.318 1.00 . A A . 3 ARG NH1 1 1 9 2193 1 1 3 ARG NH2 N 0.067 -3.672 -10.072 1.00 . A A . 3 ARG NH2 1 1 9 2194 1 1 3 ARG O O -1.704 3.195 -4.439 1.00 . A A . 3 ARG O 1 1 9 2195 1 1 4 GLY C C -4.411 3.684 -3.536 1.00 . A A . 4 GLY C 1 1 9 2196 1 1 4 GLY CA C -4.255 3.953 -5.021 1.00 . A A . 4 GLY CA 1 1 9 2197 1 1 4 GLY H H -4.005 2.342 -6.394 1.00 . A A . 4 GLY H 1 1 9 2198 1 1 4 GLY HA2 H -3.696 4.880 -5.144 1.00 . A A . 4 GLY HA2 1 1 9 2199 1 1 4 GLY HA3 H -5.241 4.067 -5.472 1.00 . A A . 4 GLY HA3 1 1 9 2200 1 1 4 GLY N N -3.534 2.877 -5.682 1.00 . A A . 4 GLY N 1 1 9 2201 1 1 4 GLY O O -4.174 2.566 -3.083 1.00 . A A . 4 GLY O 1 1 9 2202 1 1 5 TRP C C -5.608 3.408 -0.778 1.00 . A A . 5 TRP C 1 1 9 2203 1 1 5 TRP CA C -4.827 4.605 -1.313 1.00 . A A . 5 TRP CA 1 1 9 2204 1 1 5 TRP CB C -5.432 5.880 -0.722 1.00 . A A . 5 TRP CB 1 1 9 2205 1 1 5 TRP CD1 C -5.891 7.929 -2.192 1.00 . A A . 5 TRP CD1 1 1 9 2206 1 1 5 TRP CD2 C -3.769 7.747 -1.548 1.00 . A A . 5 TRP CD2 1 1 9 2207 1 1 5 TRP CE2 C -3.895 8.896 -2.363 1.00 . A A . 5 TRP CE2 1 1 9 2208 1 1 5 TRP CE3 C -2.504 7.421 -1.042 1.00 . A A . 5 TRP CE3 1 1 9 2209 1 1 5 TRP CG C -5.064 7.133 -1.462 1.00 . A A . 5 TRP CG 1 1 9 2210 1 1 5 TRP CH2 C -1.578 9.380 -2.155 1.00 . A A . 5 TRP CH2 1 1 9 2211 1 1 5 TRP CZ2 C -2.805 9.716 -2.670 1.00 . A A . 5 TRP CZ2 1 1 9 2212 1 1 5 TRP CZ3 C -1.418 8.241 -1.342 1.00 . A A . 5 TRP CZ3 1 1 9 2213 1 1 5 TRP H H -5.042 5.585 -3.186 1.00 . A A . 5 TRP H 1 1 9 2214 1 1 5 TRP HA H -3.799 4.520 -0.963 1.00 . A A . 5 TRP HA 1 1 9 2215 1 1 5 TRP HB2 H -6.518 5.779 -0.731 1.00 . A A . 5 TRP HB2 1 1 9 2216 1 1 5 TRP HB3 H -5.106 5.972 0.314 1.00 . A A . 5 TRP HB3 1 1 9 2217 1 1 5 TRP HD1 H -6.950 7.750 -2.317 1.00 . A A . 5 TRP HD1 1 1 9 2218 1 1 5 TRP HE1 H -5.634 9.707 -3.301 1.00 . A A . 5 TRP HE1 1 1 9 2219 1 1 5 TRP HE3 H -2.378 6.537 -0.434 1.00 . A A . 5 TRP HE3 1 1 9 2220 1 1 5 TRP HH2 H -0.719 9.996 -2.379 1.00 . A A . 5 TRP HH2 1 1 9 2221 1 1 5 TRP HZ2 H -2.922 10.585 -3.300 1.00 . A A . 5 TRP HZ2 1 1 9 2222 1 1 5 TRP HZ3 H -0.441 7.998 -0.950 1.00 . A A . 5 TRP HZ3 1 1 9 2223 1 1 5 TRP N N -4.791 4.700 -2.770 1.00 . A A . 5 TRP N 1 1 9 2224 1 1 5 TRP NE1 N -5.211 8.988 -2.733 1.00 . A A . 5 TRP NE1 1 1 9 2225 1 1 5 TRP O O -6.632 3.025 -1.343 1.00 . A A . 5 TRP O 1 1 9 2226 1 1 6 GLY C C -5.099 1.030 2.071 1.00 . A A . 6 GLY C 1 1 9 2227 1 1 6 GLY CA C -5.849 1.729 0.952 1.00 . A A . 6 GLY CA 1 1 9 2228 1 1 6 GLY H H -4.265 3.134 0.731 1.00 . A A . 6 GLY H 1 1 9 2229 1 1 6 GLY HA2 H -6.785 2.114 1.355 1.00 . A A . 6 GLY HA2 1 1 9 2230 1 1 6 GLY HA3 H -6.092 0.991 0.187 1.00 . A A . 6 GLY HA3 1 1 9 2231 1 1 6 GLY N N -5.133 2.822 0.318 1.00 . A A . 6 GLY N 1 1 9 2232 1 1 6 GLY O O -4.594 1.669 2.993 1.00 . A A . 6 GLY O 1 1 9 2233 1 1 7 PHE C C -2.856 -1.155 2.625 1.00 . A A . 7 PHE C 1 1 9 2234 1 1 7 PHE CA C -4.346 -1.126 2.969 1.00 . A A . 7 PHE CA 1 1 9 2235 1 1 7 PHE CB C -4.968 -2.529 2.990 1.00 . A A . 7 PHE CB 1 1 9 2236 1 1 7 PHE CD1 C -7.034 -1.792 4.230 1.00 . A A . 7 PHE CD1 1 1 9 2237 1 1 7 PHE CD2 C -5.959 -3.825 4.900 1.00 . A A . 7 PHE CD2 1 1 9 2238 1 1 7 PHE CE1 C -8.005 -1.974 5.212 1.00 . A A . 7 PHE CE1 1 1 9 2239 1 1 7 PHE CE2 C -6.922 -4.014 5.889 1.00 . A A . 7 PHE CE2 1 1 9 2240 1 1 7 PHE CG C -6.009 -2.717 4.060 1.00 . A A . 7 PHE CG 1 1 9 2241 1 1 7 PHE CZ C -7.952 -3.091 6.040 1.00 . A A . 7 PHE CZ 1 1 9 2242 1 1 7 PHE H H -5.490 -0.760 1.214 1.00 . A A . 7 PHE H 1 1 9 2243 1 1 7 PHE HA H -4.457 -0.680 3.958 1.00 . A A . 7 PHE HA 1 1 9 2244 1 1 7 PHE HB2 H -5.420 -2.728 2.020 1.00 . A A . 7 PHE HB2 1 1 9 2245 1 1 7 PHE HB3 H -4.197 -3.281 3.145 1.00 . A A . 7 PHE HB3 1 1 9 2246 1 1 7 PHE HD1 H -7.073 -0.912 3.606 1.00 . A A . 7 PHE HD1 1 1 9 2247 1 1 7 PHE HD2 H -5.171 -4.554 4.784 1.00 . A A . 7 PHE HD2 1 1 9 2248 1 1 7 PHE HE1 H -8.792 -1.245 5.338 1.00 . A A . 7 PHE HE1 1 1 9 2249 1 1 7 PHE HE2 H -6.876 -4.881 6.531 1.00 . A A . 7 PHE HE2 1 1 9 2250 1 1 7 PHE HZ H -8.703 -3.237 6.802 1.00 . A A . 7 PHE HZ 1 1 9 2251 1 1 7 PHE N N -5.046 -0.296 1.992 1.00 . A A . 7 PHE N 1 1 9 2252 1 1 7 PHE O O -2.394 -0.335 1.835 1.00 . A A . 7 PHE O 1 1 9 2253 1 1 8 GLU C C 0.046 -1.077 3.798 1.00 . A A . 8 GLU C 1 1 9 2254 1 1 8 GLU CA C -0.650 -2.219 3.067 1.00 . A A . 8 GLU CA 1 1 9 2255 1 1 8 GLU CB C -0.275 -2.383 1.569 1.00 . A A . 8 GLU CB 1 1 9 2256 1 1 8 GLU CD C 1.211 -0.479 0.808 1.00 . A A . 8 GLU CD 1 1 9 2257 1 1 8 GLU CG C 1.152 -1.950 1.175 1.00 . A A . 8 GLU CG 1 1 9 2258 1 1 8 GLU H H -2.561 -2.781 3.813 1.00 . A A . 8 GLU H 1 1 9 2259 1 1 8 GLU HA H -0.349 -3.131 3.587 1.00 . A A . 8 GLU HA 1 1 9 2260 1 1 8 GLU HB2 H -0.400 -3.436 1.309 1.00 . A A . 8 GLU HB2 1 1 9 2261 1 1 8 GLU HB3 H -0.981 -1.831 0.950 1.00 . A A . 8 GLU HB3 1 1 9 2262 1 1 8 GLU HG2 H 1.854 -2.143 1.984 1.00 . A A . 8 GLU HG2 1 1 9 2263 1 1 8 GLU HG3 H 1.472 -2.561 0.331 1.00 . A A . 8 GLU HG3 1 1 9 2264 1 1 8 GLU N N -2.107 -2.108 3.218 1.00 . A A . 8 GLU N 1 1 9 2265 1 1 8 GLU O O -0.462 0.020 3.912 1.00 . A A . 8 GLU O 1 1 9 2266 1 1 8 GLU OE1 O 0.716 0.380 1.501 1.00 . A A . 8 GLU OE1 1 1 9 2267 1 1 9 PRO C C 2.503 0.727 3.912 1.00 . A A . 9 PRO C 1 1 9 2268 1 1 9 PRO CA C 2.018 -0.236 4.989 1.00 . A A . 9 PRO CA 1 1 9 2269 1 1 9 PRO CB C 3.179 -0.967 5.669 1.00 . A A . 9 PRO CB 1 1 9 2270 1 1 9 PRO CD C 1.875 -2.639 4.604 1.00 . A A . 9 PRO CD 1 1 9 2271 1 1 9 PRO CG C 3.296 -2.254 4.915 1.00 . A A . 9 PRO CG 1 1 9 2272 1 1 9 PRO HA H 1.427 0.309 5.725 1.00 . A A . 9 PRO HA 1 1 9 2273 1 1 9 PRO HB2 H 4.098 -0.386 5.596 1.00 . A A . 9 PRO HB2 1 1 9 2274 1 1 9 PRO HB3 H 2.932 -1.170 6.711 1.00 . A A . 9 PRO HB3 1 1 9 2275 1 1 9 PRO HD2 H 1.835 -3.248 3.701 1.00 . A A . 9 PRO HD2 1 1 9 2276 1 1 9 PRO HD3 H 1.423 -3.165 5.446 1.00 . A A . 9 PRO HD3 1 1 9 2277 1 1 9 PRO HG2 H 3.855 -2.099 3.992 1.00 . A A . 9 PRO HG2 1 1 9 2278 1 1 9 PRO HG3 H 3.772 -3.016 5.531 1.00 . A A . 9 PRO HG3 1 1 9 2279 1 1 9 PRO N N 1.226 -1.329 4.415 1.00 . A A . 9 PRO N 1 1 9 2280 1 1 9 PRO O O 3.203 0.345 2.973 1.00 . A A . 9 PRO O 1 1 9 2281 1 1 10 GLY C C 0.887 3.527 2.585 1.00 . A A . 10 GLY C 1 1 9 2282 1 1 10 GLY CA C 2.233 2.963 2.997 1.00 . A A . 10 GLY CA 1 1 9 2283 1 1 10 GLY H H 1.576 2.249 4.883 1.00 . A A . 10 GLY H 1 1 9 2284 1 1 10 GLY HA2 H 2.860 3.782 3.348 1.00 . A A . 10 GLY HA2 1 1 9 2285 1 1 10 GLY HA3 H 2.701 2.502 2.128 1.00 . A A . 10 GLY HA3 1 1 9 2286 1 1 10 GLY N N 2.088 1.981 4.056 1.00 . A A . 10 GLY N 1 1 9 2287 1 1 10 GLY O O 0.839 4.572 1.938 1.00 . A A . 10 GLY O 1 1 9 2288 1 1 11 VAL C C -1.788 3.262 1.166 1.00 . A A . 11 VAL C 1 1 9 2289 1 1 11 VAL CA C -1.564 3.262 2.675 1.00 . A A . 11 VAL CA 1 1 9 2290 1 1 11 VAL CB C -1.938 4.637 3.283 1.00 . A A . 11 VAL CB 1 1 9 2291 1 1 11 VAL CG1 C -3.453 4.845 3.273 1.00 . A A . 11 VAL CG1 1 1 9 2292 1 1 11 VAL CG2 C -1.440 4.757 4.724 1.00 . A A . 11 VAL CG2 1 1 9 2293 1 1 11 VAL H H -0.061 1.978 3.469 1.00 . A A . 11 VAL H 1 1 9 2294 1 1 11 VAL HA H -2.237 2.517 3.101 1.00 . A A . 11 VAL HA 1 1 9 2295 1 1 11 VAL HB H -1.475 5.427 2.693 1.00 . A A . 11 VAL HB 1 1 9 2296 1 1 11 VAL HG11 H -3.829 4.807 2.251 1.00 . A A . 11 VAL HG11 1 1 9 2297 1 1 11 VAL HG12 H -3.937 4.067 3.865 1.00 . A A . 11 VAL HG12 1 1 9 2298 1 1 11 VAL HG13 H -3.691 5.820 3.699 1.00 . A A . 11 VAL HG13 1 1 9 2299 1 1 11 VAL HG21 H -0.351 4.780 4.738 1.00 . A A . 11 VAL HG21 1 1 9 2300 1 1 11 VAL HG22 H -1.815 5.682 5.166 1.00 . A A . 11 VAL HG22 1 1 9 2301 1 1 11 VAL HG23 H -1.795 3.909 5.309 1.00 . A A . 11 VAL HG23 1 1 9 2302 1 1 11 VAL N N -0.190 2.848 2.970 1.00 . A A . 11 VAL N 1 1 9 2303 1 1 11 VAL O O -2.241 4.244 0.580 1.00 . A A . 11 VAL O 1 1 9 2304 1 1 12 ARG C C -2.153 0.547 -1.180 1.00 . A A . 12 ARG C 1 1 9 2305 1 1 12 ARG CA C -1.646 1.963 -0.911 1.00 . A A . 12 ARG CA 1 1 9 2306 1 1 12 ARG CB C -0.325 2.210 -1.646 1.00 . A A . 12 ARG CB 1 1 9 2307 1 1 12 ARG CD C -0.282 4.732 -1.989 1.00 . A A . 12 ARG CD 1 1 9 2308 1 1 12 ARG CG C 0.389 3.524 -1.351 1.00 . A A . 12 ARG CG 1 1 9 2309 1 1 12 ARG CZ C 1.381 5.816 -3.480 1.00 . A A . 12 ARG CZ 1 1 9 2310 1 1 12 ARG H H -1.117 1.359 1.070 1.00 . A A . 12 ARG H 1 1 9 2311 1 1 12 ARG HA H -2.380 2.680 -1.275 1.00 . A A . 12 ARG HA 1 1 9 2312 1 1 12 ARG HB2 H 0.355 1.408 -1.376 1.00 . A A . 12 ARG HB2 1 1 9 2313 1 1 12 ARG HB3 H -0.499 2.140 -2.719 1.00 . A A . 12 ARG HB3 1 1 9 2314 1 1 12 ARG HD2 H -1.344 4.526 -2.119 1.00 . A A . 12 ARG HD2 1 1 9 2315 1 1 12 ARG HD3 H -0.186 5.580 -1.312 1.00 . A A . 12 ARG HD3 1 1 9 2316 1 1 12 ARG HE H -0.142 4.669 -4.100 1.00 . A A . 12 ARG HE 1 1 9 2317 1 1 12 ARG HG2 H 0.434 3.671 -0.273 1.00 . A A . 12 ARG HG2 1 1 9 2318 1 1 12 ARG HG3 H 1.410 3.456 -1.723 1.00 . A A . 12 ARG HG3 1 1 9 2319 1 1 12 ARG HH11 H 1.718 6.255 -1.545 1.00 . A A . 12 ARG HH11 1 1 9 2320 1 1 12 ARG HH12 H 2.873 6.918 -2.690 1.00 . A A . 12 ARG HH12 1 1 9 2321 1 1 12 ARG HH21 H 1.345 5.527 -5.466 1.00 . A A . 12 ARG HH21 1 1 9 2322 1 1 12 ARG HH22 H 2.622 6.582 -4.873 1.00 . A A . 12 ARG HH22 1 1 9 2323 1 1 12 ARG N N -1.477 2.136 0.532 1.00 . A A . 12 ARG N 1 1 9 2324 1 1 12 ARG NE N 0.306 5.063 -3.287 1.00 . A A . 12 ARG NE 1 1 9 2325 1 1 12 ARG NH1 N 2.047 6.377 -2.490 1.00 . A A . 12 ARG NH1 1 1 9 2326 1 1 12 ARG NH2 N 1.820 5.994 -4.709 1.00 . A A . 12 ARG NH2 1 1 9 2327 1 1 12 ARG O O -1.431 -0.426 -0.963 1.00 . A A . 12 ARG O 1 1 9 2328 1 1 13 CYS C C -3.332 -1.911 -2.486 1.00 . A A . 13 CYS C 1 1 9 2329 1 1 13 CYS CA C -4.104 -0.837 -1.726 1.00 . A A . 13 CYS CA 1 1 9 2330 1 1 13 CYS CB C -5.465 -0.642 -2.401 1.00 . A A . 13 CYS CB 1 1 9 2331 1 1 13 CYS H H -3.852 1.261 -2.010 1.00 . A A . 13 CYS H 1 1 9 2332 1 1 13 CYS HA H -4.258 -1.195 -0.709 1.00 . A A . 13 CYS HA 1 1 9 2333 1 1 13 CYS HB2 H -6.010 0.142 -1.874 1.00 . A A . 13 CYS HB2 1 1 9 2334 1 1 13 CYS HB3 H -5.292 -0.306 -3.423 1.00 . A A . 13 CYS HB3 1 1 9 2335 1 1 13 CYS N N -3.387 0.434 -1.661 1.00 . A A . 13 CYS N 1 1 9 2336 1 1 13 CYS O O -2.925 -1.714 -3.631 1.00 . A A . 13 CYS O 1 1 9 2337 1 1 13 CYS SG S -6.517 -2.130 -2.466 1.00 . A A . 13 CYS SG 1 1 9 2338 1 1 14 LEU C C -3.221 -5.499 -2.211 1.00 . A A . 14 LEU C 1 1 9 2339 1 1 14 LEU CA C -2.465 -4.194 -2.441 1.00 . A A . 14 LEU CA 1 1 9 2340 1 1 14 LEU CB C -1.050 -4.277 -1.859 1.00 . A A . 14 LEU CB 1 1 9 2341 1 1 14 LEU CD1 C 0.158 -5.632 -3.601 1.00 . A A . 14 LEU CD1 1 1 9 2342 1 1 14 LEU CD2 C 0.135 -3.141 -3.799 1.00 . A A . 14 LEU CD2 1 1 9 2343 1 1 14 LEU CG C 0.131 -4.319 -2.831 1.00 . A A . 14 LEU CG 1 1 9 2344 1 1 14 LEU H H -3.472 -3.150 -0.888 1.00 . A A . 14 LEU H 1 1 9 2345 1 1 14 LEU HA H -2.405 -4.038 -3.519 1.00 . A A . 14 LEU HA 1 1 9 2346 1 1 14 LEU HB2 H -0.908 -3.410 -1.215 1.00 . A A . 14 LEU HB2 1 1 9 2347 1 1 14 LEU HB3 H -0.992 -5.162 -1.227 1.00 . A A . 14 LEU HB3 1 1 9 2348 1 1 14 LEU HD11 H 0.209 -6.466 -2.900 1.00 . A A . 14 LEU HD11 1 1 9 2349 1 1 14 LEU HD12 H -0.742 -5.727 -4.208 1.00 . A A . 14 LEU HD12 1 1 9 2350 1 1 14 LEU HD13 H 1.034 -5.657 -4.250 1.00 . A A . 14 LEU HD13 1 1 9 2351 1 1 14 LEU HD21 H -0.648 -3.270 -4.545 1.00 . A A . 14 LEU HD21 1 1 9 2352 1 1 14 LEU HD22 H -0.042 -2.216 -3.250 1.00 . A A . 14 LEU HD22 1 1 9 2353 1 1 14 LEU HD23 H 1.103 -3.087 -4.299 1.00 . A A . 14 LEU HD23 1 1 9 2354 1 1 14 LEU HG H 1.038 -4.260 -2.231 1.00 . A A . 14 LEU HG 1 1 9 2355 1 1 14 LEU N N -3.145 -3.056 -1.837 1.00 . A A . 14 LEU N 1 1 9 2356 1 1 14 LEU O O -3.369 -6.302 -3.130 1.00 . A A . 14 LEU O 1 1 9 2357 1 1 15 ILE C C -5.767 -6.527 0.011 1.00 . A A . 15 ILE C 1 1 9 2358 1 1 15 ILE CA C -4.437 -6.914 -0.631 1.00 . A A . 15 ILE CA 1 1 9 2359 1 1 15 ILE CB C -3.651 -7.817 0.347 1.00 . A A . 15 ILE CB 1 1 9 2360 1 1 15 ILE CD1 C -1.348 -8.905 0.709 1.00 . A A . 15 ILE CD1 1 1 9 2361 1 1 15 ILE CG1 C -2.268 -8.146 -0.228 1.00 . A A . 15 ILE CG1 1 1 9 2362 1 1 15 ILE CG2 C -4.446 -9.089 0.627 1.00 . A A . 15 ILE CG2 1 1 9 2363 1 1 15 ILE H H -3.508 -5.040 -0.255 1.00 . A A . 15 ILE H 1 1 9 2364 1 1 15 ILE HA H -4.638 -7.480 -1.540 1.00 . A A . 15 ILE HA 1 1 9 2365 1 1 15 ILE HB H -3.514 -7.278 1.286 1.00 . A A . 15 ILE HB 1 1 9 2366 1 1 15 ILE HD11 H -0.352 -8.961 0.268 1.00 . A A . 15 ILE HD11 1 1 9 2367 1 1 15 ILE HD12 H -1.288 -8.384 1.665 1.00 . A A . 15 ILE HD12 1 1 9 2368 1 1 15 ILE HD13 H -1.725 -9.916 0.866 1.00 . A A . 15 ILE HD13 1 1 9 2369 1 1 15 ILE HG12 H -2.402 -8.726 -1.141 1.00 . A A . 15 ILE HG12 1 1 9 2370 1 1 15 ILE HG13 H -1.763 -7.218 -0.495 1.00 . A A . 15 ILE HG13 1 1 9 2371 1 1 15 ILE HG21 H -5.400 -8.827 1.085 1.00 . A A . 15 ILE HG21 1 1 9 2372 1 1 15 ILE HG22 H -4.631 -9.627 -0.304 1.00 . A A . 15 ILE HG22 1 1 9 2373 1 1 15 ILE HG23 H -3.898 -9.732 1.316 1.00 . A A . 15 ILE HG23 1 1 9 2374 1 1 15 ILE N N -3.685 -5.713 -0.984 1.00 . A A . 15 ILE N 1 1 9 2375 1 1 15 ILE O O -5.786 -5.891 1.065 1.00 . A A . 15 ILE O 1 1 9 2376 1 1 16 TRP C C -8.451 -5.509 0.724 1.00 . A A . 16 TRP C 1 1 9 2377 1 1 16 TRP CA C -8.229 -6.711 -0.191 1.00 . A A . 16 TRP CA 1 1 9 2378 1 1 16 TRP CB C -8.748 -7.983 0.490 1.00 . A A . 16 TRP CB 1 1 9 2379 1 1 16 TRP CD1 C -7.617 -10.281 0.472 1.00 . A A . 16 TRP CD1 1 1 9 2380 1 1 16 TRP CD2 C -8.433 -9.682 -1.510 1.00 . A A . 16 TRP CD2 1 1 9 2381 1 1 16 TRP CE2 C -7.753 -10.913 -1.654 1.00 . A A . 16 TRP CE2 1 1 9 2382 1 1 16 TRP CE3 C -9.022 -9.107 -2.644 1.00 . A A . 16 TRP CE3 1 1 9 2383 1 1 16 TRP CG C -8.285 -9.265 -0.143 1.00 . A A . 16 TRP CG 1 1 9 2384 1 1 16 TRP CH2 C -8.193 -10.961 -3.989 1.00 . A A . 16 TRP CH2 1 1 9 2385 1 1 16 TRP CZ2 C -7.614 -11.549 -2.891 1.00 . A A . 16 TRP CZ2 1 1 9 2386 1 1 16 TRP CZ3 C -8.902 -9.749 -3.874 1.00 . A A . 16 TRP CZ3 1 1 9 2387 1 1 16 TRP H H -6.738 -7.406 -1.522 1.00 . A A . 16 TRP H 1 1 9 2388 1 1 16 TRP HA H -8.849 -6.546 -1.072 1.00 . A A . 16 TRP HA 1 1 9 2389 1 1 16 TRP HB2 H -8.419 -7.981 1.529 1.00 . A A . 16 TRP HB2 1 1 9 2390 1 1 16 TRP HB3 H -9.837 -7.958 0.478 1.00 . A A . 16 TRP HB3 1 1 9 2391 1 1 16 TRP HD1 H -7.365 -10.292 1.522 1.00 . A A . 16 TRP HD1 1 1 9 2392 1 1 16 TRP HE1 H -6.790 -12.114 -0.172 1.00 . A A . 16 TRP HE1 1 1 9 2393 1 1 16 TRP HE3 H -9.557 -8.171 -2.567 1.00 . A A . 16 TRP HE3 1 1 9 2394 1 1 16 TRP HH2 H -8.103 -11.434 -4.955 1.00 . A A . 16 TRP HH2 1 1 9 2395 1 1 16 TRP HZ2 H -7.060 -12.470 -2.981 1.00 . A A . 16 TRP HZ2 1 1 9 2396 1 1 16 TRP HZ3 H -9.350 -9.309 -4.754 1.00 . A A . 16 TRP HZ3 1 1 9 2397 1 1 16 TRP N N -6.855 -6.911 -0.650 1.00 . A A . 16 TRP N 1 1 9 2398 1 1 16 TRP NE1 N -7.293 -11.273 -0.416 1.00 . A A . 16 TRP NE1 1 1 9 2399 1 1 16 TRP O O -8.848 -5.648 1.882 1.00 . A A . 16 TRP O 1 1 9 2400 1 1 17 CYS C C -9.835 -2.712 1.182 1.00 . A A . 17 CYS C 1 1 9 2401 1 1 17 CYS CA C -8.371 -3.097 0.986 1.00 . A A . 17 CYS CA 1 1 9 2402 1 1 17 CYS CB C -7.626 -1.938 0.322 1.00 . A A . 17 CYS CB 1 1 9 2403 1 1 17 CYS H H -7.899 -4.227 -0.758 1.00 . A A . 17 CYS H 1 1 9 2404 1 1 17 CYS HA H -7.935 -3.266 1.969 1.00 . A A . 17 CYS HA 1 1 9 2405 1 1 17 CYS HB2 H -7.772 -1.039 0.921 1.00 . A A . 17 CYS HB2 1 1 9 2406 1 1 17 CYS HB3 H -6.566 -2.184 0.307 1.00 . A A . 17 CYS HB3 1 1 9 2407 1 1 17 CYS N N -8.204 -4.313 0.200 1.00 . A A . 17 CYS N 1 1 9 2408 1 1 17 CYS O O -10.732 -3.131 0.453 1.00 . A A . 17 CYS O 1 1 9 2409 1 1 17 CYS SG S -8.150 -1.592 -1.387 1.00 . A A . 17 CYS SG 1 1 9 2410 1 1 18 ASP C C -11.697 -0.135 1.497 1.00 . A A . 18 ASP C 1 1 9 2411 1 1 18 ASP CA C -11.398 -1.284 2.440 1.00 . A A . 18 ASP CA 1 1 9 2412 1 1 18 ASP CB C -11.545 -0.818 3.898 1.00 . A A . 18 ASP CB 1 1 9 2413 1 1 18 ASP CG C -12.948 -0.329 4.157 1.00 . A A . 18 ASP CG 1 1 9 2414 1 1 18 ASP H H -9.318 -1.594 2.805 1.00 . A A . 18 ASP H 1 1 9 2415 1 1 18 ASP HA H -12.154 -2.044 2.235 1.00 . A A . 18 ASP HA 1 1 9 2416 1 1 18 ASP HB2 H -11.319 -1.643 4.577 1.00 . A A . 18 ASP HB2 1 1 9 2417 1 1 18 ASP HB3 H -10.842 -0.009 4.098 1.00 . A A . 18 ASP HB3 1 1 9 2418 1 1 18 ASP N N -10.075 -1.866 2.198 1.00 . A A . 18 ASP N 1 1 9 2419 1 1 18 ASP O O -10.892 0.773 1.408 1.00 . A A . 18 ASP O 1 1 9 2420 1 1 18 ASP OD1 O -13.718 -0.257 3.221 1.00 . A A . 18 ASP OD1 1 1 9 2421 1 1 18 ASP OD2 O -13.260 -0.036 5.291 1.00 . A A . 18 ASP OD2 1 1 10 2422 1 1 1 GLY C C 2.480 -0.625 -2.760 1.00 . A A . 1 GLY C 1 1 10 2423 1 1 1 GLY CA C 2.168 -1.300 -1.439 1.00 . A A . 1 GLY CA 1 1 10 2424 1 1 1 GLY H1 H 1.712 0.632 -0.719 1.00 . A A . 1 GLY H1 1 1 10 2425 1 1 1 GLY HA2 H 3.076 -1.779 -1.077 1.00 . A A . 1 GLY HA2 1 1 10 2426 1 1 1 GLY HA3 H 1.403 -2.058 -1.609 1.00 . A A . 1 GLY HA3 1 1 10 2427 1 1 1 GLY N N 1.693 -0.342 -0.456 1.00 . A A . 1 GLY N 1 1 10 2428 1 1 1 GLY O O 3.647 -0.456 -3.107 1.00 . A A . 1 GLY O 1 1 10 2429 1 1 2 SER C C 0.462 1.267 -5.291 1.00 . A A . 2 SER C 1 1 10 2430 1 1 2 SER CA C 1.634 0.432 -4.784 1.00 . A A . 2 SER CA 1 1 10 2431 1 1 2 SER CB C 1.957 -0.619 -5.847 1.00 . A A . 2 SER CB 1 1 10 2432 1 1 2 SER H H 0.506 -0.407 -3.169 1.00 . A A . 2 SER H 1 1 10 2433 1 1 2 SER HA H 2.494 1.095 -4.696 1.00 . A A . 2 SER HA 1 1 10 2434 1 1 2 SER HB2 H 2.811 -1.208 -5.515 1.00 . A A . 2 SER HB2 1 1 10 2435 1 1 2 SER HB3 H 1.100 -1.280 -5.970 1.00 . A A . 2 SER HB3 1 1 10 2436 1 1 2 SER HG H 2.884 0.707 -6.934 1.00 . A A . 2 SER HG 1 1 10 2437 1 1 2 SER N N 1.445 -0.235 -3.498 1.00 . A A . 2 SER N 1 1 10 2438 1 1 2 SER O O 0.645 2.411 -5.707 1.00 . A A . 2 SER O 1 1 10 2439 1 1 2 SER OG O 2.257 -0.003 -7.088 1.00 . A A . 2 SER OG 1 1 10 2440 1 1 3 ARG C C -2.488 2.437 -5.174 1.00 . A A . 3 ARG C 1 1 10 2441 1 1 3 ARG CA C -1.895 1.273 -5.964 1.00 . A A . 3 ARG CA 1 1 10 2442 1 1 3 ARG CB C -2.951 0.191 -6.216 1.00 . A A . 3 ARG CB 1 1 10 2443 1 1 3 ARG CD C -1.593 -0.955 -8.032 1.00 . A A . 3 ARG CD 1 1 10 2444 1 1 3 ARG CG C -2.422 -1.130 -6.768 1.00 . A A . 3 ARG CG 1 1 10 2445 1 1 3 ARG CZ C -0.493 -2.404 -9.714 1.00 . A A . 3 ARG CZ 1 1 10 2446 1 1 3 ARG H H -0.829 -0.249 -4.924 1.00 . A A . 3 ARG H 1 1 10 2447 1 1 3 ARG HA H -1.573 1.677 -6.923 1.00 . A A . 3 ARG HA 1 1 10 2448 1 1 3 ARG HB2 H -3.463 -0.017 -5.276 1.00 . A A . 3 ARG HB2 1 1 10 2449 1 1 3 ARG HB3 H -3.688 0.583 -6.918 1.00 . A A . 3 ARG HB3 1 1 10 2450 1 1 3 ARG HD2 H -2.140 -0.318 -8.725 1.00 . A A . 3 ARG HD2 1 1 10 2451 1 1 3 ARG HD3 H -0.655 -0.462 -7.771 1.00 . A A . 3 ARG HD3 1 1 10 2452 1 1 3 ARG HE H -1.735 -3.057 -8.283 1.00 . A A . 3 ARG HE 1 1 10 2453 1 1 3 ARG HG2 H -1.808 -1.618 -6.012 1.00 . A A . 3 ARG HG2 1 1 10 2454 1 1 3 ARG HG3 H -3.271 -1.778 -6.987 1.00 . A A . 3 ARG HG3 1 1 10 2455 1 1 3 ARG HH11 H 0.015 -0.467 -9.938 1.00 . A A . 3 ARG HH11 1 1 10 2456 1 1 3 ARG HH12 H 0.720 -1.581 -11.095 1.00 . A A . 3 ARG HH12 1 1 10 2457 1 1 3 ARG HH21 H -0.788 -4.392 -9.765 1.00 . A A . 3 ARG HH21 1 1 10 2458 1 1 3 ARG HH22 H 0.301 -3.750 -10.984 1.00 . A A . 3 ARG HH22 1 1 10 2459 1 1 3 ARG N N -0.730 0.678 -5.312 1.00 . A A . 3 ARG N 1 1 10 2460 1 1 3 ARG NE N -1.297 -2.236 -8.670 1.00 . A A . 3 ARG NE 1 1 10 2461 1 1 3 ARG NH1 N 0.130 -1.400 -10.299 1.00 . A A . 3 ARG NH1 1 1 10 2462 1 1 3 ARG NH2 N -0.312 -3.615 -10.196 1.00 . A A . 3 ARG NH2 1 1 10 2463 1 1 3 ARG O O -1.885 2.912 -4.214 1.00 . A A . 3 ARG O 1 1 10 2464 1 1 4 GLY C C -4.526 3.736 -3.424 1.00 . A A . 4 GLY C 1 1 10 2465 1 1 4 GLY CA C -4.299 4.022 -4.896 1.00 . A A . 4 GLY CA 1 1 10 2466 1 1 4 GLY H H -4.149 2.470 -6.347 1.00 . A A . 4 GLY H 1 1 10 2467 1 1 4 GLY HA2 H -3.650 4.894 -4.973 1.00 . A A . 4 GLY HA2 1 1 10 2468 1 1 4 GLY HA3 H -5.255 4.246 -5.369 1.00 . A A . 4 GLY HA3 1 1 10 2469 1 1 4 GLY N N -3.665 2.906 -5.576 1.00 . A A . 4 GLY N 1 1 10 2470 1 1 4 GLY O O -4.387 2.596 -2.984 1.00 . A A . 4 GLY O 1 1 10 2471 1 1 5 TRP C C -5.685 3.460 -0.689 1.00 . A A . 5 TRP C 1 1 10 2472 1 1 5 TRP CA C -4.928 4.680 -1.204 1.00 . A A . 5 TRP CA 1 1 10 2473 1 1 5 TRP CB C -5.590 5.937 -0.633 1.00 . A A . 5 TRP CB 1 1 10 2474 1 1 5 TRP CD1 C -5.957 7.994 -2.120 1.00 . A A . 5 TRP CD1 1 1 10 2475 1 1 5 TRP CD2 C -3.912 7.871 -1.248 1.00 . A A . 5 TRP CD2 1 1 10 2476 1 1 5 TRP CE2 C -4.006 9.055 -2.014 1.00 . A A . 5 TRP CE2 1 1 10 2477 1 1 5 TRP CE3 C -2.699 7.578 -0.612 1.00 . A A . 5 TRP CE3 1 1 10 2478 1 1 5 TRP CG C -5.185 7.209 -1.317 1.00 . A A . 5 TRP CG 1 1 10 2479 1 1 5 TRP CH2 C -1.774 9.664 -1.467 1.00 . A A . 5 TRP CH2 1 1 10 2480 1 1 5 TRP CZ2 C -2.940 9.955 -2.129 1.00 . A A . 5 TRP CZ2 1 1 10 2481 1 1 5 TRP CZ3 C -1.642 8.481 -0.713 1.00 . A A . 5 TRP CZ3 1 1 10 2482 1 1 5 TRP H H -5.020 5.676 -3.073 1.00 . A A . 5 TRP H 1 1 10 2483 1 1 5 TRP HA H -3.910 4.626 -0.822 1.00 . A A . 5 TRP HA 1 1 10 2484 1 1 5 TRP HB2 H -6.669 5.822 -0.723 1.00 . A A . 5 TRP HB2 1 1 10 2485 1 1 5 TRP HB3 H -5.343 6.011 0.425 1.00 . A A . 5 TRP HB3 1 1 10 2486 1 1 5 TRP HD1 H -6.983 7.773 -2.376 1.00 . A A . 5 TRP HD1 1 1 10 2487 1 1 5 TRP HE1 H -5.652 9.814 -3.144 1.00 . A A . 5 TRP HE1 1 1 10 2488 1 1 5 TRP HE3 H -2.588 6.660 -0.054 1.00 . A A . 5 TRP HE3 1 1 10 2489 1 1 5 TRP HH2 H -0.940 10.347 -1.531 1.00 . A A . 5 TRP HH2 1 1 10 2490 1 1 5 TRP HZ2 H -3.035 10.858 -2.713 1.00 . A A . 5 TRP HZ2 1 1 10 2491 1 1 5 TRP HZ3 H -0.708 8.267 -0.214 1.00 . A A . 5 TRP HZ3 1 1 10 2492 1 1 5 TRP N N -4.851 4.772 -2.658 1.00 . A A . 5 TRP N 1 1 10 2493 1 1 5 TRP NE1 N -5.268 9.098 -2.546 1.00 . A A . 5 TRP NE1 1 1 10 2494 1 1 5 TRP O O -6.719 3.079 -1.239 1.00 . A A . 5 TRP O 1 1 10 2495 1 1 6 GLY C C -5.065 0.996 2.053 1.00 . A A . 6 GLY C 1 1 10 2496 1 1 6 GLY CA C -5.852 1.710 0.971 1.00 . A A . 6 GLY CA 1 1 10 2497 1 1 6 GLY H H -4.308 3.166 0.786 1.00 . A A . 6 GLY H 1 1 10 2498 1 1 6 GLY HA2 H -6.798 2.045 1.395 1.00 . A A . 6 GLY HA2 1 1 10 2499 1 1 6 GLY HA3 H -6.072 0.994 0.179 1.00 . A A . 6 GLY HA3 1 1 10 2500 1 1 6 GLY N N -5.177 2.849 0.376 1.00 . A A . 6 GLY N 1 1 10 2501 1 1 6 GLY O O -4.445 1.624 2.910 1.00 . A A . 6 GLY O 1 1 10 2502 1 1 7 PHE C C -2.924 -1.246 2.561 1.00 . A A . 7 PHE C 1 1 10 2503 1 1 7 PHE CA C -4.399 -1.188 2.955 1.00 . A A . 7 PHE CA 1 1 10 2504 1 1 7 PHE CB C -5.042 -2.579 2.962 1.00 . A A . 7 PHE CB 1 1 10 2505 1 1 7 PHE CD1 C -7.127 -1.773 4.143 1.00 . A A . 7 PHE CD1 1 1 10 2506 1 1 7 PHE CD2 C -6.193 -3.889 4.763 1.00 . A A . 7 PHE CD2 1 1 10 2507 1 1 7 PHE CE1 C -8.159 -1.953 5.061 1.00 . A A . 7 PHE CE1 1 1 10 2508 1 1 7 PHE CE2 C -7.219 -4.077 5.687 1.00 . A A . 7 PHE CE2 1 1 10 2509 1 1 7 PHE CG C -6.143 -2.742 3.977 1.00 . A A . 7 PHE CG 1 1 10 2510 1 1 7 PHE CZ C -8.206 -3.109 5.832 1.00 . A A . 7 PHE CZ 1 1 10 2511 1 1 7 PHE H H -5.639 -0.782 1.279 1.00 . A A . 7 PHE H 1 1 10 2512 1 1 7 PHE HA H -4.470 -0.759 3.955 1.00 . A A . 7 PHE HA 1 1 10 2513 1 1 7 PHE HB2 H -5.440 -2.789 1.969 1.00 . A A . 7 PHE HB2 1 1 10 2514 1 1 7 PHE HB3 H -4.283 -3.331 3.173 1.00 . A A . 7 PHE HB3 1 1 10 2515 1 1 7 PHE HD1 H -7.091 -0.862 3.565 1.00 . A A . 7 PHE HD1 1 1 10 2516 1 1 7 PHE HD2 H -5.438 -4.652 4.651 1.00 . A A . 7 PHE HD2 1 1 10 2517 1 1 7 PHE HE1 H -8.916 -1.192 5.179 1.00 . A A . 7 PHE HE1 1 1 10 2518 1 1 7 PHE HE2 H -7.251 -4.977 6.284 1.00 . A A . 7 PHE HE2 1 1 10 2519 1 1 7 PHE HZ H -9.009 -3.255 6.541 1.00 . A A . 7 PHE HZ 1 1 10 2520 1 1 7 PHE N N -5.108 -0.331 2.010 1.00 . A A . 7 PHE N 1 1 10 2521 1 1 7 PHE O O -2.498 -0.533 1.653 1.00 . A A . 7 PHE O 1 1 10 2522 1 1 8 GLU C C -0.018 -1.049 3.806 1.00 . A A . 8 GLU C 1 1 10 2523 1 1 8 GLU CA C -0.697 -2.226 3.121 1.00 . A A . 8 GLU CA 1 1 10 2524 1 1 8 GLU CB C -0.276 -2.468 1.646 1.00 . A A . 8 GLU CB 1 1 10 2525 1 1 8 GLU CD C 1.190 -0.593 0.771 1.00 . A A . 8 GLU CD 1 1 10 2526 1 1 8 GLU CG C 1.157 -2.024 1.281 1.00 . A A . 8 GLU CG 1 1 10 2527 1 1 8 GLU H H -2.600 -2.721 3.919 1.00 . A A . 8 GLU H 1 1 10 2528 1 1 8 GLU HA H -0.404 -3.108 3.693 1.00 . A A . 8 GLU HA 1 1 10 2529 1 1 8 GLU HB2 H -0.369 -3.537 1.444 1.00 . A A . 8 GLU HB2 1 1 10 2530 1 1 8 GLU HB3 H -0.969 -1.968 0.970 1.00 . A A . 8 GLU HB3 1 1 10 2531 1 1 8 GLU HG2 H 1.817 -2.105 2.143 1.00 . A A . 8 GLU HG2 1 1 10 2532 1 1 8 GLU HG3 H 1.546 -2.705 0.525 1.00 . A A . 8 GLU HG3 1 1 10 2533 1 1 8 GLU N N -2.155 -2.115 3.250 1.00 . A A . 8 GLU N 1 1 10 2534 1 1 8 GLU O O -0.502 0.065 3.804 1.00 . A A . 8 GLU O 1 1 10 2535 1 1 8 GLU OE1 O 0.791 0.339 1.429 1.00 . A A . 8 GLU OE1 1 1 10 2536 1 1 9 PRO C C 2.426 0.744 3.989 1.00 . A A . 9 PRO C 1 1 10 2537 1 1 9 PRO CA C 1.886 -0.174 5.083 1.00 . A A . 9 PRO CA 1 1 10 2538 1 1 9 PRO CB C 2.996 -0.887 5.859 1.00 . A A . 9 PRO CB 1 1 10 2539 1 1 9 PRO CD C 1.750 -2.587 4.768 1.00 . A A . 9 PRO CD 1 1 10 2540 1 1 9 PRO CG C 3.149 -2.200 5.160 1.00 . A A . 9 PRO CG 1 1 10 2541 1 1 9 PRO HA H 1.254 0.402 5.761 1.00 . A A . 9 PRO HA 1 1 10 2542 1 1 9 PRO HB2 H 3.921 -0.313 5.822 1.00 . A A . 9 PRO HB2 1 1 10 2543 1 1 9 PRO HB3 H 2.683 -1.050 6.891 1.00 . A A . 9 PRO HB3 1 1 10 2544 1 1 9 PRO HD2 H 1.769 -3.219 3.880 1.00 . A A . 9 PRO HD2 1 1 10 2545 1 1 9 PRO HD3 H 1.244 -3.093 5.592 1.00 . A A . 9 PRO HD3 1 1 10 2546 1 1 9 PRO HG2 H 3.768 -2.079 4.271 1.00 . A A . 9 PRO HG2 1 1 10 2547 1 1 9 PRO HG3 H 3.580 -2.943 5.831 1.00 . A A . 9 PRO HG3 1 1 10 2548 1 1 9 PRO N N 1.120 -1.281 4.505 1.00 . A A . 9 PRO N 1 1 10 2549 1 1 9 PRO O O 3.120 0.308 3.069 1.00 . A A . 9 PRO O 1 1 10 2550 1 1 10 GLY C C 0.915 3.560 2.581 1.00 . A A . 10 GLY C 1 1 10 2551 1 1 10 GLY CA C 2.243 2.976 3.025 1.00 . A A . 10 GLY CA 1 1 10 2552 1 1 10 GLY H H 1.547 2.317 4.915 1.00 . A A . 10 GLY H 1 1 10 2553 1 1 10 GLY HA2 H 2.879 3.788 3.374 1.00 . A A . 10 GLY HA2 1 1 10 2554 1 1 10 GLY HA3 H 2.716 2.490 2.172 1.00 . A A . 10 GLY HA3 1 1 10 2555 1 1 10 GLY N N 2.057 2.014 4.097 1.00 . A A . 10 GLY N 1 1 10 2556 1 1 10 GLY O O 0.878 4.607 1.935 1.00 . A A . 10 GLY O 1 1 10 2557 1 1 11 VAL C C -1.728 3.356 1.135 1.00 . A A . 11 VAL C 1 1 10 2558 1 1 11 VAL CA C -1.536 3.314 2.648 1.00 . A A . 11 VAL CA 1 1 10 2559 1 1 11 VAL CB C -1.907 4.676 3.285 1.00 . A A . 11 VAL CB 1 1 10 2560 1 1 11 VAL CG1 C -3.424 4.875 3.294 1.00 . A A . 11 VAL CG1 1 1 10 2561 1 1 11 VAL CG2 C -1.393 4.770 4.722 1.00 . A A . 11 VAL CG2 1 1 10 2562 1 1 11 VAL H H -0.053 2.010 3.443 1.00 . A A . 11 VAL H 1 1 10 2563 1 1 11 VAL HA H -2.219 2.563 3.044 1.00 . A A . 11 VAL HA 1 1 10 2564 1 1 11 VAL HB H -1.453 5.479 2.704 1.00 . A A . 11 VAL HB 1 1 10 2565 1 1 11 VAL HG11 H -3.806 4.872 2.273 1.00 . A A . 11 VAL HG11 1 1 10 2566 1 1 11 VAL HG12 H -3.898 4.072 3.858 1.00 . A A . 11 VAL HG12 1 1 10 2567 1 1 11 VAL HG13 H -3.664 5.831 3.756 1.00 . A A . 11 VAL HG13 1 1 10 2568 1 1 11 VAL HG21 H -0.304 4.805 4.723 1.00 . A A . 11 VAL HG21 1 1 10 2569 1 1 11 VAL HG22 H -1.773 5.679 5.188 1.00 . A A . 11 VAL HG22 1 1 10 2570 1 1 11 VAL HG23 H -1.730 3.903 5.292 1.00 . A A . 11 VAL HG23 1 1 10 2571 1 1 11 VAL N N -0.171 2.886 2.949 1.00 . A A . 11 VAL N 1 1 10 2572 1 1 11 VAL O O -2.231 4.324 0.566 1.00 . A A . 11 VAL O 1 1 10 2573 1 1 12 ARG C C -1.878 0.702 -1.269 1.00 . A A . 12 ARG C 1 1 10 2574 1 1 12 ARG CA C -1.423 2.126 -0.969 1.00 . A A . 12 ARG CA 1 1 10 2575 1 1 12 ARG CB C -0.069 2.410 -1.624 1.00 . A A . 12 ARG CB 1 1 10 2576 1 1 12 ARG CD C -0.224 4.786 -2.465 1.00 . A A . 12 ARG CD 1 1 10 2577 1 1 12 ARG CG C 0.450 3.836 -1.490 1.00 . A A . 12 ARG CG 1 1 10 2578 1 1 12 ARG CZ C 0.093 7.102 -3.272 1.00 . A A . 12 ARG CZ 1 1 10 2579 1 1 12 ARG H H -0.936 1.507 1.017 1.00 . A A . 12 ARG H 1 1 10 2580 1 1 12 ARG HA H -2.162 2.822 -1.363 1.00 . A A . 12 ARG HA 1 1 10 2581 1 1 12 ARG HB2 H 0.667 1.755 -1.167 1.00 . A A . 12 ARG HB2 1 1 10 2582 1 1 12 ARG HB3 H -0.129 2.161 -2.684 1.00 . A A . 12 ARG HB3 1 1 10 2583 1 1 12 ARG HD2 H -0.163 4.355 -3.464 1.00 . A A . 12 ARG HD2 1 1 10 2584 1 1 12 ARG HD3 H -1.273 4.897 -2.189 1.00 . A A . 12 ARG HD3 1 1 10 2585 1 1 12 ARG HE H 1.192 6.236 -1.835 1.00 . A A . 12 ARG HE 1 1 10 2586 1 1 12 ARG HG2 H 0.300 4.192 -0.472 1.00 . A A . 12 ARG HG2 1 1 10 2587 1 1 12 ARG HG3 H 1.519 3.831 -1.701 1.00 . A A . 12 ARG HG3 1 1 10 2588 1 1 12 ARG HH11 H -1.394 6.144 -4.226 1.00 . A A . 12 ARG HH11 1 1 10 2589 1 1 12 ARG HH12 H -1.113 7.808 -4.724 1.00 . A A . 12 ARG HH12 1 1 10 2590 1 1 12 ARG HH21 H 1.534 8.301 -2.547 1.00 . A A . 12 ARG HH21 1 1 10 2591 1 1 12 ARG HH22 H 0.536 8.991 -3.819 1.00 . A A . 12 ARG HH22 1 1 10 2592 1 1 12 ARG N N -1.324 2.272 0.481 1.00 . A A . 12 ARG N 1 1 10 2593 1 1 12 ARG NE N 0.427 6.095 -2.477 1.00 . A A . 12 ARG NE 1 1 10 2594 1 1 12 ARG NH1 N -0.890 7.012 -4.147 1.00 . A A . 12 ARG NH1 1 1 10 2595 1 1 12 ARG NH2 N 0.780 8.225 -3.211 1.00 . A A . 12 ARG NH2 1 1 10 2596 1 1 12 ARG O O -1.121 -0.254 -1.101 1.00 . A A . 12 ARG O 1 1 10 2597 1 1 13 CYS C C -3.036 -1.792 -2.469 1.00 . A A . 13 CYS C 1 1 10 2598 1 1 13 CYS CA C -3.815 -0.715 -1.720 1.00 . A A . 13 CYS CA 1 1 10 2599 1 1 13 CYS CB C -5.197 -0.545 -2.358 1.00 . A A . 13 CYS CB 1 1 10 2600 1 1 13 CYS H H -3.623 1.385 -2.037 1.00 . A A . 13 CYS H 1 1 10 2601 1 1 13 CYS HA H -3.938 -1.049 -0.691 1.00 . A A . 13 CYS HA 1 1 10 2602 1 1 13 CYS HB2 H -5.752 0.215 -1.808 1.00 . A A . 13 CYS HB2 1 1 10 2603 1 1 13 CYS HB3 H -5.063 -0.193 -3.381 1.00 . A A . 13 CYS HB3 1 1 10 2604 1 1 13 CYS N N -3.124 0.569 -1.707 1.00 . A A . 13 CYS N 1 1 10 2605 1 1 13 CYS O O -2.583 -1.588 -3.595 1.00 . A A . 13 CYS O 1 1 10 2606 1 1 13 CYS SG S -6.187 -2.074 -2.409 1.00 . A A . 13 CYS SG 1 1 10 2607 1 1 14 LEU C C -3.052 -5.386 -2.210 1.00 . A A . 14 LEU C 1 1 10 2608 1 1 14 LEU CA C -2.251 -4.108 -2.446 1.00 . A A . 14 LEU CA 1 1 10 2609 1 1 14 LEU CB C -0.833 -4.240 -1.880 1.00 . A A . 14 LEU CB 1 1 10 2610 1 1 14 LEU CD1 C 0.116 -6.175 -3.208 1.00 . A A . 14 LEU CD1 1 1 10 2611 1 1 14 LEU CD2 C 0.441 -3.837 -4.032 1.00 . A A . 14 LEU CD2 1 1 10 2612 1 1 14 LEU CG C 0.295 -4.720 -2.797 1.00 . A A . 14 LEU CG 1 1 10 2613 1 1 14 LEU H H -3.236 -3.049 -0.890 1.00 . A A . 14 LEU H 1 1 10 2614 1 1 14 LEU HA H -2.197 -3.946 -3.523 1.00 . A A . 14 LEU HA 1 1 10 2615 1 1 14 LEU HB2 H -0.546 -3.259 -1.503 1.00 . A A . 14 LEU HB2 1 1 10 2616 1 1 14 LEU HB3 H -0.871 -4.910 -1.020 1.00 . A A . 14 LEU HB3 1 1 10 2617 1 1 14 LEU HD11 H 0.986 -6.501 -3.777 1.00 . A A . 14 LEU HD11 1 1 10 2618 1 1 14 LEU HD12 H 0.015 -6.797 -2.319 1.00 . A A . 14 LEU HD12 1 1 10 2619 1 1 14 LEU HD13 H -0.776 -6.279 -3.825 1.00 . A A . 14 LEU HD13 1 1 10 2620 1 1 14 LEU HD21 H 0.425 -2.789 -3.738 1.00 . A A . 14 LEU HD21 1 1 10 2621 1 1 14 LEU HD22 H 1.388 -4.059 -4.525 1.00 . A A . 14 LEU HD22 1 1 10 2622 1 1 14 LEU HD23 H -0.377 -4.031 -4.726 1.00 . A A . 14 LEU HD23 1 1 10 2623 1 1 14 LEU HG H 1.218 -4.644 -2.223 1.00 . A A . 14 LEU HG 1 1 10 2624 1 1 14 LEU N N -2.891 -2.950 -1.832 1.00 . A A . 14 LEU N 1 1 10 2625 1 1 14 LEU O O -3.250 -6.174 -3.133 1.00 . A A . 14 LEU O 1 1 10 2626 1 1 15 ILE C C -5.618 -6.388 -0.015 1.00 . A A . 15 ILE C 1 1 10 2627 1 1 15 ILE CA C -4.271 -6.782 -0.616 1.00 . A A . 15 ILE CA 1 1 10 2628 1 1 15 ILE CB C -3.512 -7.672 0.394 1.00 . A A . 15 ILE CB 1 1 10 2629 1 1 15 ILE CD1 C -1.220 -8.760 0.829 1.00 . A A . 15 ILE CD1 1 1 10 2630 1 1 15 ILE CG1 C -2.116 -8.014 -0.141 1.00 . A A . 15 ILE CG1 1 1 10 2631 1 1 15 ILE CG2 C -4.319 -8.940 0.674 1.00 . A A . 15 ILE CG2 1 1 10 2632 1 1 15 ILE H H -3.299 -4.925 -0.250 1.00 . A A . 15 ILE H 1 1 10 2633 1 1 15 ILE HA H -4.453 -7.365 -1.520 1.00 . A A . 15 ILE HA 1 1 10 2634 1 1 15 ILE HB H -3.398 -7.120 1.328 1.00 . A A . 15 ILE HB 1 1 10 2635 1 1 15 ILE HD11 H -0.213 -8.818 0.415 1.00 . A A . 15 ILE HD11 1 1 10 2636 1 1 15 ILE HD12 H -1.186 -8.228 1.780 1.00 . A A . 15 ILE HD12 1 1 10 2637 1 1 15 ILE HD13 H -1.600 -9.769 0.988 1.00 . A A . 15 ILE HD13 1 1 10 2638 1 1 15 ILE HG12 H -2.229 -8.607 -1.048 1.00 . A A . 15 ILE HG12 1 1 10 2639 1 1 15 ILE HG13 H -1.605 -7.091 -0.410 1.00 . A A . 15 ILE HG13 1 1 10 2640 1 1 15 ILE HG21 H -3.790 -9.573 1.385 1.00 . A A . 15 ILE HG21 1 1 10 2641 1 1 15 ILE HG22 H -5.283 -8.668 1.102 1.00 . A A . 15 ILE HG22 1 1 10 2642 1 1 15 ILE HG23 H -4.480 -9.491 -0.254 1.00 . A A . 15 ILE HG23 1 1 10 2643 1 1 15 ILE N N -3.501 -5.594 -0.977 1.00 . A A . 15 ILE N 1 1 10 2644 1 1 15 ILE O O -5.668 -5.738 1.029 1.00 . A A . 15 ILE O 1 1 10 2645 1 1 16 TRP C C -8.338 -5.399 0.631 1.00 . A A . 16 TRP C 1 1 10 2646 1 1 16 TRP CA C -8.071 -6.612 -0.260 1.00 . A A . 16 TRP CA 1 1 10 2647 1 1 16 TRP CB C -8.573 -7.880 0.437 1.00 . A A . 16 TRP CB 1 1 10 2648 1 1 16 TRP CD1 C -7.445 -10.180 0.348 1.00 . A A . 16 TRP CD1 1 1 10 2649 1 1 16 TRP CD2 C -8.375 -9.574 -1.581 1.00 . A A . 16 TRP CD2 1 1 10 2650 1 1 16 TRP CE2 C -7.697 -10.800 -1.771 1.00 . A A . 16 TRP CE2 1 1 10 2651 1 1 16 TRP CE3 C -9.038 -8.998 -2.674 1.00 . A A . 16 TRP CE3 1 1 10 2652 1 1 16 TRP CG C -8.148 -9.162 -0.223 1.00 . A A . 16 TRP CG 1 1 10 2653 1 1 16 TRP CH2 C -8.286 -10.847 -4.073 1.00 . A A . 16 TRP CH2 1 1 10 2654 1 1 16 TRP CZ2 C -7.633 -11.430 -3.017 1.00 . A A . 16 TRP CZ2 1 1 10 2655 1 1 16 TRP CZ3 C -8.994 -9.641 -3.911 1.00 . A A . 16 TRP CZ3 1 1 10 2656 1 1 16 TRP H H -6.547 -7.297 -1.558 1.00 . A A . 16 TRP H 1 1 10 2657 1 1 16 TRP HA H -8.679 -6.477 -1.154 1.00 . A A . 16 TRP HA 1 1 10 2658 1 1 16 TRP HB2 H -8.206 -7.886 1.464 1.00 . A A . 16 TRP HB2 1 1 10 2659 1 1 16 TRP HB3 H -9.663 -7.847 0.465 1.00 . A A . 16 TRP HB3 1 1 10 2660 1 1 16 TRP HD1 H -7.135 -10.197 1.382 1.00 . A A . 16 TRP HD1 1 1 10 2661 1 1 16 TRP HE1 H -6.649 -12.007 -0.353 1.00 . A A . 16 TRP HE1 1 1 10 2662 1 1 16 TRP HE3 H -9.569 -8.066 -2.562 1.00 . A A . 16 TRP HE3 1 1 10 2663 1 1 16 TRP HH2 H -8.254 -11.318 -5.045 1.00 . A A . 16 TRP HH2 1 1 10 2664 1 1 16 TRP HZ2 H -7.077 -12.348 -3.143 1.00 . A A . 16 TRP HZ2 1 1 10 2665 1 1 16 TRP HZ3 H -9.504 -9.204 -4.758 1.00 . A A . 16 TRP HZ3 1 1 10 2666 1 1 16 TRP N N -6.687 -6.796 -0.693 1.00 . A A . 16 TRP N 1 1 10 2667 1 1 16 TRP NE1 N -7.167 -11.165 -0.563 1.00 . A A . 16 TRP NE1 1 1 10 2668 1 1 16 TRP O O -8.772 -5.532 1.776 1.00 . A A . 16 TRP O 1 1 10 2669 1 1 17 CYS C C -9.854 -2.663 0.942 1.00 . A A . 17 CYS C 1 1 10 2670 1 1 17 CYS CA C -8.365 -2.984 0.847 1.00 . A A . 17 CYS CA 1 1 10 2671 1 1 17 CYS CB C -7.617 -1.807 0.219 1.00 . A A . 17 CYS CB 1 1 10 2672 1 1 17 CYS H H -7.736 -4.127 -0.839 1.00 . A A . 17 CYS H 1 1 10 2673 1 1 17 CYS HA H -7.993 -3.121 1.861 1.00 . A A . 17 CYS HA 1 1 10 2674 1 1 17 CYS HB2 H -7.874 -0.898 0.763 1.00 . A A . 17 CYS HB2 1 1 10 2675 1 1 17 CYS HB3 H -6.550 -1.993 0.330 1.00 . A A . 17 CYS HB3 1 1 10 2676 1 1 17 CYS N N -8.098 -4.206 0.099 1.00 . A A . 17 CYS N 1 1 10 2677 1 1 17 CYS O O -10.682 -3.125 0.159 1.00 . A A . 17 CYS O 1 1 10 2678 1 1 17 CYS SG S -7.948 -1.544 -1.553 1.00 . A A . 17 CYS SG 1 1 10 2679 1 1 18 ASP C C -12.042 -0.489 0.966 1.00 . A A . 18 ASP C 1 1 10 2680 1 1 18 ASP CA C -11.578 -1.362 2.117 1.00 . A A . 18 ASP CA 1 1 10 2681 1 1 18 ASP CB C -11.746 -0.615 3.450 1.00 . A A . 18 ASP CB 1 1 10 2682 1 1 18 ASP CG C -13.191 -0.243 3.665 1.00 . A A . 18 ASP CG 1 1 10 2683 1 1 18 ASP H H -9.495 -1.494 2.574 1.00 . A A . 18 ASP H 1 1 10 2684 1 1 18 ASP HA H -12.241 -2.230 2.115 1.00 . A A . 18 ASP HA 1 1 10 2685 1 1 18 ASP HB2 H -11.410 -1.245 4.276 1.00 . A A . 18 ASP HB2 1 1 10 2686 1 1 18 ASP HB3 H -11.141 0.292 3.443 1.00 . A A . 18 ASP HB3 1 1 10 2687 1 1 18 ASP N N -10.201 -1.829 1.937 1.00 . A A . 18 ASP N 1 1 10 2688 1 1 18 ASP O O -11.448 0.548 0.740 1.00 . A A . 18 ASP O 1 1 10 2689 1 1 18 ASP OD1 O -13.498 0.322 4.694 1.00 . A A . 18 ASP OD1 1 1 10 2690 1 1 18 ASP OD2 O -14.000 -0.530 2.806 1.00 . A A . 18 ASP OD2 1 1 11 2691 1 1 1 GLY C C 1.992 0.384 -2.104 1.00 . A A . 1 GLY C 1 1 11 2692 1 1 1 GLY CA C 1.300 -0.867 -1.593 1.00 . A A . 1 GLY CA 1 1 11 2693 1 1 1 GLY H1 H 2.431 -2.192 -0.365 1.00 . A A . 1 GLY H1 1 1 11 2694 1 1 1 GLY HA2 H 1.386 -1.629 -2.368 1.00 . A A . 1 GLY HA2 1 1 11 2695 1 1 1 GLY HA3 H 0.242 -0.634 -1.483 1.00 . A A . 1 GLY HA3 1 1 11 2696 1 1 1 GLY N N 1.751 -1.449 -0.340 1.00 . A A . 1 GLY N 1 1 11 2697 1 1 1 GLY O O 3.033 0.794 -1.592 1.00 . A A . 1 GLY O 1 1 11 2698 1 1 2 SER C C 0.862 2.957 -4.567 1.00 . A A . 2 SER C 1 1 11 2699 1 1 2 SER CA C 1.922 2.182 -3.785 1.00 . A A . 2 SER CA 1 1 11 2700 1 1 2 SER CB C 3.037 1.810 -4.763 1.00 . A A . 2 SER CB 1 1 11 2701 1 1 2 SER H H 0.563 0.571 -3.518 1.00 . A A . 2 SER H 1 1 11 2702 1 1 2 SER HA H 2.334 2.844 -3.023 1.00 . A A . 2 SER HA 1 1 11 2703 1 1 2 SER HB2 H 3.856 1.354 -4.209 1.00 . A A . 2 SER HB2 1 1 11 2704 1 1 2 SER HB3 H 2.651 1.088 -5.482 1.00 . A A . 2 SER HB3 1 1 11 2705 1 1 2 SER HG H 4.455 2.894 -5.552 1.00 . A A . 2 SER HG 1 1 11 2706 1 1 2 SER N N 1.413 0.968 -3.149 1.00 . A A . 2 SER N 1 1 11 2707 1 1 2 SER O O 0.808 4.184 -4.513 1.00 . A A . 2 SER O 1 1 11 2708 1 1 2 SER OG O 3.500 2.952 -5.462 1.00 . A A . 2 SER OG 1 1 11 2709 1 1 3 ARG C C -2.103 3.546 -5.699 1.00 . A A . 3 ARG C 1 1 11 2710 1 1 3 ARG CA C -0.888 2.828 -6.284 1.00 . A A . 3 ARG CA 1 1 11 2711 1 1 3 ARG CB C -1.357 1.758 -7.276 1.00 . A A . 3 ARG CB 1 1 11 2712 1 1 3 ARG CD C 0.719 1.895 -8.717 1.00 . A A . 3 ARG CD 1 1 11 2713 1 1 3 ARG CG C -0.247 0.984 -7.977 1.00 . A A . 3 ARG CG 1 1 11 2714 1 1 3 ARG CZ C 2.857 0.879 -9.478 1.00 . A A . 3 ARG CZ 1 1 11 2715 1 1 3 ARG H H 0.176 1.233 -5.364 1.00 . A A . 3 ARG H 1 1 11 2716 1 1 3 ARG HA H -0.356 3.601 -6.837 1.00 . A A . 3 ARG HA 1 1 11 2717 1 1 3 ARG HB2 H -1.977 1.035 -6.745 1.00 . A A . 3 ARG HB2 1 1 11 2718 1 1 3 ARG HB3 H -1.978 2.241 -8.031 1.00 . A A . 3 ARG HB3 1 1 11 2719 1 1 3 ARG HD2 H 0.137 2.624 -9.281 1.00 . A A . 3 ARG HD2 1 1 11 2720 1 1 3 ARG HD3 H 1.333 2.433 -7.995 1.00 . A A . 3 ARG HD3 1 1 11 2721 1 1 3 ARG HE H 1.125 0.785 -10.477 1.00 . A A . 3 ARG HE 1 1 11 2722 1 1 3 ARG HG2 H 0.310 0.399 -7.245 1.00 . A A . 3 ARG HG2 1 1 11 2723 1 1 3 ARG HG3 H -0.702 0.297 -8.690 1.00 . A A . 3 ARG HG3 1 1 11 2724 1 1 3 ARG HH11 H 3.104 1.883 -7.745 1.00 . A A . 3 ARG HH11 1 1 11 2725 1 1 3 ARG HH12 H 4.524 1.054 -8.362 1.00 . A A . 3 ARG HH12 1 1 11 2726 1 1 3 ARG HH21 H 2.966 -0.171 -11.189 1.00 . A A . 3 ARG HH21 1 1 11 2727 1 1 3 ARG HH22 H 4.461 -0.041 -10.278 1.00 . A A . 3 ARG HH22 1 1 11 2728 1 1 3 ARG N N 0.065 2.235 -5.349 1.00 . A A . 3 ARG N 1 1 11 2729 1 1 3 ARG NE N 1.565 1.136 -9.640 1.00 . A A . 3 ARG NE 1 1 11 2730 1 1 3 ARG NH1 N 3.550 1.303 -8.438 1.00 . A A . 3 ARG NH1 1 1 11 2731 1 1 3 ARG NH2 N 3.479 0.160 -10.388 1.00 . A A . 3 ARG NH2 1 1 11 2732 1 1 3 ARG O O -2.222 4.763 -5.825 1.00 . A A . 3 ARG O 1 1 11 2733 1 1 4 GLY C C -4.240 3.674 -3.161 1.00 . A A . 4 GLY C 1 1 11 2734 1 1 4 GLY CA C -4.283 3.312 -4.632 1.00 . A A . 4 GLY CA 1 1 11 2735 1 1 4 GLY H H -2.858 1.788 -5.046 1.00 . A A . 4 GLY H 1 1 11 2736 1 1 4 GLY HA2 H -4.548 4.204 -5.198 1.00 . A A . 4 GLY HA2 1 1 11 2737 1 1 4 GLY HA3 H -5.065 2.567 -4.780 1.00 . A A . 4 GLY HA3 1 1 11 2738 1 1 4 GLY N N -3.026 2.779 -5.130 1.00 . A A . 4 GLY N 1 1 11 2739 1 1 4 GLY O O -3.312 4.350 -2.725 1.00 . A A . 4 GLY O 1 1 11 2740 1 1 5 TRP C C -5.654 2.287 -0.120 1.00 . A A . 5 TRP C 1 1 11 2741 1 1 5 TRP CA C -5.329 3.510 -0.973 1.00 . A A . 5 TRP CA 1 1 11 2742 1 1 5 TRP CB C -6.409 4.570 -0.747 1.00 . A A . 5 TRP CB 1 1 11 2743 1 1 5 TRP CD1 C -7.092 5.985 -2.765 1.00 . A A . 5 TRP CD1 1 1 11 2744 1 1 5 TRP CD2 C -5.268 6.725 -1.728 1.00 . A A . 5 TRP CD2 1 1 11 2745 1 1 5 TRP CE2 C -5.546 7.585 -2.816 1.00 . A A . 5 TRP CE2 1 1 11 2746 1 1 5 TRP CE3 C -4.108 6.951 -0.975 1.00 . A A . 5 TRP CE3 1 1 11 2747 1 1 5 TRP CG C -6.291 5.719 -1.698 1.00 . A A . 5 TRP CG 1 1 11 2748 1 1 5 TRP CH2 C -3.637 8.917 -2.334 1.00 . A A . 5 TRP CH2 1 1 11 2749 1 1 5 TRP CZ2 C -4.743 8.690 -3.116 1.00 . A A . 5 TRP CZ2 1 1 11 2750 1 1 5 TRP CZ3 C -3.308 8.054 -1.270 1.00 . A A . 5 TRP CZ3 1 1 11 2751 1 1 5 TRP H H -5.960 2.655 -2.815 1.00 . A A . 5 TRP H 1 1 11 2752 1 1 5 TRP HA H -4.376 3.922 -0.647 1.00 . A A . 5 TRP HA 1 1 11 2753 1 1 5 TRP HB2 H -7.384 4.103 -0.874 1.00 . A A . 5 TRP HB2 1 1 11 2754 1 1 5 TRP HB3 H -6.330 4.941 0.273 1.00 . A A . 5 TRP HB3 1 1 11 2755 1 1 5 TRP HD1 H -7.949 5.388 -3.046 1.00 . A A . 5 TRP HD1 1 1 11 2756 1 1 5 TRP HE1 H -7.096 7.443 -4.283 1.00 . A A . 5 TRP HE1 1 1 11 2757 1 1 5 TRP HE3 H -3.830 6.257 -0.196 1.00 . A A . 5 TRP HE3 1 1 11 2758 1 1 5 TRP HH2 H -3.002 9.765 -2.544 1.00 . A A . 5 TRP HH2 1 1 11 2759 1 1 5 TRP HZ2 H -4.980 9.340 -3.944 1.00 . A A . 5 TRP HZ2 1 1 11 2760 1 1 5 TRP HZ3 H -2.421 8.242 -0.685 1.00 . A A . 5 TRP HZ3 1 1 11 2761 1 1 5 TRP N N -5.229 3.217 -2.400 1.00 . A A . 5 TRP N 1 1 11 2762 1 1 5 TRP NE1 N -6.656 7.090 -3.446 1.00 . A A . 5 TRP NE1 1 1 11 2763 1 1 5 TRP O O -6.388 1.393 -0.540 1.00 . A A . 5 TRP O 1 1 11 2764 1 1 6 GLY C C -4.361 0.858 3.033 1.00 . A A . 6 GLY C 1 1 11 2765 1 1 6 GLY CA C -5.450 1.191 2.032 1.00 . A A . 6 GLY CA 1 1 11 2766 1 1 6 GLY H H -4.408 2.920 1.363 1.00 . A A . 6 GLY H 1 1 11 2767 1 1 6 GLY HA2 H -6.344 1.487 2.580 1.00 . A A . 6 GLY HA2 1 1 11 2768 1 1 6 GLY HA3 H -5.682 0.285 1.472 1.00 . A A . 6 GLY HA3 1 1 11 2769 1 1 6 GLY N N -5.104 2.240 1.090 1.00 . A A . 6 GLY N 1 1 11 2770 1 1 6 GLY O O -3.536 1.703 3.377 1.00 . A A . 6 GLY O 1 1 11 2771 1 1 7 PHE C C -2.018 -1.022 3.783 1.00 . A A . 7 PHE C 1 1 11 2772 1 1 7 PHE CA C -3.383 -0.879 4.454 1.00 . A A . 7 PHE CA 1 1 11 2773 1 1 7 PHE CB C -3.841 -2.225 5.023 1.00 . A A . 7 PHE CB 1 1 11 2774 1 1 7 PHE CD1 C -6.154 -1.717 5.865 1.00 . A A . 7 PHE CD1 1 1 11 2775 1 1 7 PHE CD2 C -4.472 -2.331 7.455 1.00 . A A . 7 PHE CD2 1 1 11 2776 1 1 7 PHE CE1 C -7.088 -1.592 6.890 1.00 . A A . 7 PHE CE1 1 1 11 2777 1 1 7 PHE CE2 C -5.396 -2.204 8.490 1.00 . A A . 7 PHE CE2 1 1 11 2778 1 1 7 PHE CG C -4.844 -2.096 6.136 1.00 . A A . 7 PHE CG 1 1 11 2779 1 1 7 PHE CZ C -6.708 -1.834 8.206 1.00 . A A . 7 PHE CZ 1 1 11 2780 1 1 7 PHE H H -5.087 -1.027 3.190 1.00 . A A . 7 PHE H 1 1 11 2781 1 1 7 PHE HA H -3.293 -0.168 5.274 1.00 . A A . 7 PHE HA 1 1 11 2782 1 1 7 PHE HB2 H -4.274 -2.817 4.217 1.00 . A A . 7 PHE HB2 1 1 11 2783 1 1 7 PHE HB3 H -2.977 -2.763 5.410 1.00 . A A . 7 PHE HB3 1 1 11 2784 1 1 7 PHE HD1 H -6.442 -1.499 4.848 1.00 . A A . 7 PHE HD1 1 1 11 2785 1 1 7 PHE HD2 H -3.455 -2.617 7.685 1.00 . A A . 7 PHE HD2 1 1 11 2786 1 1 7 PHE HE1 H -8.103 -1.299 6.665 1.00 . A A . 7 PHE HE1 1 1 11 2787 1 1 7 PHE HE2 H -5.098 -2.399 9.509 1.00 . A A . 7 PHE HE2 1 1 11 2788 1 1 7 PHE HZ H -7.428 -1.734 9.005 1.00 . A A . 7 PHE HZ 1 1 11 2789 1 1 7 PHE N N -4.375 -0.383 3.505 1.00 . A A . 7 PHE N 1 1 11 2790 1 1 7 PHE O O -1.908 -0.882 2.566 1.00 . A A . 7 PHE O 1 1 11 2791 1 1 8 GLU C C 1.058 -0.034 4.079 1.00 . A A . 8 GLU C 1 1 11 2792 1 1 8 GLU CA C 0.424 -1.414 4.208 1.00 . A A . 8 GLU CA 1 1 11 2793 1 1 8 GLU CB C 0.622 -2.337 2.977 1.00 . A A . 8 GLU CB 1 1 11 2794 1 1 8 GLU CD C 1.273 -1.078 0.865 1.00 . A A . 8 GLU CD 1 1 11 2795 1 1 8 GLU CG C 1.763 -1.926 2.019 1.00 . A A . 8 GLU CG 1 1 11 2796 1 1 8 GLU H H -1.191 -1.484 5.576 1.00 . A A . 8 GLU H 1 1 11 2797 1 1 8 GLU HA H 0.937 -1.887 5.047 1.00 . A A . 8 GLU HA 1 1 11 2798 1 1 8 GLU HB2 H 0.826 -3.342 3.348 1.00 . A A . 8 GLU HB2 1 1 11 2799 1 1 8 GLU HB3 H -0.303 -2.407 2.406 1.00 . A A . 8 GLU HB3 1 1 11 2800 1 1 8 GLU HG2 H 2.553 -1.399 2.551 1.00 . A A . 8 GLU HG2 1 1 11 2801 1 1 8 GLU HG3 H 2.210 -2.834 1.610 1.00 . A A . 8 GLU HG3 1 1 11 2802 1 1 8 GLU N N -0.990 -1.321 4.605 1.00 . A A . 8 GLU N 1 1 11 2803 1 1 8 GLU O O 0.452 0.917 3.631 1.00 . A A . 8 GLU O 1 1 11 2804 1 1 8 GLU OE1 O 0.501 -0.153 0.987 1.00 . A A . 8 GLU OE1 1 1 11 2805 1 1 9 PRO C C 3.238 1.667 2.838 1.00 . A A . 9 PRO C 1 1 11 2806 1 1 9 PRO CA C 3.030 1.406 4.327 1.00 . A A . 9 PRO CA 1 1 11 2807 1 1 9 PRO CB C 4.352 1.190 5.070 1.00 . A A . 9 PRO CB 1 1 11 2808 1 1 9 PRO CD C 3.170 -0.867 5.201 1.00 . A A . 9 PRO CD 1 1 11 2809 1 1 9 PRO CG C 4.552 -0.291 5.038 1.00 . A A . 9 PRO CG 1 1 11 2810 1 1 9 PRO HA H 2.465 2.224 4.771 1.00 . A A . 9 PRO HA 1 1 11 2811 1 1 9 PRO HB2 H 5.168 1.704 4.563 1.00 . A A . 9 PRO HB2 1 1 11 2812 1 1 9 PRO HB3 H 4.262 1.532 6.100 1.00 . A A . 9 PRO HB3 1 1 11 2813 1 1 9 PRO HD2 H 3.107 -1.838 4.711 1.00 . A A . 9 PRO HD2 1 1 11 2814 1 1 9 PRO HD3 H 2.907 -0.942 6.257 1.00 . A A . 9 PRO HD3 1 1 11 2815 1 1 9 PRO HG2 H 4.971 -0.591 4.077 1.00 . A A . 9 PRO HG2 1 1 11 2816 1 1 9 PRO HG3 H 5.200 -0.610 5.855 1.00 . A A . 9 PRO HG3 1 1 11 2817 1 1 9 PRO N N 2.323 0.138 4.530 1.00 . A A . 9 PRO N 1 1 11 2818 1 1 9 PRO O O 3.590 0.768 2.076 1.00 . A A . 9 PRO O 1 1 11 2819 1 1 10 GLY C C 1.283 3.537 0.804 1.00 . A A . 10 GLY C 1 1 11 2820 1 1 10 GLY CA C 2.747 3.210 1.027 1.00 . A A . 10 GLY CA 1 1 11 2821 1 1 10 GLY H H 2.782 3.628 3.104 1.00 . A A . 10 GLY H 1 1 11 2822 1 1 10 GLY HA2 H 3.346 4.076 0.744 1.00 . A A . 10 GLY HA2 1 1 11 2823 1 1 10 GLY HA3 H 3.024 2.360 0.404 1.00 . A A . 10 GLY HA3 1 1 11 2824 1 1 10 GLY N N 2.966 2.902 2.429 1.00 . A A . 10 GLY N 1 1 11 2825 1 1 10 GLY O O 0.931 4.262 -0.125 1.00 . A A . 10 GLY O 1 1 11 2826 1 1 11 VAL C C -1.682 2.839 0.475 1.00 . A A . 11 VAL C 1 1 11 2827 1 1 11 VAL CA C -0.985 3.296 1.752 1.00 . A A . 11 VAL CA 1 1 11 2828 1 1 11 VAL CB C -1.309 4.783 2.033 1.00 . A A . 11 VAL CB 1 1 11 2829 1 1 11 VAL CG1 C -2.775 4.949 2.435 1.00 . A A . 11 VAL CG1 1 1 11 2830 1 1 11 VAL CG2 C -0.427 5.332 3.155 1.00 . A A . 11 VAL CG2 1 1 11 2831 1 1 11 VAL H H 0.819 2.386 2.397 1.00 . A A . 11 VAL H 1 1 11 2832 1 1 11 VAL HA H -1.405 2.711 2.571 1.00 . A A . 11 VAL HA 1 1 11 2833 1 1 11 VAL HB H -1.123 5.369 1.133 1.00 . A A . 11 VAL HB 1 1 11 2834 1 1 11 VAL HG11 H -3.422 4.611 1.625 1.00 . A A . 11 VAL HG11 1 1 11 2835 1 1 11 VAL HG12 H -2.982 4.363 3.330 1.00 . A A . 11 VAL HG12 1 1 11 2836 1 1 11 VAL HG13 H -2.982 6.001 2.635 1.00 . A A . 11 VAL HG13 1 1 11 2837 1 1 11 VAL HG21 H -0.761 6.334 3.427 1.00 . A A . 11 VAL HG21 1 1 11 2838 1 1 11 VAL HG22 H -0.491 4.681 4.027 1.00 . A A . 11 VAL HG22 1 1 11 2839 1 1 11 VAL HG23 H 0.607 5.388 2.816 1.00 . A A . 11 VAL HG23 1 1 11 2840 1 1 11 VAL N N 0.449 3.021 1.701 1.00 . A A . 11 VAL N 1 1 11 2841 1 1 11 VAL O O -2.245 3.643 -0.264 1.00 . A A . 11 VAL O 1 1 11 2842 1 1 12 ARG C C -2.706 -0.560 -0.444 1.00 . A A . 12 ARG C 1 1 11 2843 1 1 12 ARG CA C -2.489 0.906 -0.797 1.00 . A A . 12 ARG CA 1 1 11 2844 1 1 12 ARG CB C -1.858 1.083 -2.180 1.00 . A A . 12 ARG CB 1 1 11 2845 1 1 12 ARG CD C -3.612 -0.144 -3.570 1.00 . A A . 12 ARG CD 1 1 11 2846 1 1 12 ARG CG C -2.141 -0.017 -3.199 1.00 . A A . 12 ARG CG 1 1 11 2847 1 1 12 ARG CZ C -3.833 -1.642 -5.537 1.00 . A A . 12 ARG CZ 1 1 11 2848 1 1 12 ARG H H -1.090 0.937 0.817 1.00 . A A . 12 ARG H 1 1 11 2849 1 1 12 ARG HA H -3.455 1.404 -0.817 1.00 . A A . 12 ARG HA 1 1 11 2850 1 1 12 ARG HB2 H -2.200 2.033 -2.590 1.00 . A A . 12 ARG HB2 1 1 11 2851 1 1 12 ARG HB3 H -0.783 1.168 -2.043 1.00 . A A . 12 ARG HB3 1 1 11 2852 1 1 12 ARG HD2 H -4.063 -0.940 -2.977 1.00 . A A . 12 ARG HD2 1 1 11 2853 1 1 12 ARG HD3 H -4.125 0.787 -3.324 1.00 . A A . 12 ARG HD3 1 1 11 2854 1 1 12 ARG HE H -3.923 0.359 -5.608 1.00 . A A . 12 ARG HE 1 1 11 2855 1 1 12 ARG HG2 H -1.572 0.205 -4.101 1.00 . A A . 12 ARG HG2 1 1 11 2856 1 1 12 ARG HG3 H -1.793 -0.971 -2.806 1.00 . A A . 12 ARG HG3 1 1 11 2857 1 1 12 ARG HH11 H -3.587 -2.709 -3.839 1.00 . A A . 12 ARG HH11 1 1 11 2858 1 1 12 ARG HH12 H -3.720 -3.642 -5.316 1.00 . A A . 12 ARG HH12 1 1 11 2859 1 1 12 ARG HH21 H -4.129 -0.905 -7.386 1.00 . A A . 12 ARG HH21 1 1 11 2860 1 1 12 ARG HH22 H -4.029 -2.655 -7.265 1.00 . A A . 12 ARG HH22 1 1 11 2861 1 1 12 ARG N N -1.668 1.532 0.237 1.00 . A A . 12 ARG N 1 1 11 2862 1 1 12 ARG NE N -3.794 -0.430 -4.994 1.00 . A A . 12 ARG NE 1 1 11 2863 1 1 12 ARG NH1 N -3.694 -2.752 -4.842 1.00 . A A . 12 ARG NH1 1 1 11 2864 1 1 12 ARG NH2 N -4.005 -1.741 -6.838 1.00 . A A . 12 ARG NH2 1 1 11 2865 1 1 12 ARG O O -1.764 -1.340 -0.318 1.00 . A A . 12 ARG O 1 1 11 2866 1 1 13 CYS C C -3.663 -3.347 -0.713 1.00 . A A . 13 CYS C 1 1 11 2867 1 1 13 CYS CA C -4.339 -2.266 0.126 1.00 . A A . 13 CYS CA 1 1 11 2868 1 1 13 CYS CB C -5.855 -2.437 0.031 1.00 . A A . 13 CYS CB 1 1 11 2869 1 1 13 CYS H H -4.712 -0.263 -0.504 1.00 . A A . 13 CYS H 1 1 11 2870 1 1 13 CYS HA H -4.026 -2.385 1.163 1.00 . A A . 13 CYS HA 1 1 11 2871 1 1 13 CYS HB2 H -6.279 -1.564 -0.465 1.00 . A A . 13 CYS HB2 1 1 11 2872 1 1 13 CYS HB3 H -6.066 -3.307 -0.590 1.00 . A A . 13 CYS HB3 1 1 11 2873 1 1 13 CYS N N -3.975 -0.925 -0.311 1.00 . A A . 13 CYS N 1 1 11 2874 1 1 13 CYS O O -3.671 -3.288 -1.942 1.00 . A A . 13 CYS O 1 1 11 2875 1 1 13 CYS SG S -6.672 -2.642 1.646 1.00 . A A . 13 CYS SG 1 1 11 2876 1 1 14 LEU C C -3.834 -6.487 -0.961 1.00 . A A . 14 LEU C 1 1 11 2877 1 1 14 LEU CA C -2.647 -5.567 -0.688 1.00 . A A . 14 LEU CA 1 1 11 2878 1 1 14 LEU CB C -1.635 -6.297 0.201 1.00 . A A . 14 LEU CB 1 1 11 2879 1 1 14 LEU CD1 C 0.185 -6.890 -1.443 1.00 . A A . 14 LEU CD1 1 1 11 2880 1 1 14 LEU CD2 C 0.335 -4.744 -0.178 1.00 . A A . 14 LEU CD2 1 1 11 2881 1 1 14 LEU CG C -0.142 -6.189 -0.130 1.00 . A A . 14 LEU CG 1 1 11 2882 1 1 14 LEU H H -2.981 -4.259 0.965 1.00 . A A . 14 LEU H 1 1 11 2883 1 1 14 LEU HA H -2.185 -5.322 -1.645 1.00 . A A . 14 LEU HA 1 1 11 2884 1 1 14 LEU HB2 H -1.775 -5.950 1.224 1.00 . A A . 14 LEU HB2 1 1 11 2885 1 1 14 LEU HB3 H -1.895 -7.355 0.186 1.00 . A A . 14 LEU HB3 1 1 11 2886 1 1 14 LEU HD11 H 1.263 -6.879 -1.601 1.00 . A A . 14 LEU HD11 1 1 11 2887 1 1 14 LEU HD12 H -0.157 -7.924 -1.401 1.00 . A A . 14 LEU HD12 1 1 11 2888 1 1 14 LEU HD13 H -0.306 -6.380 -2.272 1.00 . A A . 14 LEU HD13 1 1 11 2889 1 1 14 LEU HD21 H 1.419 -4.723 -0.293 1.00 . A A . 14 LEU HD21 1 1 11 2890 1 1 14 LEU HD22 H -0.127 -4.225 -1.018 1.00 . A A . 14 LEU HD22 1 1 11 2891 1 1 14 LEU HD23 H 0.062 -4.240 0.749 1.00 . A A . 14 LEU HD23 1 1 11 2892 1 1 14 LEU HG H 0.407 -6.696 0.663 1.00 . A A . 14 LEU HG 1 1 11 2893 1 1 14 LEU N N -3.094 -4.339 -0.036 1.00 . A A . 14 LEU N 1 1 11 2894 1 1 14 LEU O O -3.787 -7.338 -1.848 1.00 . A A . 14 LEU O 1 1 11 2895 1 1 15 ILE C C -6.955 -6.290 -1.430 1.00 . A A . 15 ILE C 1 1 11 2896 1 1 15 ILE CA C -6.148 -7.028 -0.362 1.00 . A A . 15 ILE CA 1 1 11 2897 1 1 15 ILE CB C -6.985 -7.174 0.934 1.00 . A A . 15 ILE CB 1 1 11 2898 1 1 15 ILE CD1 C -6.961 -6.840 3.482 1.00 . A A . 15 ILE CD1 1 1 11 2899 1 1 15 ILE CG1 C -6.165 -6.852 2.190 1.00 . A A . 15 ILE CG1 1 1 11 2900 1 1 15 ILE CG2 C -7.547 -8.594 1.017 1.00 . A A . 15 ILE CG2 1 1 11 2901 1 1 15 ILE H H -4.840 -5.617 0.557 1.00 . A A . 15 ILE H 1 1 11 2902 1 1 15 ILE HA H -5.915 -8.026 -0.733 1.00 . A A . 15 ILE HA 1 1 11 2903 1 1 15 ILE HB H -7.820 -6.477 0.887 1.00 . A A . 15 ILE HB 1 1 11 2904 1 1 15 ILE HD11 H -6.333 -6.463 4.289 1.00 . A A . 15 ILE HD11 1 1 11 2905 1 1 15 ILE HD12 H -7.831 -6.192 3.371 1.00 . A A . 15 ILE HD12 1 1 11 2906 1 1 15 ILE HD13 H -7.288 -7.851 3.727 1.00 . A A . 15 ILE HD13 1 1 11 2907 1 1 15 ILE HG12 H -5.364 -7.586 2.278 1.00 . A A . 15 ILE HG12 1 1 11 2908 1 1 15 ILE HG13 H -5.721 -5.864 2.079 1.00 . A A . 15 ILE HG13 1 1 11 2909 1 1 15 ILE HG21 H -8.284 -8.656 1.818 1.00 . A A . 15 ILE HG21 1 1 11 2910 1 1 15 ILE HG22 H -8.031 -8.857 0.077 1.00 . A A . 15 ILE HG22 1 1 11 2911 1 1 15 ILE HG23 H -6.740 -9.302 1.211 1.00 . A A . 15 ILE HG23 1 1 11 2912 1 1 15 ILE N N -4.890 -6.309 -0.175 1.00 . A A . 15 ILE N 1 1 11 2913 1 1 15 ILE O O -6.506 -5.281 -1.970 1.00 . A A . 15 ILE O 1 1 11 2914 1 1 16 TRP C C -9.475 -4.834 -2.642 1.00 . A A . 16 TRP C 1 1 11 2915 1 1 16 TRP CA C -8.976 -6.267 -2.821 1.00 . A A . 16 TRP CA 1 1 11 2916 1 1 16 TRP CB C -10.189 -7.179 -3.040 1.00 . A A . 16 TRP CB 1 1 11 2917 1 1 16 TRP CD1 C -10.808 -8.889 -1.229 1.00 . A A . 16 TRP CD1 1 1 11 2918 1 1 16 TRP CD2 C -9.303 -9.639 -2.690 1.00 . A A . 16 TRP CD2 1 1 11 2919 1 1 16 TRP CE2 C -9.550 -10.652 -1.733 1.00 . A A . 16 TRP CE2 1 1 11 2920 1 1 16 TRP CE3 C -8.347 -9.878 -3.686 1.00 . A A . 16 TRP CE3 1 1 11 2921 1 1 16 TRP CG C -10.116 -8.507 -2.340 1.00 . A A . 16 TRP CG 1 1 11 2922 1 1 16 TRP CH2 C -7.957 -12.094 -2.749 1.00 . A A . 16 TRP CH2 1 1 11 2923 1 1 16 TRP CZ2 C -8.879 -11.879 -1.756 1.00 . A A . 16 TRP CZ2 1 1 11 2924 1 1 16 TRP CZ3 C -7.684 -11.104 -3.713 1.00 . A A . 16 TRP CZ3 1 1 11 2925 1 1 16 TRP H H -8.502 -7.588 -1.230 1.00 . A A . 16 TRP H 1 1 11 2926 1 1 16 TRP HA H -8.376 -6.284 -3.731 1.00 . A A . 16 TRP HA 1 1 11 2927 1 1 16 TRP HB2 H -11.081 -6.657 -2.693 1.00 . A A . 16 TRP HB2 1 1 11 2928 1 1 16 TRP HB3 H -10.300 -7.354 -4.111 1.00 . A A . 16 TRP HB3 1 1 11 2929 1 1 16 TRP HD1 H -11.519 -8.262 -0.710 1.00 . A A . 16 TRP HD1 1 1 11 2930 1 1 16 TRP HE1 H -10.869 -10.643 -0.054 1.00 . A A . 16 TRP HE1 1 1 11 2931 1 1 16 TRP HE3 H -8.121 -9.117 -4.418 1.00 . A A . 16 TRP HE3 1 1 11 2932 1 1 16 TRP HH2 H -7.427 -13.034 -2.788 1.00 . A A . 16 TRP HH2 1 1 11 2933 1 1 16 TRP HZ2 H -9.074 -12.633 -1.008 1.00 . A A . 16 TRP HZ2 1 1 11 2934 1 1 16 TRP HZ3 H -6.946 -11.294 -4.478 1.00 . A A . 16 TRP HZ3 1 1 11 2935 1 1 16 TRP N N -8.150 -6.787 -1.735 1.00 . A A . 16 TRP N 1 1 11 2936 1 1 16 TRP NE1 N -10.481 -10.165 -0.853 1.00 . A A . 16 TRP NE1 1 1 11 2937 1 1 16 TRP O O -10.086 -4.270 -3.549 1.00 . A A . 16 TRP O 1 1 11 2938 1 1 17 CYS C C -8.842 -1.900 -2.130 1.00 . A A . 17 CYS C 1 1 11 2939 1 1 17 CYS CA C -9.610 -2.856 -1.217 1.00 . A A . 17 CYS CA 1 1 11 2940 1 1 17 CYS CB C -9.381 -2.502 0.256 1.00 . A A . 17 CYS CB 1 1 11 2941 1 1 17 CYS H H -8.728 -4.739 -0.760 1.00 . A A . 17 CYS H 1 1 11 2942 1 1 17 CYS HA H -10.671 -2.749 -1.439 1.00 . A A . 17 CYS HA 1 1 11 2943 1 1 17 CYS HB2 H -8.919 -1.517 0.308 1.00 . A A . 17 CYS HB2 1 1 11 2944 1 1 17 CYS HB3 H -10.353 -2.442 0.747 1.00 . A A . 17 CYS HB3 1 1 11 2945 1 1 17 CYS N N -9.231 -4.241 -1.478 1.00 . A A . 17 CYS N 1 1 11 2946 1 1 17 CYS O O -7.799 -2.234 -2.691 1.00 . A A . 17 CYS O 1 1 11 2947 1 1 17 CYS SG S -8.352 -3.684 1.188 1.00 . A A . 17 CYS SG 1 1 11 2948 1 1 18 ASP C C -7.397 0.155 -3.575 1.00 . A A . 18 ASP C 1 1 11 2949 1 1 18 ASP CA C -8.880 0.302 -3.271 1.00 . A A . 18 ASP CA 1 1 11 2950 1 1 18 ASP CB C -9.223 1.737 -2.835 1.00 . A A . 18 ASP CB 1 1 11 2951 1 1 18 ASP CG C -8.944 2.710 -3.954 1.00 . A A . 18 ASP CG 1 1 11 2952 1 1 18 ASP H H -10.183 -0.418 -1.738 1.00 . A A . 18 ASP H 1 1 11 2953 1 1 18 ASP HA H -9.379 0.104 -4.222 1.00 . A A . 18 ASP HA 1 1 11 2954 1 1 18 ASP HB2 H -10.276 1.802 -2.558 1.00 . A A . 18 ASP HB2 1 1 11 2955 1 1 18 ASP HB3 H -8.624 2.011 -1.964 1.00 . A A . 18 ASP HB3 1 1 11 2956 1 1 18 ASP N N -9.383 -0.679 -2.294 1.00 . A A . 18 ASP N 1 1 11 2957 1 1 18 ASP O O -6.649 1.108 -3.451 1.00 . A A . 18 ASP O 1 1 11 2958 1 1 18 ASP OD1 O -8.756 2.274 -5.071 1.00 . A A . 18 ASP OD1 1 1 11 2959 1 1 18 ASP OD2 O -8.937 3.897 -3.701 1.00 . A A . 18 ASP OD2 1 1 12 2960 1 1 1 GLY C C 2.628 -0.158 -2.649 1.00 . A A . 1 GLY C 1 1 12 2961 1 1 1 GLY CA C 2.260 -0.974 -1.424 1.00 . A A . 1 GLY CA 1 1 12 2962 1 1 1 GLY H1 H 1.890 0.885 -0.492 1.00 . A A . 1 GLY H1 1 1 12 2963 1 1 1 GLY HA2 H 3.135 -1.541 -1.111 1.00 . A A . 1 GLY HA2 1 1 12 2964 1 1 1 GLY HA3 H 1.460 -1.665 -1.690 1.00 . A A . 1 GLY HA3 1 1 12 2965 1 1 1 GLY N N 1.817 -0.110 -0.342 1.00 . A A . 1 GLY N 1 1 12 2966 1 1 1 GLY O O 3.781 0.243 -2.800 1.00 . A A . 1 GLY O 1 1 12 2967 1 1 2 SER C C 0.709 1.587 -5.327 1.00 . A A . 2 SER C 1 1 12 2968 1 1 2 SER CA C 1.913 0.848 -4.750 1.00 . A A . 2 SER CA 1 1 12 2969 1 1 2 SER CB C 2.435 -0.115 -5.817 1.00 . A A . 2 SER CB 1 1 12 2970 1 1 2 SER H H 0.722 -0.226 -3.334 1.00 . A A . 2 SER H 1 1 12 2971 1 1 2 SER HA H 2.693 1.583 -4.551 1.00 . A A . 2 SER HA 1 1 12 2972 1 1 2 SER HB2 H 3.243 -0.712 -5.394 1.00 . A A . 2 SER HB2 1 1 12 2973 1 1 2 SER HB3 H 1.630 -0.782 -6.122 1.00 . A A . 2 SER HB3 1 1 12 2974 1 1 2 SER HG H 2.332 1.333 -7.120 1.00 . A A . 2 SER HG 1 1 12 2975 1 1 2 SER N N 1.658 0.103 -3.519 1.00 . A A . 2 SER N 1 1 12 2976 1 1 2 SER O O 0.825 2.741 -5.737 1.00 . A A . 2 SER O 1 1 12 2977 1 1 2 SER OG O 2.916 0.593 -6.947 1.00 . A A . 2 SER OG 1 1 12 2978 1 1 3 ARG C C -2.284 2.580 -5.343 1.00 . A A . 3 ARG C 1 1 12 2979 1 1 3 ARG CA C -1.629 1.409 -6.075 1.00 . A A . 3 ARG CA 1 1 12 2980 1 1 3 ARG CB C -2.637 0.267 -6.252 1.00 . A A . 3 ARG CB 1 1 12 2981 1 1 3 ARG CD C -1.341 -0.906 -8.092 1.00 . A A . 3 ARG CD 1 1 12 2982 1 1 3 ARG CG C -2.080 -1.056 -6.772 1.00 . A A . 3 ARG CG 1 1 12 2983 1 1 3 ARG CZ C -0.439 -2.381 -9.866 1.00 . A A . 3 ARG CZ 1 1 12 2984 1 1 3 ARG H H -0.460 -0.038 -5.042 1.00 . A A . 3 ARG H 1 1 12 2985 1 1 3 ARG HA H -1.340 1.775 -7.059 1.00 . A A . 3 ARG HA 1 1 12 2986 1 1 3 ARG HB2 H -3.109 0.077 -5.288 1.00 . A A . 3 ARG HB2 1 1 12 2987 1 1 3 ARG HB3 H -3.414 0.597 -6.942 1.00 . A A . 3 ARG HB3 1 1 12 2988 1 1 3 ARG HD2 H -1.931 -0.272 -8.753 1.00 . A A . 3 ARG HD2 1 1 12 2989 1 1 3 ARG HD3 H -0.382 -0.421 -7.907 1.00 . A A . 3 ARG HD3 1 1 12 2990 1 1 3 ARG HE H -1.498 -3.015 -8.287 1.00 . A A . 3 ARG HE 1 1 12 2991 1 1 3 ARG HG2 H -1.402 -1.482 -6.033 1.00 . A A . 3 ARG HG2 1 1 12 2992 1 1 3 ARG HG3 H -2.912 -1.747 -6.911 1.00 . A A . 3 ARG HG3 1 1 12 2993 1 1 3 ARG HH11 H 0.025 -0.443 -10.171 1.00 . A A . 3 ARG HH11 1 1 12 2994 1 1 3 ARG HH12 H 0.604 -1.569 -11.387 1.00 . A A . 3 ARG HH12 1 1 12 2995 1 1 3 ARG HH21 H -0.722 -4.373 -9.855 1.00 . A A . 3 ARG HH21 1 1 12 2996 1 1 3 ARG HH22 H 0.203 -3.741 -11.207 1.00 . A A . 3 ARG HH22 1 1 12 2997 1 1 3 ARG N N -0.428 0.902 -5.410 1.00 . A A . 3 ARG N 1 1 12 2998 1 1 3 ARG NE N -1.109 -2.199 -8.736 1.00 . A A . 3 ARG NE 1 1 12 2999 1 1 3 ARG NH1 N 0.106 -1.381 -10.530 1.00 . A A . 3 ARG NH1 1 1 12 3000 1 1 3 ARG NH2 N -0.307 -3.598 -10.349 1.00 . A A . 3 ARG NH2 1 1 12 3001 1 1 3 ARG O O -1.673 3.193 -4.472 1.00 . A A . 3 ARG O 1 1 12 3002 1 1 4 GLY C C -4.377 3.699 -3.524 1.00 . A A . 4 GLY C 1 1 12 3003 1 1 4 GLY CA C -4.231 3.976 -5.007 1.00 . A A . 4 GLY CA 1 1 12 3004 1 1 4 GLY H H -4.017 2.368 -6.388 1.00 . A A . 4 GLY H 1 1 12 3005 1 1 4 GLY HA2 H -3.663 4.898 -5.130 1.00 . A A . 4 GLY HA2 1 1 12 3006 1 1 4 GLY HA3 H -5.219 4.104 -5.448 1.00 . A A . 4 GLY HA3 1 1 12 3007 1 1 4 GLY N N -3.529 2.897 -5.682 1.00 . A A . 4 GLY N 1 1 12 3008 1 1 4 GLY O O -4.114 2.587 -3.072 1.00 . A A . 4 GLY O 1 1 12 3009 1 1 5 TRP C C -5.588 3.396 -0.778 1.00 . A A . 5 TRP C 1 1 12 3010 1 1 5 TRP CA C -4.815 4.605 -1.298 1.00 . A A . 5 TRP CA 1 1 12 3011 1 1 5 TRP CB C -5.428 5.876 -0.705 1.00 . A A . 5 TRP CB 1 1 12 3012 1 1 5 TRP CD1 C -5.871 7.930 -2.172 1.00 . A A . 5 TRP CD1 1 1 12 3013 1 1 5 TRP CD2 C -3.756 7.746 -1.505 1.00 . A A . 5 TRP CD2 1 1 12 3014 1 1 5 TRP CE2 C -3.873 8.895 -2.320 1.00 . A A . 5 TRP CE2 1 1 12 3015 1 1 5 TRP CE3 C -2.496 7.415 -0.990 1.00 . A A . 5 TRP CE3 1 1 12 3016 1 1 5 TRP CG C -5.051 7.132 -1.434 1.00 . A A . 5 TRP CG 1 1 12 3017 1 1 5 TRP CH2 C -1.554 9.369 -2.099 1.00 . A A . 5 TRP CH2 1 1 12 3018 1 1 5 TRP CZ2 C -2.776 9.711 -2.620 1.00 . A A . 5 TRP CZ2 1 1 12 3019 1 1 5 TRP CZ3 C -1.404 8.232 -1.283 1.00 . A A . 5 TRP CZ3 1 1 12 3020 1 1 5 TRP H H -5.045 5.587 -3.167 1.00 . A A . 5 TRP H 1 1 12 3021 1 1 5 TRP HA H -3.788 4.523 -0.947 1.00 . A A . 5 TRP HA 1 1 12 3022 1 1 5 TRP HB2 H -6.512 5.773 -0.729 1.00 . A A . 5 TRP HB2 1 1 12 3023 1 1 5 TRP HB3 H -5.118 5.963 0.335 1.00 . A A . 5 TRP HB3 1 1 12 3024 1 1 5 TRP HD1 H -6.928 7.754 -2.309 1.00 . A A . 5 TRP HD1 1 1 12 3025 1 1 5 TRP HE1 H -5.601 9.708 -3.278 1.00 . A A . 5 TRP HE1 1 1 12 3026 1 1 5 TRP HE3 H -2.377 6.532 -0.382 1.00 . A A . 5 TRP HE3 1 1 12 3027 1 1 5 TRP HH2 H -0.693 9.985 -2.314 1.00 . A A . 5 TRP HH2 1 1 12 3028 1 1 5 TRP HZ2 H -2.889 10.584 -3.246 1.00 . A A . 5 TRP HZ2 1 1 12 3029 1 1 5 TRP HZ3 H -0.431 7.984 -0.885 1.00 . A A . 5 TRP HZ3 1 1 12 3030 1 1 5 TRP N N -4.778 4.705 -2.754 1.00 . A A . 5 TRP N 1 1 12 3031 1 1 5 TRP NE1 N -5.184 8.990 -2.705 1.00 . A A . 5 TRP NE1 1 1 12 3032 1 1 5 TRP O O -6.602 3.002 -1.353 1.00 . A A . 5 TRP O 1 1 12 3033 1 1 6 GLY C C -5.079 1.010 2.066 1.00 . A A . 6 GLY C 1 1 12 3034 1 1 6 GLY CA C -5.826 1.712 0.947 1.00 . A A . 6 GLY CA 1 1 12 3035 1 1 6 GLY H H -4.254 3.133 0.740 1.00 . A A . 6 GLY H 1 1 12 3036 1 1 6 GLY HA2 H -6.767 2.090 1.347 1.00 . A A . 6 GLY HA2 1 1 12 3037 1 1 6 GLY HA3 H -6.061 0.976 0.179 1.00 . A A . 6 GLY HA3 1 1 12 3038 1 1 6 GLY N N -5.115 2.812 0.319 1.00 . A A . 6 GLY N 1 1 12 3039 1 1 6 GLY O O -4.574 1.644 2.992 1.00 . A A . 6 GLY O 1 1 12 3040 1 1 7 PHE C C -2.830 -1.162 2.621 1.00 . A A . 7 PHE C 1 1 12 3041 1 1 7 PHE CA C -4.322 -1.150 2.953 1.00 . A A . 7 PHE CA 1 1 12 3042 1 1 7 PHE CB C -4.932 -2.558 2.950 1.00 . A A . 7 PHE CB 1 1 12 3043 1 1 7 PHE CD1 C -7.016 -1.839 4.177 1.00 . A A . 7 PHE CD1 1 1 12 3044 1 1 7 PHE CD2 C -5.963 -3.895 4.811 1.00 . A A . 7 PHE CD2 1 1 12 3045 1 1 7 PHE CE1 C -8.005 -2.043 5.136 1.00 . A A . 7 PHE CE1 1 1 12 3046 1 1 7 PHE CE2 C -6.944 -4.105 5.779 1.00 . A A . 7 PHE CE2 1 1 12 3047 1 1 7 PHE CG C -5.992 -2.765 3.999 1.00 . A A . 7 PHE CG 1 1 12 3048 1 1 7 PHE CZ C -7.970 -3.179 5.936 1.00 . A A . 7 PHE CZ 1 1 12 3049 1 1 7 PHE H H -5.464 -0.776 1.199 1.00 . A A . 7 PHE H 1 1 12 3050 1 1 7 PHE HA H -4.444 -0.718 3.947 1.00 . A A . 7 PHE HA 1 1 12 3051 1 1 7 PHE HB2 H -5.362 -2.754 1.969 1.00 . A A . 7 PHE HB2 1 1 12 3052 1 1 7 PHE HB3 H -4.156 -3.304 3.115 1.00 . A A . 7 PHE HB3 1 1 12 3053 1 1 7 PHE HD1 H -7.045 -0.946 3.571 1.00 . A A . 7 PHE HD1 1 1 12 3054 1 1 7 PHE HD2 H -5.180 -4.629 4.685 1.00 . A A . 7 PHE HD2 1 1 12 3055 1 1 7 PHE HE1 H -8.794 -1.316 5.262 1.00 . A A . 7 PHE HE1 1 1 12 3056 1 1 7 PHE HE2 H -6.911 -4.987 6.401 1.00 . A A . 7 PHE HE2 1 1 12 3057 1 1 7 PHE HZ H -8.736 -3.341 6.680 1.00 . A A . 7 PHE HZ 1 1 12 3058 1 1 7 PHE N N -5.023 -0.315 1.980 1.00 . A A . 7 PHE N 1 1 12 3059 1 1 7 PHE O O -2.372 -0.350 1.819 1.00 . A A . 7 PHE O 1 1 12 3060 1 1 8 GLU C C 0.071 -1.051 3.816 1.00 . A A . 8 GLU C 1 1 12 3061 1 1 8 GLU CA C -0.618 -2.202 3.093 1.00 . A A . 8 GLU CA 1 1 12 3062 1 1 8 GLU CB C -0.234 -2.379 1.598 1.00 . A A . 8 GLU CB 1 1 12 3063 1 1 8 GLU CD C 1.242 -0.467 0.826 1.00 . A A . 8 GLU CD 1 1 12 3064 1 1 8 GLU CG C 1.190 -1.935 1.210 1.00 . A A . 8 GLU CG 1 1 12 3065 1 1 8 GLU H H -2.529 -2.766 3.837 1.00 . A A . 8 GLU H 1 1 12 3066 1 1 8 GLU HA H -0.314 -3.106 3.625 1.00 . A A . 8 GLU HA 1 1 12 3067 1 1 8 GLU HB2 H -0.345 -3.437 1.349 1.00 . A A . 8 GLU HB2 1 1 12 3068 1 1 8 GLU HB3 H -0.943 -1.844 0.967 1.00 . A A . 8 GLU HB3 1 1 12 3069 1 1 8 GLU HG2 H 1.884 -2.110 2.032 1.00 . A A . 8 GLU HG2 1 1 12 3070 1 1 8 GLU HG3 H 1.527 -2.551 0.378 1.00 . A A . 8 GLU HG3 1 1 12 3071 1 1 8 GLU N N -2.076 -2.099 3.234 1.00 . A A . 8 GLU N 1 1 12 3072 1 1 8 GLU O O -0.432 0.052 3.901 1.00 . A A . 8 GLU O 1 1 12 3073 1 1 8 GLU OE1 O 0.797 0.404 1.536 1.00 . A A . 8 GLU OE1 1 1 12 3074 1 1 9 PRO C C 2.512 0.756 3.972 1.00 . A A . 9 PRO C 1 1 12 3075 1 1 9 PRO CA C 2.016 -0.205 5.048 1.00 . A A . 9 PRO CA 1 1 12 3076 1 1 9 PRO CB C 3.166 -0.934 5.748 1.00 . A A . 9 PRO CB 1 1 12 3077 1 1 9 PRO CD C 1.882 -2.609 4.665 1.00 . A A . 9 PRO CD 1 1 12 3078 1 1 9 PRO CG C 3.297 -2.222 5.000 1.00 . A A . 9 PRO CG 1 1 12 3079 1 1 9 PRO HA H 1.409 0.339 5.771 1.00 . A A . 9 PRO HA 1 1 12 3080 1 1 9 PRO HB2 H 4.085 -0.352 5.688 1.00 . A A . 9 PRO HB2 1 1 12 3081 1 1 9 PRO HB3 H 2.902 -1.134 6.787 1.00 . A A . 9 PRO HB3 1 1 12 3082 1 1 9 PRO HD2 H 1.861 -3.221 3.764 1.00 . A A . 9 PRO HD2 1 1 12 3083 1 1 9 PRO HD3 H 1.417 -3.133 5.501 1.00 . A A . 9 PRO HD3 1 1 12 3084 1 1 9 PRO HG2 H 3.872 -2.067 4.087 1.00 . A A . 9 PRO HG2 1 1 12 3085 1 1 9 PRO HG3 H 3.765 -2.982 5.625 1.00 . A A . 9 PRO HG3 1 1 12 3086 1 1 9 PRO N N 1.236 -1.299 4.460 1.00 . A A . 9 PRO N 1 1 12 3087 1 1 9 PRO O O 3.221 0.367 3.044 1.00 . A A . 9 PRO O 1 1 12 3088 1 1 10 GLY C C 0.895 3.531 2.597 1.00 . A A . 10 GLY C 1 1 12 3089 1 1 10 GLY CA C 2.239 2.984 3.036 1.00 . A A . 10 GLY CA 1 1 12 3090 1 1 10 GLY H H 1.568 2.280 4.921 1.00 . A A . 10 GLY H 1 1 12 3091 1 1 10 GLY HA2 H 2.853 3.812 3.389 1.00 . A A . 10 GLY HA2 1 1 12 3092 1 1 10 GLY HA3 H 2.724 2.519 2.179 1.00 . A A . 10 GLY HA3 1 1 12 3093 1 1 10 GLY N N 2.090 2.009 4.101 1.00 . A A . 10 GLY N 1 1 12 3094 1 1 10 GLY O O 0.840 4.569 1.937 1.00 . A A . 10 GLY O 1 1 12 3095 1 1 11 VAL C C -1.776 3.256 1.171 1.00 . A A . 11 VAL C 1 1 12 3096 1 1 11 VAL CA C -1.554 3.251 2.681 1.00 . A A . 11 VAL CA 1 1 12 3097 1 1 11 VAL CB C -1.936 4.622 3.295 1.00 . A A . 11 VAL CB 1 1 12 3098 1 1 11 VAL CG1 C -3.452 4.823 3.287 1.00 . A A . 11 VAL CG1 1 1 12 3099 1 1 11 VAL CG2 C -1.435 4.740 4.735 1.00 . A A . 11 VAL CG2 1 1 12 3100 1 1 11 VAL H H -0.047 1.979 3.482 1.00 . A A . 11 VAL H 1 1 12 3101 1 1 11 VAL HA H -2.224 2.502 3.103 1.00 . A A . 11 VAL HA 1 1 12 3102 1 1 11 VAL HB H -1.478 5.418 2.706 1.00 . A A . 11 VAL HB 1 1 12 3103 1 1 11 VAL HG11 H -3.932 4.039 3.874 1.00 . A A . 11 VAL HG11 1 1 12 3104 1 1 11 VAL HG12 H -3.694 5.794 3.720 1.00 . A A . 11 VAL HG12 1 1 12 3105 1 1 11 VAL HG13 H -3.828 4.790 2.265 1.00 . A A . 11 VAL HG13 1 1 12 3106 1 1 11 VAL HG21 H -1.781 3.885 5.317 1.00 . A A . 11 VAL HG21 1 1 12 3107 1 1 11 VAL HG22 H -0.347 4.771 4.748 1.00 . A A . 11 VAL HG22 1 1 12 3108 1 1 11 VAL HG23 H -1.817 5.658 5.182 1.00 . A A . 11 VAL HG23 1 1 12 3109 1 1 11 VAL N N -0.180 2.848 2.979 1.00 . A A . 11 VAL N 1 1 12 3110 1 1 11 VAL O O -2.218 4.244 0.585 1.00 . A A . 11 VAL O 1 1 12 3111 1 1 12 ARG C C -2.169 0.535 -1.171 1.00 . A A . 12 ARG C 1 1 12 3112 1 1 12 ARG CA C -1.662 1.949 -0.904 1.00 . A A . 12 ARG CA 1 1 12 3113 1 1 12 ARG CB C -0.353 2.190 -1.663 1.00 . A A . 12 ARG CB 1 1 12 3114 1 1 12 ARG CD C -0.322 4.714 -1.990 1.00 . A A . 12 ARG CD 1 1 12 3115 1 1 12 ARG CG C 0.367 3.503 -1.380 1.00 . A A . 12 ARG CG 1 1 12 3116 1 1 12 ARG CZ C 1.358 5.899 -3.381 1.00 . A A . 12 ARG CZ 1 1 12 3117 1 1 12 ARG H H -1.115 1.351 1.073 1.00 . A A . 12 ARG H 1 1 12 3118 1 1 12 ARG HA H -2.401 2.666 -1.261 1.00 . A A . 12 ARG HA 1 1 12 3119 1 1 12 ARG HB2 H 0.329 1.386 -1.405 1.00 . A A . 12 ARG HB2 1 1 12 3120 1 1 12 ARG HB3 H -0.548 2.119 -2.732 1.00 . A A . 12 ARG HB3 1 1 12 3121 1 1 12 ARG HD2 H -1.372 4.481 -2.165 1.00 . A A . 12 ARG HD2 1 1 12 3122 1 1 12 ARG HD3 H -0.273 5.537 -1.277 1.00 . A A . 12 ARG HD3 1 1 12 3123 1 1 12 ARG HE H -0.112 4.739 -4.098 1.00 . A A . 12 ARG HE 1 1 12 3124 1 1 12 ARG HG2 H 0.444 3.644 -0.303 1.00 . A A . 12 ARG HG2 1 1 12 3125 1 1 12 ARG HG3 H 1.377 3.437 -1.782 1.00 . A A . 12 ARG HG3 1 1 12 3126 1 1 12 ARG HH11 H 1.628 6.262 -1.419 1.00 . A A . 12 ARG HH11 1 1 12 3127 1 1 12 ARG HH12 H 2.781 7.026 -2.503 1.00 . A A . 12 ARG HH12 1 1 12 3128 1 1 12 ARG HH21 H 1.381 5.706 -5.380 1.00 . A A . 12 ARG HH21 1 1 12 3129 1 1 12 ARG HH22 H 2.615 6.758 -4.702 1.00 . A A . 12 ARG HH22 1 1 12 3130 1 1 12 ARG N N -1.476 2.128 0.535 1.00 . A A . 12 ARG N 1 1 12 3131 1 1 12 ARG NE N 0.300 5.110 -3.254 1.00 . A A . 12 ARG NE 1 1 12 3132 1 1 12 ARG NH1 N 1.974 6.442 -2.350 1.00 . A A . 12 ARG NH1 1 1 12 3133 1 1 12 ARG NH2 N 1.824 6.145 -4.588 1.00 . A A . 12 ARG NH2 1 1 12 3134 1 1 12 ARG O O -1.452 -0.441 -0.947 1.00 . A A . 12 ARG O 1 1 12 3135 1 1 13 CYS C C -3.339 -1.913 -2.498 1.00 . A A . 13 CYS C 1 1 12 3136 1 1 13 CYS CA C -4.114 -0.846 -1.732 1.00 . A A . 13 CYS CA 1 1 12 3137 1 1 13 CYS CB C -5.476 -0.643 -2.402 1.00 . A A . 13 CYS CB 1 1 12 3138 1 1 13 CYS H H -3.859 1.253 -2.012 1.00 . A A . 13 CYS H 1 1 12 3139 1 1 13 CYS HA H -4.268 -1.209 -0.716 1.00 . A A . 13 CYS HA 1 1 12 3140 1 1 13 CYS HB2 H -6.020 0.139 -1.872 1.00 . A A . 13 CYS HB2 1 1 12 3141 1 1 13 CYS HB3 H -5.306 -0.305 -3.424 1.00 . A A . 13 CYS HB3 1 1 12 3142 1 1 13 CYS N N -3.400 0.425 -1.661 1.00 . A A . 13 CYS N 1 1 12 3143 1 1 13 CYS O O -2.928 -1.708 -3.640 1.00 . A A . 13 CYS O 1 1 12 3144 1 1 13 CYS SG S -6.523 -2.134 -2.462 1.00 . A A . 13 CYS SG 1 1 12 3145 1 1 14 LEU C C -3.235 -5.506 -2.223 1.00 . A A . 14 LEU C 1 1 12 3146 1 1 14 LEU CA C -2.481 -4.202 -2.467 1.00 . A A . 14 LEU CA 1 1 12 3147 1 1 14 LEU CB C -1.059 -4.285 -1.905 1.00 . A A . 14 LEU CB 1 1 12 3148 1 1 14 LEU CD1 C 0.129 -5.636 -3.667 1.00 . A A . 14 LEU CD1 1 1 12 3149 1 1 14 LEU CD2 C 0.107 -3.142 -3.852 1.00 . A A . 14 LEU CD2 1 1 12 3150 1 1 14 LEU CG C 0.113 -4.327 -2.890 1.00 . A A . 14 LEU CG 1 1 12 3151 1 1 14 LEU H H -3.482 -3.163 -0.906 1.00 . A A . 14 LEU H 1 1 12 3152 1 1 14 LEU HA H -2.436 -4.047 -3.545 1.00 . A A . 14 LEU HA 1 1 12 3153 1 1 14 LEU HB2 H -0.907 -3.421 -1.258 1.00 . A A . 14 LEU HB2 1 1 12 3154 1 1 14 LEU HB3 H -0.992 -5.173 -1.275 1.00 . A A . 14 LEU HB3 1 1 12 3155 1 1 14 LEU HD11 H 0.179 -6.473 -2.970 1.00 . A A . 14 LEU HD11 1 1 12 3156 1 1 14 LEU HD12 H -0.774 -5.722 -4.271 1.00 . A A . 14 LEU HD12 1 1 12 3157 1 1 14 LEU HD13 H 1.002 -5.661 -4.319 1.00 . A A . 14 LEU HD13 1 1 12 3158 1 1 14 LEU HD21 H -0.676 -3.275 -4.598 1.00 . A A . 14 LEU HD21 1 1 12 3159 1 1 14 LEU HD22 H -0.079 -2.223 -3.297 1.00 . A A . 14 LEU HD22 1 1 12 3160 1 1 14 LEU HD23 H 1.074 -3.077 -4.352 1.00 . A A . 14 LEU HD23 1 1 12 3161 1 1 14 LEU HG H 1.026 -4.271 -2.299 1.00 . A A . 14 LEU HG 1 1 12 3162 1 1 14 LEU N N -3.156 -3.063 -1.856 1.00 . A A . 14 LEU N 1 1 12 3163 1 1 14 LEU O O -3.394 -6.313 -3.136 1.00 . A A . 14 LEU O 1 1 12 3164 1 1 15 ILE C C -5.770 -6.520 0.012 1.00 . A A . 15 ILE C 1 1 12 3165 1 1 15 ILE CA C -4.438 -6.909 -0.622 1.00 . A A . 15 ILE CA 1 1 12 3166 1 1 15 ILE CB C -3.650 -7.800 0.367 1.00 . A A . 15 ILE CB 1 1 12 3167 1 1 15 ILE CD1 C -1.346 -8.881 0.743 1.00 . A A . 15 ILE CD1 1 1 12 3168 1 1 15 ILE CG1 C -2.266 -8.132 -0.202 1.00 . A A . 15 ILE CG1 1 1 12 3169 1 1 15 ILE CG2 C -4.444 -9.072 0.660 1.00 . A A . 15 ILE CG2 1 1 12 3170 1 1 15 ILE H H -3.503 -5.035 -0.267 1.00 . A A . 15 ILE H 1 1 12 3171 1 1 15 ILE HA H -4.637 -7.488 -1.525 1.00 . A A . 15 ILE HA 1 1 12 3172 1 1 15 ILE HB H -3.517 -7.252 1.299 1.00 . A A . 15 ILE HB 1 1 12 3173 1 1 15 ILE HD11 H -1.293 -8.354 1.696 1.00 . A A . 15 ILE HD11 1 1 12 3174 1 1 15 ILE HD12 H -1.719 -9.892 0.904 1.00 . A A . 15 ILE HD12 1 1 12 3175 1 1 15 ILE HD13 H -0.348 -8.934 0.307 1.00 . A A . 15 ILE HD13 1 1 12 3176 1 1 15 ILE HG12 H -2.398 -8.718 -1.111 1.00 . A A . 15 ILE HG12 1 1 12 3177 1 1 15 ILE HG13 H -1.763 -7.205 -0.475 1.00 . A A . 15 ILE HG13 1 1 12 3178 1 1 15 ILE HG21 H -3.897 -9.706 1.359 1.00 . A A . 15 ILE HG21 1 1 12 3179 1 1 15 ILE HG22 H -5.400 -8.807 1.110 1.00 . A A . 15 ILE HG22 1 1 12 3180 1 1 15 ILE HG23 H -4.622 -9.622 -0.265 1.00 . A A . 15 ILE HG23 1 1 12 3181 1 1 15 ILE N N -3.687 -5.712 -0.990 1.00 . A A . 15 ILE N 1 1 12 3182 1 1 15 ILE O O -5.795 -5.878 1.061 1.00 . A A . 15 ILE O 1 1 12 3183 1 1 16 TRP C C -8.462 -5.510 0.716 1.00 . A A . 16 TRP C 1 1 12 3184 1 1 16 TRP CA C -8.232 -6.713 -0.197 1.00 . A A . 16 TRP CA 1 1 12 3185 1 1 16 TRP CB C -8.748 -7.984 0.484 1.00 . A A . 16 TRP CB 1 1 12 3186 1 1 16 TRP CD1 C -7.608 -10.279 0.479 1.00 . A A . 16 TRP CD1 1 1 12 3187 1 1 16 TRP CD2 C -8.422 -9.692 -1.507 1.00 . A A . 16 TRP CD2 1 1 12 3188 1 1 16 TRP CE2 C -7.740 -10.924 -1.643 1.00 . A A . 16 TRP CE2 1 1 12 3189 1 1 16 TRP CE3 C -9.009 -9.124 -2.646 1.00 . A A . 16 TRP CE3 1 1 12 3190 1 1 16 TRP CG C -8.279 -9.269 -0.142 1.00 . A A . 16 TRP CG 1 1 12 3191 1 1 16 TRP CH2 C -8.179 -10.989 -3.977 1.00 . A A . 16 TRP CH2 1 1 12 3192 1 1 16 TRP CZ2 C -7.600 -11.568 -2.876 1.00 . A A . 16 TRP CZ2 1 1 12 3193 1 1 16 TRP CZ3 C -8.887 -9.776 -3.872 1.00 . A A . 16 TRP CZ3 1 1 12 3194 1 1 16 TRP H H -6.733 -7.409 -1.520 1.00 . A A . 16 TRP H 1 1 12 3195 1 1 16 TRP HA H -8.848 -6.553 -1.082 1.00 . A A . 16 TRP HA 1 1 12 3196 1 1 16 TRP HB2 H -8.425 -7.980 1.525 1.00 . A A . 16 TRP HB2 1 1 12 3197 1 1 16 TRP HB3 H -9.838 -7.966 0.467 1.00 . A A . 16 TRP HB3 1 1 12 3198 1 1 16 TRP HD1 H -7.356 -10.283 1.529 1.00 . A A . 16 TRP HD1 1 1 12 3199 1 1 16 TRP HE1 H -6.775 -12.114 -0.153 1.00 . A A . 16 TRP HE1 1 1 12 3200 1 1 16 TRP HE3 H -9.540 -8.187 -2.578 1.00 . A A . 16 TRP HE3 1 1 12 3201 1 1 16 TRP HH2 H -8.088 -11.470 -4.941 1.00 . A A . 16 TRP HH2 1 1 12 3202 1 1 16 TRP HZ2 H -7.043 -12.490 -2.958 1.00 . A A . 16 TRP HZ2 1 1 12 3203 1 1 16 TRP HZ3 H -9.334 -9.343 -4.755 1.00 . A A . 16 TRP HZ3 1 1 12 3204 1 1 16 TRP N N -6.855 -6.911 -0.650 1.00 . A A . 16 TRP N 1 1 12 3205 1 1 16 TRP NE1 N -7.280 -11.275 -0.401 1.00 . A A . 16 TRP NE1 1 1 12 3206 1 1 16 TRP O O -8.868 -5.650 1.870 1.00 . A A . 16 TRP O 1 1 12 3207 1 1 17 CYS C C -9.866 -2.718 1.153 1.00 . A A . 17 CYS C 1 1 12 3208 1 1 17 CYS CA C -8.399 -3.098 0.976 1.00 . A A . 17 CYS CA 1 1 12 3209 1 1 17 CYS CB C -7.650 -1.937 0.320 1.00 . A A . 17 CYS CB 1 1 12 3210 1 1 17 CYS H H -7.903 -4.226 -0.761 1.00 . A A . 17 CYS H 1 1 12 3211 1 1 17 CYS HA H -7.975 -3.264 1.965 1.00 . A A . 17 CYS HA 1 1 12 3212 1 1 17 CYS HB2 H -7.804 -1.038 0.917 1.00 . A A . 17 CYS HB2 1 1 12 3213 1 1 17 CYS HB3 H -6.589 -2.181 0.314 1.00 . A A . 17 CYS HB3 1 1 12 3214 1 1 17 CYS N N -8.215 -4.314 0.194 1.00 . A A . 17 CYS N 1 1 12 3215 1 1 17 CYS O O -10.753 -3.143 0.414 1.00 . A A . 17 CYS O 1 1 12 3216 1 1 17 CYS SG S -8.162 -1.593 -1.393 1.00 . A A . 17 CYS SG 1 1 12 3217 1 1 18 ASP C C -11.817 -0.278 1.312 1.00 . A A . 18 ASP C 1 1 12 3218 1 1 18 ASP CA C -11.453 -1.293 2.380 1.00 . A A . 18 ASP CA 1 1 12 3219 1 1 18 ASP CB C -11.565 -0.655 3.773 1.00 . A A . 18 ASP CB 1 1 12 3220 1 1 18 ASP CG C -12.972 -0.174 4.023 1.00 . A A . 18 ASP CG 1 1 12 3221 1 1 18 ASP H H -9.376 -1.590 2.778 1.00 . A A . 18 ASP H 1 1 12 3222 1 1 18 ASP HA H -12.193 -2.091 2.297 1.00 . A A . 18 ASP HA 1 1 12 3223 1 1 18 ASP HB2 H -11.292 -1.383 4.540 1.00 . A A . 18 ASP HB2 1 1 12 3224 1 1 18 ASP HB3 H -10.880 0.192 3.846 1.00 . A A . 18 ASP HB3 1 1 12 3225 1 1 18 ASP N N -10.123 -1.868 2.161 1.00 . A A . 18 ASP N 1 1 12 3226 1 1 18 ASP O O -11.077 0.670 1.129 1.00 . A A . 18 ASP O 1 1 12 3227 1 1 18 ASP OD1 O -13.778 -0.246 3.116 1.00 . A A . 18 ASP OD1 1 1 12 3228 1 1 18 ASP OD2 O -13.253 0.257 5.120 1.00 . A A . 18 ASP OD2 1 1 13 3229 1 1 1 GLY C C 2.748 1.091 -1.957 1.00 . A A . 1 GLY C 1 1 13 3230 1 1 1 GLY CA C 2.630 -0.421 -1.988 1.00 . A A . 1 GLY CA 1 1 13 3231 1 1 1 GLY H1 H 2.463 -0.481 0.136 1.00 . A A . 1 GLY H1 1 1 13 3232 1 1 1 GLY HA2 H 3.608 -0.843 -2.223 1.00 . A A . 1 GLY HA2 1 1 13 3233 1 1 1 GLY HA3 H 1.928 -0.708 -2.771 1.00 . A A . 1 GLY HA3 1 1 13 3234 1 1 1 GLY N N 2.170 -0.947 -0.712 1.00 . A A . 1 GLY N 1 1 13 3235 1 1 1 GLY O O 3.214 1.632 -0.956 1.00 . A A . 1 GLY O 1 1 13 3236 1 1 2 SER C C 1.403 3.957 -3.972 1.00 . A A . 2 SER C 1 1 13 3237 1 1 2 SER CA C 2.390 3.234 -3.057 1.00 . A A . 2 SER CA 1 1 13 3238 1 1 2 SER CB C 3.796 3.671 -3.471 1.00 . A A . 2 SER CB 1 1 13 3239 1 1 2 SER H H 1.976 1.281 -3.824 1.00 . A A . 2 SER H 1 1 13 3240 1 1 2 SER HA H 2.212 3.598 -2.044 1.00 . A A . 2 SER HA 1 1 13 3241 1 1 2 SER HB2 H 4.488 2.848 -3.296 1.00 . A A . 2 SER HB2 1 1 13 3242 1 1 2 SER HB3 H 3.796 3.913 -4.534 1.00 . A A . 2 SER HB3 1 1 13 3243 1 1 2 SER HG H 3.504 5.448 -2.725 1.00 . A A . 2 SER HG 1 1 13 3244 1 1 2 SER N N 2.339 1.773 -3.022 1.00 . A A . 2 SER N 1 1 13 3245 1 1 2 SER O O 1.088 5.122 -3.740 1.00 . A A . 2 SER O 1 1 13 3246 1 1 2 SER OG O 4.217 4.805 -2.732 1.00 . A A . 2 SER OG 1 1 13 3247 1 1 3 ARG C C -1.204 4.476 -5.670 1.00 . A A . 3 ARG C 1 1 13 3248 1 1 3 ARG CA C 0.176 3.970 -6.087 1.00 . A A . 3 ARG CA 1 1 13 3249 1 1 3 ARG CB C 0.045 3.066 -7.317 1.00 . A A . 3 ARG CB 1 1 13 3250 1 1 3 ARG CD C 2.436 3.438 -8.102 1.00 . A A . 3 ARG CD 1 1 13 3251 1 1 3 ARG CG C 1.335 2.426 -7.816 1.00 . A A . 3 ARG CG 1 1 13 3252 1 1 3 ARG CZ C 4.537 2.164 -8.459 1.00 . A A . 3 ARG CZ 1 1 13 3253 1 1 3 ARG H H 1.241 2.349 -5.196 1.00 . A A . 3 ARG H 1 1 13 3254 1 1 3 ARG HA H 0.719 4.867 -6.382 1.00 . A A . 3 ARG HA 1 1 13 3255 1 1 3 ARG HB2 H -0.650 2.260 -7.087 1.00 . A A . 3 ARG HB2 1 1 13 3256 1 1 3 ARG HB3 H -0.388 3.656 -8.124 1.00 . A A . 3 ARG HB3 1 1 13 3257 1 1 3 ARG HD2 H 2.000 4.284 -8.632 1.00 . A A . 3 ARG HD2 1 1 13 3258 1 1 3 ARG HD3 H 2.849 3.797 -7.159 1.00 . A A . 3 ARG HD3 1 1 13 3259 1 1 3 ARG HE H 3.435 2.983 -9.916 1.00 . A A . 3 ARG HE 1 1 13 3260 1 1 3 ARG HG2 H 1.695 1.714 -7.074 1.00 . A A . 3 ARG HG2 1 1 13 3261 1 1 3 ARG HG3 H 1.114 1.879 -8.732 1.00 . A A . 3 ARG HG3 1 1 13 3262 1 1 3 ARG HH11 H 4.084 2.310 -6.500 1.00 . A A . 3 ARG HH11 1 1 13 3263 1 1 3 ARG HH12 H 5.532 1.394 -6.886 1.00 . A A . 3 ARG HH12 1 1 13 3264 1 1 3 ARG HH21 H 5.277 1.853 -10.303 1.00 . A A . 3 ARG HH21 1 1 13 3265 1 1 3 ARG HH22 H 6.206 1.161 -8.984 1.00 . A A . 3 ARG HH22 1 1 13 3266 1 1 3 ARG N N 0.967 3.309 -5.049 1.00 . A A . 3 ARG N 1 1 13 3267 1 1 3 ARG NE N 3.498 2.850 -8.918 1.00 . A A . 3 ARG NE 1 1 13 3268 1 1 3 ARG NH1 N 4.730 1.933 -7.176 1.00 . A A . 3 ARG NH1 1 1 13 3269 1 1 3 ARG NH2 N 5.411 1.683 -9.318 1.00 . A A . 3 ARG NH2 1 1 13 3270 1 1 3 ARG O O -1.432 5.682 -5.616 1.00 . A A . 3 ARG O 1 1 13 3271 1 1 4 GLY C C -3.632 3.815 -3.524 1.00 . A A . 4 GLY C 1 1 13 3272 1 1 4 GLY CA C -3.482 3.897 -5.030 1.00 . A A . 4 GLY CA 1 1 13 3273 1 1 4 GLY H H -1.877 2.579 -5.510 1.00 . A A . 4 GLY H 1 1 13 3274 1 1 4 GLY HA2 H -3.715 4.910 -5.356 1.00 . A A . 4 GLY HA2 1 1 13 3275 1 1 4 GLY HA3 H -4.182 3.202 -5.493 1.00 . A A . 4 GLY HA3 1 1 13 3276 1 1 4 GLY N N -2.128 3.552 -5.431 1.00 . A A . 4 GLY N 1 1 13 3277 1 1 4 GLY O O -2.638 3.590 -2.840 1.00 . A A . 4 GLY O 1 1 13 3278 1 1 5 TRP C C -5.475 2.531 -1.037 1.00 . A A . 5 TRP C 1 1 13 3279 1 1 5 TRP CA C -5.043 3.905 -1.542 1.00 . A A . 5 TRP CA 1 1 13 3280 1 1 5 TRP CB C -6.100 4.919 -1.093 1.00 . A A . 5 TRP CB 1 1 13 3281 1 1 5 TRP CD1 C -7.358 6.470 -2.700 1.00 . A A . 5 TRP CD1 1 1 13 3282 1 1 5 TRP CD2 C -5.295 7.157 -2.226 1.00 . A A . 5 TRP CD2 1 1 13 3283 1 1 5 TRP CE2 C -5.907 8.117 -3.065 1.00 . A A . 5 TRP CE2 1 1 13 3284 1 1 5 TRP CE3 C -3.957 7.348 -1.855 1.00 . A A . 5 TRP CE3 1 1 13 3285 1 1 5 TRP CG C -6.257 6.121 -1.978 1.00 . A A . 5 TRP CG 1 1 13 3286 1 1 5 TRP CH2 C -3.948 9.462 -3.067 1.00 . A A . 5 TRP CH2 1 1 13 3287 1 1 5 TRP CZ2 C -5.245 9.276 -3.479 1.00 . A A . 5 TRP CZ2 1 1 13 3288 1 1 5 TRP CZ3 C -3.297 8.505 -2.265 1.00 . A A . 5 TRP CZ3 1 1 13 3289 1 1 5 TRP H H -5.634 4.186 -3.569 1.00 . A A . 5 TRP H 1 1 13 3290 1 1 5 TRP HA H -4.098 4.151 -1.063 1.00 . A A . 5 TRP HA 1 1 13 3291 1 1 5 TRP HB2 H -7.062 4.410 -1.037 1.00 . A A . 5 TRP HB2 1 1 13 3292 1 1 5 TRP HB3 H -5.842 5.262 -0.092 1.00 . A A . 5 TRP HB3 1 1 13 3293 1 1 5 TRP HD1 H -8.268 5.889 -2.739 1.00 . A A . 5 TRP HD1 1 1 13 3294 1 1 5 TRP HE1 H -7.853 8.097 -3.948 1.00 . A A . 5 TRP HE1 1 1 13 3295 1 1 5 TRP HE3 H -3.446 6.599 -1.271 1.00 . A A . 5 TRP HE3 1 1 13 3296 1 1 5 TRP HH2 H -3.416 10.350 -3.371 1.00 . A A . 5 TRP HH2 1 1 13 3297 1 1 5 TRP HZ2 H -5.735 10.001 -4.112 1.00 . A A . 5 TRP HZ2 1 1 13 3298 1 1 5 TRP HZ3 H -2.269 8.663 -1.973 1.00 . A A . 5 TRP HZ3 1 1 13 3299 1 1 5 TRP N N -4.837 3.976 -2.987 1.00 . A A . 5 TRP N 1 1 13 3300 1 1 5 TRP NE1 N -7.164 7.656 -3.356 1.00 . A A . 5 TRP NE1 1 1 13 3301 1 1 5 TRP O O -6.144 1.785 -1.751 1.00 . A A . 5 TRP O 1 1 13 3302 1 1 6 GLY C C -4.946 0.574 2.121 1.00 . A A . 6 GLY C 1 1 13 3303 1 1 6 GLY CA C -5.617 0.990 0.825 1.00 . A A . 6 GLY CA 1 1 13 3304 1 1 6 GLY H H -4.487 2.790 0.727 1.00 . A A . 6 GLY H 1 1 13 3305 1 1 6 GLY HA2 H -6.681 1.124 1.021 1.00 . A A . 6 GLY HA2 1 1 13 3306 1 1 6 GLY HA3 H -5.514 0.170 0.116 1.00 . A A . 6 GLY HA3 1 1 13 3307 1 1 6 GLY N N -5.114 2.199 0.198 1.00 . A A . 6 GLY N 1 1 13 3308 1 1 6 GLY O O -4.397 1.404 2.843 1.00 . A A . 6 GLY O 1 1 13 3309 1 1 7 PHE C C -3.079 -1.609 3.752 1.00 . A A . 7 PHE C 1 1 13 3310 1 1 7 PHE CA C -4.569 -1.275 3.695 1.00 . A A . 7 PHE CA 1 1 13 3311 1 1 7 PHE CB C -5.339 -2.565 3.996 1.00 . A A . 7 PHE CB 1 1 13 3312 1 1 7 PHE CD1 C -7.462 -1.186 4.351 1.00 . A A . 7 PHE CD1 1 1 13 3313 1 1 7 PHE CD2 C -7.386 -3.454 5.105 1.00 . A A . 7 PHE CD2 1 1 13 3314 1 1 7 PHE CE1 C -8.774 -1.076 4.805 1.00 . A A . 7 PHE CE1 1 1 13 3315 1 1 7 PHE CE2 C -8.694 -3.353 5.571 1.00 . A A . 7 PHE CE2 1 1 13 3316 1 1 7 PHE CG C -6.753 -2.378 4.490 1.00 . A A . 7 PHE CG 1 1 13 3317 1 1 7 PHE CZ C -9.392 -2.161 5.415 1.00 . A A . 7 PHE CZ 1 1 13 3318 1 1 7 PHE H H -5.427 -1.359 1.753 1.00 . A A . 7 PHE H 1 1 13 3319 1 1 7 PHE HA H -4.766 -0.551 4.486 1.00 . A A . 7 PHE HA 1 1 13 3320 1 1 7 PHE HB2 H -5.355 -3.184 3.099 1.00 . A A . 7 PHE HB2 1 1 13 3321 1 1 7 PHE HB3 H -4.790 -3.108 4.765 1.00 . A A . 7 PHE HB3 1 1 13 3322 1 1 7 PHE HD1 H -7.004 -0.322 3.896 1.00 . A A . 7 PHE HD1 1 1 13 3323 1 1 7 PHE HD2 H -6.858 -4.390 5.222 1.00 . A A . 7 PHE HD2 1 1 13 3324 1 1 7 PHE HE1 H -9.309 -0.144 4.691 1.00 . A A . 7 PHE HE1 1 1 13 3325 1 1 7 PHE HE2 H -9.167 -4.200 6.045 1.00 . A A . 7 PHE HE2 1 1 13 3326 1 1 7 PHE HZ H -10.411 -2.079 5.769 1.00 . A A . 7 PHE HZ 1 1 13 3327 1 1 7 PHE N N -5.019 -0.720 2.418 1.00 . A A . 7 PHE N 1 1 13 3328 1 1 7 PHE O O -2.525 -1.875 4.818 1.00 . A A . 7 PHE O 1 1 13 3329 1 1 8 GLU C C -0.216 -0.721 3.148 1.00 . A A . 8 GLU C 1 1 13 3330 1 1 8 GLU CA C -0.977 -1.858 2.493 1.00 . A A . 8 GLU CA 1 1 13 3331 1 1 8 GLU CB C -0.565 -1.964 1.012 1.00 . A A . 8 GLU CB 1 1 13 3332 1 1 8 GLU CD C 1.338 -1.998 -0.598 1.00 . A A . 8 GLU CD 1 1 13 3333 1 1 8 GLU CG C 0.913 -2.338 0.808 1.00 . A A . 8 GLU CG 1 1 13 3334 1 1 8 GLU H H -2.919 -1.413 1.732 1.00 . A A . 8 GLU H 1 1 13 3335 1 1 8 GLU HA H -0.746 -2.786 3.020 1.00 . A A . 8 GLU HA 1 1 13 3336 1 1 8 GLU HB2 H -1.198 -2.693 0.504 1.00 . A A . 8 GLU HB2 1 1 13 3337 1 1 8 GLU HB3 H -0.740 -0.995 0.544 1.00 . A A . 8 GLU HB3 1 1 13 3338 1 1 8 GLU HG2 H 1.538 -1.779 1.503 1.00 . A A . 8 GLU HG2 1 1 13 3339 1 1 8 GLU HG3 H 1.067 -3.402 0.997 1.00 . A A . 8 GLU HG3 1 1 13 3340 1 1 8 GLU N N -2.417 -1.615 2.586 1.00 . A A . 8 GLU N 1 1 13 3341 1 1 8 GLU O O -0.525 0.438 2.953 1.00 . A A . 8 GLU O 1 1 13 3342 1 1 8 GLU OE1 O 0.936 -2.602 -1.572 1.00 . A A . 8 GLU OE1 1 1 13 3343 1 1 9 PRO C C 2.430 0.714 3.223 1.00 . A A . 9 PRO C 1 1 13 3344 1 1 9 PRO CA C 1.734 0.051 4.409 1.00 . A A . 9 PRO CA 1 1 13 3345 1 1 9 PRO CB C 2.702 -0.693 5.332 1.00 . A A . 9 PRO CB 1 1 13 3346 1 1 9 PRO CD C 1.292 -2.350 4.357 1.00 . A A . 9 PRO CD 1 1 13 3347 1 1 9 PRO CG C 2.704 -2.093 4.814 1.00 . A A . 9 PRO CG 1 1 13 3348 1 1 9 PRO HA H 1.165 0.795 4.968 1.00 . A A . 9 PRO HA 1 1 13 3349 1 1 9 PRO HB2 H 3.699 -0.256 5.279 1.00 . A A . 9 PRO HB2 1 1 13 3350 1 1 9 PRO HB3 H 2.328 -0.675 6.357 1.00 . A A . 9 PRO HB3 1 1 13 3351 1 1 9 PRO HD2 H 1.291 -3.055 3.526 1.00 . A A . 9 PRO HD2 1 1 13 3352 1 1 9 PRO HD3 H 0.677 -2.713 5.180 1.00 . A A . 9 PRO HD3 1 1 13 3353 1 1 9 PRO HG2 H 3.389 -2.176 3.970 1.00 . A A . 9 PRO HG2 1 1 13 3354 1 1 9 PRO HG3 H 2.984 -2.794 5.601 1.00 . A A . 9 PRO HG3 1 1 13 3355 1 1 9 PRO N N 0.843 -1.011 3.934 1.00 . A A . 9 PRO N 1 1 13 3356 1 1 9 PRO O O 2.780 0.060 2.240 1.00 . A A . 9 PRO O 1 1 13 3357 1 1 10 GLY C C 1.648 3.282 1.400 1.00 . A A . 10 GLY C 1 1 13 3358 1 1 10 GLY CA C 2.899 2.824 2.125 1.00 . A A . 10 GLY CA 1 1 13 3359 1 1 10 GLY H H 2.358 2.517 4.158 1.00 . A A . 10 GLY H 1 1 13 3360 1 1 10 GLY HA2 H 3.461 3.706 2.433 1.00 . A A . 10 GLY HA2 1 1 13 3361 1 1 10 GLY HA3 H 3.511 2.237 1.441 1.00 . A A . 10 GLY HA3 1 1 13 3362 1 1 10 GLY N N 2.570 2.033 3.298 1.00 . A A . 10 GLY N 1 1 13 3363 1 1 10 GLY O O 1.726 4.035 0.429 1.00 . A A . 10 GLY O 1 1 13 3364 1 1 11 VAL C C -1.110 2.677 0.047 1.00 . A A . 11 VAL C 1 1 13 3365 1 1 11 VAL CA C -0.829 3.230 1.441 1.00 . A A . 11 VAL CA 1 1 13 3366 1 1 11 VAL CB C -1.053 4.760 1.490 1.00 . A A . 11 VAL CB 1 1 13 3367 1 1 11 VAL CG1 C -2.480 5.105 1.082 1.00 . A A . 11 VAL CG1 1 1 13 3368 1 1 11 VAL CG2 C -0.787 5.294 2.898 1.00 . A A . 11 VAL CG2 1 1 13 3369 1 1 11 VAL H H 0.537 2.179 2.671 1.00 . A A . 11 VAL H 1 1 13 3370 1 1 11 VAL HA H -1.556 2.777 2.114 1.00 . A A . 11 VAL HA 1 1 13 3371 1 1 11 VAL HB H -0.367 5.249 0.799 1.00 . A A . 11 VAL HB 1 1 13 3372 1 1 11 VAL HG11 H -3.188 4.508 1.656 1.00 . A A . 11 VAL HG11 1 1 13 3373 1 1 11 VAL HG12 H -2.668 6.164 1.261 1.00 . A A . 11 VAL HG12 1 1 13 3374 1 1 11 VAL HG13 H -2.599 4.903 0.019 1.00 . A A . 11 VAL HG13 1 1 13 3375 1 1 11 VAL HG21 H -1.413 4.766 3.618 1.00 . A A . 11 VAL HG21 1 1 13 3376 1 1 11 VAL HG22 H 0.262 5.152 3.156 1.00 . A A . 11 VAL HG22 1 1 13 3377 1 1 11 VAL HG23 H -1.016 6.359 2.933 1.00 . A A . 11 VAL HG23 1 1 13 3378 1 1 11 VAL N N 0.501 2.841 1.908 1.00 . A A . 11 VAL N 1 1 13 3379 1 1 11 VAL O O -0.771 3.287 -0.965 1.00 . A A . 11 VAL O 1 1 13 3380 1 1 12 ARG C C -3.196 -0.235 -1.007 1.00 . A A . 12 ARG C 1 1 13 3381 1 1 12 ARG CA C -2.179 0.878 -1.235 1.00 . A A . 12 ARG CA 1 1 13 3382 1 1 12 ARG CB C -0.972 0.299 -1.978 1.00 . A A . 12 ARG CB 1 1 13 3383 1 1 12 ARG CD C -1.947 0.116 -4.312 1.00 . A A . 12 ARG CD 1 1 13 3384 1 1 12 ARG CG C -0.842 0.696 -3.442 1.00 . A A . 12 ARG CG 1 1 13 3385 1 1 12 ARG CZ C -0.892 -0.840 -6.339 1.00 . A A . 12 ARG CZ 1 1 13 3386 1 1 12 ARG H H -1.875 0.999 0.878 1.00 . A A . 12 ARG H 1 1 13 3387 1 1 12 ARG HA H -2.644 1.652 -1.845 1.00 . A A . 12 ARG HA 1 1 13 3388 1 1 12 ARG HB2 H -0.070 0.631 -1.462 1.00 . A A . 12 ARG HB2 1 1 13 3389 1 1 12 ARG HB3 H -1.011 -0.788 -1.916 1.00 . A A . 12 ARG HB3 1 1 13 3390 1 1 12 ARG HD2 H -2.148 -0.905 -3.988 1.00 . A A . 12 ARG HD2 1 1 13 3391 1 1 12 ARG HD3 H -2.853 0.707 -4.168 1.00 . A A . 12 ARG HD3 1 1 13 3392 1 1 12 ARG HE H -1.940 0.869 -6.298 1.00 . A A . 12 ARG HE 1 1 13 3393 1 1 12 ARG HG2 H -0.849 1.784 -3.521 1.00 . A A . 12 ARG HG2 1 1 13 3394 1 1 12 ARG HG3 H 0.114 0.326 -3.811 1.00 . A A . 12 ARG HG3 1 1 13 3395 1 1 12 ARG HH11 H -0.559 -1.993 -4.718 1.00 . A A . 12 ARG HH11 1 1 13 3396 1 1 12 ARG HH12 H 0.153 -2.560 -6.216 1.00 . A A . 12 ARG HH12 1 1 13 3397 1 1 12 ARG HH21 H -1.064 0.044 -8.139 1.00 . A A . 12 ARG HH21 1 1 13 3398 1 1 12 ARG HH22 H -0.111 -1.430 -8.099 1.00 . A A . 12 ARG HH22 1 1 13 3399 1 1 12 ARG N N -1.727 1.499 0.011 1.00 . A A . 12 ARG N 1 1 13 3400 1 1 12 ARG NE N -1.597 0.107 -5.732 1.00 . A A . 12 ARG NE 1 1 13 3401 1 1 12 ARG NH1 N -0.384 -1.878 -5.704 1.00 . A A . 12 ARG NH1 1 1 13 3402 1 1 12 ARG NH2 N -0.663 -0.729 -7.630 1.00 . A A . 12 ARG NH2 1 1 13 3403 1 1 12 ARG O O -3.171 -0.911 0.018 1.00 . A A . 12 ARG O 1 1 13 3404 1 1 13 CYS C C -4.068 -2.843 -2.485 1.00 . A A . 13 CYS C 1 1 13 3405 1 1 13 CYS CA C -4.894 -1.674 -1.957 1.00 . A A . 13 CYS CA 1 1 13 3406 1 1 13 CYS CB C -6.157 -1.496 -2.802 1.00 . A A . 13 CYS CB 1 1 13 3407 1 1 13 CYS H H -4.202 0.202 -2.719 1.00 . A A . 13 CYS H 1 1 13 3408 1 1 13 CYS HA H -5.188 -1.892 -0.932 1.00 . A A . 13 CYS HA 1 1 13 3409 1 1 13 CYS HB2 H -6.676 -0.594 -2.477 1.00 . A A . 13 CYS HB2 1 1 13 3410 1 1 13 CYS HB3 H -5.874 -1.388 -3.849 1.00 . A A . 13 CYS HB3 1 1 13 3411 1 1 13 CYS N N -4.086 -0.459 -1.966 1.00 . A A . 13 CYS N 1 1 13 3412 1 1 13 CYS O O -3.550 -2.789 -3.600 1.00 . A A . 13 CYS O 1 1 13 3413 1 1 13 CYS SG S -7.301 -2.903 -2.641 1.00 . A A . 13 CYS SG 1 1 13 3414 1 1 14 LEU C C -3.955 -6.338 -1.621 1.00 . A A . 14 LEU C 1 1 13 3415 1 1 14 LEU CA C -3.199 -5.087 -2.063 1.00 . A A . 14 LEU CA 1 1 13 3416 1 1 14 LEU CB C -1.798 -5.034 -1.444 1.00 . A A . 14 LEU CB 1 1 13 3417 1 1 14 LEU CD1 C -0.756 -7.200 -2.255 1.00 . A A . 14 LEU CD1 1 1 13 3418 1 1 14 LEU CD2 C -0.401 -5.098 -3.553 1.00 . A A . 14 LEU CD2 1 1 13 3419 1 1 14 LEU CG C -0.615 -5.687 -2.163 1.00 . A A . 14 LEU CG 1 1 13 3420 1 1 14 LEU H H -4.338 -3.866 -0.751 1.00 . A A . 14 LEU H 1 1 13 3421 1 1 14 LEU HA H -3.114 -5.111 -3.150 1.00 . A A . 14 LEU HA 1 1 13 3422 1 1 14 LEU HB2 H -1.544 -3.981 -1.322 1.00 . A A . 14 LEU HB2 1 1 13 3423 1 1 14 LEU HB3 H -1.853 -5.461 -0.444 1.00 . A A . 14 LEU HB3 1 1 13 3424 1 1 14 LEU HD11 H -1.629 -7.458 -2.855 1.00 . A A . 14 LEU HD11 1 1 13 3425 1 1 14 LEU HD12 H 0.135 -7.621 -2.720 1.00 . A A . 14 LEU HD12 1 1 13 3426 1 1 14 LEU HD13 H -0.866 -7.619 -1.255 1.00 . A A . 14 LEU HD13 1 1 13 3427 1 1 14 LEU HD21 H 0.536 -5.471 -3.964 1.00 . A A . 14 LEU HD21 1 1 13 3428 1 1 14 LEU HD22 H -1.221 -5.383 -4.212 1.00 . A A . 14 LEU HD22 1 1 13 3429 1 1 14 LEU HD23 H -0.352 -4.010 -3.482 1.00 . A A . 14 LEU HD23 1 1 13 3430 1 1 14 LEU HG H 0.271 -5.470 -1.570 1.00 . A A . 14 LEU HG 1 1 13 3431 1 1 14 LEU N N -3.932 -3.887 -1.674 1.00 . A A . 14 LEU N 1 1 13 3432 1 1 14 LEU O O -4.163 -7.257 -2.410 1.00 . A A . 14 LEU O 1 1 13 3433 1 1 15 ILE C C -6.448 -6.925 0.802 1.00 . A A . 15 ILE C 1 1 13 3434 1 1 15 ILE CA C -5.158 -7.464 0.188 1.00 . A A . 15 ILE CA 1 1 13 3435 1 1 15 ILE CB C -4.375 -8.248 1.267 1.00 . A A . 15 ILE CB 1 1 13 3436 1 1 15 ILE CD1 C -2.104 -9.380 1.711 1.00 . A A . 15 ILE CD1 1 1 13 3437 1 1 15 ILE CG1 C -3.025 -8.711 0.708 1.00 . A A . 15 ILE CG1 1 1 13 3438 1 1 15 ILE CG2 C -5.208 -9.431 1.755 1.00 . A A . 15 ILE CG2 1 1 13 3439 1 1 15 ILE H H -4.137 -5.603 0.260 1.00 . A A . 15 ILE H 1 1 13 3440 1 1 15 ILE HA H -5.414 -8.150 -0.620 1.00 . A A . 15 ILE HA 1 1 13 3441 1 1 15 ILE HB H -4.186 -7.584 2.112 1.00 . A A . 15 ILE HB 1 1 13 3442 1 1 15 ILE HD11 H -2.000 -8.746 2.592 1.00 . A A . 15 ILE HD11 1 1 13 3443 1 1 15 ILE HD12 H -2.512 -10.348 2.004 1.00 . A A . 15 ILE HD12 1 1 13 3444 1 1 15 ILE HD13 H -1.124 -9.528 1.258 1.00 . A A . 15 ILE HD13 1 1 13 3445 1 1 15 ILE HG12 H -3.209 -9.397 -0.117 1.00 . A A . 15 ILE HG12 1 1 13 3446 1 1 15 ILE HG13 H -2.494 -7.847 0.310 1.00 . A A . 15 ILE HG13 1 1 13 3447 1 1 15 ILE HG21 H -4.660 -9.992 2.511 1.00 . A A . 15 ILE HG21 1 1 13 3448 1 1 15 ILE HG22 H -6.131 -9.062 2.201 1.00 . A A . 15 ILE HG22 1 1 13 3449 1 1 15 ILE HG23 H -5.450 -10.088 0.919 1.00 . A A . 15 ILE HG23 1 1 13 3450 1 1 15 ILE N N -4.374 -6.362 -0.360 1.00 . A A . 15 ILE N 1 1 13 3451 1 1 15 ILE O O -6.403 -6.132 1.741 1.00 . A A . 15 ILE O 1 1 13 3452 1 1 16 TRP C C -9.055 -5.631 1.366 1.00 . A A . 16 TRP C 1 1 13 3453 1 1 16 TRP CA C -8.918 -7.007 0.716 1.00 . A A . 16 TRP CA 1 1 13 3454 1 1 16 TRP CB C -9.445 -8.082 1.673 1.00 . A A . 16 TRP CB 1 1 13 3455 1 1 16 TRP CD1 C -8.441 -10.415 2.011 1.00 . A A . 16 TRP CD1 1 1 13 3456 1 1 16 TRP CD2 C -9.429 -10.154 0.034 1.00 . A A . 16 TRP CD2 1 1 13 3457 1 1 16 TRP CE2 C -8.833 -11.436 0.077 1.00 . A A . 16 TRP CE2 1 1 13 3458 1 1 16 TRP CE3 C -10.109 -9.772 -1.131 1.00 . A A . 16 TRP CE3 1 1 13 3459 1 1 16 TRP CG C -9.117 -9.493 1.270 1.00 . A A . 16 TRP CG 1 1 13 3460 1 1 16 TRP CH2 C -9.534 -11.913 -2.144 1.00 . A A . 16 TRP CH2 1 1 13 3461 1 1 16 TRP CZ2 C -8.864 -12.311 -1.013 1.00 . A A . 16 TRP CZ2 1 1 13 3462 1 1 16 TRP CZ3 C -10.161 -10.654 -2.209 1.00 . A A . 16 TRP CZ3 1 1 13 3463 1 1 16 TRP H H -7.521 -7.999 -0.529 1.00 . A A . 16 TRP H 1 1 13 3464 1 1 16 TRP HA H -9.576 -7.004 -0.153 1.00 . A A . 16 TRP HA 1 1 13 3465 1 1 16 TRP HB2 H -9.027 -7.905 2.664 1.00 . A A . 16 TRP HB2 1 1 13 3466 1 1 16 TRP HB3 H -10.528 -7.981 1.739 1.00 . A A . 16 TRP HB3 1 1 13 3467 1 1 16 TRP HD1 H -8.080 -10.240 3.013 1.00 . A A . 16 TRP HD1 1 1 13 3468 1 1 16 TRP HE1 H -7.778 -12.391 1.672 1.00 . A A . 16 TRP HE1 1 1 13 3469 1 1 16 TRP HE3 H -10.580 -8.803 -1.195 1.00 . A A . 16 TRP HE3 1 1 13 3470 1 1 16 TRP HH2 H -9.577 -12.574 -2.997 1.00 . A A . 16 TRP HH2 1 1 13 3471 1 1 16 TRP HZ2 H -8.368 -13.269 -0.968 1.00 . A A . 16 TRP HZ2 1 1 13 3472 1 1 16 TRP HZ3 H -10.684 -10.365 -3.110 1.00 . A A . 16 TRP HZ3 1 1 13 3473 1 1 16 TRP N N -7.577 -7.360 0.250 1.00 . A A . 16 TRP N 1 1 13 3474 1 1 16 TRP NE1 N -8.261 -11.580 1.313 1.00 . A A . 16 TRP NE1 1 1 13 3475 1 1 16 TRP O O -9.454 -5.510 2.525 1.00 . A A . 16 TRP O 1 1 13 3476 1 1 17 CYS C C -10.334 -2.770 1.160 1.00 . A A . 17 CYS C 1 1 13 3477 1 1 17 CYS CA C -8.877 -3.222 1.115 1.00 . A A . 17 CYS CA 1 1 13 3478 1 1 17 CYS CB C -8.096 -2.258 0.219 1.00 . A A . 17 CYS CB 1 1 13 3479 1 1 17 CYS H H -8.419 -4.716 -0.334 1.00 . A A . 17 CYS H 1 1 13 3480 1 1 17 CYS HA H -8.463 -3.179 2.120 1.00 . A A . 17 CYS HA 1 1 13 3481 1 1 17 CYS HB2 H -8.125 -1.265 0.667 1.00 . A A . 17 CYS HB2 1 1 13 3482 1 1 17 CYS HB3 H -7.061 -2.593 0.171 1.00 . A A . 17 CYS HB3 1 1 13 3483 1 1 17 CYS N N -8.742 -4.584 0.612 1.00 . A A . 17 CYS N 1 1 13 3484 1 1 17 CYS O O -11.221 -3.342 0.527 1.00 . A A . 17 CYS O 1 1 13 3485 1 1 17 CYS SG S -8.774 -2.146 -1.468 1.00 . A A . 17 CYS SG 1 1 13 3486 1 1 18 ASP C C -12.126 -0.296 0.560 1.00 . A A . 18 ASP C 1 1 13 3487 1 1 18 ASP CA C -11.886 -1.007 1.878 1.00 . A A . 18 ASP CA 1 1 13 3488 1 1 18 ASP CB C -12.039 -0.019 3.044 1.00 . A A . 18 ASP CB 1 1 13 3489 1 1 18 ASP CG C -13.418 0.591 3.036 1.00 . A A . 18 ASP CG 1 1 13 3490 1 1 18 ASP H H -9.853 -1.294 2.481 1.00 . A A . 18 ASP H 1 1 13 3491 1 1 18 ASP HA H -12.669 -1.764 1.953 1.00 . A A . 18 ASP HA 1 1 13 3492 1 1 18 ASP HB2 H -11.875 -0.532 3.993 1.00 . A A . 18 ASP HB2 1 1 13 3493 1 1 18 ASP HB3 H -11.297 0.776 2.953 1.00 . A A . 18 ASP HB3 1 1 13 3494 1 1 18 ASP N N -10.584 -1.682 1.907 1.00 . A A . 18 ASP N 1 1 13 3495 1 1 18 ASP O O -11.330 0.550 0.196 1.00 . A A . 18 ASP O 1 1 13 3496 1 1 18 ASP OD1 O -14.190 0.268 2.156 1.00 . A A . 18 ASP OD1 1 1 13 3497 1 1 18 ASP OD2 O -13.712 1.374 3.914 1.00 . A A . 18 ASP OD2 1 1 14 3498 1 1 1 GLY C C 2.530 1.175 -1.583 1.00 . A A . 1 GLY C 1 1 14 3499 1 1 1 GLY CA C 1.532 0.131 -1.123 1.00 . A A . 1 GLY CA 1 1 14 3500 1 1 1 GLY H1 H 2.598 -0.607 0.585 1.00 . A A . 1 GLY H1 1 1 14 3501 1 1 1 GLY HA2 H 1.323 -0.499 -1.987 1.00 . A A . 1 GLY HA2 1 1 14 3502 1 1 1 GLY HA3 H 0.618 0.672 -0.889 1.00 . A A . 1 GLY HA3 1 1 14 3503 1 1 1 GLY N N 1.787 -0.755 0.000 1.00 . A A . 1 GLY N 1 1 14 3504 1 1 1 GLY O O 3.682 1.201 -1.153 1.00 . A A . 1 GLY O 1 1 14 3505 1 1 2 SER C C 2.015 4.080 -3.905 1.00 . A A . 2 SER C 1 1 14 3506 1 1 2 SER CA C 2.849 3.098 -3.080 1.00 . A A . 2 SER CA 1 1 14 3507 1 1 2 SER CB C 3.942 2.503 -3.970 1.00 . A A . 2 SER CB 1 1 14 3508 1 1 2 SER H H 1.087 1.960 -2.766 1.00 . A A . 2 SER H 1 1 14 3509 1 1 2 SER HA H 3.331 3.655 -2.277 1.00 . A A . 2 SER HA 1 1 14 3510 1 1 2 SER HB2 H 4.134 1.478 -3.653 1.00 . A A . 2 SER HB2 1 1 14 3511 1 1 2 SER HB3 H 3.603 2.495 -5.005 1.00 . A A . 2 SER HB3 1 1 14 3512 1 1 2 SER HG H 5.865 2.721 -4.192 1.00 . A A . 2 SER HG 1 1 14 3513 1 1 2 SER N N 2.056 2.023 -2.491 1.00 . A A . 2 SER N 1 1 14 3514 1 1 2 SER O O 2.203 5.292 -3.814 1.00 . A A . 2 SER O 1 1 14 3515 1 1 2 SER OG O 5.139 3.255 -3.869 1.00 . A A . 2 SER OG 1 1 14 3516 1 1 3 ARG C C -0.985 4.889 -5.145 1.00 . A A . 3 ARG C 1 1 14 3517 1 1 3 ARG CA C 0.353 4.378 -5.681 1.00 . A A . 3 ARG CA 1 1 14 3518 1 1 3 ARG CB C 0.184 3.635 -7.012 1.00 . A A . 3 ARG CB 1 1 14 3519 1 1 3 ARG CD C 2.576 4.032 -7.766 1.00 . A A . 3 ARG CD 1 1 14 3520 1 1 3 ARG CG C 1.452 3.022 -7.599 1.00 . A A . 3 ARG CG 1 1 14 3521 1 1 3 ARG CZ C 3.391 3.857 -10.105 1.00 . A A . 3 ARG CZ 1 1 14 3522 1 1 3 ARG H H 1.037 2.558 -4.808 1.00 . A A . 3 ARG H 1 1 14 3523 1 1 3 ARG HA H 0.935 5.278 -5.869 1.00 . A A . 3 ARG HA 1 1 14 3524 1 1 3 ARG HB2 H -0.530 2.824 -6.877 1.00 . A A . 3 ARG HB2 1 1 14 3525 1 1 3 ARG HB3 H -0.230 4.331 -7.741 1.00 . A A . 3 ARG HB3 1 1 14 3526 1 1 3 ARG HD2 H 2.145 5.001 -8.013 1.00 . A A . 3 ARG HD2 1 1 14 3527 1 1 3 ARG HD3 H 3.100 4.129 -6.814 1.00 . A A . 3 ARG HD3 1 1 14 3528 1 1 3 ARG HE H 4.358 3.144 -8.501 1.00 . A A . 3 ARG HE 1 1 14 3529 1 1 3 ARG HG2 H 1.798 2.213 -6.956 1.00 . A A . 3 ARG HG2 1 1 14 3530 1 1 3 ARG HG3 H 1.205 2.600 -8.573 1.00 . A A . 3 ARG HG3 1 1 14 3531 1 1 3 ARG HH11 H 1.615 4.806 -10.002 1.00 . A A . 3 ARG HH11 1 1 14 3532 1 1 3 ARG HH12 H 2.289 4.613 -11.611 1.00 . A A . 3 ARG HH12 1 1 14 3533 1 1 3 ARG HH21 H 5.141 2.974 -10.556 1.00 . A A . 3 ARG HH21 1 1 14 3534 1 1 3 ARG HH22 H 4.236 3.615 -11.918 1.00 . A A . 3 ARG HH22 1 1 14 3535 1 1 3 ARG N N 1.130 3.560 -4.751 1.00 . A A . 3 ARG N 1 1 14 3536 1 1 3 ARG NE N 3.526 3.629 -8.804 1.00 . A A . 3 ARG NE 1 1 14 3537 1 1 3 ARG NH1 N 2.343 4.473 -10.615 1.00 . A A . 3 ARG NH1 1 1 14 3538 1 1 3 ARG NH2 N 4.332 3.446 -10.929 1.00 . A A . 3 ARG NH2 1 1 14 3539 1 1 3 ARG O O -1.021 5.901 -4.447 1.00 . A A . 3 ARG O 1 1 14 3540 1 1 4 GLY C C -3.690 4.090 -3.650 1.00 . A A . 4 GLY C 1 1 14 3541 1 1 4 GLY CA C -3.401 4.634 -5.035 1.00 . A A . 4 GLY CA 1 1 14 3542 1 1 4 GLY H H -2.007 3.417 -6.090 1.00 . A A . 4 GLY H 1 1 14 3543 1 1 4 GLY HA2 H -3.443 5.722 -4.996 1.00 . A A . 4 GLY HA2 1 1 14 3544 1 1 4 GLY HA3 H -4.160 4.270 -5.728 1.00 . A A . 4 GLY HA3 1 1 14 3545 1 1 4 GLY N N -2.084 4.229 -5.497 1.00 . A A . 4 GLY N 1 1 14 3546 1 1 4 GLY O O -2.770 3.656 -2.964 1.00 . A A . 4 GLY O 1 1 14 3547 1 1 5 TRP C C -5.600 2.552 -1.298 1.00 . A A . 5 TRP C 1 1 14 3548 1 1 5 TRP CA C -5.232 3.950 -1.786 1.00 . A A . 5 TRP CA 1 1 14 3549 1 1 5 TRP CB C -6.342 4.917 -1.365 1.00 . A A . 5 TRP CB 1 1 14 3550 1 1 5 TRP CD1 C -7.442 6.641 -2.911 1.00 . A A . 5 TRP CD1 1 1 14 3551 1 1 5 TRP CD2 C -5.367 7.179 -2.306 1.00 . A A . 5 TRP CD2 1 1 14 3552 1 1 5 TRP CE2 C -5.873 8.203 -3.139 1.00 . A A . 5 TRP CE2 1 1 14 3553 1 1 5 TRP CE3 C -4.039 7.266 -1.871 1.00 . A A . 5 TRP CE3 1 1 14 3554 1 1 5 TRP CG C -6.398 6.189 -2.162 1.00 . A A . 5 TRP CG 1 1 14 3555 1 1 5 TRP CH2 C -3.820 9.395 -3.035 1.00 . A A . 5 TRP CH2 1 1 14 3556 1 1 5 TRP CZ2 C -5.109 9.317 -3.500 1.00 . A A . 5 TRP CZ2 1 1 14 3557 1 1 5 TRP CZ3 C -3.276 8.376 -2.229 1.00 . A A . 5 TRP CZ3 1 1 14 3558 1 1 5 TRP H H -5.703 4.372 -3.819 1.00 . A A . 5 TRP H 1 1 14 3559 1 1 5 TRP HA H -4.328 4.237 -1.255 1.00 . A A . 5 TRP HA 1 1 14 3560 1 1 5 TRP HB2 H -7.299 4.406 -1.463 1.00 . A A . 5 TRP HB2 1 1 14 3561 1 1 5 TRP HB3 H -6.198 5.170 -0.316 1.00 . A A . 5 TRP HB3 1 1 14 3562 1 1 5 TRP HD1 H -8.382 6.122 -3.020 1.00 . A A . 5 TRP HD1 1 1 14 3563 1 1 5 TRP HE1 H -7.778 8.355 -4.095 1.00 . A A . 5 TRP HE1 1 1 14 3564 1 1 5 TRP HE3 H -3.608 6.474 -1.277 1.00 . A A . 5 TRP HE3 1 1 14 3565 1 1 5 TRP HH2 H -3.209 10.246 -3.300 1.00 . A A . 5 TRP HH2 1 1 14 3566 1 1 5 TRP HZ2 H -5.517 10.090 -4.136 1.00 . A A . 5 TRP HZ2 1 1 14 3567 1 1 5 TRP HZ3 H -2.253 8.453 -1.891 1.00 . A A . 5 TRP HZ3 1 1 14 3568 1 1 5 TRP N N -4.942 4.115 -3.208 1.00 . A A . 5 TRP N 1 1 14 3569 1 1 5 TRP NE1 N -7.146 7.844 -3.497 1.00 . A A . 5 TRP NE1 1 1 14 3570 1 1 5 TRP O O -6.277 1.793 -1.993 1.00 . A A . 5 TRP O 1 1 14 3571 1 1 6 GLY C C -4.889 0.695 1.877 1.00 . A A . 6 GLY C 1 1 14 3572 1 1 6 GLY CA C -5.630 1.034 0.599 1.00 . A A . 6 GLY CA 1 1 14 3573 1 1 6 GLY H H -4.508 2.824 0.397 1.00 . A A . 6 GLY H 1 1 14 3574 1 1 6 GLY HA2 H -6.686 1.160 0.840 1.00 . A A . 6 GLY HA2 1 1 14 3575 1 1 6 GLY HA3 H -5.548 0.186 -0.078 1.00 . A A . 6 GLY HA3 1 1 14 3576 1 1 6 GLY N N -5.165 2.228 -0.085 1.00 . A A . 6 GLY N 1 1 14 3577 1 1 6 GLY O O -4.788 1.522 2.782 1.00 . A A . 6 GLY O 1 1 14 3578 1 1 7 PHE C C -2.808 -1.515 3.708 1.00 . A A . 7 PHE C 1 1 14 3579 1 1 7 PHE CA C -4.233 -1.224 3.241 1.00 . A A . 7 PHE CA 1 1 14 3580 1 1 7 PHE CB C -5.017 -2.538 3.193 1.00 . A A . 7 PHE CB 1 1 14 3581 1 1 7 PHE CD1 C -7.202 -1.398 3.707 1.00 . A A . 7 PHE CD1 1 1 14 3582 1 1 7 PHE CD2 C -6.731 -3.498 4.759 1.00 . A A . 7 PHE CD2 1 1 14 3583 1 1 7 PHE CE1 C -8.411 -1.317 4.393 1.00 . A A . 7 PHE CE1 1 1 14 3584 1 1 7 PHE CE2 C -7.954 -3.442 5.425 1.00 . A A . 7 PHE CE2 1 1 14 3585 1 1 7 PHE CG C -6.345 -2.477 3.896 1.00 . A A . 7 PHE CG 1 1 14 3586 1 1 7 PHE CZ C -8.793 -2.347 5.246 1.00 . A A . 7 PHE CZ 1 1 14 3587 1 1 7 PHE H H -4.124 -1.026 1.121 1.00 . A A . 7 PHE H 1 1 14 3588 1 1 7 PHE HA H -4.677 -0.593 4.009 1.00 . A A . 7 PHE HA 1 1 14 3589 1 1 7 PHE HB2 H -5.185 -2.811 2.150 1.00 . A A . 7 PHE HB2 1 1 14 3590 1 1 7 PHE HB3 H -4.417 -3.322 3.654 1.00 . A A . 7 PHE HB3 1 1 14 3591 1 1 7 PHE HD1 H -6.922 -0.605 3.028 1.00 . A A . 7 PHE HD1 1 1 14 3592 1 1 7 PHE HD2 H -6.082 -4.347 4.912 1.00 . A A . 7 PHE HD2 1 1 14 3593 1 1 7 PHE HE1 H -9.046 -0.454 4.267 1.00 . A A . 7 PHE HE1 1 1 14 3594 1 1 7 PHE HE2 H -8.249 -4.248 6.080 1.00 . A A . 7 PHE HE2 1 1 14 3595 1 1 7 PHE HZ H -9.735 -2.295 5.770 1.00 . A A . 7 PHE HZ 1 1 14 3596 1 1 7 PHE N N -4.386 -0.533 1.963 1.00 . A A . 7 PHE N 1 1 14 3597 1 1 7 PHE O O -2.501 -1.380 4.891 1.00 . A A . 7 PHE O 1 1 14 3598 1 1 8 GLU C C 0.240 -0.958 3.336 1.00 . A A . 8 GLU C 1 1 14 3599 1 1 8 GLU CA C -0.540 -2.245 3.164 1.00 . A A . 8 GLU CA 1 1 14 3600 1 1 8 GLU CB C 0.120 -3.231 2.172 1.00 . A A . 8 GLU CB 1 1 14 3601 1 1 8 GLU CD C 0.948 -1.765 0.295 1.00 . A A . 8 GLU CD 1 1 14 3602 1 1 8 GLU CG C 1.353 -2.665 1.434 1.00 . A A . 8 GLU CG 1 1 14 3603 1 1 8 GLU H H -2.204 -2.060 1.830 1.00 . A A . 8 GLU H 1 1 14 3604 1 1 8 GLU HA H -0.570 -2.717 4.148 1.00 . A A . 8 GLU HA 1 1 14 3605 1 1 8 GLU HB2 H 0.426 -4.121 2.724 1.00 . A A . 8 GLU HB2 1 1 14 3606 1 1 8 GLU HB3 H -0.620 -3.553 1.437 1.00 . A A . 8 GLU HB3 1 1 14 3607 1 1 8 GLU HG2 H 2.010 -2.132 2.122 1.00 . A A . 8 GLU HG2 1 1 14 3608 1 1 8 GLU HG3 H 1.929 -3.494 1.020 1.00 . A A . 8 GLU HG3 1 1 14 3609 1 1 8 GLU N N -1.926 -1.950 2.792 1.00 . A A . 8 GLU N 1 1 14 3610 1 1 8 GLU O O -0.012 0.028 2.673 1.00 . A A . 8 GLU O 1 1 14 3611 1 1 8 GLU OE1 O -0.058 -1.963 -0.356 1.00 . A A . 8 GLU OE1 1 1 14 3612 1 1 9 PRO C C 2.687 0.773 3.226 1.00 . A A . 9 PRO C 1 1 14 3613 1 1 9 PRO CA C 1.997 0.298 4.501 1.00 . A A . 9 PRO CA 1 1 14 3614 1 1 9 PRO CB C 2.980 -0.122 5.598 1.00 . A A . 9 PRO CB 1 1 14 3615 1 1 9 PRO CD C 1.700 -2.054 5.078 1.00 . A A . 9 PRO CD 1 1 14 3616 1 1 9 PRO CG C 3.086 -1.608 5.459 1.00 . A A . 9 PRO CG 1 1 14 3617 1 1 9 PRO HA H 1.334 1.084 4.864 1.00 . A A . 9 PRO HA 1 1 14 3618 1 1 9 PRO HB2 H 3.949 0.355 5.453 1.00 . A A . 9 PRO HB2 1 1 14 3619 1 1 9 PRO HB3 H 2.573 0.128 6.577 1.00 . A A . 9 PRO HB3 1 1 14 3620 1 1 9 PRO HD2 H 1.747 -2.978 4.501 1.00 . A A . 9 PRO HD2 1 1 14 3621 1 1 9 PRO HD3 H 1.073 -2.173 5.963 1.00 . A A . 9 PRO HD3 1 1 14 3622 1 1 9 PRO HG2 H 3.791 -1.860 4.666 1.00 . A A . 9 PRO HG2 1 1 14 3623 1 1 9 PRO HG3 H 3.391 -2.062 6.402 1.00 . A A . 9 PRO HG3 1 1 14 3624 1 1 9 PRO N N 1.227 -0.925 4.258 1.00 . A A . 9 PRO N 1 1 14 3625 1 1 9 PRO O O 3.203 -0.020 2.438 1.00 . A A . 9 PRO O 1 1 14 3626 1 1 10 GLY C C 1.654 2.996 0.956 1.00 . A A . 10 GLY C 1 1 14 3627 1 1 10 GLY CA C 2.927 2.658 1.708 1.00 . A A . 10 GLY CA 1 1 14 3628 1 1 10 GLY H H 2.263 2.695 3.722 1.00 . A A . 10 GLY H 1 1 14 3629 1 1 10 GLY HA2 H 3.495 3.577 1.849 1.00 . A A . 10 GLY HA2 1 1 14 3630 1 1 10 GLY HA3 H 3.523 1.962 1.119 1.00 . A A . 10 GLY HA3 1 1 14 3631 1 1 10 GLY N N 2.622 2.081 3.006 1.00 . A A . 10 GLY N 1 1 14 3632 1 1 10 GLY O O 1.683 3.775 0.005 1.00 . A A . 10 GLY O 1 1 14 3633 1 1 11 VAL C C -1.131 2.324 -0.419 1.00 . A A . 11 VAL C 1 1 14 3634 1 1 11 VAL CA C -0.812 2.796 0.998 1.00 . A A . 11 VAL CA 1 1 14 3635 1 1 11 VAL CB C -1.077 4.314 1.149 1.00 . A A . 11 VAL CB 1 1 14 3636 1 1 11 VAL CG1 C -2.511 4.646 0.763 1.00 . A A . 11 VAL CG1 1 1 14 3637 1 1 11 VAL CG2 C -0.825 4.760 2.590 1.00 . A A . 11 VAL CG2 1 1 14 3638 1 1 11 VAL H H 0.620 1.732 2.142 1.00 . A A . 11 VAL H 1 1 14 3639 1 1 11 VAL HA H -1.508 2.286 1.664 1.00 . A A . 11 VAL HA 1 1 14 3640 1 1 11 VAL HB H -0.407 4.867 0.492 1.00 . A A . 11 VAL HB 1 1 14 3641 1 1 11 VAL HG11 H -3.204 4.013 1.317 1.00 . A A . 11 VAL HG11 1 1 14 3642 1 1 11 VAL HG12 H -2.718 5.694 0.985 1.00 . A A . 11 VAL HG12 1 1 14 3643 1 1 11 VAL HG13 H -2.628 4.483 -0.307 1.00 . A A . 11 VAL HG13 1 1 14 3644 1 1 11 VAL HG21 H -1.090 5.811 2.697 1.00 . A A . 11 VAL HG21 1 1 14 3645 1 1 11 VAL HG22 H -1.430 4.163 3.273 1.00 . A A . 11 VAL HG22 1 1 14 3646 1 1 11 VAL HG23 H 0.229 4.636 2.836 1.00 . A A . 11 VAL HG23 1 1 14 3647 1 1 11 VAL N N 0.540 2.437 1.420 1.00 . A A . 11 VAL N 1 1 14 3648 1 1 11 VAL O O -0.767 2.961 -1.406 1.00 . A A . 11 VAL O 1 1 14 3649 1 1 12 ARG C C -3.391 -0.438 -1.393 1.00 . A A . 12 ARG C 1 1 14 3650 1 1 12 ARG CA C -2.424 0.688 -1.735 1.00 . A A . 12 ARG CA 1 1 14 3651 1 1 12 ARG CB C -1.369 0.132 -2.699 1.00 . A A . 12 ARG CB 1 1 14 3652 1 1 12 ARG CD C -2.022 0.991 -4.968 1.00 . A A . 12 ARG CD 1 1 14 3653 1 1 12 ARG CG C -1.836 -0.241 -4.098 1.00 . A A . 12 ARG CG 1 1 14 3654 1 1 12 ARG CZ C -1.654 0.191 -7.292 1.00 . A A . 12 ARG CZ 1 1 14 3655 1 1 12 ARG H H -1.862 0.590 0.316 1.00 . A A . 12 ARG H 1 1 14 3656 1 1 12 ARG HA H -2.963 1.510 -2.206 1.00 . A A . 12 ARG HA 1 1 14 3657 1 1 12 ARG HB2 H -0.575 0.871 -2.799 1.00 . A A . 12 ARG HB2 1 1 14 3658 1 1 12 ARG HB3 H -0.947 -0.763 -2.245 1.00 . A A . 12 ARG HB3 1 1 14 3659 1 1 12 ARG HD2 H -2.777 1.630 -4.512 1.00 . A A . 12 ARG HD2 1 1 14 3660 1 1 12 ARG HD3 H -1.083 1.541 -4.999 1.00 . A A . 12 ARG HD3 1 1 14 3661 1 1 12 ARG HE H -3.418 0.787 -6.554 1.00 . A A . 12 ARG HE 1 1 14 3662 1 1 12 ARG HG2 H -1.081 -0.881 -4.552 1.00 . A A . 12 ARG HG2 1 1 14 3663 1 1 12 ARG HG3 H -2.772 -0.795 -4.050 1.00 . A A . 12 ARG HG3 1 1 14 3664 1 1 12 ARG HH11 H 0.038 0.101 -6.201 1.00 . A A . 12 ARG HH11 1 1 14 3665 1 1 12 ARG HH12 H 0.184 -0.380 -7.884 1.00 . A A . 12 ARG HH12 1 1 14 3666 1 1 12 ARG HH21 H -3.149 0.123 -8.635 1.00 . A A . 12 ARG HH21 1 1 14 3667 1 1 12 ARG HH22 H -1.578 -0.393 -9.219 1.00 . A A . 12 ARG HH22 1 1 14 3668 1 1 12 ARG N N -1.794 1.174 -0.507 1.00 . A A . 12 ARG N 1 1 14 3669 1 1 12 ARG NE N -2.442 0.657 -6.330 1.00 . A A . 12 ARG NE 1 1 14 3670 1 1 12 ARG NH1 N -0.369 -0.041 -7.112 1.00 . A A . 12 ARG NH1 1 1 14 3671 1 1 12 ARG NH2 N -2.167 -0.041 -8.482 1.00 . A A . 12 ARG NH2 1 1 14 3672 1 1 12 ARG O O -3.168 -1.179 -0.437 1.00 . A A . 12 ARG O 1 1 14 3673 1 1 13 CYS C C -4.393 -2.978 -2.526 1.00 . A A . 13 CYS C 1 1 14 3674 1 1 13 CYS CA C -5.261 -1.800 -2.095 1.00 . A A . 13 CYS CA 1 1 14 3675 1 1 13 CYS CB C -6.503 -1.700 -2.983 1.00 . A A . 13 CYS CB 1 1 14 3676 1 1 13 CYS H H -4.695 0.119 -2.853 1.00 . A A . 13 CYS H 1 1 14 3677 1 1 13 CYS HA H -5.572 -1.954 -1.063 1.00 . A A . 13 CYS HA 1 1 14 3678 1 1 13 CYS HB2 H -7.063 -0.806 -2.708 1.00 . A A . 13 CYS HB2 1 1 14 3679 1 1 13 CYS HB3 H -6.188 -1.621 -4.023 1.00 . A A . 13 CYS HB3 1 1 14 3680 1 1 13 CYS N N -4.454 -0.588 -2.174 1.00 . A A . 13 CYS N 1 1 14 3681 1 1 13 CYS O O -3.888 -3.006 -3.649 1.00 . A A . 13 CYS O 1 1 14 3682 1 1 13 CYS SG S -7.598 -3.145 -2.807 1.00 . A A . 13 CYS SG 1 1 14 3683 1 1 14 LEU C C -4.009 -6.363 -1.415 1.00 . A A . 14 LEU C 1 1 14 3684 1 1 14 LEU CA C -3.328 -5.071 -1.861 1.00 . A A . 14 LEU CA 1 1 14 3685 1 1 14 LEU CB C -2.006 -4.865 -1.112 1.00 . A A . 14 LEU CB 1 1 14 3686 1 1 14 LEU CD1 C -0.532 -6.513 -2.311 1.00 . A A . 14 LEU CD1 1 1 14 3687 1 1 14 LEU CD2 C -0.538 -4.121 -3.046 1.00 . A A . 14 LEU CD2 1 1 14 3688 1 1 14 LEU CG C -0.686 -5.067 -1.860 1.00 . A A . 14 LEU CG 1 1 14 3689 1 1 14 LEU H H -4.615 -3.844 -0.703 1.00 . A A . 14 LEU H 1 1 14 3690 1 1 14 LEU HA H -3.133 -5.148 -2.931 1.00 . A A . 14 LEU HA 1 1 14 3691 1 1 14 LEU HB2 H -2.000 -3.846 -0.726 1.00 . A A . 14 LEU HB2 1 1 14 3692 1 1 14 LEU HB3 H -1.997 -5.531 -0.251 1.00 . A A . 14 LEU HB3 1 1 14 3693 1 1 14 LEU HD11 H -0.621 -7.177 -1.450 1.00 . A A . 14 LEU HD11 1 1 14 3694 1 1 14 LEU HD12 H -1.304 -6.760 -3.040 1.00 . A A . 14 LEU HD12 1 1 14 3695 1 1 14 LEU HD13 H 0.449 -6.650 -2.766 1.00 . A A . 14 LEU HD13 1 1 14 3696 1 1 14 LEU HD21 H -1.271 -4.368 -3.815 1.00 . A A . 14 LEU HD21 1 1 14 3697 1 1 14 LEU HD22 H -0.696 -3.096 -2.712 1.00 . A A . 14 LEU HD22 1 1 14 3698 1 1 14 LEU HD23 H 0.465 -4.214 -3.462 1.00 . A A . 14 LEU HD23 1 1 14 3699 1 1 14 LEU HG H 0.116 -4.845 -1.156 1.00 . A A . 14 LEU HG 1 1 14 3700 1 1 14 LEU N N -4.189 -3.921 -1.614 1.00 . A A . 14 LEU N 1 1 14 3701 1 1 14 LEU O O -4.072 -7.332 -2.169 1.00 . A A . 14 LEU O 1 1 14 3702 1 1 15 ILE C C -6.532 -7.033 0.993 1.00 . A A . 15 ILE C 1 1 14 3703 1 1 15 ILE CA C -5.227 -7.516 0.367 1.00 . A A . 15 ILE CA 1 1 14 3704 1 1 15 ILE CB C -4.388 -8.252 1.438 1.00 . A A . 15 ILE CB 1 1 14 3705 1 1 15 ILE CD1 C -2.050 -9.242 1.867 1.00 . A A . 15 ILE CD1 1 1 14 3706 1 1 15 ILE CG1 C -3.022 -8.645 0.866 1.00 . A A . 15 ILE CG1 1 1 14 3707 1 1 15 ILE CG2 C -5.154 -9.475 1.939 1.00 . A A . 15 ILE CG2 1 1 14 3708 1 1 15 ILE H H -4.380 -5.570 0.415 1.00 . A A . 15 ILE H 1 1 14 3709 1 1 15 ILE HA H -5.453 -8.213 -0.439 1.00 . A A . 15 ILE HA 1 1 14 3710 1 1 15 ILE HB H -4.227 -7.575 2.279 1.00 . A A . 15 ILE HB 1 1 14 3711 1 1 15 ILE HD11 H -1.963 -8.582 2.730 1.00 . A A . 15 ILE HD11 1 1 14 3712 1 1 15 ILE HD12 H -2.403 -10.222 2.189 1.00 . A A . 15 ILE HD12 1 1 14 3713 1 1 15 ILE HD13 H -1.072 -9.350 1.397 1.00 . A A . 15 ILE HD13 1 1 14 3714 1 1 15 ILE HG12 H -3.179 -9.356 0.056 1.00 . A A . 15 ILE HG12 1 1 14 3715 1 1 15 ILE HG13 H -2.546 -7.760 0.444 1.00 . A A . 15 ILE HG13 1 1 14 3716 1 1 15 ILE HG21 H -4.562 -10.012 2.680 1.00 . A A . 15 ILE HG21 1 1 14 3717 1 1 15 ILE HG22 H -6.082 -9.150 2.408 1.00 . A A . 15 ILE HG22 1 1 14 3718 1 1 15 ILE HG23 H -5.384 -10.140 1.106 1.00 . A A . 15 ILE HG23 1 1 14 3719 1 1 15 ILE N N -4.509 -6.371 -0.184 1.00 . A A . 15 ILE N 1 1 14 3720 1 1 15 ILE O O -6.509 -6.225 1.920 1.00 . A A . 15 ILE O 1 1 14 3721 1 1 16 TRP C C -9.165 -5.804 1.513 1.00 . A A . 16 TRP C 1 1 14 3722 1 1 16 TRP CA C -8.996 -7.214 0.948 1.00 . A A . 16 TRP CA 1 1 14 3723 1 1 16 TRP CB C -9.438 -8.250 1.987 1.00 . A A . 16 TRP CB 1 1 14 3724 1 1 16 TRP CD1 C -8.344 -10.540 2.343 1.00 . A A . 16 TRP CD1 1 1 14 3725 1 1 16 TRP CD2 C -9.479 -10.386 0.436 1.00 . A A . 16 TRP CD2 1 1 14 3726 1 1 16 TRP CE2 C -8.828 -11.641 0.477 1.00 . A A . 16 TRP CE2 1 1 14 3727 1 1 16 TRP CE3 C -10.258 -10.073 -0.686 1.00 . A A . 16 TRP CE3 1 1 14 3728 1 1 16 TRP CG C -9.100 -9.668 1.621 1.00 . A A . 16 TRP CG 1 1 14 3729 1 1 16 TRP CH2 C -9.662 -12.221 -1.673 1.00 . A A . 16 TRP CH2 1 1 14 3730 1 1 16 TRP CZ2 C -8.896 -12.551 -0.583 1.00 . A A . 16 TRP CZ2 1 1 14 3731 1 1 16 TRP CZ3 C -10.351 -10.992 -1.730 1.00 . A A . 16 TRP CZ3 1 1 14 3732 1 1 16 TRP H H -7.579 -8.178 -0.300 1.00 . A A . 16 TRP H 1 1 14 3733 1 1 16 TRP HA H -9.678 -7.296 0.103 1.00 . A A . 16 TRP HA 1 1 14 3734 1 1 16 TRP HB2 H -8.963 -8.016 2.940 1.00 . A A . 16 TRP HB2 1 1 14 3735 1 1 16 TRP HB3 H -10.517 -8.169 2.114 1.00 . A A . 16 TRP HB3 1 1 14 3736 1 1 16 TRP HD1 H -7.922 -10.317 3.312 1.00 . A A . 16 TRP HD1 1 1 14 3737 1 1 16 TRP HE1 H -7.634 -12.503 2.025 1.00 . A A . 16 TRP HE1 1 1 14 3738 1 1 16 TRP HE3 H -10.776 -9.127 -0.745 1.00 . A A . 16 TRP HE3 1 1 14 3739 1 1 16 TRP HH2 H -9.734 -12.909 -2.501 1.00 . A A . 16 TRP HH2 1 1 14 3740 1 1 16 TRP HZ2 H -8.354 -13.485 -0.546 1.00 . A A . 16 TRP HZ2 1 1 14 3741 1 1 16 TRP HZ3 H -10.950 -10.757 -2.597 1.00 . A A . 16 TRP HZ3 1 1 14 3742 1 1 16 TRP N N -7.650 -7.527 0.468 1.00 . A A . 16 TRP N 1 1 14 3743 1 1 16 TRP NE1 N -8.170 -11.722 1.674 1.00 . A A . 16 TRP NE1 1 1 14 3744 1 1 16 TRP O O -9.517 -5.619 2.677 1.00 . A A . 16 TRP O 1 1 14 3745 1 1 17 CYS C C -10.422 -2.888 1.235 1.00 . A A . 17 CYS C 1 1 14 3746 1 1 17 CYS CA C -8.995 -3.413 1.100 1.00 . A A . 17 CYS CA 1 1 14 3747 1 1 17 CYS CB C -8.243 -2.536 0.099 1.00 . A A . 17 CYS CB 1 1 14 3748 1 1 17 CYS H H -8.665 -4.996 -0.285 1.00 . A A . 17 CYS H 1 1 14 3749 1 1 17 CYS HA H -8.503 -3.328 2.068 1.00 . A A . 17 CYS HA 1 1 14 3750 1 1 17 CYS HB2 H -8.190 -1.521 0.493 1.00 . A A . 17 CYS HB2 1 1 14 3751 1 1 17 CYS HB3 H -7.231 -2.926 -0.005 1.00 . A A . 17 CYS HB3 1 1 14 3752 1 1 17 CYS N N -8.920 -4.805 0.672 1.00 . A A . 17 CYS N 1 1 14 3753 1 1 17 CYS O O -11.385 -3.450 0.714 1.00 . A A . 17 CYS O 1 1 14 3754 1 1 17 CYS SG S -9.034 -2.476 -1.540 1.00 . A A . 17 CYS SG 1 1 14 3755 1 1 18 ASP C C -12.068 -0.244 0.685 1.00 . A A . 18 ASP C 1 1 14 3756 1 1 18 ASP CA C -11.806 -0.992 1.978 1.00 . A A . 18 ASP CA 1 1 14 3757 1 1 18 ASP CB C -11.828 -0.014 3.163 1.00 . A A . 18 ASP CB 1 1 14 3758 1 1 18 ASP CG C -13.160 0.689 3.241 1.00 . A A . 18 ASP CG 1 1 14 3759 1 1 18 ASP H H -9.749 -1.368 2.412 1.00 . A A . 18 ASP H 1 1 14 3760 1 1 18 ASP HA H -12.631 -1.698 2.087 1.00 . A A . 18 ASP HA 1 1 14 3761 1 1 18 ASP HB2 H -11.648 -0.552 4.095 1.00 . A A . 18 ASP HB2 1 1 14 3762 1 1 18 ASP HB3 H -11.039 0.730 3.040 1.00 . A A . 18 ASP HB3 1 1 14 3763 1 1 18 ASP N N -10.549 -1.746 1.928 1.00 . A A . 18 ASP N 1 1 14 3764 1 1 18 ASP O O -11.236 0.552 0.290 1.00 . A A . 18 ASP O 1 1 14 3765 1 1 18 ASP OD1 O -13.994 0.450 2.393 1.00 . A A . 18 ASP OD1 1 1 14 3766 1 1 18 ASP OD2 O -13.354 1.462 4.157 1.00 . A A . 18 ASP OD2 1 1 15 3767 1 1 1 GLY C C 2.678 1.096 -1.944 1.00 . A A . 1 GLY C 1 1 15 3768 1 1 1 GLY CA C 3.167 -0.336 -1.825 1.00 . A A . 1 GLY CA 1 1 15 3769 1 1 1 GLY H1 H 4.038 -1.441 -0.221 1.00 . A A . 1 GLY H1 1 1 15 3770 1 1 1 GLY HA2 H 4.157 -0.388 -2.276 1.00 . A A . 1 GLY HA2 1 1 15 3771 1 1 1 GLY HA3 H 2.498 -0.966 -2.411 1.00 . A A . 1 GLY HA3 1 1 15 3772 1 1 1 GLY N N 3.240 -0.879 -0.476 1.00 . A A . 1 GLY N 1 1 15 3773 1 1 1 GLY O O 2.802 1.860 -0.989 1.00 . A A . 1 GLY O 1 1 15 3774 1 1 2 SER C C 0.760 2.954 -4.581 1.00 . A A . 2 SER C 1 1 15 3775 1 1 2 SER CA C 1.571 2.804 -3.294 1.00 . A A . 2 SER CA 1 1 15 3776 1 1 2 SER CB C 2.678 3.855 -3.296 1.00 . A A . 2 SER CB 1 1 15 3777 1 1 2 SER H H 2.156 0.845 -3.893 1.00 . A A . 2 SER H 1 1 15 3778 1 1 2 SER HA H 0.917 3.014 -2.447 1.00 . A A . 2 SER HA 1 1 15 3779 1 1 2 SER HB2 H 3.406 3.594 -2.530 1.00 . A A . 2 SER HB2 1 1 15 3780 1 1 2 SER HB3 H 3.157 3.835 -4.273 1.00 . A A . 2 SER HB3 1 1 15 3781 1 1 2 SER HG H 1.741 5.135 -2.159 1.00 . A A . 2 SER HG 1 1 15 3782 1 1 2 SER N N 2.155 1.476 -3.106 1.00 . A A . 2 SER N 1 1 15 3783 1 1 2 SER O O 0.996 3.841 -5.402 1.00 . A A . 2 SER O 1 1 15 3784 1 1 2 SER OG O 2.162 5.148 -3.028 1.00 . A A . 2 SER OG 1 1 15 3785 1 1 3 ARG C C -2.541 2.733 -5.183 1.00 . A A . 3 ARG C 1 1 15 3786 1 1 3 ARG CA C -1.242 2.183 -5.771 1.00 . A A . 3 ARG CA 1 1 15 3787 1 1 3 ARG CB C -1.465 0.865 -6.522 1.00 . A A . 3 ARG CB 1 1 15 3788 1 1 3 ARG CD C 0.521 1.254 -8.022 1.00 . A A . 3 ARG CD 1 1 15 3789 1 1 3 ARG CG C -0.217 0.254 -7.147 1.00 . A A . 3 ARG CG 1 1 15 3790 1 1 3 ARG CZ C 1.685 1.227 -10.210 1.00 . A A . 3 ARG CZ 1 1 15 3791 1 1 3 ARG H H -0.119 1.185 -4.243 1.00 . A A . 3 ARG H 1 1 15 3792 1 1 3 ARG HA H -0.918 2.935 -6.489 1.00 . A A . 3 ARG HA 1 1 15 3793 1 1 3 ARG HB2 H -1.883 0.131 -5.835 1.00 . A A . 3 ARG HB2 1 1 15 3794 1 1 3 ARG HB3 H -2.191 1.044 -7.314 1.00 . A A . 3 ARG HB3 1 1 15 3795 1 1 3 ARG HD2 H -0.203 1.967 -8.413 1.00 . A A . 3 ARG HD2 1 1 15 3796 1 1 3 ARG HD3 H 1.236 1.796 -7.400 1.00 . A A . 3 ARG HD3 1 1 15 3797 1 1 3 ARG HE H 1.338 -0.394 -9.084 1.00 . A A . 3 ARG HE 1 1 15 3798 1 1 3 ARG HG2 H 0.453 -0.091 -6.360 1.00 . A A . 3 ARG HG2 1 1 15 3799 1 1 3 ARG HG3 H -0.516 -0.603 -7.747 1.00 . A A . 3 ARG HG3 1 1 15 3800 1 1 3 ARG HH11 H 1.154 3.093 -9.660 1.00 . A A . 3 ARG HH11 1 1 15 3801 1 1 3 ARG HH12 H 1.932 2.950 -11.225 1.00 . A A . 3 ARG HH12 1 1 15 3802 1 1 3 ARG HH21 H 2.364 -0.477 -11.035 1.00 . A A . 3 ARG HH21 1 1 15 3803 1 1 3 ARG HH22 H 2.638 0.986 -11.968 1.00 . A A . 3 ARG HH22 1 1 15 3804 1 1 3 ARG N N -0.175 2.032 -4.783 1.00 . A A . 3 ARG N 1 1 15 3805 1 1 3 ARG NE N 1.215 0.606 -9.135 1.00 . A A . 3 ARG NE 1 1 15 3806 1 1 3 ARG NH1 N 1.578 2.530 -10.380 1.00 . A A . 3 ARG NH1 1 1 15 3807 1 1 3 ARG NH2 N 2.278 0.521 -11.149 1.00 . A A . 3 ARG NH2 1 1 15 3808 1 1 3 ARG O O -2.622 3.924 -4.889 1.00 . A A . 3 ARG O 1 1 15 3809 1 1 4 GLY C C -4.962 2.098 -3.026 1.00 . A A . 4 GLY C 1 1 15 3810 1 1 4 GLY CA C -4.843 2.330 -4.520 1.00 . A A . 4 GLY CA 1 1 15 3811 1 1 4 GLY H H -3.457 0.925 -5.305 1.00 . A A . 4 GLY H 1 1 15 3812 1 1 4 GLY HA2 H -4.970 3.393 -4.722 1.00 . A A . 4 GLY HA2 1 1 15 3813 1 1 4 GLY HA3 H -5.644 1.784 -5.020 1.00 . A A . 4 GLY HA3 1 1 15 3814 1 1 4 GLY N N -3.561 1.893 -5.042 1.00 . A A . 4 GLY N 1 1 15 3815 1 1 4 GLY O O -4.564 1.048 -2.524 1.00 . A A . 4 GLY O 1 1 15 3816 1 1 5 TRP C C -5.630 2.144 0.029 1.00 . A A . 5 TRP C 1 1 15 3817 1 1 5 TRP CA C -5.219 3.285 -0.895 1.00 . A A . 5 TRP CA 1 1 15 3818 1 1 5 TRP CB C -5.933 4.551 -0.416 1.00 . A A . 5 TRP CB 1 1 15 3819 1 1 5 TRP CD1 C -7.005 6.243 -2.011 1.00 . A A . 5 TRP CD1 1 1 15 3820 1 1 5 TRP CD2 C -4.786 6.388 -1.913 1.00 . A A . 5 TRP CD2 1 1 15 3821 1 1 5 TRP CE2 C -5.265 7.389 -2.789 1.00 . A A . 5 TRP CE2 1 1 15 3822 1 1 5 TRP CE3 C -3.401 6.248 -1.750 1.00 . A A . 5 TRP CE3 1 1 15 3823 1 1 5 TRP CG C -5.924 5.678 -1.405 1.00 . A A . 5 TRP CG 1 1 15 3824 1 1 5 TRP CH2 C -3.055 8.127 -3.261 1.00 . A A . 5 TRP CH2 1 1 15 3825 1 1 5 TRP CZ2 C -4.406 8.267 -3.459 1.00 . A A . 5 TRP CZ2 1 1 15 3826 1 1 5 TRP CZ3 C -2.545 7.122 -2.417 1.00 . A A . 5 TRP CZ3 1 1 15 3827 1 1 5 TRP H H -6.078 3.770 -2.773 1.00 . A A . 5 TRP H 1 1 15 3828 1 1 5 TRP HA H -4.143 3.430 -0.792 1.00 . A A . 5 TRP HA 1 1 15 3829 1 1 5 TRP HB2 H -6.969 4.297 -0.194 1.00 . A A . 5 TRP HB2 1 1 15 3830 1 1 5 TRP HB3 H -5.466 4.892 0.507 1.00 . A A . 5 TRP HB3 1 1 15 3831 1 1 5 TRP HD1 H -8.026 5.925 -1.852 1.00 . A A . 5 TRP HD1 1 1 15 3832 1 1 5 TRP HE1 H -7.272 7.827 -3.379 1.00 . A A . 5 TRP HE1 1 1 15 3833 1 1 5 TRP HE3 H -3.005 5.461 -1.127 1.00 . A A . 5 TRP HE3 1 1 15 3834 1 1 5 TRP HH2 H -2.371 8.793 -3.766 1.00 . A A . 5 TRP HH2 1 1 15 3835 1 1 5 TRP HZ2 H -4.793 9.027 -4.122 1.00 . A A . 5 TRP HZ2 1 1 15 3836 1 1 5 TRP HZ3 H -1.476 7.021 -2.291 1.00 . A A . 5 TRP HZ3 1 1 15 3837 1 1 5 TRP N N -5.498 3.084 -2.313 1.00 . A A . 5 TRP N 1 1 15 3838 1 1 5 TRP NE1 N -6.629 7.272 -2.834 1.00 . A A . 5 TRP NE1 1 1 15 3839 1 1 5 TRP O O -6.628 1.465 -0.216 1.00 . A A . 5 TRP O 1 1 15 3840 1 1 6 GLY C C -4.117 0.731 3.141 1.00 . A A . 6 GLY C 1 1 15 3841 1 1 6 GLY CA C -5.202 0.953 2.105 1.00 . A A . 6 GLY CA 1 1 15 3842 1 1 6 GLY H H -4.044 2.512 1.249 1.00 . A A . 6 GLY H 1 1 15 3843 1 1 6 GLY HA2 H -6.118 1.249 2.618 1.00 . A A . 6 GLY HA2 1 1 15 3844 1 1 6 GLY HA3 H -5.387 0.009 1.598 1.00 . A A . 6 GLY HA3 1 1 15 3845 1 1 6 GLY N N -4.873 1.954 1.106 1.00 . A A . 6 GLY N 1 1 15 3846 1 1 6 GLY O O -3.538 1.681 3.667 1.00 . A A . 6 GLY O 1 1 15 3847 1 1 7 PHE C C -1.449 -0.765 3.749 1.00 . A A . 7 PHE C 1 1 15 3848 1 1 7 PHE CA C -2.825 -0.936 4.396 1.00 . A A . 7 PHE CA 1 1 15 3849 1 1 7 PHE CB C -3.099 -2.374 4.850 1.00 . A A . 7 PHE CB 1 1 15 3850 1 1 7 PHE CD1 C -5.355 -2.093 5.921 1.00 . A A . 7 PHE CD1 1 1 15 3851 1 1 7 PHE CD2 C -3.547 -2.893 7.270 1.00 . A A . 7 PHE CD2 1 1 15 3852 1 1 7 PHE CE1 C -6.222 -2.195 7.007 1.00 . A A . 7 PHE CE1 1 1 15 3853 1 1 7 PHE CE2 C -4.401 -2.992 8.366 1.00 . A A . 7 PHE CE2 1 1 15 3854 1 1 7 PHE CG C -4.020 -2.460 6.036 1.00 . A A . 7 PHE CG 1 1 15 3855 1 1 7 PHE CZ C -5.743 -2.649 8.232 1.00 . A A . 7 PHE CZ 1 1 15 3856 1 1 7 PHE H H -4.361 -1.270 2.966 1.00 . A A . 7 PHE H 1 1 15 3857 1 1 7 PHE HA H -2.885 -0.283 5.266 1.00 . A A . 7 PHE HA 1 1 15 3858 1 1 7 PHE HB2 H -3.544 -2.921 4.018 1.00 . A A . 7 PHE HB2 1 1 15 3859 1 1 7 PHE HB3 H -2.165 -2.868 5.112 1.00 . A A . 7 PHE HB3 1 1 15 3860 1 1 7 PHE HD1 H -5.720 -1.707 4.980 1.00 . A A . 7 PHE HD1 1 1 15 3861 1 1 7 PHE HD2 H -2.507 -3.165 7.383 1.00 . A A . 7 PHE HD2 1 1 15 3862 1 1 7 PHE HE1 H -7.258 -1.914 6.901 1.00 . A A . 7 PHE HE1 1 1 15 3863 1 1 7 PHE HE2 H -4.024 -3.337 9.317 1.00 . A A . 7 PHE HE2 1 1 15 3864 1 1 7 PHE HZ H -6.410 -2.734 9.077 1.00 . A A . 7 PHE HZ 1 1 15 3865 1 1 7 PHE N N -3.854 -0.537 3.438 1.00 . A A . 7 PHE N 1 1 15 3866 1 1 7 PHE O O -1.339 -0.100 2.723 1.00 . A A . 7 PHE O 1 1 15 3867 1 1 8 GLU C C 1.495 0.192 4.014 1.00 . A A . 8 GLU C 1 1 15 3868 1 1 8 GLU CA C 0.991 -1.237 3.873 1.00 . A A . 8 GLU CA 1 1 15 3869 1 1 8 GLU CB C 1.128 -1.772 2.424 1.00 . A A . 8 GLU CB 1 1 15 3870 1 1 8 GLU CD C 2.285 -0.694 0.456 1.00 . A A . 8 GLU CD 1 1 15 3871 1 1 8 GLU CG C 2.483 -1.457 1.747 1.00 . A A . 8 GLU CG 1 1 15 3872 1 1 8 GLU H H -0.556 -1.909 5.178 1.00 . A A . 8 GLU H 1 1 15 3873 1 1 8 GLU HA H 1.611 -1.856 4.522 1.00 . A A . 8 GLU HA 1 1 15 3874 1 1 8 GLU HB2 H 0.981 -2.854 2.436 1.00 . A A . 8 GLU HB2 1 1 15 3875 1 1 8 GLU HB3 H 0.324 -1.361 1.814 1.00 . A A . 8 GLU HB3 1 1 15 3876 1 1 8 GLU HG2 H 3.125 -0.875 2.405 1.00 . A A . 8 GLU HG2 1 1 15 3877 1 1 8 GLU HG3 H 3.000 -2.393 1.530 1.00 . A A . 8 GLU HG3 1 1 15 3878 1 1 8 GLU N N -0.396 -1.359 4.350 1.00 . A A . 8 GLU N 1 1 15 3879 1 1 8 GLU O O 0.835 1.152 3.672 1.00 . A A . 8 GLU O 1 1 15 3880 1 1 8 GLU OE1 O 1.313 -0.008 0.239 1.00 . A A . 8 GLU OE1 1 1 15 3881 1 1 9 PRO C C 3.492 2.187 3.088 1.00 . A A . 9 PRO C 1 1 15 3882 1 1 9 PRO CA C 3.313 1.736 4.536 1.00 . A A . 9 PRO CA 1 1 15 3883 1 1 9 PRO CB C 4.637 1.540 5.279 1.00 . A A . 9 PRO CB 1 1 15 3884 1 1 9 PRO CD C 3.630 -0.616 5.116 1.00 . A A . 9 PRO CD 1 1 15 3885 1 1 9 PRO CG C 4.958 0.092 5.094 1.00 . A A . 9 PRO CG 1 1 15 3886 1 1 9 PRO HA H 2.668 2.437 5.065 1.00 . A A . 9 PRO HA 1 1 15 3887 1 1 9 PRO HB2 H 5.416 2.170 4.850 1.00 . A A . 9 PRO HB2 1 1 15 3888 1 1 9 PRO HB3 H 4.504 1.760 6.338 1.00 . A A . 9 PRO HB3 1 1 15 3889 1 1 9 PRO HD2 H 3.676 -1.510 4.493 1.00 . A A . 9 PRO HD2 1 1 15 3890 1 1 9 PRO HD3 H 3.337 -0.862 6.136 1.00 . A A . 9 PRO HD3 1 1 15 3891 1 1 9 PRO HG2 H 5.446 -0.061 4.132 1.00 . A A . 9 PRO HG2 1 1 15 3892 1 1 9 PRO HG3 H 5.594 -0.266 5.905 1.00 . A A . 9 PRO HG3 1 1 15 3893 1 1 9 PRO N N 2.720 0.396 4.548 1.00 . A A . 9 PRO N 1 1 15 3894 1 1 9 PRO O O 4.006 1.445 2.250 1.00 . A A . 9 PRO O 1 1 15 3895 1 1 10 GLY C C 1.450 3.827 0.941 1.00 . A A . 10 GLY C 1 1 15 3896 1 1 10 GLY CA C 2.886 3.865 1.433 1.00 . A A . 10 GLY CA 1 1 15 3897 1 1 10 GLY H H 2.634 3.969 3.536 1.00 . A A . 10 GLY H 1 1 15 3898 1 1 10 GLY HA2 H 3.232 4.897 1.384 1.00 . A A . 10 GLY HA2 1 1 15 3899 1 1 10 GLY HA3 H 3.505 3.258 0.773 1.00 . A A . 10 GLY HA3 1 1 15 3900 1 1 10 GLY N N 3.008 3.391 2.800 1.00 . A A . 10 GLY N 1 1 15 3901 1 1 10 GLY O O 1.126 4.411 -0.093 1.00 . A A . 10 GLY O 1 1 15 3902 1 1 11 VAL C C -1.389 2.595 0.337 1.00 . A A . 11 VAL C 1 1 15 3903 1 1 11 VAL CA C -0.862 3.260 1.607 1.00 . A A . 11 VAL CA 1 1 15 3904 1 1 11 VAL CB C -1.384 4.712 1.727 1.00 . A A . 11 VAL CB 1 1 15 3905 1 1 11 VAL CG1 C -2.896 4.726 1.914 1.00 . A A . 11 VAL CG1 1 1 15 3906 1 1 11 VAL CG2 C -0.741 5.433 2.913 1.00 . A A . 11 VAL CG2 1 1 15 3907 1 1 11 VAL H H 0.959 2.615 2.479 1.00 . A A . 11 VAL H 1 1 15 3908 1 1 11 VAL HA H -1.277 2.701 2.446 1.00 . A A . 11 VAL HA 1 1 15 3909 1 1 11 VAL HB H -1.139 5.260 0.817 1.00 . A A . 11 VAL HB 1 1 15 3910 1 1 11 VAL HG11 H -3.370 4.257 1.054 1.00 . A A . 11 VAL HG11 1 1 15 3911 1 1 11 VAL HG12 H -3.164 4.182 2.820 1.00 . A A . 11 VAL HG12 1 1 15 3912 1 1 11 VAL HG13 H -3.246 5.755 1.993 1.00 . A A . 11 VAL HG13 1 1 15 3913 1 1 11 VAL HG21 H 0.320 5.591 2.720 1.00 . A A . 11 VAL HG21 1 1 15 3914 1 1 11 VAL HG22 H -1.217 6.404 3.054 1.00 . A A . 11 VAL HG22 1 1 15 3915 1 1 11 VAL HG23 H -0.861 4.836 3.817 1.00 . A A . 11 VAL HG23 1 1 15 3916 1 1 11 VAL N N 0.592 3.182 1.726 1.00 . A A . 11 VAL N 1 1 15 3917 1 1 11 VAL O O -1.710 3.249 -0.655 1.00 . A A . 11 VAL O 1 1 15 3918 1 1 12 ARG C C -2.805 -0.751 -0.178 1.00 . A A . 12 ARG C 1 1 15 3919 1 1 12 ARG CA C -2.047 0.466 -0.699 1.00 . A A . 12 ARG CA 1 1 15 3920 1 1 12 ARG CB C -0.910 0.022 -1.620 1.00 . A A . 12 ARG CB 1 1 15 3921 1 1 12 ARG CD C -1.897 -1.854 -3.005 1.00 . A A . 12 ARG CD 1 1 15 3922 1 1 12 ARG CG C -1.320 -0.450 -3.006 1.00 . A A . 12 ARG CG 1 1 15 3923 1 1 12 ARG CZ C -2.878 -2.356 -5.223 1.00 . A A . 12 ARG CZ 1 1 15 3924 1 1 12 ARG H H -1.207 0.791 1.233 1.00 . A A . 12 ARG H 1 1 15 3925 1 1 12 ARG HA H -2.732 1.085 -1.274 1.00 . A A . 12 ARG HA 1 1 15 3926 1 1 12 ARG HB2 H -0.232 0.866 -1.742 1.00 . A A . 12 ARG HB2 1 1 15 3927 1 1 12 ARG HB3 H -0.363 -0.784 -1.132 1.00 . A A . 12 ARG HB3 1 1 15 3928 1 1 12 ARG HD2 H -1.313 -2.472 -2.323 1.00 . A A . 12 ARG HD2 1 1 15 3929 1 1 12 ARG HD3 H -2.920 -1.810 -2.634 1.00 . A A . 12 ARG HD3 1 1 15 3930 1 1 12 ARG HE H -1.086 -3.004 -4.594 1.00 . A A . 12 ARG HE 1 1 15 3931 1 1 12 ARG HG2 H -2.055 0.241 -3.417 1.00 . A A . 12 ARG HG2 1 1 15 3932 1 1 12 ARG HG3 H -0.437 -0.448 -3.643 1.00 . A A . 12 ARG HG3 1 1 15 3933 1 1 12 ARG HH11 H -4.098 -1.194 -4.116 1.00 . A A . 12 ARG HH11 1 1 15 3934 1 1 12 ARG HH12 H -4.682 -1.603 -5.718 1.00 . A A . 12 ARG HH12 1 1 15 3935 1 1 12 ARG HH21 H -1.915 -3.500 -6.568 1.00 . A A . 12 ARG HH21 1 1 15 3936 1 1 12 ARG HH22 H -3.483 -2.883 -7.069 1.00 . A A . 12 ARG HH22 1 1 15 3937 1 1 12 ARG N N -1.504 1.272 0.393 1.00 . A A . 12 ARG N 1 1 15 3938 1 1 12 ARG NE N -1.892 -2.453 -4.339 1.00 . A A . 12 ARG NE 1 1 15 3939 1 1 12 ARG NH1 N -3.969 -1.648 -5.007 1.00 . A A . 12 ARG NH1 1 1 15 3940 1 1 12 ARG NH2 N -2.744 -2.956 -6.387 1.00 . A A . 12 ARG NH2 1 1 15 3941 1 1 12 ARG O O -2.274 -1.572 0.569 1.00 . A A . 12 ARG O 1 1 15 3942 1 1 13 CYS C C -4.339 -3.311 -0.904 1.00 . A A . 13 CYS C 1 1 15 3943 1 1 13 CYS CA C -4.880 -2.033 -0.267 1.00 . A A . 13 CYS CA 1 1 15 3944 1 1 13 CYS CB C -6.316 -1.790 -0.735 1.00 . A A . 13 CYS CB 1 1 15 3945 1 1 13 CYS H H -4.446 -0.173 -1.214 1.00 . A A . 13 CYS H 1 1 15 3946 1 1 13 CYS HA H -4.882 -2.155 0.816 1.00 . A A . 13 CYS HA 1 1 15 3947 1 1 13 CYS HB2 H -6.342 -0.876 -1.327 1.00 . A A . 13 CYS HB2 1 1 15 3948 1 1 13 CYS HB3 H -6.618 -2.613 -1.384 1.00 . A A . 13 CYS HB3 1 1 15 3949 1 1 13 CYS N N -4.055 -0.882 -0.610 1.00 . A A . 13 CYS N 1 1 15 3950 1 1 13 CYS O O -4.465 -3.513 -2.111 1.00 . A A . 13 CYS O 1 1 15 3951 1 1 13 CYS SG S -7.518 -1.629 0.625 1.00 . A A . 13 CYS SG 1 1 15 3952 1 1 14 LEU C C -4.403 -6.397 -0.902 1.00 . A A . 14 LEU C 1 1 15 3953 1 1 14 LEU CA C -3.244 -5.464 -0.565 1.00 . A A . 14 LEU CA 1 1 15 3954 1 1 14 LEU CB C -2.361 -6.111 0.509 1.00 . A A . 14 LEU CB 1 1 15 3955 1 1 14 LEU CD1 C -0.656 -7.314 -0.909 1.00 . A A . 14 LEU CD1 1 1 15 3956 1 1 14 LEU CD2 C -0.171 -4.995 -0.116 1.00 . A A . 14 LEU CD2 1 1 15 3957 1 1 14 LEU CG C -0.871 -6.309 0.216 1.00 . A A . 14 LEU CG 1 1 15 3958 1 1 14 LEU H H -3.571 -3.919 0.872 1.00 . A A . 14 LEU H 1 1 15 3959 1 1 14 LEU HA H -2.663 -5.320 -1.477 1.00 . A A . 14 LEU HA 1 1 15 3960 1 1 14 LEU HB2 H -2.444 -5.516 1.417 1.00 . A A . 14 LEU HB2 1 1 15 3961 1 1 14 LEU HB3 H -2.782 -7.092 0.729 1.00 . A A . 14 LEU HB3 1 1 15 3962 1 1 14 LEU HD11 H -1.065 -6.925 -1.842 1.00 . A A . 14 LEU HD11 1 1 15 3963 1 1 14 LEU HD12 H 0.411 -7.500 -1.033 1.00 . A A . 14 LEU HD12 1 1 15 3964 1 1 14 LEU HD13 H -1.154 -8.251 -0.662 1.00 . A A . 14 LEU HD13 1 1 15 3965 1 1 14 LEU HD21 H -0.538 -4.606 -1.066 1.00 . A A . 14 LEU HD21 1 1 15 3966 1 1 14 LEU HD22 H -0.370 -4.267 0.672 1.00 . A A . 14 LEU HD22 1 1 15 3967 1 1 14 LEU HD23 H 0.903 -5.163 -0.185 1.00 . A A . 14 LEU HD23 1 1 15 3968 1 1 14 LEU HG H -0.410 -6.712 1.116 1.00 . A A . 14 LEU HG 1 1 15 3969 1 1 14 LEU N N -3.723 -4.166 -0.095 1.00 . A A . 14 LEU N 1 1 15 3970 1 1 14 LEU O O -4.278 -7.283 -1.748 1.00 . A A . 14 LEU O 1 1 15 3971 1 1 15 ILE C C -7.465 -6.221 -1.646 1.00 . A A . 15 ILE C 1 1 15 3972 1 1 15 ILE CA C -6.759 -6.928 -0.490 1.00 . A A . 15 ILE CA 1 1 15 3973 1 1 15 ILE CB C -7.710 -7.000 0.734 1.00 . A A . 15 ILE CB 1 1 15 3974 1 1 15 ILE CD1 C -7.823 -6.755 3.293 1.00 . A A . 15 ILE CD1 1 1 15 3975 1 1 15 ILE CG1 C -6.947 -6.859 2.058 1.00 . A A . 15 ILE CG1 1 1 15 3976 1 1 15 ILE CG2 C -8.483 -8.322 0.720 1.00 . A A . 15 ILE CG2 1 1 15 3977 1 1 15 ILE H H -5.554 -5.448 0.457 1.00 . A A . 15 ILE H 1 1 15 3978 1 1 15 ILE HA H -6.501 -7.942 -0.795 1.00 . A A . 15 ILE HA 1 1 15 3979 1 1 15 ILE HB H -8.427 -6.182 0.663 1.00 . A A . 15 ILE HB 1 1 15 3980 1 1 15 ILE HD11 H -8.319 -7.708 3.480 1.00 . A A . 15 ILE HD11 1 1 15 3981 1 1 15 ILE HD12 H -7.201 -6.503 4.153 1.00 . A A . 15 ILE HD12 1 1 15 3982 1 1 15 ILE HD13 H -8.570 -5.975 3.149 1.00 . A A . 15 ILE HD13 1 1 15 3983 1 1 15 ILE HG12 H -6.285 -7.717 2.168 1.00 . A A . 15 ILE HG12 1 1 15 3984 1 1 15 ILE HG13 H -6.340 -5.955 2.028 1.00 . A A . 15 ILE HG13 1 1 15 3985 1 1 15 ILE HG21 H -9.200 -8.345 1.540 1.00 . A A . 15 ILE HG21 1 1 15 3986 1 1 15 ILE HG22 H -9.033 -8.424 -0.215 1.00 . A A . 15 ILE HG22 1 1 15 3987 1 1 15 ILE HG23 H -7.791 -9.158 0.822 1.00 . A A . 15 ILE HG23 1 1 15 3988 1 1 15 ILE N N -5.528 -6.187 -0.229 1.00 . A A . 15 ILE N 1 1 15 3989 1 1 15 ILE O O -7.068 -5.127 -2.047 1.00 . A A . 15 ILE O 1 1 15 3990 1 1 16 TRP C C -10.188 -5.103 -2.612 1.00 . A A . 16 TRP C 1 1 15 3991 1 1 16 TRP CA C -9.358 -6.240 -3.208 1.00 . A A . 16 TRP CA 1 1 15 3992 1 1 16 TRP CB C -10.261 -7.300 -3.848 1.00 . A A . 16 TRP CB 1 1 15 3993 1 1 16 TRP CD1 C -11.452 -8.761 -2.102 1.00 . A A . 16 TRP CD1 1 1 15 3994 1 1 16 TRP CD2 C -9.607 -9.680 -2.943 1.00 . A A . 16 TRP CD2 1 1 15 3995 1 1 16 TRP CE2 C -10.153 -10.562 -1.982 1.00 . A A . 16 TRP CE2 1 1 15 3996 1 1 16 TRP CE3 C -8.386 -10.013 -3.543 1.00 . A A . 16 TRP CE3 1 1 15 3997 1 1 16 TRP CG C -10.454 -8.523 -2.998 1.00 . A A . 16 TRP CG 1 1 15 3998 1 1 16 TRP CH2 C -8.351 -12.087 -2.264 1.00 . A A . 16 TRP CH2 1 1 15 3999 1 1 16 TRP CZ2 C -9.529 -11.767 -1.637 1.00 . A A . 16 TRP CZ2 1 1 15 4000 1 1 16 TRP CZ3 C -7.773 -11.221 -3.213 1.00 . A A . 16 TRP CZ3 1 1 15 4001 1 1 16 TRP H H -8.782 -7.749 -1.835 1.00 . A A . 16 TRP H 1 1 15 4002 1 1 16 TRP HA H -8.705 -5.832 -3.980 1.00 . A A . 16 TRP HA 1 1 15 4003 1 1 16 TRP HB2 H -11.233 -6.862 -4.068 1.00 . A A . 16 TRP HB2 1 1 15 4004 1 1 16 TRP HB3 H -9.812 -7.608 -4.793 1.00 . A A . 16 TRP HB3 1 1 15 4005 1 1 16 TRP HD1 H -12.261 -8.073 -1.900 1.00 . A A . 16 TRP HD1 1 1 15 4006 1 1 16 TRP HE1 H -11.907 -10.347 -0.782 1.00 . A A . 16 TRP HE1 1 1 15 4007 1 1 16 TRP HE3 H -7.923 -9.330 -4.241 1.00 . A A . 16 TRP HE3 1 1 15 4008 1 1 16 TRP HH2 H -7.854 -13.015 -2.020 1.00 . A A . 16 TRP HH2 1 1 15 4009 1 1 16 TRP HZ2 H -9.958 -12.421 -0.893 1.00 . A A . 16 TRP HZ2 1 1 15 4010 1 1 16 TRP HZ3 H -6.839 -11.493 -3.684 1.00 . A A . 16 TRP HZ3 1 1 15 4011 1 1 16 TRP N N -8.519 -6.835 -2.172 1.00 . A A . 16 TRP N 1 1 15 4012 1 1 16 TRP NE1 N -11.287 -9.975 -1.488 1.00 . A A . 16 TRP NE1 1 1 15 4013 1 1 16 TRP O O -11.379 -5.241 -2.337 1.00 . A A . 16 TRP O 1 1 15 4014 1 1 17 CYS C C -9.374 -1.542 -2.273 1.00 . A A . 17 CYS C 1 1 15 4015 1 1 17 CYS CA C -10.131 -2.784 -1.805 1.00 . A A . 17 CYS CA 1 1 15 4016 1 1 17 CYS CB C -10.151 -2.922 -0.279 1.00 . A A . 17 CYS CB 1 1 15 4017 1 1 17 CYS H H -8.536 -3.940 -2.593 1.00 . A A . 17 CYS H 1 1 15 4018 1 1 17 CYS HA H -11.155 -2.700 -2.163 1.00 . A A . 17 CYS HA 1 1 15 4019 1 1 17 CYS HB2 H -10.530 -1.999 0.157 1.00 . A A . 17 CYS HB2 1 1 15 4020 1 1 17 CYS HB3 H -10.859 -3.716 -0.042 1.00 . A A . 17 CYS HB3 1 1 15 4021 1 1 17 CYS N N -9.525 -3.975 -2.388 1.00 . A A . 17 CYS N 1 1 15 4022 1 1 17 CYS O O -8.369 -1.639 -2.973 1.00 . A A . 17 CYS O 1 1 15 4023 1 1 17 CYS SG S -8.576 -3.358 0.528 1.00 . A A . 17 CYS SG 1 1 15 4024 1 1 18 ASP C C -7.863 0.911 -2.650 1.00 . A A . 18 ASP C 1 1 15 4025 1 1 18 ASP CA C -9.349 0.943 -2.347 1.00 . A A . 18 ASP CA 1 1 15 4026 1 1 18 ASP CB C -9.662 2.043 -1.317 1.00 . A A . 18 ASP CB 1 1 15 4027 1 1 18 ASP CG C -9.229 3.407 -1.798 1.00 . A A . 18 ASP CG 1 1 15 4028 1 1 18 ASP H H -10.691 -0.340 -1.291 1.00 . A A . 18 ASP H 1 1 15 4029 1 1 18 ASP HA H -9.819 1.208 -3.298 1.00 . A A . 18 ASP HA 1 1 15 4030 1 1 18 ASP HB2 H -10.735 2.062 -1.117 1.00 . A A . 18 ASP HB2 1 1 15 4031 1 1 18 ASP HB3 H -9.151 1.820 -0.379 1.00 . A A . 18 ASP HB3 1 1 15 4032 1 1 18 ASP N N -9.887 -0.353 -1.901 1.00 . A A . 18 ASP N 1 1 15 4033 1 1 18 ASP O O -7.503 0.993 -3.809 1.00 . A A . 18 ASP O 1 1 15 4034 1 1 18 ASP OD1 O -8.573 3.495 -2.815 1.00 . A A . 18 ASP OD1 1 1 15 4035 1 1 18 ASP OD2 O -9.549 4.375 -1.141 1.00 . A A . 18 ASP OD2 1 1 16 4036 1 1 1 GLY C C 2.614 0.980 -1.991 1.00 . A A . 1 GLY C 1 1 16 4037 1 1 1 GLY CA C 2.774 -0.525 -1.903 1.00 . A A . 1 GLY CA 1 1 16 4038 1 1 1 GLY H1 H 2.463 -0.552 0.203 1.00 . A A . 1 GLY H1 1 1 16 4039 1 1 1 GLY HA2 H 3.833 -0.766 -1.986 1.00 . A A . 1 GLY HA2 1 1 16 4040 1 1 1 GLY HA3 H 2.247 -0.985 -2.739 1.00 . A A . 1 GLY HA3 1 1 16 4041 1 1 1 GLY N N 2.261 -1.055 -0.650 1.00 . A A . 1 GLY N 1 1 16 4042 1 1 1 GLY O O 2.268 1.617 -0.998 1.00 . A A . 1 GLY O 1 1 16 4043 1 1 2 SER C C 1.787 3.664 -4.076 1.00 . A A . 2 SER C 1 1 16 4044 1 1 2 SER CA C 2.935 3.010 -3.309 1.00 . A A . 2 SER CA 1 1 16 4045 1 1 2 SER CB C 4.227 3.379 -4.037 1.00 . A A . 2 SER CB 1 1 16 4046 1 1 2 SER H H 3.149 0.990 -3.949 1.00 . A A . 2 SER H 1 1 16 4047 1 1 2 SER HA H 2.967 3.461 -2.317 1.00 . A A . 2 SER HA 1 1 16 4048 1 1 2 SER HB2 H 4.217 2.932 -5.031 1.00 . A A . 2 SER HB2 1 1 16 4049 1 1 2 SER HB3 H 4.272 4.462 -4.137 1.00 . A A . 2 SER HB3 1 1 16 4050 1 1 2 SER HG H 6.151 3.288 -3.726 1.00 . A A . 2 SER HG 1 1 16 4051 1 1 2 SER N N 2.890 1.557 -3.157 1.00 . A A . 2 SER N 1 1 16 4052 1 1 2 SER O O 1.592 4.875 -3.993 1.00 . A A . 2 SER O 1 1 16 4053 1 1 2 SER OG O 5.362 2.913 -3.325 1.00 . A A . 2 SER OG 1 1 16 4054 1 1 3 ARG C C -1.299 3.598 -4.880 1.00 . A A . 3 ARG C 1 1 16 4055 1 1 3 ARG CA C -0.022 3.400 -5.697 1.00 . A A . 3 ARG CA 1 1 16 4056 1 1 3 ARG CB C -0.252 2.495 -6.913 1.00 . A A . 3 ARG CB 1 1 16 4057 1 1 3 ARG CD C 1.929 3.136 -8.052 1.00 . A A . 3 ARG CD 1 1 16 4058 1 1 3 ARG CG C 1.002 2.004 -7.628 1.00 . A A . 3 ARG CG 1 1 16 4059 1 1 3 ARG CZ C 2.795 2.624 -10.323 1.00 . A A . 3 ARG CZ 1 1 16 4060 1 1 3 ARG H H 1.298 1.901 -4.934 1.00 . A A . 3 ARG H 1 1 16 4061 1 1 3 ARG HA H 0.273 4.389 -6.049 1.00 . A A . 3 ARG HA 1 1 16 4062 1 1 3 ARG HB2 H -0.812 1.618 -6.590 1.00 . A A . 3 ARG HB2 1 1 16 4063 1 1 3 ARG HB3 H -0.865 3.037 -7.632 1.00 . A A . 3 ARG HB3 1 1 16 4064 1 1 3 ARG HD2 H 1.334 3.937 -8.488 1.00 . A A . 3 ARG HD2 1 1 16 4065 1 1 3 ARG HD3 H 2.425 3.531 -7.164 1.00 . A A . 3 ARG HD3 1 1 16 4066 1 1 3 ARG HE H 3.838 2.412 -8.626 1.00 . A A . 3 ARG HE 1 1 16 4067 1 1 3 ARG HG2 H 1.552 1.326 -6.974 1.00 . A A . 3 ARG HG2 1 1 16 4068 1 1 3 ARG HG3 H 0.696 1.447 -8.513 1.00 . A A . 3 ARG HG3 1 1 16 4069 1 1 3 ARG HH11 H 0.900 3.310 -10.393 1.00 . A A . 3 ARG HH11 1 1 16 4070 1 1 3 ARG HH12 H 1.620 2.888 -11.936 1.00 . A A . 3 ARG HH12 1 1 16 4071 1 1 3 ARG HH21 H 4.662 1.928 -10.607 1.00 . A A . 3 ARG HH21 1 1 16 4072 1 1 3 ARG HH22 H 3.695 2.133 -12.057 1.00 . A A . 3 ARG HH22 1 1 16 4073 1 1 3 ARG N N 1.067 2.881 -4.872 1.00 . A A . 3 ARG N 1 1 16 4074 1 1 3 ARG NE N 2.945 2.687 -9.005 1.00 . A A . 3 ARG NE 1 1 16 4075 1 1 3 ARG NH1 N 1.678 2.967 -10.932 1.00 . A A . 3 ARG NH1 1 1 16 4076 1 1 3 ARG NH2 N 3.798 2.190 -11.056 1.00 . A A . 3 ARG NH2 1 1 16 4077 1 1 3 ARG O O -1.265 3.550 -3.654 1.00 . A A . 3 ARG O 1 1 16 4078 1 1 4 GLY C C -4.194 3.431 -3.773 1.00 . A A . 4 GLY C 1 1 16 4079 1 1 4 GLY CA C -3.629 4.287 -4.891 1.00 . A A . 4 GLY CA 1 1 16 4080 1 1 4 GLY H H -2.440 3.709 -6.556 1.00 . A A . 4 GLY H 1 1 16 4081 1 1 4 GLY HA2 H -3.412 5.265 -4.459 1.00 . A A . 4 GLY HA2 1 1 16 4082 1 1 4 GLY HA3 H -4.408 4.424 -5.639 1.00 . A A . 4 GLY HA3 1 1 16 4083 1 1 4 GLY N N -2.421 3.827 -5.554 1.00 . A A . 4 GLY N 1 1 16 4084 1 1 4 GLY O O -3.932 2.234 -3.662 1.00 . A A . 4 GLY O 1 1 16 4085 1 1 5 TRP C C -5.527 2.562 -0.979 1.00 . A A . 5 TRP C 1 1 16 4086 1 1 5 TRP CA C -5.002 3.899 -1.495 1.00 . A A . 5 TRP CA 1 1 16 4087 1 1 5 TRP CB C -5.843 5.010 -0.856 1.00 . A A . 5 TRP CB 1 1 16 4088 1 1 5 TRP CD1 C -6.942 6.929 -2.150 1.00 . A A . 5 TRP CD1 1 1 16 4089 1 1 5 TRP CD2 C -4.744 7.173 -1.898 1.00 . A A . 5 TRP CD2 1 1 16 4090 1 1 5 TRP CE2 C -5.245 8.291 -2.605 1.00 . A A . 5 TRP CE2 1 1 16 4091 1 1 5 TRP CE3 C -3.362 7.083 -1.683 1.00 . A A . 5 TRP CE3 1 1 16 4092 1 1 5 TRP CG C -5.856 6.311 -1.607 1.00 . A A . 5 TRP CG 1 1 16 4093 1 1 5 TRP CH2 C -3.067 9.218 -2.819 1.00 . A A . 5 TRP CH2 1 1 16 4094 1 1 5 TRP CZ2 C -4.414 9.318 -3.064 1.00 . A A . 5 TRP CZ2 1 1 16 4095 1 1 5 TRP CZ3 C -2.534 8.108 -2.136 1.00 . A A . 5 TRP CZ3 1 1 16 4096 1 1 5 TRP H H -5.580 4.827 -3.304 1.00 . A A . 5 TRP H 1 1 16 4097 1 1 5 TRP HA H -3.975 4.009 -1.146 1.00 . A A . 5 TRP HA 1 1 16 4098 1 1 5 TRP HB2 H -6.870 4.656 -0.773 1.00 . A A . 5 TRP HB2 1 1 16 4099 1 1 5 TRP HB3 H -5.472 5.193 0.152 1.00 . A A . 5 TRP HB3 1 1 16 4100 1 1 5 TRP HD1 H -7.949 6.537 -2.106 1.00 . A A . 5 TRP HD1 1 1 16 4101 1 1 5 TRP HE1 H -7.249 8.734 -3.198 1.00 . A A . 5 TRP HE1 1 1 16 4102 1 1 5 TRP HE3 H -2.944 6.223 -1.179 1.00 . A A . 5 TRP HE3 1 1 16 4103 1 1 5 TRP HH2 H -2.405 10.000 -3.162 1.00 . A A . 5 TRP HH2 1 1 16 4104 1 1 5 TRP HZ2 H -4.819 10.162 -3.603 1.00 . A A . 5 TRP HZ2 1 1 16 4105 1 1 5 TRP HZ3 H -1.468 8.046 -1.969 1.00 . A A . 5 TRP HZ3 1 1 16 4106 1 1 5 TRP N N -4.999 4.086 -2.943 1.00 . A A . 5 TRP N 1 1 16 4107 1 1 5 TRP NE1 N -6.596 8.113 -2.743 1.00 . A A . 5 TRP NE1 1 1 16 4108 1 1 5 TRP O O -6.346 1.910 -1.627 1.00 . A A . 5 TRP O 1 1 16 4109 1 1 6 GLY C C -4.866 0.553 2.119 1.00 . A A . 6 GLY C 1 1 16 4110 1 1 6 GLY CA C -5.585 0.961 0.846 1.00 . A A . 6 GLY CA 1 1 16 4111 1 1 6 GLY H H -4.376 2.703 0.698 1.00 . A A . 6 GLY H 1 1 16 4112 1 1 6 GLY HA2 H -6.639 1.110 1.081 1.00 . A A . 6 GLY HA2 1 1 16 4113 1 1 6 GLY HA3 H -5.512 0.139 0.137 1.00 . A A . 6 GLY HA3 1 1 16 4114 1 1 6 GLY N N -5.079 2.164 0.209 1.00 . A A . 6 GLY N 1 1 16 4115 1 1 6 GLY O O -4.278 1.392 2.801 1.00 . A A . 6 GLY O 1 1 16 4116 1 1 7 PHE C C -2.930 -1.598 3.743 1.00 . A A . 7 PHE C 1 1 16 4117 1 1 7 PHE CA C -4.418 -1.254 3.711 1.00 . A A . 7 PHE CA 1 1 16 4118 1 1 7 PHE CB C -5.174 -2.527 4.109 1.00 . A A . 7 PHE CB 1 1 16 4119 1 1 7 PHE CD1 C -7.227 -1.092 4.606 1.00 . A A . 7 PHE CD1 1 1 16 4120 1 1 7 PHE CD2 C -7.434 -3.476 4.558 1.00 . A A . 7 PHE CD2 1 1 16 4121 1 1 7 PHE CE1 C -8.571 -0.979 4.951 1.00 . A A . 7 PHE CE1 1 1 16 4122 1 1 7 PHE CE2 C -8.777 -3.372 4.910 1.00 . A A . 7 PHE CE2 1 1 16 4123 1 1 7 PHE CG C -6.639 -2.342 4.418 1.00 . A A . 7 PHE CG 1 1 16 4124 1 1 7 PHE CZ C -9.345 -2.122 5.116 1.00 . A A . 7 PHE CZ 1 1 16 4125 1 1 7 PHE H H -5.396 -1.383 1.830 1.00 . A A . 7 PHE H 1 1 16 4126 1 1 7 PHE HA H -4.573 -0.502 4.485 1.00 . A A . 7 PHE HA 1 1 16 4127 1 1 7 PHE HB2 H -5.076 -3.256 3.304 1.00 . A A . 7 PHE HB2 1 1 16 4128 1 1 7 PHE HB3 H -4.693 -2.940 4.996 1.00 . A A . 7 PHE HB3 1 1 16 4129 1 1 7 PHE HD1 H -6.645 -0.189 4.495 1.00 . A A . 7 PHE HD1 1 1 16 4130 1 1 7 PHE HD2 H -7.003 -4.454 4.402 1.00 . A A . 7 PHE HD2 1 1 16 4131 1 1 7 PHE HE1 H -9.010 -0.003 5.099 1.00 . A A . 7 PHE HE1 1 1 16 4132 1 1 7 PHE HE2 H -9.376 -4.264 5.021 1.00 . A A . 7 PHE HE2 1 1 16 4133 1 1 7 PHE HZ H -10.384 -2.039 5.399 1.00 . A A . 7 PHE HZ 1 1 16 4134 1 1 7 PHE N N -4.937 -0.733 2.448 1.00 . A A . 7 PHE N 1 1 16 4135 1 1 7 PHE O O -2.342 -1.760 4.812 1.00 . A A . 7 PHE O 1 1 16 4136 1 1 8 GLU C C -0.120 -0.793 3.072 1.00 . A A . 8 GLU C 1 1 16 4137 1 1 8 GLU CA C -0.864 -1.974 2.477 1.00 . A A . 8 GLU CA 1 1 16 4138 1 1 8 GLU CB C -0.450 -2.162 1.005 1.00 . A A . 8 GLU CB 1 1 16 4139 1 1 8 GLU CD C 1.495 -2.158 -0.563 1.00 . A A . 8 GLU CD 1 1 16 4140 1 1 8 GLU CG C 1.041 -2.506 0.831 1.00 . A A . 8 GLU CG 1 1 16 4141 1 1 8 GLU H H -2.822 -1.610 1.707 1.00 . A A . 8 GLU H 1 1 16 4142 1 1 8 GLU HA H -0.625 -2.864 3.061 1.00 . A A . 8 GLU HA 1 1 16 4143 1 1 8 GLU HB2 H -1.062 -2.939 0.545 1.00 . A A . 8 GLU HB2 1 1 16 4144 1 1 8 GLU HB3 H -0.651 -1.230 0.478 1.00 . A A . 8 GLU HB3 1 1 16 4145 1 1 8 GLU HG2 H 1.641 -1.931 1.535 1.00 . A A . 8 GLU HG2 1 1 16 4146 1 1 8 GLU HG3 H 1.212 -3.566 1.027 1.00 . A A . 8 GLU HG3 1 1 16 4147 1 1 8 GLU N N -2.304 -1.728 2.565 1.00 . A A . 8 GLU N 1 1 16 4148 1 1 8 GLU O O -0.459 0.347 2.828 1.00 . A A . 8 GLU O 1 1 16 4149 1 1 8 GLU OE1 O 1.188 -2.808 -1.541 1.00 . A A . 8 GLU OE1 1 1 16 4150 1 1 9 PRO C C 2.393 0.798 3.097 1.00 . A A . 9 PRO C 1 1 16 4151 1 1 9 PRO CA C 1.795 0.090 4.310 1.00 . A A . 9 PRO CA 1 1 16 4152 1 1 9 PRO CB C 2.843 -0.597 5.189 1.00 . A A . 9 PRO CB 1 1 16 4153 1 1 9 PRO CD C 1.450 -2.328 4.330 1.00 . A A . 9 PRO CD 1 1 16 4154 1 1 9 PRO CG C 2.875 -2.011 4.699 1.00 . A A . 9 PRO CG 1 1 16 4155 1 1 9 PRO HA H 1.204 0.797 4.893 1.00 . A A . 9 PRO HA 1 1 16 4156 1 1 9 PRO HB2 H 3.816 -0.122 5.073 1.00 . A A . 9 PRO HB2 1 1 16 4157 1 1 9 PRO HB3 H 2.526 -0.575 6.232 1.00 . A A . 9 PRO HB3 1 1 16 4158 1 1 9 PRO HD2 H 1.427 -3.076 3.538 1.00 . A A . 9 PRO HD2 1 1 16 4159 1 1 9 PRO HD3 H 0.886 -2.662 5.200 1.00 . A A . 9 PRO HD3 1 1 16 4160 1 1 9 PRO HG2 H 3.514 -2.085 3.818 1.00 . A A . 9 PRO HG2 1 1 16 4161 1 1 9 PRO HG3 H 3.226 -2.681 5.483 1.00 . A A . 9 PRO HG3 1 1 16 4162 1 1 9 PRO N N 0.950 -1.021 3.865 1.00 . A A . 9 PRO N 1 1 16 4163 1 1 9 PRO O O 2.782 0.163 2.115 1.00 . A A . 9 PRO O 1 1 16 4164 1 1 10 GLY C C 1.245 3.437 1.420 1.00 . A A . 10 GLY C 1 1 16 4165 1 1 10 GLY CA C 2.573 2.944 1.967 1.00 . A A . 10 GLY CA 1 1 16 4166 1 1 10 GLY H H 2.181 2.593 4.023 1.00 . A A . 10 GLY H 1 1 16 4167 1 1 10 GLY HA2 H 3.180 3.812 2.219 1.00 . A A . 10 GLY HA2 1 1 16 4168 1 1 10 GLY HA3 H 3.083 2.371 1.194 1.00 . A A . 10 GLY HA3 1 1 16 4169 1 1 10 GLY N N 2.398 2.126 3.155 1.00 . A A . 10 GLY N 1 1 16 4170 1 1 10 GLY O O 1.209 4.275 0.520 1.00 . A A . 10 GLY O 1 1 16 4171 1 1 11 VAL C C -1.599 2.887 0.274 1.00 . A A . 11 VAL C 1 1 16 4172 1 1 11 VAL CA C -1.214 3.313 1.689 1.00 . A A . 11 VAL CA 1 1 16 4173 1 1 11 VAL CB C -1.493 4.819 1.907 1.00 . A A . 11 VAL CB 1 1 16 4174 1 1 11 VAL CG1 C -2.996 5.086 1.881 1.00 . A A . 11 VAL CG1 1 1 16 4175 1 1 11 VAL CG2 C -0.932 5.290 3.249 1.00 . A A . 11 VAL CG2 1 1 16 4176 1 1 11 VAL H H 0.288 2.211 2.701 1.00 . A A . 11 VAL H 1 1 16 4177 1 1 11 VAL HA H -1.864 2.763 2.370 1.00 . A A . 11 VAL HA 1 1 16 4178 1 1 11 VAL HB H -1.019 5.395 1.112 1.00 . A A . 11 VAL HB 1 1 16 4179 1 1 11 VAL HG11 H -3.403 4.786 0.916 1.00 . A A . 11 VAL HG11 1 1 16 4180 1 1 11 VAL HG12 H -3.488 4.522 2.674 1.00 . A A . 11 VAL HG12 1 1 16 4181 1 1 11 VAL HG13 H -3.180 6.151 2.026 1.00 . A A . 11 VAL HG13 1 1 16 4182 1 1 11 VAL HG21 H -1.240 6.319 3.433 1.00 . A A . 11 VAL HG21 1 1 16 4183 1 1 11 VAL HG22 H -1.305 4.653 4.051 1.00 . A A . 11 VAL HG22 1 1 16 4184 1 1 11 VAL HG23 H 0.156 5.249 3.229 1.00 . A A . 11 VAL HG23 1 1 16 4185 1 1 11 VAL N N 0.163 2.929 2.001 1.00 . A A . 11 VAL N 1 1 16 4186 1 1 11 VAL O O -1.756 3.708 -0.630 1.00 . A A . 11 VAL O 1 1 16 4187 1 1 12 ARG C C -3.070 -0.186 -1.040 1.00 . A A . 12 ARG C 1 1 16 4188 1 1 12 ARG CA C -2.102 0.984 -1.192 1.00 . A A . 12 ARG CA 1 1 16 4189 1 1 12 ARG CB C -0.798 0.544 -1.865 1.00 . A A . 12 ARG CB 1 1 16 4190 1 1 12 ARG CD C -1.592 0.161 -4.226 1.00 . A A . 12 ARG CD 1 1 16 4191 1 1 12 ARG CG C -0.913 -0.449 -3.014 1.00 . A A . 12 ARG CG 1 1 16 4192 1 1 12 ARG CZ C -2.376 -0.618 -6.439 1.00 . A A . 12 ARG CZ 1 1 16 4193 1 1 12 ARG H H -1.645 0.966 0.893 1.00 . A A . 12 ARG H 1 1 16 4194 1 1 12 ARG HA H -2.571 1.742 -1.819 1.00 . A A . 12 ARG HA 1 1 16 4195 1 1 12 ARG HB2 H -0.290 1.438 -2.228 1.00 . A A . 12 ARG HB2 1 1 16 4196 1 1 12 ARG HB3 H -0.160 0.099 -1.103 1.00 . A A . 12 ARG HB3 1 1 16 4197 1 1 12 ARG HD2 H -2.630 0.370 -3.970 1.00 . A A . 12 ARG HD2 1 1 16 4198 1 1 12 ARG HD3 H -1.099 1.103 -4.464 1.00 . A A . 12 ARG HD3 1 1 16 4199 1 1 12 ARG HE H -0.878 -1.459 -5.400 1.00 . A A . 12 ARG HE 1 1 16 4200 1 1 12 ARG HG2 H 0.089 -0.770 -3.298 1.00 . A A . 12 ARG HG2 1 1 16 4201 1 1 12 ARG HG3 H -1.476 -1.325 -2.690 1.00 . A A . 12 ARG HG3 1 1 16 4202 1 1 12 ARG HH11 H -3.439 0.954 -5.762 1.00 . A A . 12 ARG HH11 1 1 16 4203 1 1 12 ARG HH12 H -3.896 0.344 -7.346 1.00 . A A . 12 ARG HH12 1 1 16 4204 1 1 12 ARG HH21 H -1.531 -2.178 -7.383 1.00 . A A . 12 ARG HH21 1 1 16 4205 1 1 12 ARG HH22 H -2.844 -1.388 -8.241 1.00 . A A . 12 ARG HH22 1 1 16 4206 1 1 12 ARG N N -1.770 1.581 0.101 1.00 . A A . 12 ARG N 1 1 16 4207 1 1 12 ARG NE N -1.560 -0.714 -5.397 1.00 . A A . 12 ARG NE 1 1 16 4208 1 1 12 ARG NH1 N -3.309 0.310 -6.527 1.00 . A A . 12 ARG NH1 1 1 16 4209 1 1 12 ARG NH2 N -2.235 -1.458 -7.443 1.00 . A A . 12 ARG NH2 1 1 16 4210 1 1 12 ARG O O -2.957 -0.982 -0.110 1.00 . A A . 12 ARG O 1 1 16 4211 1 1 13 CYS C C -4.085 -2.669 -2.563 1.00 . A A . 13 CYS C 1 1 16 4212 1 1 13 CYS CA C -4.871 -1.501 -1.976 1.00 . A A . 13 CYS CA 1 1 16 4213 1 1 13 CYS CB C -6.145 -1.271 -2.789 1.00 . A A . 13 CYS CB 1 1 16 4214 1 1 13 CYS H H -4.196 0.430 -2.616 1.00 . A A . 13 CYS H 1 1 16 4215 1 1 13 CYS HA H -5.153 -1.758 -0.956 1.00 . A A . 13 CYS HA 1 1 16 4216 1 1 13 CYS HB2 H -6.662 -0.391 -2.402 1.00 . A A . 13 CYS HB2 1 1 16 4217 1 1 13 CYS HB3 H -5.874 -1.094 -3.830 1.00 . A A . 13 CYS HB3 1 1 16 4218 1 1 13 CYS N N -4.038 -0.304 -1.941 1.00 . A A . 13 CYS N 1 1 16 4219 1 1 13 CYS O O -3.628 -2.608 -3.703 1.00 . A A . 13 CYS O 1 1 16 4220 1 1 13 CYS SG S -7.277 -2.695 -2.706 1.00 . A A . 13 CYS SG 1 1 16 4221 1 1 14 LEU C C -3.952 -6.180 -1.762 1.00 . A A . 14 LEU C 1 1 16 4222 1 1 14 LEU CA C -3.209 -4.921 -2.206 1.00 . A A . 14 LEU CA 1 1 16 4223 1 1 14 LEU CB C -1.787 -4.882 -1.637 1.00 . A A . 14 LEU CB 1 1 16 4224 1 1 14 LEU CD1 C -0.790 -7.035 -2.531 1.00 . A A . 14 LEU CD1 1 1 16 4225 1 1 14 LEU CD2 C -0.461 -4.903 -3.792 1.00 . A A . 14 LEU CD2 1 1 16 4226 1 1 14 LEU CG C -0.633 -5.526 -2.410 1.00 . A A . 14 LEU CG 1 1 16 4227 1 1 14 LEU H H -4.277 -3.709 -0.828 1.00 . A A . 14 LEU H 1 1 16 4228 1 1 14 LEU HA H -3.162 -4.923 -3.296 1.00 . A A . 14 LEU HA 1 1 16 4229 1 1 14 LEU HB2 H -1.524 -3.833 -1.505 1.00 . A A . 14 LEU HB2 1 1 16 4230 1 1 14 LEU HB3 H -1.807 -5.327 -0.643 1.00 . A A . 14 LEU HB3 1 1 16 4231 1 1 14 LEU HD11 H -0.871 -7.475 -1.538 1.00 . A A . 14 LEU HD11 1 1 16 4232 1 1 14 LEU HD12 H -1.683 -7.272 -3.110 1.00 . A A . 14 LEU HD12 1 1 16 4233 1 1 14 LEU HD13 H 0.083 -7.451 -3.035 1.00 . A A . 14 LEU HD13 1 1 16 4234 1 1 14 LEU HD21 H -0.400 -3.819 -3.696 1.00 . A A . 14 LEU HD21 1 1 16 4235 1 1 14 LEU HD22 H 0.459 -5.274 -4.244 1.00 . A A . 14 LEU HD22 1 1 16 4236 1 1 14 LEU HD23 H -1.306 -5.165 -4.429 1.00 . A A . 14 LEU HD23 1 1 16 4237 1 1 14 LEU HG H 0.274 -5.330 -1.840 1.00 . A A . 14 LEU HG 1 1 16 4238 1 1 14 LEU N N -3.917 -3.724 -1.771 1.00 . A A . 14 LEU N 1 1 16 4239 1 1 14 LEU O O -4.198 -7.079 -2.563 1.00 . A A . 14 LEU O 1 1 16 4240 1 1 15 ILE C C -6.353 -6.836 0.724 1.00 . A A . 15 ILE C 1 1 16 4241 1 1 15 ILE CA C -5.076 -7.353 0.068 1.00 . A A . 15 ILE CA 1 1 16 4242 1 1 15 ILE CB C -4.256 -8.151 1.108 1.00 . A A . 15 ILE CB 1 1 16 4243 1 1 15 ILE CD1 C -1.968 -9.287 1.456 1.00 . A A . 15 ILE CD1 1 1 16 4244 1 1 15 ILE CG1 C -2.922 -8.598 0.497 1.00 . A A . 15 ILE CG1 1 1 16 4245 1 1 15 ILE CG2 C -5.069 -9.347 1.600 1.00 . A A . 15 ILE CG2 1 1 16 4246 1 1 15 ILE H H -4.055 -5.490 0.143 1.00 . A A . 15 ILE H 1 1 16 4247 1 1 15 ILE HA H -5.348 -8.025 -0.746 1.00 . A A . 15 ILE HA 1 1 16 4248 1 1 15 ILE HB H -4.044 -7.502 1.959 1.00 . A A . 15 ILE HB 1 1 16 4249 1 1 15 ILE HD11 H -2.365 -10.262 1.740 1.00 . A A . 15 ILE HD11 1 1 16 4250 1 1 15 ILE HD12 H -1.003 -9.422 0.968 1.00 . A A . 15 ILE HD12 1 1 16 4251 1 1 15 ILE HD13 H -1.838 -8.672 2.346 1.00 . A A . 15 ILE HD13 1 1 16 4252 1 1 15 ILE HG12 H -3.130 -9.267 -0.337 1.00 . A A . 15 ILE HG12 1 1 16 4253 1 1 15 ILE HG13 H -2.407 -7.724 0.102 1.00 . A A . 15 ILE HG13 1 1 16 4254 1 1 15 ILE HG21 H -5.978 -8.990 2.083 1.00 . A A . 15 ILE HG21 1 1 16 4255 1 1 15 ILE HG22 H -5.337 -9.988 0.760 1.00 . A A . 15 ILE HG22 1 1 16 4256 1 1 15 ILE HG23 H -4.494 -9.921 2.326 1.00 . A A . 15 ILE HG23 1 1 16 4257 1 1 15 ILE N N -4.315 -6.235 -0.484 1.00 . A A . 15 ILE N 1 1 16 4258 1 1 15 ILE O O -6.293 -6.064 1.680 1.00 . A A . 15 ILE O 1 1 16 4259 1 1 16 TRP C C -8.961 -5.550 1.334 1.00 . A A . 16 TRP C 1 1 16 4260 1 1 16 TRP CA C -8.823 -6.927 0.687 1.00 . A A . 16 TRP CA 1 1 16 4261 1 1 16 TRP CB C -9.308 -8.001 1.666 1.00 . A A . 16 TRP CB 1 1 16 4262 1 1 16 TRP CD1 C -8.292 -10.336 1.948 1.00 . A A . 16 TRP CD1 1 1 16 4263 1 1 16 TRP CD2 C -9.383 -10.070 0.026 1.00 . A A . 16 TRP CD2 1 1 16 4264 1 1 16 TRP CE2 C -8.786 -11.352 0.036 1.00 . A A . 16 TRP CE2 1 1 16 4265 1 1 16 TRP CE3 C -10.123 -9.685 -1.099 1.00 . A A . 16 TRP CE3 1 1 16 4266 1 1 16 TRP CG C -9.004 -9.411 1.246 1.00 . A A . 16 TRP CG 1 1 16 4267 1 1 16 TRP CH2 C -9.603 -11.824 -2.146 1.00 . A A . 16 TRP CH2 1 1 16 4268 1 1 16 TRP CZ2 C -8.874 -12.224 -1.054 1.00 . A A . 16 TRP CZ2 1 1 16 4269 1 1 16 TRP CZ3 C -10.234 -10.565 -2.175 1.00 . A A . 16 TRP CZ3 1 1 16 4270 1 1 16 TRP H H -7.448 -7.887 -0.606 1.00 . A A . 16 TRP H 1 1 16 4271 1 1 16 TRP HA H -9.505 -6.938 -0.163 1.00 . A A . 16 TRP HA 1 1 16 4272 1 1 16 TRP HB2 H -8.845 -7.826 2.636 1.00 . A A . 16 TRP HB2 1 1 16 4273 1 1 16 TRP HB3 H -10.388 -7.897 1.781 1.00 . A A . 16 TRP HB3 1 1 16 4274 1 1 16 TRP HD1 H -7.878 -10.164 2.931 1.00 . A A . 16 TRP HD1 1 1 16 4275 1 1 16 TRP HE1 H -7.650 -12.313 1.570 1.00 . A A . 16 TRP HE1 1 1 16 4276 1 1 16 TRP HE3 H -10.597 -8.716 -1.134 1.00 . A A . 16 TRP HE3 1 1 16 4277 1 1 16 TRP HH2 H -9.692 -12.482 -2.997 1.00 . A A . 16 TRP HH2 1 1 16 4278 1 1 16 TRP HZ2 H -8.375 -13.181 -1.038 1.00 . A A . 16 TRP HZ2 1 1 16 4279 1 1 16 TRP HZ3 H -10.803 -10.274 -3.046 1.00 . A A . 16 TRP HZ3 1 1 16 4280 1 1 16 TRP N N -7.491 -7.266 0.188 1.00 . A A . 16 TRP N 1 1 16 4281 1 1 16 TRP NE1 N -8.152 -11.500 1.240 1.00 . A A . 16 TRP NE1 1 1 16 4282 1 1 16 TRP O O -9.342 -5.432 2.499 1.00 . A A . 16 TRP O 1 1 16 4283 1 1 17 CYS C C -10.283 -2.725 1.182 1.00 . A A . 17 CYS C 1 1 16 4284 1 1 17 CYS CA C -8.817 -3.138 1.080 1.00 . A A . 17 CYS CA 1 1 16 4285 1 1 17 CYS CB C -8.074 -2.156 0.173 1.00 . A A . 17 CYS CB 1 1 16 4286 1 1 17 CYS H H -8.359 -4.627 -0.376 1.00 . A A . 17 CYS H 1 1 16 4287 1 1 17 CYS HA H -8.375 -3.091 2.073 1.00 . A A . 17 CYS HA 1 1 16 4288 1 1 17 CYS HB2 H -8.111 -1.168 0.630 1.00 . A A . 17 CYS HB2 1 1 16 4289 1 1 17 CYS HB3 H -7.034 -2.471 0.104 1.00 . A A . 17 CYS HB3 1 1 16 4290 1 1 17 CYS N N -8.671 -4.498 0.575 1.00 . A A . 17 CYS N 1 1 16 4291 1 1 17 CYS O O -11.177 -3.319 0.580 1.00 . A A . 17 CYS O 1 1 16 4292 1 1 17 CYS SG S -8.773 -2.037 -1.505 1.00 . A A . 17 CYS SG 1 1 16 4293 1 1 18 ASP C C -12.271 -0.372 0.743 1.00 . A A . 18 ASP C 1 1 16 4294 1 1 18 ASP CA C -11.875 -1.061 2.034 1.00 . A A . 18 ASP CA 1 1 16 4295 1 1 18 ASP CB C -11.993 -0.080 3.211 1.00 . A A . 18 ASP CB 1 1 16 4296 1 1 18 ASP CG C -13.416 0.403 3.350 1.00 . A A . 18 ASP CG 1 1 16 4297 1 1 18 ASP H H -9.787 -1.225 2.471 1.00 . A A . 18 ASP H 1 1 16 4298 1 1 18 ASP HA H -12.600 -1.865 2.175 1.00 . A A . 18 ASP HA 1 1 16 4299 1 1 18 ASP HB2 H -11.689 -0.569 4.137 1.00 . A A . 18 ASP HB2 1 1 16 4300 1 1 18 ASP HB3 H -11.339 0.777 3.044 1.00 . A A . 18 ASP HB3 1 1 16 4301 1 1 18 ASP N N -10.536 -1.655 1.953 1.00 . A A . 18 ASP N 1 1 16 4302 1 1 18 ASP O O -11.596 0.559 0.344 1.00 . A A . 18 ASP O 1 1 16 4303 1 1 18 ASP OD1 O -14.229 0.060 2.515 1.00 . A A . 18 ASP OD1 1 1 16 4304 1 1 18 ASP OD2 O -13.700 1.107 4.295 1.00 . A A . 18 ASP OD2 1 1 17 4305 1 1 1 GLY C C 2.683 0.958 -2.017 1.00 . A A . 1 GLY C 1 1 17 4306 1 1 1 GLY CA C 2.771 -0.554 -1.934 1.00 . A A . 1 GLY CA 1 1 17 4307 1 1 1 GLY H1 H 2.528 -0.536 0.181 1.00 . A A . 1 GLY H1 1 1 17 4308 1 1 1 GLY HA2 H 3.811 -0.848 -2.076 1.00 . A A . 1 GLY HA2 1 1 17 4309 1 1 1 GLY HA3 H 2.175 -0.986 -2.737 1.00 . A A . 1 GLY HA3 1 1 17 4310 1 1 1 GLY N N 2.303 -1.060 -0.654 1.00 . A A . 1 GLY N 1 1 17 4311 1 1 1 GLY O O 2.469 1.613 -0.999 1.00 . A A . 1 GLY O 1 1 17 4312 1 1 2 SER C C 1.937 3.693 -4.157 1.00 . A A . 2 SER C 1 1 17 4313 1 1 2 SER CA C 3.020 2.964 -3.365 1.00 . A A . 2 SER CA 1 1 17 4314 1 1 2 SER CB C 4.351 3.240 -4.062 1.00 . A A . 2 SER CB 1 1 17 4315 1 1 2 SER H H 3.023 0.936 -4.019 1.00 . A A . 2 SER H 1 1 17 4316 1 1 2 SER HA H 3.061 3.418 -2.374 1.00 . A A . 2 SER HA 1 1 17 4317 1 1 2 SER HB2 H 4.322 2.817 -5.065 1.00 . A A . 2 SER HB2 1 1 17 4318 1 1 2 SER HB3 H 4.484 4.318 -4.137 1.00 . A A . 2 SER HB3 1 1 17 4319 1 1 2 SER HG H 6.252 3.045 -3.671 1.00 . A A . 2 SER HG 1 1 17 4320 1 1 2 SER N N 2.881 1.517 -3.207 1.00 . A A . 2 SER N 1 1 17 4321 1 1 2 SER O O 1.886 4.922 -4.154 1.00 . A A . 2 SER O 1 1 17 4322 1 1 2 SER OG O 5.431 2.668 -3.344 1.00 . A A . 2 SER OG 1 1 17 4323 1 1 3 ARG C C -1.200 3.871 -4.913 1.00 . A A . 3 ARG C 1 1 17 4324 1 1 3 ARG CA C 0.057 3.531 -5.714 1.00 . A A . 3 ARG CA 1 1 17 4325 1 1 3 ARG CB C -0.253 2.608 -6.899 1.00 . A A . 3 ARG CB 1 1 17 4326 1 1 3 ARG CD C 1.911 3.097 -8.119 1.00 . A A . 3 ARG CD 1 1 17 4327 1 1 3 ARG CG C 0.953 2.024 -7.624 1.00 . A A . 3 ARG CG 1 1 17 4328 1 1 3 ARG CZ C 3.915 1.965 -9.052 1.00 . A A . 3 ARG CZ 1 1 17 4329 1 1 3 ARG H H 1.228 1.948 -4.882 1.00 . A A . 3 ARG H 1 1 17 4330 1 1 3 ARG HA H 0.431 4.477 -6.104 1.00 . A A . 3 ARG HA 1 1 17 4331 1 1 3 ARG HB2 H -0.859 1.777 -6.542 1.00 . A A . 3 ARG HB2 1 1 17 4332 1 1 3 ARG HB3 H -0.845 3.166 -7.624 1.00 . A A . 3 ARG HB3 1 1 17 4333 1 1 3 ARG HD2 H 1.327 3.943 -8.479 1.00 . A A . 3 ARG HD2 1 1 17 4334 1 1 3 ARG HD3 H 2.527 3.440 -7.287 1.00 . A A . 3 ARG HD3 1 1 17 4335 1 1 3 ARG HE H 2.445 2.771 -10.147 1.00 . A A . 3 ARG HE 1 1 17 4336 1 1 3 ARG HG2 H 1.489 1.349 -6.956 1.00 . A A . 3 ARG HG2 1 1 17 4337 1 1 3 ARG HG3 H 0.595 1.449 -8.476 1.00 . A A . 3 ARG HG3 1 1 17 4338 1 1 3 ARG HH11 H 3.955 2.005 -7.039 1.00 . A A . 3 ARG HH11 1 1 17 4339 1 1 3 ARG HH12 H 5.309 1.200 -7.817 1.00 . A A . 3 ARG HH12 1 1 17 4340 1 1 3 ARG HH21 H 4.182 1.761 -11.035 1.00 . A A . 3 ARG HH21 1 1 17 4341 1 1 3 ARG HH22 H 5.445 1.080 -10.023 1.00 . A A . 3 ARG HH22 1 1 17 4342 1 1 3 ARG N N 1.108 2.949 -4.882 1.00 . A A . 3 ARG N 1 1 17 4343 1 1 3 ARG NE N 2.762 2.603 -9.203 1.00 . A A . 3 ARG NE 1 1 17 4344 1 1 3 ARG NH1 N 4.435 1.699 -7.870 1.00 . A A . 3 ARG NH1 1 1 17 4345 1 1 3 ARG NH2 N 4.567 1.566 -10.124 1.00 . A A . 3 ARG NH2 1 1 17 4346 1 1 3 ARG O O -1.124 4.109 -3.711 1.00 . A A . 3 ARG O 1 1 17 4347 1 1 4 GLY C C -4.107 3.576 -3.785 1.00 . A A . 4 GLY C 1 1 17 4348 1 1 4 GLY CA C -3.576 4.384 -4.954 1.00 . A A . 4 GLY CA 1 1 17 4349 1 1 4 GLY H H -2.385 3.629 -6.545 1.00 . A A . 4 GLY H 1 1 17 4350 1 1 4 GLY HA2 H -3.394 5.396 -4.591 1.00 . A A . 4 GLY HA2 1 1 17 4351 1 1 4 GLY HA3 H -4.358 4.439 -5.711 1.00 . A A . 4 GLY HA3 1 1 17 4352 1 1 4 GLY N N -2.352 3.912 -5.577 1.00 . A A . 4 GLY N 1 1 17 4353 1 1 4 GLY O O -3.807 2.396 -3.616 1.00 . A A . 4 GLY O 1 1 17 4354 1 1 5 TRP C C -5.469 2.715 -1.025 1.00 . A A . 5 TRP C 1 1 17 4355 1 1 5 TRP CA C -4.953 4.061 -1.527 1.00 . A A . 5 TRP CA 1 1 17 4356 1 1 5 TRP CB C -5.818 5.161 -0.902 1.00 . A A . 5 TRP CB 1 1 17 4357 1 1 5 TRP CD1 C -7.087 6.915 -2.272 1.00 . A A . 5 TRP CD1 1 1 17 4358 1 1 5 TRP CD2 C -4.906 7.329 -2.099 1.00 . A A . 5 TRP CD2 1 1 17 4359 1 1 5 TRP CE2 C -5.499 8.343 -2.888 1.00 . A A . 5 TRP CE2 1 1 17 4360 1 1 5 TRP CE3 C -3.518 7.353 -1.910 1.00 . A A . 5 TRP CE3 1 1 17 4361 1 1 5 TRP CG C -5.947 6.411 -1.725 1.00 . A A . 5 TRP CG 1 1 17 4362 1 1 5 TRP CH2 C -3.392 9.381 -3.255 1.00 . A A . 5 TRP CH2 1 1 17 4363 1 1 5 TRP CZ2 C -4.749 9.372 -3.466 1.00 . A A . 5 TRP CZ2 1 1 17 4364 1 1 5 TRP CZ3 C -2.771 8.381 -2.483 1.00 . A A . 5 TRP CZ3 1 1 17 4365 1 1 5 TRP H H -5.493 4.987 -3.353 1.00 . A A . 5 TRP H 1 1 17 4366 1 1 5 TRP HA H -3.934 4.181 -1.163 1.00 . A A . 5 TRP HA 1 1 17 4367 1 1 5 TRP HB2 H -6.818 4.761 -0.736 1.00 . A A . 5 TRP HB2 1 1 17 4368 1 1 5 TRP HB3 H -5.399 5.427 0.068 1.00 . A A . 5 TRP HB3 1 1 17 4369 1 1 5 TRP HD1 H -8.063 6.463 -2.166 1.00 . A A . 5 TRP HD1 1 1 17 4370 1 1 5 TRP HE1 H -7.545 8.615 -3.438 1.00 . A A . 5 TRP HE1 1 1 17 4371 1 1 5 TRP HE3 H -3.033 6.577 -1.337 1.00 . A A . 5 TRP HE3 1 1 17 4372 1 1 5 TRP HH2 H -2.791 10.167 -3.689 1.00 . A A . 5 TRP HH2 1 1 17 4373 1 1 5 TRP HZ2 H -5.221 10.134 -4.069 1.00 . A A . 5 TRP HZ2 1 1 17 4374 1 1 5 TRP HZ3 H -1.700 8.405 -2.340 1.00 . A A . 5 TRP HZ3 1 1 17 4375 1 1 5 TRP N N -4.921 4.245 -2.976 1.00 . A A . 5 TRP N 1 1 17 4376 1 1 5 TRP NE1 N -6.839 8.072 -2.961 1.00 . A A . 5 TRP NE1 1 1 17 4377 1 1 5 TRP O O -6.255 2.047 -1.697 1.00 . A A . 5 TRP O 1 1 17 4378 1 1 6 GLY C C -4.951 0.708 2.112 1.00 . A A . 6 GLY C 1 1 17 4379 1 1 6 GLY CA C -5.587 1.130 0.801 1.00 . A A . 6 GLY CA 1 1 17 4380 1 1 6 GLY H H -4.371 2.871 0.686 1.00 . A A . 6 GLY H 1 1 17 4381 1 1 6 GLY HA2 H -6.652 1.277 0.977 1.00 . A A . 6 GLY HA2 1 1 17 4382 1 1 6 GLY HA3 H -5.483 0.307 0.098 1.00 . A A . 6 GLY HA3 1 1 17 4383 1 1 6 GLY N N -5.056 2.330 0.178 1.00 . A A . 6 GLY N 1 1 17 4384 1 1 6 GLY O O -4.646 1.537 2.968 1.00 . A A . 6 GLY O 1 1 17 4385 1 1 7 PHE C C -2.946 -1.567 3.682 1.00 . A A . 7 PHE C 1 1 17 4386 1 1 7 PHE CA C -4.427 -1.218 3.550 1.00 . A A . 7 PHE CA 1 1 17 4387 1 1 7 PHE CB C -5.244 -2.498 3.749 1.00 . A A . 7 PHE CB 1 1 17 4388 1 1 7 PHE CD1 C -7.323 -1.097 4.196 1.00 . A A . 7 PHE CD1 1 1 17 4389 1 1 7 PHE CD2 C -7.197 -3.319 5.072 1.00 . A A . 7 PHE CD2 1 1 17 4390 1 1 7 PHE CE1 C -8.566 -0.925 4.798 1.00 . A A . 7 PHE CE1 1 1 17 4391 1 1 7 PHE CE2 C -8.447 -3.163 5.665 1.00 . A A . 7 PHE CE2 1 1 17 4392 1 1 7 PHE CG C -6.615 -2.289 4.341 1.00 . A A . 7 PHE CG 1 1 17 4393 1 1 7 PHE CZ C -9.131 -1.960 5.537 1.00 . A A . 7 PHE CZ 1 1 17 4394 1 1 7 PHE H H -4.992 -1.222 1.504 1.00 . A A . 7 PHE H 1 1 17 4395 1 1 7 PHE HA H -4.662 -0.528 4.360 1.00 . A A . 7 PHE HA 1 1 17 4396 1 1 7 PHE HB2 H -5.339 -3.014 2.794 1.00 . A A . 7 PHE HB2 1 1 17 4397 1 1 7 PHE HB3 H -4.689 -3.147 4.427 1.00 . A A . 7 PHE HB3 1 1 17 4398 1 1 7 PHE HD1 H -6.912 -0.282 3.620 1.00 . A A . 7 PHE HD1 1 1 17 4399 1 1 7 PHE HD2 H -6.672 -4.256 5.189 1.00 . A A . 7 PHE HD2 1 1 17 4400 1 1 7 PHE HE1 H -9.090 0.015 4.699 1.00 . A A . 7 PHE HE1 1 1 17 4401 1 1 7 PHE HE2 H -8.883 -3.975 6.229 1.00 . A A . 7 PHE HE2 1 1 17 4402 1 1 7 PHE HZ H -10.096 -1.830 6.003 1.00 . A A . 7 PHE HZ 1 1 17 4403 1 1 7 PHE N N -4.804 -0.603 2.278 1.00 . A A . 7 PHE N 1 1 17 4404 1 1 7 PHE O O -2.405 -1.639 4.785 1.00 . A A . 7 PHE O 1 1 17 4405 1 1 8 GLU C C -0.116 -0.797 3.073 1.00 . A A . 8 GLU C 1 1 17 4406 1 1 8 GLU CA C -0.826 -2.012 2.509 1.00 . A A . 8 GLU CA 1 1 17 4407 1 1 8 GLU CB C -0.385 -2.244 1.051 1.00 . A A . 8 GLU CB 1 1 17 4408 1 1 8 GLU CD C 1.549 -2.166 -0.519 1.00 . A A . 8 GLU CD 1 1 17 4409 1 1 8 GLU CG C 1.125 -2.485 0.892 1.00 . A A . 8 GLU CG 1 1 17 4410 1 1 8 GLU H H -2.760 -1.735 1.660 1.00 . A A . 8 GLU H 1 1 17 4411 1 1 8 GLU HA H -0.589 -2.878 3.130 1.00 . A A . 8 GLU HA 1 1 17 4412 1 1 8 GLU HB2 H -0.939 -3.085 0.629 1.00 . A A . 8 GLU HB2 1 1 17 4413 1 1 8 GLU HB3 H -0.648 -1.358 0.474 1.00 . A A . 8 GLU HB3 1 1 17 4414 1 1 8 GLU HG2 H 1.684 -1.844 1.572 1.00 . A A . 8 GLU HG2 1 1 17 4415 1 1 8 GLU HG3 H 1.371 -3.523 1.126 1.00 . A A . 8 GLU HG3 1 1 17 4416 1 1 8 GLU N N -2.272 -1.784 2.542 1.00 . A A . 8 GLU N 1 1 17 4417 1 1 8 GLU O O -0.473 0.328 2.786 1.00 . A A . 8 GLU O 1 1 17 4418 1 1 8 GLU OE1 O 1.218 -2.838 -1.475 1.00 . A A . 8 GLU OE1 1 1 17 4419 1 1 9 PRO C C 2.369 0.867 3.118 1.00 . A A . 9 PRO C 1 1 17 4420 1 1 9 PRO CA C 1.756 0.165 4.327 1.00 . A A . 9 PRO CA 1 1 17 4421 1 1 9 PRO CB C 2.800 -0.478 5.244 1.00 . A A . 9 PRO CB 1 1 17 4422 1 1 9 PRO CD C 1.476 -2.259 4.388 1.00 . A A . 9 PRO CD 1 1 17 4423 1 1 9 PRO CG C 2.884 -1.897 4.779 1.00 . A A . 9 PRO CG 1 1 17 4424 1 1 9 PRO HA H 1.136 0.869 4.882 1.00 . A A . 9 PRO HA 1 1 17 4425 1 1 9 PRO HB2 H 3.762 0.025 5.144 1.00 . A A . 9 PRO HB2 1 1 17 4426 1 1 9 PRO HB3 H 2.455 -0.447 6.278 1.00 . A A . 9 PRO HB3 1 1 17 4427 1 1 9 PRO HD2 H 1.489 -3.021 3.610 1.00 . A A . 9 PRO HD2 1 1 17 4428 1 1 9 PRO HD3 H 0.904 -2.593 5.255 1.00 . A A . 9 PRO HD3 1 1 17 4429 1 1 9 PRO HG2 H 3.541 -1.965 3.912 1.00 . A A . 9 PRO HG2 1 1 17 4430 1 1 9 PRO HG3 H 3.238 -2.544 5.580 1.00 . A A . 9 PRO HG3 1 1 17 4431 1 1 9 PRO N N 0.947 -0.976 3.889 1.00 . A A . 9 PRO N 1 1 17 4432 1 1 9 PRO O O 2.769 0.228 2.143 1.00 . A A . 9 PRO O 1 1 17 4433 1 1 10 GLY C C 1.208 3.447 1.412 1.00 . A A . 10 GLY C 1 1 17 4434 1 1 10 GLY CA C 2.545 3.003 1.974 1.00 . A A . 10 GLY CA 1 1 17 4435 1 1 10 GLY H H 2.180 2.668 4.039 1.00 . A A . 10 GLY H 1 1 17 4436 1 1 10 GLY HA2 H 3.125 3.893 2.220 1.00 . A A . 10 GLY HA2 1 1 17 4437 1 1 10 GLY HA3 H 3.080 2.436 1.213 1.00 . A A . 10 GLY HA3 1 1 17 4438 1 1 10 GLY N N 2.383 2.194 3.170 1.00 . A A . 10 GLY N 1 1 17 4439 1 1 10 GLY O O 1.148 4.255 0.487 1.00 . A A . 10 GLY O 1 1 17 4440 1 1 11 VAL C C -1.623 2.827 0.290 1.00 . A A . 11 VAL C 1 1 17 4441 1 1 11 VAL CA C -1.247 3.273 1.699 1.00 . A A . 11 VAL CA 1 1 17 4442 1 1 11 VAL CB C -1.560 4.775 1.903 1.00 . A A . 11 VAL CB 1 1 17 4443 1 1 11 VAL CG1 C -3.069 5.004 1.887 1.00 . A A . 11 VAL CG1 1 1 17 4444 1 1 11 VAL CG2 C -1.001 5.274 3.236 1.00 . A A . 11 VAL CG2 1 1 17 4445 1 1 11 VAL H H 0.286 2.232 2.727 1.00 . A A . 11 VAL H 1 1 17 4446 1 1 11 VAL HA H -1.880 2.717 2.388 1.00 . A A . 11 VAL HA 1 1 17 4447 1 1 11 VAL HB H -1.107 5.353 1.099 1.00 . A A . 11 VAL HB 1 1 17 4448 1 1 11 VAL HG11 H -3.540 4.432 2.687 1.00 . A A . 11 VAL HG11 1 1 17 4449 1 1 11 VAL HG12 H -3.279 6.064 2.027 1.00 . A A . 11 VAL HG12 1 1 17 4450 1 1 11 VAL HG13 H -3.475 4.688 0.927 1.00 . A A . 11 VAL HG13 1 1 17 4451 1 1 11 VAL HG21 H -1.352 4.636 4.047 1.00 . A A . 11 VAL HG21 1 1 17 4452 1 1 11 VAL HG22 H 0.089 5.260 3.208 1.00 . A A . 11 VAL HG22 1 1 17 4453 1 1 11 VAL HG23 H -1.333 6.297 3.411 1.00 . A A . 11 VAL HG23 1 1 17 4454 1 1 11 VAL N N 0.140 2.929 2.011 1.00 . A A . 11 VAL N 1 1 17 4455 1 1 11 VAL O O -1.782 3.633 -0.626 1.00 . A A . 11 VAL O 1 1 17 4456 1 1 12 ARG C C -3.066 -0.273 -1.008 1.00 . A A . 12 ARG C 1 1 17 4457 1 1 12 ARG CA C -2.116 0.912 -1.157 1.00 . A A . 12 ARG CA 1 1 17 4458 1 1 12 ARG CB C -0.811 0.492 -1.841 1.00 . A A . 12 ARG CB 1 1 17 4459 1 1 12 ARG CD C -1.641 0.267 -4.209 1.00 . A A . 12 ARG CD 1 1 17 4460 1 1 12 ARG CG C -0.939 -0.422 -3.053 1.00 . A A . 12 ARG CG 1 1 17 4461 1 1 12 ARG CZ C -2.517 -0.380 -6.428 1.00 . A A . 12 ARG CZ 1 1 17 4462 1 1 12 ARG H H -1.651 0.909 0.929 1.00 . A A . 12 ARG H 1 1 17 4463 1 1 12 ARG HA H -2.603 1.666 -1.777 1.00 . A A . 12 ARG HA 1 1 17 4464 1 1 12 ARG HB2 H -0.283 1.397 -2.142 1.00 . A A . 12 ARG HB2 1 1 17 4465 1 1 12 ARG HB3 H -0.191 -0.015 -1.104 1.00 . A A . 12 ARG HB3 1 1 17 4466 1 1 12 ARG HD2 H -2.667 0.475 -3.905 1.00 . A A . 12 ARG HD2 1 1 17 4467 1 1 12 ARG HD3 H -1.142 1.213 -4.415 1.00 . A A . 12 ARG HD3 1 1 17 4468 1 1 12 ARG HE H -1.021 -1.320 -5.477 1.00 . A A . 12 ARG HE 1 1 17 4469 1 1 12 ARG HG2 H 0.057 -0.725 -3.372 1.00 . A A . 12 ARG HG2 1 1 17 4470 1 1 12 ARG HG3 H -1.500 -1.316 -2.778 1.00 . A A . 12 ARG HG3 1 1 17 4471 1 1 12 ARG HH11 H -3.489 1.205 -5.654 1.00 . A A . 12 ARG HH11 1 1 17 4472 1 1 12 ARG HH12 H -4.030 0.676 -7.240 1.00 . A A . 12 ARG HH12 1 1 17 4473 1 1 12 ARG HH21 H -1.773 -1.936 -7.462 1.00 . A A . 12 ARG HH21 1 1 17 4474 1 1 12 ARG HH22 H -3.075 -1.055 -8.243 1.00 . A A . 12 ARG HH22 1 1 17 4475 1 1 12 ARG N N -1.784 1.516 0.131 1.00 . A A . 12 ARG N 1 1 17 4476 1 1 12 ARG NE N -1.673 -0.553 -5.419 1.00 . A A . 12 ARG NE 1 1 17 4477 1 1 12 ARG NH1 N -3.415 0.586 -6.446 1.00 . A A . 12 ARG NH1 1 1 17 4478 1 1 12 ARG NH2 N -2.445 -1.185 -7.468 1.00 . A A . 12 ARG NH2 1 1 17 4479 1 1 12 ARG O O -2.918 -1.095 -0.108 1.00 . A A . 12 ARG O 1 1 17 4480 1 1 13 CYS C C -4.166 -2.737 -2.492 1.00 . A A . 13 CYS C 1 1 17 4481 1 1 13 CYS CA C -4.918 -1.558 -1.882 1.00 . A A . 13 CYS CA 1 1 17 4482 1 1 13 CYS CB C -6.214 -1.302 -2.650 1.00 . A A . 13 CYS CB 1 1 17 4483 1 1 13 CYS H H -4.230 0.360 -2.551 1.00 . A A . 13 CYS H 1 1 17 4484 1 1 13 CYS HA H -5.170 -1.808 -0.853 1.00 . A A . 13 CYS HA 1 1 17 4485 1 1 13 CYS HB2 H -6.687 -0.401 -2.258 1.00 . A A . 13 CYS HB2 1 1 17 4486 1 1 13 CYS HB3 H -5.979 -1.153 -3.704 1.00 . A A . 13 CYS HB3 1 1 17 4487 1 1 13 CYS N N -4.064 -0.375 -1.878 1.00 . A A . 13 CYS N 1 1 17 4488 1 1 13 CYS O O -3.753 -2.685 -3.649 1.00 . A A . 13 CYS O 1 1 17 4489 1 1 13 CYS SG S -7.395 -2.680 -2.495 1.00 . A A . 13 CYS SG 1 1 17 4490 1 1 14 LEU C C -4.008 -6.252 -1.739 1.00 . A A . 14 LEU C 1 1 17 4491 1 1 14 LEU CA C -3.266 -4.981 -2.151 1.00 . A A . 14 LEU CA 1 1 17 4492 1 1 14 LEU CB C -1.848 -4.955 -1.573 1.00 . A A . 14 LEU CB 1 1 17 4493 1 1 14 LEU CD1 C -0.840 -7.035 -2.604 1.00 . A A . 14 LEU CD1 1 1 17 4494 1 1 14 LEU CD2 C -0.507 -4.821 -3.715 1.00 . A A . 14 LEU CD2 1 1 17 4495 1 1 14 LEU CG C -0.685 -5.537 -2.380 1.00 . A A . 14 LEU CG 1 1 17 4496 1 1 14 LEU H H -4.302 -3.769 -0.747 1.00 . A A . 14 LEU H 1 1 17 4497 1 1 14 LEU HA H -3.212 -4.964 -3.239 1.00 . A A . 14 LEU HA 1 1 17 4498 1 1 14 LEU HB2 H -1.599 -3.912 -1.378 1.00 . A A . 14 LEU HB2 1 1 17 4499 1 1 14 LEU HB3 H -1.864 -5.460 -0.607 1.00 . A A . 14 LEU HB3 1 1 17 4500 1 1 14 LEU HD11 H 0.045 -7.421 -3.111 1.00 . A A . 14 LEU HD11 1 1 17 4501 1 1 14 LEU HD12 H -0.950 -7.539 -1.644 1.00 . A A . 14 LEU HD12 1 1 17 4502 1 1 14 LEU HD13 H -1.719 -7.230 -3.219 1.00 . A A . 14 LEU HD13 1 1 17 4503 1 1 14 LEU HD21 H -1.350 -5.034 -4.371 1.00 . A A . 14 LEU HD21 1 1 17 4504 1 1 14 LEU HD22 H -0.442 -3.746 -3.544 1.00 . A A . 14 LEU HD22 1 1 17 4505 1 1 14 LEU HD23 H 0.414 -5.162 -4.188 1.00 . A A . 14 LEU HD23 1 1 17 4506 1 1 14 LEU HG H 0.218 -5.380 -1.793 1.00 . A A . 14 LEU HG 1 1 17 4507 1 1 14 LEU N N -3.973 -3.787 -1.700 1.00 . A A . 14 LEU N 1 1 17 4508 1 1 14 LEU O O -4.242 -7.134 -2.562 1.00 . A A . 14 LEU O 1 1 17 4509 1 1 15 ILE C C -6.432 -6.982 0.699 1.00 . A A . 15 ILE C 1 1 17 4510 1 1 15 ILE CA C -5.142 -7.474 0.049 1.00 . A A . 15 ILE CA 1 1 17 4511 1 1 15 ILE CB C -4.331 -8.288 1.085 1.00 . A A . 15 ILE CB 1 1 17 4512 1 1 15 ILE CD1 C -2.038 -9.405 1.446 1.00 . A A . 15 ILE CD1 1 1 17 4513 1 1 15 ILE CG1 C -2.984 -8.711 0.485 1.00 . A A . 15 ILE CG1 1 1 17 4514 1 1 15 ILE CG2 C -5.142 -9.502 1.536 1.00 . A A . 15 ILE CG2 1 1 17 4515 1 1 15 ILE H H -4.133 -5.607 0.181 1.00 . A A . 15 ILE H 1 1 17 4516 1 1 15 ILE HA H -5.398 -8.130 -0.782 1.00 . A A . 15 ILE HA 1 1 17 4517 1 1 15 ILE HB H -4.137 -7.657 1.952 1.00 . A A . 15 ILE HB 1 1 17 4518 1 1 15 ILE HD11 H -1.923 -8.802 2.346 1.00 . A A . 15 ILE HD11 1 1 17 4519 1 1 15 ILE HD12 H -2.430 -10.387 1.711 1.00 . A A . 15 ILE HD12 1 1 17 4520 1 1 15 ILE HD13 H -1.066 -9.526 0.968 1.00 . A A . 15 ILE HD13 1 1 17 4521 1 1 15 ILE HG12 H -3.174 -9.368 -0.363 1.00 . A A . 15 ILE HG12 1 1 17 4522 1 1 15 ILE HG13 H -2.472 -7.825 0.111 1.00 . A A . 15 ILE HG13 1 1 17 4523 1 1 15 ILE HG21 H -6.062 -9.163 2.012 1.00 . A A . 15 ILE HG21 1 1 17 4524 1 1 15 ILE HG22 H -5.390 -10.128 0.678 1.00 . A A . 15 ILE HG22 1 1 17 4525 1 1 15 ILE HG23 H -4.573 -10.087 2.260 1.00 . A A . 15 ILE HG23 1 1 17 4526 1 1 15 ILE N N -4.384 -6.337 -0.467 1.00 . A A . 15 ILE N 1 1 17 4527 1 1 15 ILE O O -6.389 -6.231 1.674 1.00 . A A . 15 ILE O 1 1 17 4528 1 1 16 TRP C C -9.042 -5.754 1.349 1.00 . A A . 16 TRP C 1 1 17 4529 1 1 16 TRP CA C -8.904 -7.090 0.621 1.00 . A A . 16 TRP CA 1 1 17 4530 1 1 16 TRP CB C -9.417 -8.219 1.522 1.00 . A A . 16 TRP CB 1 1 17 4531 1 1 16 TRP CD1 C -8.368 -10.544 1.759 1.00 . A A . 16 TRP CD1 1 1 17 4532 1 1 16 TRP CD2 C -9.364 -10.218 -0.204 1.00 . A A . 16 TRP CD2 1 1 17 4533 1 1 16 TRP CE2 C -8.747 -11.491 -0.214 1.00 . A A . 16 TRP CE2 1 1 17 4534 1 1 16 TRP CE3 C -10.051 -9.798 -1.352 1.00 . A A . 16 TRP CE3 1 1 17 4535 1 1 16 TRP CG C -9.063 -9.604 1.060 1.00 . A A . 16 TRP CG 1 1 17 4536 1 1 16 TRP CH2 C -9.440 -11.883 -2.454 1.00 . A A . 16 TRP CH2 1 1 17 4537 1 1 16 TRP CZ2 C -8.763 -12.318 -1.341 1.00 . A A . 16 TRP CZ2 1 1 17 4538 1 1 16 TRP CZ3 C -10.089 -10.634 -2.467 1.00 . A A . 16 TRP CZ3 1 1 17 4539 1 1 16 TRP H H -7.499 -8.006 -0.673 1.00 . A A . 16 TRP H 1 1 17 4540 1 1 16 TRP HA H -9.566 -7.044 -0.243 1.00 . A A . 16 TRP HA 1 1 17 4541 1 1 16 TRP HB2 H -9.008 -8.081 2.524 1.00 . A A . 16 TRP HB2 1 1 17 4542 1 1 16 TRP HB3 H -10.502 -8.138 1.585 1.00 . A A . 16 TRP HB3 1 1 17 4543 1 1 16 TRP HD1 H -8.009 -10.405 2.768 1.00 . A A . 16 TRP HD1 1 1 17 4544 1 1 16 TRP HE1 H -7.671 -12.492 1.336 1.00 . A A . 16 TRP HE1 1 1 17 4545 1 1 16 TRP HE3 H -10.537 -8.835 -1.374 1.00 . A A . 16 TRP HE3 1 1 17 4546 1 1 16 TRP HH2 H -9.471 -12.507 -3.335 1.00 . A A . 16 TRP HH2 1 1 17 4547 1 1 16 TRP HZ2 H -8.251 -13.268 -1.337 1.00 . A A . 16 TRP HZ2 1 1 17 4548 1 1 16 TRP HZ3 H -10.618 -10.316 -3.354 1.00 . A A . 16 TRP HZ3 1 1 17 4549 1 1 16 TRP N N -7.560 -7.405 0.136 1.00 . A A . 16 TRP N 1 1 17 4550 1 1 16 TRP NE1 N -8.170 -11.676 1.013 1.00 . A A . 16 TRP NE1 1 1 17 4551 1 1 16 TRP O O -9.425 -5.703 2.518 1.00 . A A . 16 TRP O 1 1 17 4552 1 1 17 CYS C C -10.258 -2.852 1.429 1.00 . A A . 17 CYS C 1 1 17 4553 1 1 17 CYS CA C -8.819 -3.341 1.277 1.00 . A A . 17 CYS CA 1 1 17 4554 1 1 17 CYS CB C -8.022 -2.324 0.458 1.00 . A A . 17 CYS CB 1 1 17 4555 1 1 17 CYS H H -8.447 -4.726 -0.305 1.00 . A A . 17 CYS H 1 1 17 4556 1 1 17 CYS HA H -8.371 -3.406 2.267 1.00 . A A . 17 CYS HA 1 1 17 4557 1 1 17 CYS HB2 H -7.967 -1.393 1.023 1.00 . A A . 17 CYS HB2 1 1 17 4558 1 1 17 CYS HB3 H -7.011 -2.708 0.321 1.00 . A A . 17 CYS HB3 1 1 17 4559 1 1 17 CYS N N -8.740 -4.659 0.659 1.00 . A A . 17 CYS N 1 1 17 4560 1 1 17 CYS O O -11.180 -3.317 0.761 1.00 . A A . 17 CYS O 1 1 17 4561 1 1 17 CYS SG S -8.757 -1.967 -1.170 1.00 . A A . 17 CYS SG 1 1 17 4562 1 1 18 ASP C C -12.931 -2.004 2.156 1.00 . A A . 18 ASP C 1 1 17 4563 1 1 18 ASP CA C -11.717 -1.183 2.546 1.00 . A A . 18 ASP CA 1 1 17 4564 1 1 18 ASP CB C -11.729 0.164 1.814 1.00 . A A . 18 ASP CB 1 1 17 4565 1 1 18 ASP CG C -13.048 0.859 2.022 1.00 . A A . 18 ASP CG 1 1 17 4566 1 1 18 ASP H H -9.648 -1.566 2.878 1.00 . A A . 18 ASP H 1 1 17 4567 1 1 18 ASP HA H -11.839 -0.997 3.616 1.00 . A A . 18 ASP HA 1 1 17 4568 1 1 18 ASP HB2 H -10.922 0.796 2.188 1.00 . A A . 18 ASP HB2 1 1 17 4569 1 1 18 ASP HB3 H -11.567 0.002 0.747 1.00 . A A . 18 ASP HB3 1 1 17 4570 1 1 18 ASP N N -10.436 -1.867 2.326 1.00 . A A . 18 ASP N 1 1 17 4571 1 1 18 ASP O O -13.756 -2.252 3.013 1.00 . A A . 18 ASP O 1 1 17 4572 1 1 18 ASP OD1 O -13.946 0.639 1.238 1.00 . A A . 18 ASP OD1 1 1 17 4573 1 1 18 ASP OD2 O -13.167 1.604 2.972 1.00 . A A . 18 ASP OD2 1 1 18 4574 1 1 1 GLY C C 2.967 1.459 -1.821 1.00 . A A . 1 GLY C 1 1 18 4575 1 1 1 GLY CA C 3.135 -0.045 -1.946 1.00 . A A . 1 GLY CA 1 1 18 4576 1 1 1 GLY H1 H 3.476 -1.712 -0.665 1.00 . A A . 1 GLY H1 1 1 18 4577 1 1 1 GLY HA2 H 4.141 -0.227 -2.322 1.00 . A A . 1 GLY HA2 1 1 18 4578 1 1 1 GLY HA3 H 2.434 -0.390 -2.705 1.00 . A A . 1 GLY HA3 1 1 18 4579 1 1 1 GLY N N 2.940 -0.863 -0.757 1.00 . A A . 1 GLY N 1 1 18 4580 1 1 1 GLY O O 3.299 2.039 -0.790 1.00 . A A . 1 GLY O 1 1 18 4581 1 1 2 SER C C 1.325 4.008 -4.038 1.00 . A A . 2 SER C 1 1 18 4582 1 1 2 SER CA C 2.186 3.525 -2.872 1.00 . A A . 2 SER CA 1 1 18 4583 1 1 2 SER CB C 3.493 4.317 -2.889 1.00 . A A . 2 SER CB 1 1 18 4584 1 1 2 SER H H 2.362 1.592 -3.754 1.00 . A A . 2 SER H 1 1 18 4585 1 1 2 SER HA H 1.665 3.752 -1.941 1.00 . A A . 2 SER HA 1 1 18 4586 1 1 2 SER HB2 H 4.199 3.841 -2.211 1.00 . A A . 2 SER HB2 1 1 18 4587 1 1 2 SER HB3 H 3.890 4.286 -3.902 1.00 . A A . 2 SER HB3 1 1 18 4588 1 1 2 SER HG H 2.574 6.026 -3.014 1.00 . A A . 2 SER HG 1 1 18 4589 1 1 2 SER N N 2.496 2.094 -2.890 1.00 . A A . 2 SER N 1 1 18 4590 1 1 2 SER O O 1.347 5.181 -4.411 1.00 . A A . 2 SER O 1 1 18 4591 1 1 2 SER OG O 3.287 5.661 -2.491 1.00 . A A . 2 SER OG 1 1 18 4592 1 1 3 ARG C C -1.760 3.641 -5.130 1.00 . A A . 3 ARG C 1 1 18 4593 1 1 3 ARG CA C -0.367 3.394 -5.707 1.00 . A A . 3 ARG CA 1 1 18 4594 1 1 3 ARG CB C -0.359 2.312 -6.793 1.00 . A A . 3 ARG CB 1 1 18 4595 1 1 3 ARG CD C 1.879 3.043 -7.715 1.00 . A A . 3 ARG CD 1 1 18 4596 1 1 3 ARG CG C 1.019 1.871 -7.266 1.00 . A A . 3 ARG CG 1 1 18 4597 1 1 3 ARG CZ C 2.717 2.460 -9.976 1.00 . A A . 3 ARG CZ 1 1 18 4598 1 1 3 ARG H H 0.713 2.124 -4.363 1.00 . A A . 3 ARG H 1 1 18 4599 1 1 3 ARG HA H -0.061 4.337 -6.159 1.00 . A A . 3 ARG HA 1 1 18 4600 1 1 3 ARG HB2 H -0.880 1.432 -6.421 1.00 . A A . 3 ARG HB2 1 1 18 4601 1 1 3 ARG HB3 H -0.911 2.689 -7.652 1.00 . A A . 3 ARG HB3 1 1 18 4602 1 1 3 ARG HD2 H 1.238 3.800 -8.165 1.00 . A A . 3 ARG HD2 1 1 18 4603 1 1 3 ARG HD3 H 2.358 3.481 -6.839 1.00 . A A . 3 ARG HD3 1 1 18 4604 1 1 3 ARG HE H 3.827 2.448 -8.307 1.00 . A A . 3 ARG HE 1 1 18 4605 1 1 3 ARG HG2 H 1.532 1.345 -6.461 1.00 . A A . 3 ARG HG2 1 1 18 4606 1 1 3 ARG HG3 H 0.890 1.179 -8.098 1.00 . A A . 3 ARG HG3 1 1 18 4607 1 1 3 ARG HH11 H 0.767 2.972 -10.011 1.00 . A A . 3 ARG HH11 1 1 18 4608 1 1 3 ARG HH12 H 1.463 2.501 -11.551 1.00 . A A . 3 ARG HH12 1 1 18 4609 1 1 3 ARG HH21 H 4.627 1.915 -10.288 1.00 . A A . 3 ARG HH21 1 1 18 4610 1 1 3 ARG HH22 H 3.598 1.934 -11.709 1.00 . A A . 3 ARG HH22 1 1 18 4611 1 1 3 ARG N N 0.593 3.080 -4.648 1.00 . A A . 3 ARG N 1 1 18 4612 1 1 3 ARG NE N 2.903 2.622 -8.671 1.00 . A A . 3 ARG NE 1 1 18 4613 1 1 3 ARG NH1 N 1.551 2.658 -10.560 1.00 . A A . 3 ARG NH1 1 1 18 4614 1 1 3 ARG NH2 N 3.730 2.067 -10.719 1.00 . A A . 3 ARG NH2 1 1 18 4615 1 1 3 ARG O O -1.894 4.380 -4.159 1.00 . A A . 3 ARG O 1 1 18 4616 1 1 4 GLY C C -4.346 2.838 -3.812 1.00 . A A . 4 GLY C 1 1 18 4617 1 1 4 GLY CA C -4.152 3.297 -5.244 1.00 . A A . 4 GLY CA 1 1 18 4618 1 1 4 GLY H H -2.658 2.424 -6.490 1.00 . A A . 4 GLY H 1 1 18 4619 1 1 4 GLY HA2 H -4.344 4.368 -5.291 1.00 . A A . 4 GLY HA2 1 1 18 4620 1 1 4 GLY HA3 H -4.869 2.781 -5.883 1.00 . A A . 4 GLY HA3 1 1 18 4621 1 1 4 GLY N N -2.800 3.053 -5.715 1.00 . A A . 4 GLY N 1 1 18 4622 1 1 4 GLY O O -3.927 1.742 -3.449 1.00 . A A . 4 GLY O 1 1 18 4623 1 1 5 TRP C C -5.587 2.362 -0.925 1.00 . A A . 5 TRP C 1 1 18 4624 1 1 5 TRP CA C -4.913 3.587 -1.542 1.00 . A A . 5 TRP CA 1 1 18 4625 1 1 5 TRP CB C -5.575 4.835 -0.949 1.00 . A A . 5 TRP CB 1 1 18 4626 1 1 5 TRP CD1 C -6.166 6.941 -2.284 1.00 . A A . 5 TRP CD1 1 1 18 4627 1 1 5 TRP CD2 C -3.985 6.716 -1.893 1.00 . A A . 5 TRP CD2 1 1 18 4628 1 1 5 TRP CE2 C -4.193 7.908 -2.625 1.00 . A A . 5 TRP CE2 1 1 18 4629 1 1 5 TRP CE3 C -2.671 6.346 -1.579 1.00 . A A . 5 TRP CE3 1 1 18 4630 1 1 5 TRP CG C -5.270 6.109 -1.684 1.00 . A A . 5 TRP CG 1 1 18 4631 1 1 5 TRP CH2 C -1.860 8.363 -2.676 1.00 . A A . 5 TRP CH2 1 1 18 4632 1 1 5 TRP CZ2 C -3.136 8.737 -3.017 1.00 . A A . 5 TRP CZ2 1 1 18 4633 1 1 5 TRP CZ3 C -1.619 7.173 -1.963 1.00 . A A . 5 TRP CZ3 1 1 18 4634 1 1 5 TRP H H -5.383 4.524 -3.380 1.00 . A A . 5 TRP H 1 1 18 4635 1 1 5 TRP HA H -3.863 3.576 -1.246 1.00 . A A . 5 TRP HA 1 1 18 4636 1 1 5 TRP HB2 H -6.654 4.684 -0.959 1.00 . A A . 5 TRP HB2 1 1 18 4637 1 1 5 TRP HB3 H -5.261 4.944 0.088 1.00 . A A . 5 TRP HB3 1 1 18 4638 1 1 5 TRP HD1 H -7.233 6.775 -2.301 1.00 . A A . 5 TRP HD1 1 1 18 4639 1 1 5 TRP HE1 H -6.015 8.764 -3.338 1.00 . A A . 5 TRP HE1 1 1 18 4640 1 1 5 TRP HE3 H -2.479 5.420 -1.057 1.00 . A A . 5 TRP HE3 1 1 18 4641 1 1 5 TRP HH2 H -1.026 8.985 -2.967 1.00 . A A . 5 TRP HH2 1 1 18 4642 1 1 5 TRP HZ2 H -3.316 9.642 -3.579 1.00 . A A . 5 TRP HZ2 1 1 18 4643 1 1 5 TRP HZ3 H -0.604 6.892 -1.718 1.00 . A A . 5 TRP HZ3 1 1 18 4644 1 1 5 TRP N N -4.952 3.695 -2.998 1.00 . A A . 5 TRP N 1 1 18 4645 1 1 5 TRP NE1 N -5.539 8.020 -2.849 1.00 . A A . 5 TRP NE1 1 1 18 4646 1 1 5 TRP O O -6.555 1.835 -1.470 1.00 . A A . 5 TRP O 1 1 18 4647 1 1 6 GLY C C -4.903 0.295 2.128 1.00 . A A . 6 GLY C 1 1 18 4648 1 1 6 GLY CA C -5.702 0.825 0.951 1.00 . A A . 6 GLY CA 1 1 18 4649 1 1 6 GLY H H -4.270 2.362 0.627 1.00 . A A . 6 GLY H 1 1 18 4650 1 1 6 GLY HA2 H -6.678 1.146 1.312 1.00 . A A . 6 GLY HA2 1 1 18 4651 1 1 6 GLY HA3 H -5.858 0.007 0.250 1.00 . A A . 6 GLY HA3 1 1 18 4652 1 1 6 GLY N N -5.088 1.925 0.227 1.00 . A A . 6 GLY N 1 1 18 4653 1 1 6 GLY O O -4.612 1.024 3.074 1.00 . A A . 6 GLY O 1 1 18 4654 1 1 7 PHE C C -2.287 -1.267 2.862 1.00 . A A . 7 PHE C 1 1 18 4655 1 1 7 PHE CA C -3.750 -1.661 3.076 1.00 . A A . 7 PHE CA 1 1 18 4656 1 1 7 PHE CB C -3.984 -3.172 2.960 1.00 . A A . 7 PHE CB 1 1 18 4657 1 1 7 PHE CD1 C -6.400 -3.379 3.604 1.00 . A A . 7 PHE CD1 1 1 18 4658 1 1 7 PHE CD2 C -4.760 -4.438 4.990 1.00 . A A . 7 PHE CD2 1 1 18 4659 1 1 7 PHE CE1 C -7.418 -3.872 4.418 1.00 . A A . 7 PHE CE1 1 1 18 4660 1 1 7 PHE CE2 C -5.766 -4.923 5.821 1.00 . A A . 7 PHE CE2 1 1 18 4661 1 1 7 PHE CG C -5.070 -3.677 3.868 1.00 . A A . 7 PHE CG 1 1 18 4662 1 1 7 PHE CZ C -7.099 -4.649 5.528 1.00 . A A . 7 PHE CZ 1 1 18 4663 1 1 7 PHE H H -4.819 -1.525 1.250 1.00 . A A . 7 PHE H 1 1 18 4664 1 1 7 PHE HA H -4.067 -1.330 4.064 1.00 . A A . 7 PHE HA 1 1 18 4665 1 1 7 PHE HB2 H -4.253 -3.402 1.930 1.00 . A A . 7 PHE HB2 1 1 18 4666 1 1 7 PHE HB3 H -3.071 -3.718 3.193 1.00 . A A . 7 PHE HB3 1 1 18 4667 1 1 7 PHE HD1 H -6.644 -2.743 2.767 1.00 . A A . 7 PHE HD1 1 1 18 4668 1 1 7 PHE HD2 H -3.728 -4.664 5.221 1.00 . A A . 7 PHE HD2 1 1 18 4669 1 1 7 PHE HE1 H -8.450 -3.651 4.190 1.00 . A A . 7 PHE HE1 1 1 18 4670 1 1 7 PHE HE2 H -5.515 -5.518 6.687 1.00 . A A . 7 PHE HE2 1 1 18 4671 1 1 7 PHE HZ H -7.883 -5.034 6.163 1.00 . A A . 7 PHE HZ 1 1 18 4672 1 1 7 PHE N N -4.561 -0.987 2.063 1.00 . A A . 7 PHE N 1 1 18 4673 1 1 7 PHE O O -2.023 -0.247 2.232 1.00 . A A . 7 PHE O 1 1 18 4674 1 1 8 GLU C C 0.633 -0.610 3.809 1.00 . A A . 8 GLU C 1 1 18 4675 1 1 8 GLU CA C 0.111 -1.873 3.136 1.00 . A A . 8 GLU CA 1 1 18 4676 1 1 8 GLU CB C 0.407 -1.862 1.618 1.00 . A A . 8 GLU CB 1 1 18 4677 1 1 8 GLU CD C 2.059 -0.578 0.222 1.00 . A A . 8 GLU CD 1 1 18 4678 1 1 8 GLU CG C 1.897 -1.659 1.267 1.00 . A A . 8 GLU CG 1 1 18 4679 1 1 8 GLU H H -1.605 -2.862 3.927 1.00 . A A . 8 GLU H 1 1 18 4680 1 1 8 GLU HA H 0.633 -2.716 3.587 1.00 . A A . 8 GLU HA 1 1 18 4681 1 1 8 GLU HB2 H 0.057 -2.797 1.177 1.00 . A A . 8 GLU HB2 1 1 18 4682 1 1 8 GLU HB3 H -0.170 -1.061 1.158 1.00 . A A . 8 GLU HB3 1 1 18 4683 1 1 8 GLU HG2 H 2.473 -1.385 2.150 1.00 . A A . 8 GLU HG2 1 1 18 4684 1 1 8 GLU HG3 H 2.310 -2.595 0.885 1.00 . A A . 8 GLU HG3 1 1 18 4685 1 1 8 GLU N N -1.329 -2.071 3.370 1.00 . A A . 8 GLU N 1 1 18 4686 1 1 8 GLU O O 0.053 0.454 3.736 1.00 . A A . 8 GLU O 1 1 18 4687 1 1 8 GLU OE1 O 1.405 0.440 0.221 1.00 . A A . 8 GLU OE1 1 1 18 4688 1 1 9 PRO C C 2.980 1.255 3.552 1.00 . A A . 9 PRO C 1 1 18 4689 1 1 9 PRO CA C 2.523 0.556 4.830 1.00 . A A . 9 PRO CA 1 1 18 4690 1 1 9 PRO CB C 3.687 0.051 5.686 1.00 . A A . 9 PRO CB 1 1 18 4691 1 1 9 PRO CD C 2.533 -1.887 4.898 1.00 . A A . 9 PRO CD 1 1 18 4692 1 1 9 PRO CG C 3.902 -1.355 5.228 1.00 . A A . 9 PRO CG 1 1 18 4693 1 1 9 PRO HA H 1.879 1.220 5.406 1.00 . A A . 9 PRO HA 1 1 18 4694 1 1 9 PRO HB2 H 4.578 0.657 5.521 1.00 . A A . 9 PRO HB2 1 1 18 4695 1 1 9 PRO HB3 H 3.405 0.060 6.739 1.00 . A A . 9 PRO HB3 1 1 18 4696 1 1 9 PRO HD2 H 2.605 -2.609 4.085 1.00 . A A . 9 PRO HD2 1 1 18 4697 1 1 9 PRO HD3 H 2.067 -2.332 5.777 1.00 . A A . 9 PRO HD3 1 1 18 4698 1 1 9 PRO HG2 H 4.529 -1.361 4.336 1.00 . A A . 9 PRO HG2 1 1 18 4699 1 1 9 PRO HG3 H 4.363 -1.947 6.019 1.00 . A A . 9 PRO HG3 1 1 18 4700 1 1 9 PRO N N 1.802 -0.674 4.487 1.00 . A A . 9 PRO N 1 1 18 4701 1 1 9 PRO O O 3.633 0.655 2.698 1.00 . A A . 9 PRO O 1 1 18 4702 1 1 10 GLY C C 1.377 3.437 1.476 1.00 . A A . 10 GLY C 1 1 18 4703 1 1 10 GLY CA C 2.718 3.231 2.156 1.00 . A A . 10 GLY CA 1 1 18 4704 1 1 10 GLY H H 2.091 2.973 4.168 1.00 . A A . 10 GLY H 1 1 18 4705 1 1 10 GLY HA2 H 3.153 4.211 2.350 1.00 . A A . 10 GLY HA2 1 1 18 4706 1 1 10 GLY HA3 H 3.376 2.682 1.485 1.00 . A A . 10 GLY HA3 1 1 18 4707 1 1 10 GLY N N 2.581 2.514 3.413 1.00 . A A . 10 GLY N 1 1 18 4708 1 1 10 GLY O O 1.258 4.242 0.554 1.00 . A A . 10 GLY O 1 1 18 4709 1 1 11 VAL C C -1.326 2.473 0.171 1.00 . A A . 11 VAL C 1 1 18 4710 1 1 11 VAL CA C -1.036 2.916 1.603 1.00 . A A . 11 VAL CA 1 1 18 4711 1 1 11 VAL CB C -1.539 4.357 1.850 1.00 . A A . 11 VAL CB 1 1 18 4712 1 1 11 VAL CG1 C -3.060 4.397 1.781 1.00 . A A . 11 VAL CG1 1 1 18 4713 1 1 11 VAL CG2 C -1.099 4.871 3.223 1.00 . A A . 11 VAL CG2 1 1 18 4714 1 1 11 VAL H H 0.560 2.052 2.699 1.00 . A A . 11 VAL H 1 1 18 4715 1 1 11 VAL HA H -1.618 2.264 2.255 1.00 . A A . 11 VAL HA 1 1 18 4716 1 1 11 VAL HB H -1.134 5.018 1.085 1.00 . A A . 11 VAL HB 1 1 18 4717 1 1 11 VAL HG11 H -3.406 5.423 1.909 1.00 . A A . 11 VAL HG11 1 1 18 4718 1 1 11 VAL HG12 H -3.384 4.030 0.808 1.00 . A A . 11 VAL HG12 1 1 18 4719 1 1 11 VAL HG13 H -3.484 3.768 2.565 1.00 . A A . 11 VAL HG13 1 1 18 4720 1 1 11 VAL HG21 H -0.018 5.012 3.235 1.00 . A A . 11 VAL HG21 1 1 18 4721 1 1 11 VAL HG22 H -1.580 5.827 3.426 1.00 . A A . 11 VAL HG22 1 1 18 4722 1 1 11 VAL HG23 H -1.381 4.153 3.994 1.00 . A A . 11 VAL HG23 1 1 18 4723 1 1 11 VAL N N 0.364 2.742 1.986 1.00 . A A . 11 VAL N 1 1 18 4724 1 1 11 VAL O O -1.310 3.257 -0.778 1.00 . A A . 11 VAL O 1 1 18 4725 1 1 12 ARG C C -3.017 -0.534 -1.050 1.00 . A A . 12 ARG C 1 1 18 4726 1 1 12 ARG CA C -1.961 0.548 -1.237 1.00 . A A . 12 ARG CA 1 1 18 4727 1 1 12 ARG CB C -0.705 -0.104 -1.820 1.00 . A A . 12 ARG CB 1 1 18 4728 1 1 12 ARG CD C -1.244 -0.231 -4.288 1.00 . A A . 12 ARG CD 1 1 18 4729 1 1 12 ARG CG C -0.911 -1.007 -3.027 1.00 . A A . 12 ARG CG 1 1 18 4730 1 1 12 ARG CZ C -0.475 -1.660 -6.170 1.00 . A A . 12 ARG CZ 1 1 18 4731 1 1 12 ARG H H -1.617 0.604 0.864 1.00 . A A . 12 ARG H 1 1 18 4732 1 1 12 ARG HA H -2.334 1.306 -1.923 1.00 . A A . 12 ARG HA 1 1 18 4733 1 1 12 ARG HB2 H 0.010 0.679 -2.073 1.00 . A A . 12 ARG HB2 1 1 18 4734 1 1 12 ARG HB3 H -0.266 -0.721 -1.037 1.00 . A A . 12 ARG HB3 1 1 18 4735 1 1 12 ARG HD2 H -2.161 0.337 -4.123 1.00 . A A . 12 ARG HD2 1 1 18 4736 1 1 12 ARG HD3 H -0.436 0.469 -4.494 1.00 . A A . 12 ARG HD3 1 1 18 4737 1 1 12 ARG HE H -2.389 -1.362 -5.666 1.00 . A A . 12 ARG HE 1 1 18 4738 1 1 12 ARG HG2 H 0.007 -1.569 -3.195 1.00 . A A . 12 ARG HG2 1 1 18 4739 1 1 12 ARG HG3 H -1.712 -1.716 -2.820 1.00 . A A . 12 ARG HG3 1 1 18 4740 1 1 12 ARG HH11 H 1.075 -0.842 -5.178 1.00 . A A . 12 ARG HH11 1 1 18 4741 1 1 12 ARG HH12 H 1.492 -1.847 -6.559 1.00 . A A . 12 ARG HH12 1 1 18 4742 1 1 12 ARG HH21 H -1.773 -2.654 -7.337 1.00 . A A . 12 ARG HH21 1 1 18 4743 1 1 12 ARG HH22 H -0.078 -2.865 -7.739 1.00 . A A . 12 ARG HH22 1 1 18 4744 1 1 12 ARG N N -1.627 1.185 0.035 1.00 . A A . 12 ARG N 1 1 18 4745 1 1 12 ARG NE N -1.437 -1.122 -5.432 1.00 . A A . 12 ARG NE 1 1 18 4746 1 1 12 ARG NH1 N 0.805 -1.425 -5.953 1.00 . A A . 12 ARG NH1 1 1 18 4747 1 1 12 ARG NH2 N -0.800 -2.454 -7.168 1.00 . A A . 12 ARG NH2 1 1 18 4748 1 1 12 ARG O O -2.863 -1.427 -0.217 1.00 . A A . 12 ARG O 1 1 18 4749 1 1 13 CYS C C -4.258 -2.844 -2.419 1.00 . A A . 13 CYS C 1 1 18 4750 1 1 13 CYS CA C -5.006 -1.606 -1.931 1.00 . A A . 13 CYS CA 1 1 18 4751 1 1 13 CYS CB C -6.176 -1.277 -2.859 1.00 . A A . 13 CYS CB 1 1 18 4752 1 1 13 CYS H H -4.190 0.294 -2.483 1.00 . A A . 13 CYS H 1 1 18 4753 1 1 13 CYS HA H -5.389 -1.801 -0.931 1.00 . A A . 13 CYS HA 1 1 18 4754 1 1 13 CYS HB2 H -6.592 -0.311 -2.569 1.00 . A A . 13 CYS HB2 1 1 18 4755 1 1 13 CYS HB3 H -5.808 -1.208 -3.882 1.00 . A A . 13 CYS HB3 1 1 18 4756 1 1 13 CYS N N -4.062 -0.497 -1.867 1.00 . A A . 13 CYS N 1 1 18 4757 1 1 13 CYS O O -3.844 -2.917 -3.576 1.00 . A A . 13 CYS O 1 1 18 4758 1 1 13 CYS SG S -7.514 -2.511 -2.791 1.00 . A A . 13 CYS SG 1 1 18 4759 1 1 14 LEU C C -4.106 -6.232 -1.489 1.00 . A A . 14 LEU C 1 1 18 4760 1 1 14 LEU CA C -3.269 -4.992 -1.790 1.00 . A A . 14 LEU CA 1 1 18 4761 1 1 14 LEU CB C -2.001 -4.957 -0.931 1.00 . A A . 14 LEU CB 1 1 18 4762 1 1 14 LEU CD1 C -0.907 -7.168 -1.546 1.00 . A A . 14 LEU CD1 1 1 18 4763 1 1 14 LEU CD2 C -0.218 -5.070 -2.716 1.00 . A A . 14 LEU CD2 1 1 18 4764 1 1 14 LEU CG C -0.727 -5.662 -1.407 1.00 . A A . 14 LEU CG 1 1 18 4765 1 1 14 LEU H H -4.394 -3.666 -0.571 1.00 . A A . 14 LEU H 1 1 18 4766 1 1 14 LEU HA H -2.999 -5.005 -2.846 1.00 . A A . 14 LEU HA 1 1 18 4767 1 1 14 LEU HB2 H -1.741 -3.909 -0.784 1.00 . A A . 14 LEU HB2 1 1 18 4768 1 1 14 LEU HB3 H -2.248 -5.355 0.052 1.00 . A A . 14 LEU HB3 1 1 18 4769 1 1 14 LEU HD11 H 0.047 -7.627 -1.805 1.00 . A A . 14 LEU HD11 1 1 18 4770 1 1 14 LEU HD12 H -1.257 -7.583 -0.601 1.00 . A A . 14 LEU HD12 1 1 18 4771 1 1 14 LEU HD13 H -1.634 -7.386 -2.329 1.00 . A A . 14 LEU HD13 1 1 18 4772 1 1 14 LEU HD21 H 0.756 -5.498 -2.953 1.00 . A A . 14 LEU HD21 1 1 18 4773 1 1 14 LEU HD22 H -0.915 -5.295 -3.523 1.00 . A A . 14 LEU HD22 1 1 18 4774 1 1 14 LEU HD23 H -0.118 -3.990 -2.612 1.00 . A A . 14 LEU HD23 1 1 18 4775 1 1 14 LEU HG H 0.033 -5.486 -0.648 1.00 . A A . 14 LEU HG 1 1 18 4776 1 1 14 LEU N N -4.044 -3.788 -1.510 1.00 . A A . 14 LEU N 1 1 18 4777 1 1 14 LEU O O -4.202 -7.145 -2.307 1.00 . A A . 14 LEU O 1 1 18 4778 1 1 15 ILE C C -6.992 -6.652 0.419 1.00 . A A . 15 ILE C 1 1 18 4779 1 1 15 ILE CA C -5.654 -7.300 0.077 1.00 . A A . 15 ILE CA 1 1 18 4780 1 1 15 ILE CB C -5.157 -8.104 1.299 1.00 . A A . 15 ILE CB 1 1 18 4781 1 1 15 ILE CD1 C -3.084 -9.318 2.222 1.00 . A A . 15 ILE CD1 1 1 18 4782 1 1 15 ILE CG1 C -3.746 -8.646 1.035 1.00 . A A . 15 ILE CG1 1 1 18 4783 1 1 15 ILE CG2 C -6.140 -9.234 1.602 1.00 . A A . 15 ILE CG2 1 1 18 4784 1 1 15 ILE H H -4.560 -5.499 0.347 1.00 . A A . 15 ILE H 1 1 18 4785 1 1 15 ILE HA H -5.789 -7.979 -0.763 1.00 . A A . 15 ILE HA 1 1 18 4786 1 1 15 ILE HB H -5.112 -7.438 2.161 1.00 . A A . 15 ILE HB 1 1 18 4787 1 1 15 ILE HD11 H -2.049 -9.551 1.972 1.00 . A A . 15 ILE HD11 1 1 18 4788 1 1 15 ILE HD12 H -3.103 -8.646 3.080 1.00 . A A . 15 ILE HD12 1 1 18 4789 1 1 15 ILE HD13 H -3.609 -10.240 2.468 1.00 . A A . 15 ILE HD13 1 1 18 4790 1 1 15 ILE HG12 H -3.797 -9.353 0.208 1.00 . A A . 15 ILE HG12 1 1 18 4791 1 1 15 ILE HG13 H -3.104 -7.822 0.730 1.00 . A A . 15 ILE HG13 1 1 18 4792 1 1 15 ILE HG21 H -7.122 -8.812 1.820 1.00 . A A . 15 ILE HG21 1 1 18 4793 1 1 15 ILE HG22 H -6.220 -9.900 0.742 1.00 . A A . 15 ILE HG22 1 1 18 4794 1 1 15 ILE HG23 H -5.805 -9.801 2.471 1.00 . A A . 15 ILE HG23 1 1 18 4795 1 1 15 ILE N N -4.722 -6.245 -0.311 1.00 . A A . 15 ILE N 1 1 18 4796 1 1 15 ILE O O -7.079 -5.879 1.372 1.00 . A A . 15 ILE O 1 1 18 4797 1 1 16 TRP C C -9.531 -5.237 0.623 1.00 . A A . 16 TRP C 1 1 18 4798 1 1 16 TRP CA C -9.377 -6.495 -0.231 1.00 . A A . 16 TRP CA 1 1 18 4799 1 1 16 TRP CB C -10.272 -7.618 0.308 1.00 . A A . 16 TRP CB 1 1 18 4800 1 1 16 TRP CD1 C -9.411 -9.993 0.743 1.00 . A A . 16 TRP CD1 1 1 18 4801 1 1 16 TRP CD2 C -9.771 -9.561 -1.410 1.00 . A A . 16 TRP CD2 1 1 18 4802 1 1 16 TRP CE2 C -9.230 -10.863 -1.294 1.00 . A A . 16 TRP CE2 1 1 18 4803 1 1 16 TRP CE3 C -10.052 -9.066 -2.691 1.00 . A A . 16 TRP CE3 1 1 18 4804 1 1 16 TRP CG C -9.839 -9.002 -0.089 1.00 . A A . 16 TRP CG 1 1 18 4805 1 1 16 TRP CH2 C -9.245 -11.155 -3.652 1.00 . A A . 16 TRP CH2 1 1 18 4806 1 1 16 TRP CZ2 C -8.953 -11.658 -2.409 1.00 . A A . 16 TRP CZ2 1 1 18 4807 1 1 16 TRP CZ3 C -9.795 -9.868 -3.803 1.00 . A A . 16 TRP CZ3 1 1 18 4808 1 1 16 TRP H H -7.822 -7.592 -1.159 1.00 . A A . 16 TRP H 1 1 18 4809 1 1 16 TRP HA H -9.742 -6.242 -1.225 1.00 . A A . 16 TRP HA 1 1 18 4810 1 1 16 TRP HB2 H -10.287 -7.570 1.396 1.00 . A A . 16 TRP HB2 1 1 18 4811 1 1 16 TRP HB3 H -11.286 -7.451 -0.053 1.00 . A A . 16 TRP HB3 1 1 18 4812 1 1 16 TRP HD1 H -9.359 -9.902 1.819 1.00 . A A . 16 TRP HD1 1 1 18 4813 1 1 16 TRP HE1 H -8.689 -11.957 0.460 1.00 . A A . 16 TRP HE1 1 1 18 4814 1 1 16 TRP HE3 H -10.453 -8.071 -2.814 1.00 . A A . 16 TRP HE3 1 1 18 4815 1 1 16 TRP HH2 H -9.044 -11.754 -4.529 1.00 . A A . 16 TRP HH2 1 1 18 4816 1 1 16 TRP HZ2 H -8.515 -12.639 -2.295 1.00 . A A . 16 TRP HZ2 1 1 18 4817 1 1 16 TRP HZ3 H -10.012 -9.493 -4.792 1.00 . A A . 16 TRP HZ3 1 1 18 4818 1 1 16 TRP N N -8.003 -6.968 -0.385 1.00 . A A . 16 TRP N 1 1 18 4819 1 1 16 TRP NE1 N -9.044 -11.110 0.041 1.00 . A A . 16 TRP NE1 1 1 18 4820 1 1 16 TRP O O -9.933 -5.288 1.785 1.00 . A A . 16 TRP O 1 1 18 4821 1 1 17 CYS C C -10.732 -2.334 0.862 1.00 . A A . 17 CYS C 1 1 18 4822 1 1 17 CYS CA C -9.289 -2.817 0.729 1.00 . A A . 17 CYS CA 1 1 18 4823 1 1 17 CYS CB C -8.463 -1.767 -0.015 1.00 . A A . 17 CYS CB 1 1 18 4824 1 1 17 CYS H H -8.870 -4.093 -0.922 1.00 . A A . 17 CYS H 1 1 18 4825 1 1 17 CYS HA H -8.877 -2.936 1.730 1.00 . A A . 17 CYS HA 1 1 18 4826 1 1 17 CYS HB2 H -8.556 -0.812 0.503 1.00 . A A . 17 CYS HB2 1 1 18 4827 1 1 17 CYS HB3 H -7.420 -2.074 0.009 1.00 . A A . 17 CYS HB3 1 1 18 4828 1 1 17 CYS N N -9.194 -4.094 0.034 1.00 . A A . 17 CYS N 1 1 18 4829 1 1 17 CYS O O -11.647 -2.791 0.175 1.00 . A A . 17 CYS O 1 1 18 4830 1 1 17 CYS SG S -8.961 -1.540 -1.752 1.00 . A A . 17 CYS SG 1 1 18 4831 1 1 18 ASP C C -12.766 -0.083 0.698 1.00 . A A . 18 ASP C 1 1 18 4832 1 1 18 ASP CA C -12.257 -0.751 1.961 1.00 . A A . 18 ASP CA 1 1 18 4833 1 1 18 ASP CB C -12.245 0.254 3.124 1.00 . A A . 18 ASP CB 1 1 18 4834 1 1 18 ASP CG C -13.636 0.780 3.377 1.00 . A A . 18 ASP CG 1 1 18 4835 1 1 18 ASP H H -10.170 -1.033 2.328 1.00 . A A . 18 ASP H 1 1 18 4836 1 1 18 ASP HA H -12.976 -1.541 2.186 1.00 . A A . 18 ASP HA 1 1 18 4837 1 1 18 ASP HB2 H -11.870 -0.228 4.030 1.00 . A A . 18 ASP HB2 1 1 18 4838 1 1 18 ASP HB3 H -11.585 1.089 2.883 1.00 . A A . 18 ASP HB3 1 1 18 4839 1 1 18 ASP N N -10.940 -1.367 1.770 1.00 . A A . 18 ASP N 1 1 18 4840 1 1 18 ASP O O -12.176 0.889 0.266 1.00 . A A . 18 ASP O 1 1 18 4841 1 1 18 ASP OD1 O -14.539 0.398 2.662 1.00 . A A . 18 ASP OD1 1 1 18 4842 1 1 18 ASP OD2 O -13.804 1.557 4.293 1.00 . A A . 18 ASP OD2 1 1 19 4843 1 1 1 GLY C C 2.854 1.187 -1.980 1.00 . A A . 1 GLY C 1 1 19 4844 1 1 1 GLY CA C 2.795 -0.321 -2.141 1.00 . A A . 1 GLY CA 1 1 19 4845 1 1 1 GLY H1 H 2.969 -2.011 -0.855 1.00 . A A . 1 GLY H1 1 1 19 4846 1 1 1 GLY HA2 H 3.752 -0.641 -2.553 1.00 . A A . 1 GLY HA2 1 1 19 4847 1 1 1 GLY HA3 H 2.027 -0.545 -2.881 1.00 . A A . 1 GLY HA3 1 1 19 4848 1 1 1 GLY N N 2.518 -1.114 -0.953 1.00 . A A . 1 GLY N 1 1 19 4849 1 1 1 GLY O O 3.344 1.693 -0.972 1.00 . A A . 1 GLY O 1 1 19 4850 1 1 2 SER C C 1.471 4.026 -4.027 1.00 . A A . 2 SER C 1 1 19 4851 1 1 2 SER CA C 2.403 3.364 -3.011 1.00 . A A . 2 SER CA 1 1 19 4852 1 1 2 SER CB C 3.818 3.829 -3.353 1.00 . A A . 2 SER CB 1 1 19 4853 1 1 2 SER H H 2.043 1.429 -3.820 1.00 . A A . 2 SER H 1 1 19 4854 1 1 2 SER HA H 2.144 3.732 -2.019 1.00 . A A . 2 SER HA 1 1 19 4855 1 1 2 SER HB2 H 4.130 3.351 -4.282 1.00 . A A . 2 SER HB2 1 1 19 4856 1 1 2 SER HB3 H 3.801 4.906 -3.501 1.00 . A A . 2 SER HB3 1 1 19 4857 1 1 2 SER HG H 4.283 2.932 -1.685 1.00 . A A . 2 SER HG 1 1 19 4858 1 1 2 SER N N 2.393 1.902 -3.002 1.00 . A A . 2 SER N 1 1 19 4859 1 1 2 SER O O 1.342 5.249 -4.057 1.00 . A A . 2 SER O 1 1 19 4860 1 1 2 SER OG O 4.734 3.499 -2.324 1.00 . A A . 2 SER OG 1 1 19 4861 1 1 3 ARG C C -1.303 4.242 -5.697 1.00 . A A . 3 ARG C 1 1 19 4862 1 1 3 ARG CA C 0.090 3.713 -6.035 1.00 . A A . 3 ARG CA 1 1 19 4863 1 1 3 ARG CB C 0.015 2.625 -7.114 1.00 . A A . 3 ARG CB 1 1 19 4864 1 1 3 ARG CD C 2.366 3.030 -7.962 1.00 . A A . 3 ARG CD 1 1 19 4865 1 1 3 ARG CG C 1.346 1.997 -7.512 1.00 . A A . 3 ARG CG 1 1 19 4866 1 1 3 ARG CZ C 4.117 3.140 -9.712 1.00 . A A . 3 ARG CZ 1 1 19 4867 1 1 3 ARG H H 1.054 2.233 -4.846 1.00 . A A . 3 ARG H 1 1 19 4868 1 1 3 ARG HA H 0.618 4.571 -6.447 1.00 . A A . 3 ARG HA 1 1 19 4869 1 1 3 ARG HB2 H -0.630 1.823 -6.759 1.00 . A A . 3 ARG HB2 1 1 19 4870 1 1 3 ARG HB3 H -0.445 3.056 -8.004 1.00 . A A . 3 ARG HB3 1 1 19 4871 1 1 3 ARG HD2 H 1.834 3.845 -8.453 1.00 . A A . 3 ARG HD2 1 1 19 4872 1 1 3 ARG HD3 H 2.881 3.430 -7.087 1.00 . A A . 3 ARG HD3 1 1 19 4873 1 1 3 ARG HE H 3.407 1.443 -8.916 1.00 . A A . 3 ARG HE 1 1 19 4874 1 1 3 ARG HG2 H 1.756 1.436 -6.672 1.00 . A A . 3 ARG HG2 1 1 19 4875 1 1 3 ARG HG3 H 1.164 1.302 -8.332 1.00 . A A . 3 ARG HG3 1 1 19 4876 1 1 3 ARG HH11 H 3.513 4.974 -9.136 1.00 . A A . 3 ARG HH11 1 1 19 4877 1 1 3 ARG HH12 H 4.717 4.930 -10.413 1.00 . A A . 3 ARG HH12 1 1 19 4878 1 1 3 ARG HH21 H 4.935 1.478 -10.499 1.00 . A A . 3 ARG HH21 1 1 19 4879 1 1 3 ARG HH22 H 5.516 2.999 -11.156 1.00 . A A . 3 ARG HH22 1 1 19 4880 1 1 3 ARG N N 0.885 3.224 -4.910 1.00 . A A . 3 ARG N 1 1 19 4881 1 1 3 ARG NE N 3.335 2.449 -8.891 1.00 . A A . 3 ARG NE 1 1 19 4882 1 1 3 ARG NH1 N 4.113 4.457 -9.759 1.00 . A A . 3 ARG NH1 1 1 19 4883 1 1 3 ARG NH2 N 4.923 2.485 -10.522 1.00 . A A . 3 ARG NH2 1 1 19 4884 1 1 3 ARG O O -1.492 5.451 -5.593 1.00 . A A . 3 ARG O 1 1 19 4885 1 1 4 GLY C C -3.763 3.683 -3.676 1.00 . A A . 4 GLY C 1 1 19 4886 1 1 4 GLY CA C -3.625 3.741 -5.184 1.00 . A A . 4 GLY CA 1 1 19 4887 1 1 4 GLY H H -2.081 2.371 -5.714 1.00 . A A . 4 GLY H 1 1 19 4888 1 1 4 GLY HA2 H -3.811 4.763 -5.514 1.00 . A A . 4 GLY HA2 1 1 19 4889 1 1 4 GLY HA3 H -4.355 3.074 -5.640 1.00 . A A . 4 GLY HA3 1 1 19 4890 1 1 4 GLY N N -2.281 3.350 -5.573 1.00 . A A . 4 GLY N 1 1 19 4891 1 1 4 GLY O O -2.748 3.614 -2.990 1.00 . A A . 4 GLY O 1 1 19 4892 1 1 5 TRP C C -5.718 2.457 -1.092 1.00 . A A . 5 TRP C 1 1 19 4893 1 1 5 TRP CA C -5.177 3.750 -1.693 1.00 . A A . 5 TRP CA 1 1 19 4894 1 1 5 TRP CB C -6.144 4.876 -1.320 1.00 . A A . 5 TRP CB 1 1 19 4895 1 1 5 TRP CD1 C -7.275 6.353 -3.085 1.00 . A A . 5 TRP CD1 1 1 19 4896 1 1 5 TRP CD2 C -5.160 6.910 -2.666 1.00 . A A . 5 TRP CD2 1 1 19 4897 1 1 5 TRP CE2 C -5.680 7.805 -3.630 1.00 . A A . 5 TRP CE2 1 1 19 4898 1 1 5 TRP CE3 C -3.810 7.019 -2.310 1.00 . A A . 5 TRP CE3 1 1 19 4899 1 1 5 TRP CG C -6.210 5.997 -2.314 1.00 . A A . 5 TRP CG 1 1 19 4900 1 1 5 TRP CH2 C -3.598 8.941 -3.792 1.00 . A A . 5 TRP CH2 1 1 19 4901 1 1 5 TRP CZ2 C -4.907 8.828 -4.189 1.00 . A A . 5 TRP CZ2 1 1 19 4902 1 1 5 TRP CZ3 C -3.040 8.041 -2.863 1.00 . A A . 5 TRP CZ3 1 1 19 4903 1 1 5 TRP H H -5.796 3.784 -3.730 1.00 . A A . 5 TRP H 1 1 19 4904 1 1 5 TRP HA H -4.213 3.961 -1.229 1.00 . A A . 5 TRP HA 1 1 19 4905 1 1 5 TRP HB2 H -7.143 4.454 -1.209 1.00 . A A . 5 TRP HB2 1 1 19 4906 1 1 5 TRP HB3 H -5.840 5.285 -0.358 1.00 . A A . 5 TRP HB3 1 1 19 4907 1 1 5 TRP HD1 H -8.234 5.855 -3.066 1.00 . A A . 5 TRP HD1 1 1 19 4908 1 1 5 TRP HE1 H -7.617 7.854 -4.528 1.00 . A A . 5 TRP HE1 1 1 19 4909 1 1 5 TRP HE3 H -3.370 6.304 -1.630 1.00 . A A . 5 TRP HE3 1 1 19 4910 1 1 5 TRP HH2 H -2.982 9.726 -4.205 1.00 . A A . 5 TRP HH2 1 1 19 4911 1 1 5 TRP HZ2 H -5.325 9.506 -4.920 1.00 . A A . 5 TRP HZ2 1 1 19 4912 1 1 5 TRP HZ3 H -2.001 8.137 -2.584 1.00 . A A . 5 TRP HZ3 1 1 19 4913 1 1 5 TRP N N -4.980 3.714 -3.141 1.00 . A A . 5 TRP N 1 1 19 4914 1 1 5 TRP NE1 N -6.974 7.429 -3.877 1.00 . A A . 5 TRP NE1 1 1 19 4915 1 1 5 TRP O O -6.513 1.758 -1.720 1.00 . A A . 5 TRP O 1 1 19 4916 1 1 6 GLY C C -5.035 0.698 2.105 1.00 . A A . 6 GLY C 1 1 19 4917 1 1 6 GLY CA C -5.834 1.002 0.853 1.00 . A A . 6 GLY CA 1 1 19 4918 1 1 6 GLY H H -4.606 2.712 0.595 1.00 . A A . 6 GLY H 1 1 19 4919 1 1 6 GLY HA2 H -6.872 1.188 1.127 1.00 . A A . 6 GLY HA2 1 1 19 4920 1 1 6 GLY HA3 H -5.798 0.132 0.199 1.00 . A A . 6 GLY HA3 1 1 19 4921 1 1 6 GLY N N -5.308 2.150 0.135 1.00 . A A . 6 GLY N 1 1 19 4922 1 1 6 GLY O O -4.566 1.619 2.773 1.00 . A A . 6 GLY O 1 1 19 4923 1 1 7 PHE C C -2.542 -0.888 3.029 1.00 . A A . 7 PHE C 1 1 19 4924 1 1 7 PHE CA C -3.990 -0.999 3.510 1.00 . A A . 7 PHE CA 1 1 19 4925 1 1 7 PHE CB C -4.351 -2.412 3.986 1.00 . A A . 7 PHE CB 1 1 19 4926 1 1 7 PHE CD1 C -6.525 -1.569 4.972 1.00 . A A . 7 PHE CD1 1 1 19 4927 1 1 7 PHE CD2 C -6.420 -3.817 4.156 1.00 . A A . 7 PHE CD2 1 1 19 4928 1 1 7 PHE CE1 C -7.855 -1.756 5.339 1.00 . A A . 7 PHE CE1 1 1 19 4929 1 1 7 PHE CE2 C -7.743 -4.023 4.541 1.00 . A A . 7 PHE CE2 1 1 19 4930 1 1 7 PHE CG C -5.796 -2.592 4.373 1.00 . A A . 7 PHE CG 1 1 19 4931 1 1 7 PHE CZ C -8.465 -2.988 5.127 1.00 . A A . 7 PHE CZ 1 1 19 4932 1 1 7 PHE H H -5.303 -1.304 1.865 1.00 . A A . 7 PHE H 1 1 19 4933 1 1 7 PHE HA H -4.108 -0.302 4.340 1.00 . A A . 7 PHE HA 1 1 19 4934 1 1 7 PHE HB2 H -4.119 -3.117 3.187 1.00 . A A . 7 PHE HB2 1 1 19 4935 1 1 7 PHE HB3 H -3.735 -2.657 4.852 1.00 . A A . 7 PHE HB3 1 1 19 4936 1 1 7 PHE HD1 H -6.064 -0.609 5.148 1.00 . A A . 7 PHE HD1 1 1 19 4937 1 1 7 PHE HD2 H -5.873 -4.625 3.693 1.00 . A A . 7 PHE HD2 1 1 19 4938 1 1 7 PHE HE1 H -8.410 -0.951 5.797 1.00 . A A . 7 PHE HE1 1 1 19 4939 1 1 7 PHE HE2 H -8.210 -4.983 4.376 1.00 . A A . 7 PHE HE2 1 1 19 4940 1 1 7 PHE HZ H -9.493 -3.144 5.421 1.00 . A A . 7 PHE HZ 1 1 19 4941 1 1 7 PHE N N -4.864 -0.584 2.417 1.00 . A A . 7 PHE N 1 1 19 4942 1 1 7 PHE O O -2.212 0.069 2.335 1.00 . A A . 7 PHE O 1 1 19 4943 1 1 8 GLU C C 0.453 -0.682 3.756 1.00 . A A . 8 GLU C 1 1 19 4944 1 1 8 GLU CA C -0.248 -1.841 3.061 1.00 . A A . 8 GLU CA 1 1 19 4945 1 1 8 GLU CB C -0.033 -1.788 1.531 1.00 . A A . 8 GLU CB 1 1 19 4946 1 1 8 GLU CD C 1.679 -0.728 0.027 1.00 . A A . 8 GLU CD 1 1 19 4947 1 1 8 GLU CG C 1.453 -1.754 1.113 1.00 . A A . 8 GLU CG 1 1 19 4948 1 1 8 GLU H H -2.029 -2.651 3.909 1.00 . A A . 8 GLU H 1 1 19 4949 1 1 8 GLU HA H 0.191 -2.763 3.443 1.00 . A A . 8 GLU HA 1 1 19 4950 1 1 8 GLU HB2 H -0.519 -2.648 1.067 1.00 . A A . 8 GLU HB2 1 1 19 4951 1 1 8 GLU HB3 H -0.524 -0.898 1.141 1.00 . A A . 8 GLU HB3 1 1 19 4952 1 1 8 GLU HG2 H 2.090 -1.503 1.958 1.00 . A A . 8 GLU HG2 1 1 19 4953 1 1 8 GLU HG3 H 1.755 -2.739 0.752 1.00 . A A . 8 GLU HG3 1 1 19 4954 1 1 8 GLU N N -1.682 -1.866 3.384 1.00 . A A . 8 GLU N 1 1 19 4955 1 1 8 GLU O O -0.006 0.440 3.771 1.00 . A A . 8 GLU O 1 1 19 4956 1 1 8 GLU OE1 O 1.123 0.346 0.005 1.00 . A A . 8 GLU OE1 1 1 19 4957 1 1 9 PRO C C 2.958 0.915 3.468 1.00 . A A . 9 PRO C 1 1 19 4958 1 1 9 PRO CA C 2.504 0.207 4.742 1.00 . A A . 9 PRO CA 1 1 19 4959 1 1 9 PRO CB C 3.646 -0.472 5.502 1.00 . A A . 9 PRO CB 1 1 19 4960 1 1 9 PRO CD C 2.264 -2.222 4.637 1.00 . A A . 9 PRO CD 1 1 19 4961 1 1 9 PRO CG C 3.694 -1.856 4.941 1.00 . A A . 9 PRO CG 1 1 19 4962 1 1 9 PRO HA H 1.963 0.902 5.385 1.00 . A A . 9 PRO HA 1 1 19 4963 1 1 9 PRO HB2 H 4.587 0.050 5.331 1.00 . A A . 9 PRO HB2 1 1 19 4964 1 1 9 PRO HB3 H 3.414 -0.509 6.567 1.00 . A A . 9 PRO HB3 1 1 19 4965 1 1 9 PRO HD2 H 2.228 -2.875 3.765 1.00 . A A . 9 PRO HD2 1 1 19 4966 1 1 9 PRO HD3 H 1.793 -2.694 5.498 1.00 . A A . 9 PRO HD3 1 1 19 4967 1 1 9 PRO HG2 H 4.283 -1.862 4.023 1.00 . A A . 9 PRO HG2 1 1 19 4968 1 1 9 PRO HG3 H 4.119 -2.548 5.668 1.00 . A A . 9 PRO HG3 1 1 19 4969 1 1 9 PRO N N 1.641 -0.915 4.362 1.00 . A A . 9 PRO N 1 1 19 4970 1 1 9 PRO O O 3.633 0.326 2.622 1.00 . A A . 9 PRO O 1 1 19 4971 1 1 10 GLY C C 1.349 3.288 1.446 1.00 . A A . 10 GLY C 1 1 19 4972 1 1 10 GLY CA C 2.674 2.883 2.064 1.00 . A A . 10 GLY CA 1 1 19 4973 1 1 10 GLY H H 1.990 2.600 4.054 1.00 . A A . 10 GLY H 1 1 19 4974 1 1 10 GLY HA2 H 3.251 3.788 2.248 1.00 . A A . 10 GLY HA2 1 1 19 4975 1 1 10 GLY HA3 H 3.216 2.266 1.350 1.00 . A A . 10 GLY HA3 1 1 19 4976 1 1 10 GLY N N 2.518 2.159 3.315 1.00 . A A . 10 GLY N 1 1 19 4977 1 1 10 GLY O O 1.327 4.102 0.524 1.00 . A A . 10 GLY O 1 1 19 4978 1 1 11 VAL C C -1.393 2.684 0.141 1.00 . A A . 11 VAL C 1 1 19 4979 1 1 11 VAL CA C -1.107 3.094 1.581 1.00 . A A . 11 VAL CA 1 1 19 4980 1 1 11 VAL CB C -1.432 4.594 1.780 1.00 . A A . 11 VAL CB 1 1 19 4981 1 1 11 VAL CG1 C -2.905 4.873 1.481 1.00 . A A . 11 VAL CG1 1 1 19 4982 1 1 11 VAL CG2 C -1.124 5.026 3.214 1.00 . A A . 11 VAL CG2 1 1 19 4983 1 1 11 VAL H H 0.362 2.048 2.702 1.00 . A A . 11 VAL H 1 1 19 4984 1 1 11 VAL HA H -1.790 2.528 2.217 1.00 . A A . 11 VAL HA 1 1 19 4985 1 1 11 VAL HB H -0.822 5.190 1.102 1.00 . A A . 11 VAL HB 1 1 19 4986 1 1 11 VAL HG11 H -3.130 5.916 1.698 1.00 . A A . 11 VAL HG11 1 1 19 4987 1 1 11 VAL HG12 H -3.103 4.683 0.426 1.00 . A A . 11 VAL HG12 1 1 19 4988 1 1 11 VAL HG13 H -3.536 4.230 2.093 1.00 . A A . 11 VAL HG13 1 1 19 4989 1 1 11 VAL HG21 H -1.661 4.387 3.916 1.00 . A A . 11 VAL HG21 1 1 19 4990 1 1 11 VAL HG22 H -0.053 4.950 3.399 1.00 . A A . 11 VAL HG22 1 1 19 4991 1 1 11 VAL HG23 H -1.434 6.061 3.359 1.00 . A A . 11 VAL HG23 1 1 19 4992 1 1 11 VAL N N 0.257 2.749 1.980 1.00 . A A . 11 VAL N 1 1 19 4993 1 1 11 VAL O O -1.258 3.472 -0.793 1.00 . A A . 11 VAL O 1 1 19 4994 1 1 12 ARG C C -3.030 -0.385 -1.099 1.00 . A A . 12 ARG C 1 1 19 4995 1 1 12 ARG CA C -2.198 0.874 -1.315 1.00 . A A . 12 ARG CA 1 1 19 4996 1 1 12 ARG CB C -0.940 0.539 -2.121 1.00 . A A . 12 ARG CB 1 1 19 4997 1 1 12 ARG CD C -2.098 -0.208 -4.270 1.00 . A A . 12 ARG CD 1 1 19 4998 1 1 12 ARG CG C -1.041 0.680 -3.632 1.00 . A A . 12 ARG CG 1 1 19 4999 1 1 12 ARG CZ C -1.113 -1.181 -6.325 1.00 . A A . 12 ARG CZ 1 1 19 5000 1 1 12 ARG H H -1.836 0.827 0.789 1.00 . A A . 12 ARG H 1 1 19 5001 1 1 12 ARG HA H -2.783 1.619 -1.853 1.00 . A A . 12 ARG HA 1 1 19 5002 1 1 12 ARG HB2 H -0.149 1.213 -1.792 1.00 . A A . 12 ARG HB2 1 1 19 5003 1 1 12 ARG HB3 H -0.632 -0.477 -1.881 1.00 . A A . 12 ARG HB3 1 1 19 5004 1 1 12 ARG HD2 H -2.051 -1.198 -3.813 1.00 . A A . 12 ARG HD2 1 1 19 5005 1 1 12 ARG HD3 H -3.080 0.216 -4.062 1.00 . A A . 12 ARG HD3 1 1 19 5006 1 1 12 ARG HE H -2.493 0.272 -6.300 1.00 . A A . 12 ARG HE 1 1 19 5007 1 1 12 ARG HG2 H -1.261 1.720 -3.867 1.00 . A A . 12 ARG HG2 1 1 19 5008 1 1 12 ARG HG3 H -0.071 0.429 -4.060 1.00 . A A . 12 ARG HG3 1 1 19 5009 1 1 12 ARG HH11 H -0.360 -2.032 -4.663 1.00 . A A . 12 ARG HH11 1 1 19 5010 1 1 12 ARG HH12 H 0.299 -2.613 -6.183 1.00 . A A . 12 ARG HH12 1 1 19 5011 1 1 12 ARG HH21 H -1.684 -0.581 -8.158 1.00 . A A . 12 ARG HH21 1 1 19 5012 1 1 12 ARG HH22 H -0.447 -1.828 -8.114 1.00 . A A . 12 ARG HH22 1 1 19 5013 1 1 12 ARG N N -1.807 1.430 -0.022 1.00 . A A . 12 ARG N 1 1 19 5014 1 1 12 ARG NE N -1.926 -0.327 -5.718 1.00 . A A . 12 ARG NE 1 1 19 5015 1 1 12 ARG NH1 N -0.317 -2.003 -5.669 1.00 . A A . 12 ARG NH1 1 1 19 5016 1 1 12 ARG NH2 N -1.071 -1.191 -7.641 1.00 . A A . 12 ARG NH2 1 1 19 5017 1 1 12 ARG O O -2.648 -1.271 -0.336 1.00 . A A . 12 ARG O 1 1 19 5018 1 1 13 CYS C C -4.202 -2.879 -2.247 1.00 . A A . 13 CYS C 1 1 19 5019 1 1 13 CYS CA C -4.987 -1.686 -1.710 1.00 . A A . 13 CYS CA 1 1 19 5020 1 1 13 CYS CB C -6.276 -1.484 -2.509 1.00 . A A . 13 CYS CB 1 1 19 5021 1 1 13 CYS H H -4.477 0.286 -2.356 1.00 . A A . 13 CYS H 1 1 19 5022 1 1 13 CYS HA H -5.238 -1.876 -0.667 1.00 . A A . 13 CYS HA 1 1 19 5023 1 1 13 CYS HB2 H -6.704 -0.520 -2.234 1.00 . A A . 13 CYS HB2 1 1 19 5024 1 1 13 CYS HB3 H -6.033 -1.469 -3.571 1.00 . A A . 13 CYS HB3 1 1 19 5025 1 1 13 CYS N N -4.167 -0.481 -1.779 1.00 . A A . 13 CYS N 1 1 19 5026 1 1 13 CYS O O -3.815 -2.901 -3.416 1.00 . A A . 13 CYS O 1 1 19 5027 1 1 13 CYS SG S -7.559 -2.743 -2.216 1.00 . A A . 13 CYS SG 1 1 19 5028 1 1 14 LEU C C -4.007 -6.307 -1.495 1.00 . A A . 14 LEU C 1 1 19 5029 1 1 14 LEU CA C -3.182 -5.045 -1.735 1.00 . A A . 14 LEU CA 1 1 19 5030 1 1 14 LEU CB C -1.896 -5.102 -0.903 1.00 . A A . 14 LEU CB 1 1 19 5031 1 1 14 LEU CD1 C -0.209 -5.882 -2.604 1.00 . A A . 14 LEU CD1 1 1 19 5032 1 1 14 LEU CD2 C -0.508 -3.432 -2.230 1.00 . A A . 14 LEU CD2 1 1 19 5033 1 1 14 LEU CG C -0.552 -4.808 -1.579 1.00 . A A . 14 LEU CG 1 1 19 5034 1 1 14 LEU H H -4.247 -3.758 -0.421 1.00 . A A . 14 LEU H 1 1 19 5035 1 1 14 LEU HA H -2.930 -5.009 -2.795 1.00 . A A . 14 LEU HA 1 1 19 5036 1 1 14 LEU HB2 H -2.003 -4.403 -0.074 1.00 . A A . 14 LEU HB2 1 1 19 5037 1 1 14 LEU HB3 H -1.824 -6.100 -0.472 1.00 . A A . 14 LEU HB3 1 1 19 5038 1 1 14 LEU HD11 H -0.240 -6.862 -2.130 1.00 . A A . 14 LEU HD11 1 1 19 5039 1 1 14 LEU HD12 H -0.925 -5.856 -3.426 1.00 . A A . 14 LEU HD12 1 1 19 5040 1 1 14 LEU HD13 H 0.793 -5.707 -2.994 1.00 . A A . 14 LEU HD13 1 1 19 5041 1 1 14 LEU HD21 H -0.782 -2.677 -1.495 1.00 . A A . 14 LEU HD21 1 1 19 5042 1 1 14 LEU HD22 H 0.502 -3.233 -2.592 1.00 . A A . 14 LEU HD22 1 1 19 5043 1 1 14 LEU HD23 H -1.207 -3.395 -3.065 1.00 . A A . 14 LEU HD23 1 1 19 5044 1 1 14 LEU HG H 0.210 -4.829 -0.802 1.00 . A A . 14 LEU HG 1 1 19 5045 1 1 14 LEU N N -3.937 -3.849 -1.377 1.00 . A A . 14 LEU N 1 1 19 5046 1 1 14 LEU O O -4.088 -7.176 -2.361 1.00 . A A . 14 LEU O 1 1 19 5047 1 1 15 ILE C C -6.841 -6.947 0.420 1.00 . A A . 15 ILE C 1 1 19 5048 1 1 15 ILE CA C -5.481 -7.520 0.036 1.00 . A A . 15 ILE CA 1 1 19 5049 1 1 15 ILE CB C -4.925 -8.349 1.216 1.00 . A A . 15 ILE CB 1 1 19 5050 1 1 15 ILE CD1 C -2.787 -9.511 2.053 1.00 . A A . 15 ILE CD1 1 1 19 5051 1 1 15 ILE CG1 C -3.501 -8.825 0.904 1.00 . A A . 15 ILE CG1 1 1 19 5052 1 1 15 ILE CG2 C -5.853 -9.529 1.500 1.00 . A A . 15 ILE CG2 1 1 19 5053 1 1 15 ILE H H -4.470 -5.683 0.379 1.00 . A A . 15 ILE H 1 1 19 5054 1 1 15 ILE HA H -5.596 -8.168 -0.831 1.00 . A A . 15 ILE HA 1 1 19 5055 1 1 15 ILE HB H -4.888 -7.713 2.102 1.00 . A A . 15 ILE HB 1 1 19 5056 1 1 15 ILE HD11 H -3.267 -10.464 2.273 1.00 . A A . 15 ILE HD11 1 1 19 5057 1 1 15 ILE HD12 H -1.748 -9.688 1.775 1.00 . A A . 15 ILE HD12 1 1 19 5058 1 1 15 ILE HD13 H -2.818 -8.871 2.936 1.00 . A A . 15 ILE HD13 1 1 19 5059 1 1 15 ILE HG12 H -3.543 -9.506 0.054 1.00 . A A . 15 ILE HG12 1 1 19 5060 1 1 15 ILE HG13 H -2.898 -7.967 0.612 1.00 . A A . 15 ILE HG13 1 1 19 5061 1 1 15 ILE HG21 H -6.849 -9.159 1.740 1.00 . A A . 15 ILE HG21 1 1 19 5062 1 1 15 ILE HG22 H -5.910 -10.176 0.624 1.00 . A A . 15 ILE HG22 1 1 19 5063 1 1 15 ILE HG23 H -5.481 -10.102 2.350 1.00 . A A . 15 ILE HG23 1 1 19 5064 1 1 15 ILE N N -4.606 -6.404 -0.313 1.00 . A A . 15 ILE N 1 1 19 5065 1 1 15 ILE O O -6.936 -6.201 1.395 1.00 . A A . 15 ILE O 1 1 19 5066 1 1 16 TRP C C -9.428 -5.710 0.789 1.00 . A A . 16 TRP C 1 1 19 5067 1 1 16 TRP CA C -9.234 -6.834 -0.228 1.00 . A A . 16 TRP CA 1 1 19 5068 1 1 16 TRP CB C -10.179 -8.006 0.066 1.00 . A A . 16 TRP CB 1 1 19 5069 1 1 16 TRP CD1 C -9.299 -10.259 0.917 1.00 . A A . 16 TRP CD1 1 1 19 5070 1 1 16 TRP CD2 C -9.174 -10.034 -1.294 1.00 . A A . 16 TRP CD2 1 1 19 5071 1 1 16 TRP CE2 C -8.629 -11.289 -0.935 1.00 . A A . 16 TRP CE2 1 1 19 5072 1 1 16 TRP CE3 C -9.164 -9.662 -2.645 1.00 . A A . 16 TRP CE3 1 1 19 5073 1 1 16 TRP CG C -9.574 -9.374 -0.082 1.00 . A A . 16 TRP CG 1 1 19 5074 1 1 16 TRP CH2 C -8.090 -11.778 -3.198 1.00 . A A . 16 TRP CH2 1 1 19 5075 1 1 16 TRP CZ2 C -8.079 -12.161 -1.880 1.00 . A A . 16 TRP CZ2 1 1 19 5076 1 1 16 TRP CZ3 C -8.630 -10.538 -3.589 1.00 . A A . 16 TRP CZ3 1 1 19 5077 1 1 16 TRP H H -7.665 -7.918 -1.140 1.00 . A A . 16 TRP H 1 1 19 5078 1 1 16 TRP HA H -9.538 -6.427 -1.193 1.00 . A A . 16 TRP HA 1 1 19 5079 1 1 16 TRP HB2 H -10.560 -7.916 1.083 1.00 . A A . 16 TRP HB2 1 1 19 5080 1 1 16 TRP HB3 H -11.030 -7.934 -0.612 1.00 . A A . 16 TRP HB3 1 1 19 5081 1 1 16 TRP HD1 H -9.495 -10.071 1.963 1.00 . A A . 16 TRP HD1 1 1 19 5082 1 1 16 TRP HE1 H -8.452 -12.191 0.994 1.00 . A A . 16 TRP HE1 1 1 19 5083 1 1 16 TRP HE3 H -9.560 -8.704 -2.949 1.00 . A A . 16 TRP HE3 1 1 19 5084 1 1 16 TRP HH2 H -7.673 -12.436 -3.946 1.00 . A A . 16 TRP HH2 1 1 19 5085 1 1 16 TRP HZ2 H -7.653 -13.106 -1.580 1.00 . A A . 16 TRP HZ2 1 1 19 5086 1 1 16 TRP HZ3 H -8.621 -10.257 -4.633 1.00 . A A . 16 TRP HZ3 1 1 19 5087 1 1 16 TRP N N -7.853 -7.290 -0.372 1.00 . A A . 16 TRP N 1 1 19 5088 1 1 16 TRP NE1 N -8.738 -11.407 0.425 1.00 . A A . 16 TRP NE1 1 1 19 5089 1 1 16 TRP O O -9.835 -5.924 1.931 1.00 . A A . 16 TRP O 1 1 19 5090 1 1 17 CYS C C -10.628 -2.860 1.429 1.00 . A A . 17 CYS C 1 1 19 5091 1 1 17 CYS CA C -9.190 -3.328 1.230 1.00 . A A . 17 CYS CA 1 1 19 5092 1 1 17 CYS CB C -8.350 -2.193 0.644 1.00 . A A . 17 CYS CB 1 1 19 5093 1 1 17 CYS H H -8.784 -4.361 -0.586 1.00 . A A . 17 CYS H 1 1 19 5094 1 1 17 CYS HA H -8.777 -3.592 2.201 1.00 . A A . 17 CYS HA 1 1 19 5095 1 1 17 CYS HB2 H -8.428 -1.321 1.294 1.00 . A A . 17 CYS HB2 1 1 19 5096 1 1 17 CYS HB3 H -7.311 -2.515 0.614 1.00 . A A . 17 CYS HB3 1 1 19 5097 1 1 17 CYS N N -9.105 -4.495 0.361 1.00 . A A . 17 CYS N 1 1 19 5098 1 1 17 CYS O O -11.539 -3.216 0.684 1.00 . A A . 17 CYS O 1 1 19 5099 1 1 17 CYS SG S -8.871 -1.736 -1.040 1.00 . A A . 17 CYS SG 1 1 19 5100 1 1 18 ASP C C -13.047 -1.285 1.602 1.00 . A A . 18 ASP C 1 1 19 5101 1 1 18 ASP CA C -12.132 -1.441 2.800 1.00 . A A . 18 ASP CA 1 1 19 5102 1 1 18 ASP CB C -11.947 -0.089 3.504 1.00 . A A . 18 ASP CB 1 1 19 5103 1 1 18 ASP CG C -13.276 0.471 3.939 1.00 . A A . 18 ASP CG 1 1 19 5104 1 1 18 ASP H H -10.037 -1.779 3.046 1.00 . A A . 18 ASP H 1 1 19 5105 1 1 18 ASP HA H -12.659 -2.123 3.474 1.00 . A A . 18 ASP HA 1 1 19 5106 1 1 18 ASP HB2 H -11.306 -0.210 4.379 1.00 . A A . 18 ASP HB2 1 1 19 5107 1 1 18 ASP HB3 H -11.467 0.617 2.824 1.00 . A A . 18 ASP HB3 1 1 19 5108 1 1 18 ASP N N -10.823 -2.022 2.463 1.00 . A A . 18 ASP N 1 1 19 5109 1 1 18 ASP O O -14.249 -1.335 1.777 1.00 . A A . 18 ASP O 1 1 19 5110 1 1 18 ASP OD1 O -13.866 -0.073 4.849 1.00 . A A . 18 ASP OD1 1 1 19 5111 1 1 18 ASP OD2 O -13.700 1.457 3.373 1.00 . A A . 18 ASP OD2 1 1 20 5112 1 1 1 GLY C C 1.991 0.165 -2.695 1.00 . A A . 1 GLY C 1 1 20 5113 1 1 1 GLY CA C 1.778 -0.768 -1.517 1.00 . A A . 1 GLY CA 1 1 20 5114 1 1 1 GLY H1 H 1.483 1.041 -0.479 1.00 . A A . 1 GLY H1 1 1 20 5115 1 1 1 GLY HA2 H 2.691 -1.339 -1.338 1.00 . A A . 1 GLY HA2 1 1 20 5116 1 1 1 GLY HA3 H 0.951 -1.442 -1.740 1.00 . A A . 1 GLY HA3 1 1 20 5117 1 1 1 GLY N N 1.451 0.040 -0.354 1.00 . A A . 1 GLY N 1 1 20 5118 1 1 1 GLY O O 2.392 1.311 -2.500 1.00 . A A . 1 GLY O 1 1 20 5119 1 1 2 SER C C 0.856 1.212 -5.747 1.00 . A A . 2 SER C 1 1 20 5120 1 1 2 SER CA C 2.028 0.461 -5.119 1.00 . A A . 2 SER CA 1 1 20 5121 1 1 2 SER CB C 2.572 -0.496 -6.180 1.00 . A A . 2 SER CB 1 1 20 5122 1 1 2 SER H H 1.383 -1.246 -4.023 1.00 . A A . 2 SER H 1 1 20 5123 1 1 2 SER HA H 2.805 1.188 -4.888 1.00 . A A . 2 SER HA 1 1 20 5124 1 1 2 SER HB2 H 1.817 -1.250 -6.403 1.00 . A A . 2 SER HB2 1 1 20 5125 1 1 2 SER HB3 H 2.782 0.071 -7.085 1.00 . A A . 2 SER HB3 1 1 20 5126 1 1 2 SER HG H 4.133 -1.631 -6.457 1.00 . A A . 2 SER HG 1 1 20 5127 1 1 2 SER N N 1.740 -0.308 -3.910 1.00 . A A . 2 SER N 1 1 20 5128 1 1 2 SER O O 1.058 2.130 -6.542 1.00 . A A . 2 SER O 1 1 20 5129 1 1 2 SER OG O 3.753 -1.135 -5.728 1.00 . A A . 2 SER OG 1 1 20 5130 1 1 3 ARG C C -2.175 2.489 -5.459 1.00 . A A . 3 ARG C 1 1 20 5131 1 1 3 ARG CA C -1.561 1.266 -6.139 1.00 . A A . 3 ARG CA 1 1 20 5132 1 1 3 ARG CB C -2.571 0.121 -6.279 1.00 . A A . 3 ARG CB 1 1 20 5133 1 1 3 ARG CD C -1.136 -1.147 -7.942 1.00 . A A . 3 ARG CD 1 1 20 5134 1 1 3 ARG CG C -1.975 -1.228 -6.673 1.00 . A A . 3 ARG CG 1 1 20 5135 1 1 3 ARG CZ C 0.188 -2.676 -9.371 1.00 . A A . 3 ARG CZ 1 1 20 5136 1 1 3 ARG H H -0.471 0.030 -4.786 1.00 . A A . 3 ARG H 1 1 20 5137 1 1 3 ARG HA H -1.266 1.588 -7.138 1.00 . A A . 3 ARG HA 1 1 20 5138 1 1 3 ARG HB2 H -3.087 -0.004 -5.327 1.00 . A A . 3 ARG HB2 1 1 20 5139 1 1 3 ARG HB3 H -3.310 0.401 -7.028 1.00 . A A . 3 ARG HB3 1 1 20 5140 1 1 3 ARG HD2 H -1.732 -0.678 -8.724 1.00 . A A . 3 ARG HD2 1 1 20 5141 1 1 3 ARG HD3 H -0.266 -0.520 -7.747 1.00 . A A . 3 ARG HD3 1 1 20 5142 1 1 3 ARG HE H -1.053 -3.267 -7.911 1.00 . A A . 3 ARG HE 1 1 20 5143 1 1 3 ARG HG2 H -1.349 -1.597 -5.861 1.00 . A A . 3 ARG HG2 1 1 20 5144 1 1 3 ARG HG3 H -2.788 -1.938 -6.825 1.00 . A A . 3 ARG HG3 1 1 20 5145 1 1 3 ARG HH11 H 0.500 -0.741 -9.841 1.00 . A A . 3 ARG HH11 1 1 20 5146 1 1 3 ARG HH12 H 1.398 -1.913 -10.790 1.00 . A A . 3 ARG HH12 1 1 20 5147 1 1 3 ARG HH21 H 0.106 -4.674 -9.158 1.00 . A A . 3 ARG HH21 1 1 20 5148 1 1 3 ARG HH22 H 1.181 -4.085 -10.415 1.00 . A A . 3 ARG HH22 1 1 20 5149 1 1 3 ARG N N -0.366 0.777 -5.455 1.00 . A A . 3 ARG N 1 1 20 5150 1 1 3 ARG NE N -0.679 -2.461 -8.389 1.00 . A A . 3 ARG NE 1 1 20 5151 1 1 3 ARG NH1 N 0.744 -1.695 -10.054 1.00 . A A . 3 ARG NH1 1 1 20 5152 1 1 3 ARG NH2 N 0.522 -3.913 -9.671 1.00 . A A . 3 ARG NH2 1 1 20 5153 1 1 3 ARG O O -1.467 3.242 -4.795 1.00 . A A . 3 ARG O 1 1 20 5154 1 1 4 GLY C C -4.249 3.649 -3.494 1.00 . A A . 4 GLY C 1 1 20 5155 1 1 4 GLY CA C -4.137 3.834 -4.995 1.00 . A A . 4 GLY CA 1 1 20 5156 1 1 4 GLY H H -4.024 2.082 -6.199 1.00 . A A . 4 GLY H 1 1 20 5157 1 1 4 GLY HA2 H -3.567 4.741 -5.191 1.00 . A A . 4 GLY HA2 1 1 20 5158 1 1 4 GLY HA3 H -5.138 3.948 -5.410 1.00 . A A . 4 GLY HA3 1 1 20 5159 1 1 4 GLY N N -3.473 2.712 -5.635 1.00 . A A . 4 GLY N 1 1 20 5160 1 1 4 GLY O O -3.905 2.589 -2.977 1.00 . A A . 4 GLY O 1 1 20 5161 1 1 5 TRP C C -5.541 3.440 -0.753 1.00 . A A . 5 TRP C 1 1 20 5162 1 1 5 TRP CA C -4.795 4.642 -1.326 1.00 . A A . 5 TRP CA 1 1 20 5163 1 1 5 TRP CB C -5.487 5.909 -0.818 1.00 . A A . 5 TRP CB 1 1 20 5164 1 1 5 TRP CD1 C -5.808 7.930 -2.363 1.00 . A A . 5 TRP CD1 1 1 20 5165 1 1 5 TRP CD2 C -3.796 7.834 -1.418 1.00 . A A . 5 TRP CD2 1 1 20 5166 1 1 5 TRP CE2 C -3.861 8.995 -2.223 1.00 . A A . 5 TRP CE2 1 1 20 5167 1 1 5 TRP CE3 C -2.608 7.563 -0.726 1.00 . A A . 5 TRP CE3 1 1 20 5168 1 1 5 TRP CG C -5.063 7.167 -1.515 1.00 . A A . 5 TRP CG 1 1 20 5169 1 1 5 TRP CH2 C -1.645 9.613 -1.626 1.00 . A A . 5 TRP CH2 1 1 20 5170 1 1 5 TRP CZ2 C -2.788 9.886 -2.335 1.00 . A A . 5 TRP CZ2 1 1 20 5171 1 1 5 TRP CZ3 C -1.546 8.464 -0.819 1.00 . A A . 5 TRP CZ3 1 1 20 5172 1 1 5 TRP H H -5.036 5.508 -3.247 1.00 . A A . 5 TRP H 1 1 20 5173 1 1 5 TRP HA H -3.776 4.627 -0.941 1.00 . A A . 5 TRP HA 1 1 20 5174 1 1 5 TRP HB2 H -6.561 5.785 -0.947 1.00 . A A . 5 TRP HB2 1 1 20 5175 1 1 5 TRP HB3 H -5.284 6.014 0.248 1.00 . A A . 5 TRP HB3 1 1 20 5176 1 1 5 TRP HD1 H -6.826 7.703 -2.649 1.00 . A A . 5 TRP HD1 1 1 20 5177 1 1 5 TRP HE1 H -5.471 9.724 -3.422 1.00 . A A . 5 TRP HE1 1 1 20 5178 1 1 5 TRP HE3 H -2.521 6.664 -0.136 1.00 . A A . 5 TRP HE3 1 1 20 5179 1 1 5 TRP HH2 H -0.805 10.291 -1.689 1.00 . A A . 5 TRP HH2 1 1 20 5180 1 1 5 TRP HZ2 H -2.860 10.766 -2.955 1.00 . A A . 5 TRP HZ2 1 1 20 5181 1 1 5 TRP HZ3 H -0.637 8.274 -0.269 1.00 . A A . 5 TRP HZ3 1 1 20 5182 1 1 5 TRP N N -4.727 4.666 -2.784 1.00 . A A . 5 TRP N 1 1 20 5183 1 1 5 TRP NE1 N -5.105 9.023 -2.795 1.00 . A A . 5 TRP NE1 1 1 20 5184 1 1 5 TRP O O -6.513 2.966 -1.341 1.00 . A A . 5 TRP O 1 1 20 5185 1 1 6 GLY C C -5.062 1.157 2.165 1.00 . A A . 6 GLY C 1 1 20 5186 1 1 6 GLY CA C -5.831 1.900 1.089 1.00 . A A . 6 GLY CA 1 1 20 5187 1 1 6 GLY H H -4.260 3.317 0.830 1.00 . A A . 6 GLY H 1 1 20 5188 1 1 6 GLY HA2 H -6.721 2.335 1.545 1.00 . A A . 6 GLY HA2 1 1 20 5189 1 1 6 GLY HA3 H -6.160 1.176 0.346 1.00 . A A . 6 GLY HA3 1 1 20 5190 1 1 6 GLY N N -5.103 2.954 0.405 1.00 . A A . 6 GLY N 1 1 20 5191 1 1 6 GLY O O -4.493 1.757 3.076 1.00 . A A . 6 GLY O 1 1 20 5192 1 1 7 PHE C C -2.917 -1.110 2.650 1.00 . A A . 7 PHE C 1 1 20 5193 1 1 7 PHE CA C -4.401 -1.052 3.008 1.00 . A A . 7 PHE CA 1 1 20 5194 1 1 7 PHE CB C -5.064 -2.434 2.962 1.00 . A A . 7 PHE CB 1 1 20 5195 1 1 7 PHE CD1 C -7.111 -1.544 4.172 1.00 . A A . 7 PHE CD1 1 1 20 5196 1 1 7 PHE CD2 C -6.469 -3.828 4.496 1.00 . A A . 7 PHE CD2 1 1 20 5197 1 1 7 PHE CE1 C -8.194 -1.721 5.028 1.00 . A A . 7 PHE CE1 1 1 20 5198 1 1 7 PHE CE2 C -7.556 -4.018 5.346 1.00 . A A . 7 PHE CE2 1 1 20 5199 1 1 7 PHE CG C -6.235 -2.592 3.897 1.00 . A A . 7 PHE CG 1 1 20 5200 1 1 7 PHE CZ C -8.420 -2.962 5.615 1.00 . A A . 7 PHE CZ 1 1 20 5201 1 1 7 PHE H H -5.553 -0.595 1.281 1.00 . A A . 7 PHE H 1 1 20 5202 1 1 7 PHE HA H -4.491 -0.645 4.016 1.00 . A A . 7 PHE HA 1 1 20 5203 1 1 7 PHE HB2 H -5.395 -2.630 1.943 1.00 . A A . 7 PHE HB2 1 1 20 5204 1 1 7 PHE HB3 H -4.332 -3.197 3.223 1.00 . A A . 7 PHE HB3 1 1 20 5205 1 1 7 PHE HD1 H -6.955 -0.574 3.726 1.00 . A A . 7 PHE HD1 1 1 20 5206 1 1 7 PHE HD2 H -5.806 -4.656 4.294 1.00 . A A . 7 PHE HD2 1 1 20 5207 1 1 7 PHE HE1 H -8.853 -0.894 5.245 1.00 . A A . 7 PHE HE1 1 1 20 5208 1 1 7 PHE HE2 H -7.730 -4.985 5.792 1.00 . A A . 7 PHE HE2 1 1 20 5209 1 1 7 PHE HZ H -9.260 -3.104 6.279 1.00 . A A . 7 PHE HZ 1 1 20 5210 1 1 7 PHE N N -5.074 -0.168 2.059 1.00 . A A . 7 PHE N 1 1 20 5211 1 1 7 PHE O O -2.455 -0.330 1.819 1.00 . A A . 7 PHE O 1 1 20 5212 1 1 8 GLU C C 0.002 -1.063 3.853 1.00 . A A . 8 GLU C 1 1 20 5213 1 1 8 GLU CA C -0.720 -2.187 3.119 1.00 . A A . 8 GLU CA 1 1 20 5214 1 1 8 GLU CB C -0.342 -2.374 1.623 1.00 . A A . 8 GLU CB 1 1 20 5215 1 1 8 GLU CD C 1.028 -0.371 0.858 1.00 . A A . 8 GLU CD 1 1 20 5216 1 1 8 GLU CG C 1.047 -1.852 1.194 1.00 . A A . 8 GLU CG 1 1 20 5217 1 1 8 GLU H H -2.632 -2.691 3.898 1.00 . A A . 8 GLU H 1 1 20 5218 1 1 8 GLU HA H -0.439 -3.101 3.646 1.00 . A A . 8 GLU HA 1 1 20 5219 1 1 8 GLU HB2 H -0.388 -3.443 1.403 1.00 . A A . 8 GLU HB2 1 1 20 5220 1 1 8 GLU HB3 H -1.093 -1.904 0.991 1.00 . A A . 8 GLU HB3 1 1 20 5221 1 1 8 GLU HG2 H 1.780 -2.023 1.980 1.00 . A A . 8 GLU HG2 1 1 20 5222 1 1 8 GLU HG3 H 1.377 -2.427 0.329 1.00 . A A . 8 GLU HG3 1 1 20 5223 1 1 8 GLU N N -2.174 -2.048 3.273 1.00 . A A . 8 GLU N 1 1 20 5224 1 1 8 GLU O O -0.494 0.037 3.997 1.00 . A A . 8 GLU O 1 1 20 5225 1 1 8 GLU OE1 O 0.667 0.466 1.651 1.00 . A A . 8 GLU OE1 1 1 20 5226 1 1 9 PRO C C 2.480 0.711 3.952 1.00 . A A . 9 PRO C 1 1 20 5227 1 1 9 PRO CA C 2.006 -0.267 5.024 1.00 . A A . 9 PRO CA 1 1 20 5228 1 1 9 PRO CB C 3.164 -1.028 5.674 1.00 . A A . 9 PRO CB 1 1 20 5229 1 1 9 PRO CD C 1.831 -2.657 4.578 1.00 . A A . 9 PRO CD 1 1 20 5230 1 1 9 PRO CG C 3.259 -2.297 4.887 1.00 . A A . 9 PRO CG 1 1 20 5231 1 1 9 PRO HA H 1.433 0.271 5.779 1.00 . A A . 9 PRO HA 1 1 20 5232 1 1 9 PRO HB2 H 4.090 -0.457 5.605 1.00 . A A . 9 PRO HB2 1 1 20 5233 1 1 9 PRO HB3 H 2.927 -1.253 6.714 1.00 . A A . 9 PRO HB3 1 1 20 5234 1 1 9 PRO HD2 H 1.779 -3.237 3.656 1.00 . A A . 9 PRO HD2 1 1 20 5235 1 1 9 PRO HD3 H 1.385 -3.206 5.408 1.00 . A A . 9 PRO HD3 1 1 20 5236 1 1 9 PRO HG2 H 3.811 -2.123 3.962 1.00 . A A . 9 PRO HG2 1 1 20 5237 1 1 9 PRO HG3 H 3.736 -3.081 5.476 1.00 . A A . 9 PRO HG3 1 1 20 5238 1 1 9 PRO N N 1.193 -1.336 4.438 1.00 . A A . 9 PRO N 1 1 20 5239 1 1 9 PRO O O 3.128 0.325 2.978 1.00 . A A . 9 PRO O 1 1 20 5240 1 1 10 GLY C C 0.888 3.539 2.674 1.00 . A A . 10 GLY C 1 1 20 5241 1 1 10 GLY CA C 2.236 2.974 3.085 1.00 . A A . 10 GLY CA 1 1 20 5242 1 1 10 GLY H H 1.636 2.241 4.982 1.00 . A A . 10 GLY H 1 1 20 5243 1 1 10 GLY HA2 H 2.855 3.793 3.448 1.00 . A A . 10 GLY HA2 1 1 20 5244 1 1 10 GLY HA3 H 2.711 2.533 2.210 1.00 . A A . 10 GLY HA3 1 1 20 5245 1 1 10 GLY N N 2.106 1.973 4.130 1.00 . A A . 10 GLY N 1 1 20 5246 1 1 10 GLY O O 0.825 4.565 1.998 1.00 . A A . 10 GLY O 1 1 20 5247 1 1 11 VAL C C -1.866 3.328 1.372 1.00 . A A . 11 VAL C 1 1 20 5248 1 1 11 VAL CA C -1.560 3.312 2.867 1.00 . A A . 11 VAL CA 1 1 20 5249 1 1 11 VAL CB C -1.891 4.686 3.503 1.00 . A A . 11 VAL CB 1 1 20 5250 1 1 11 VAL CG1 C -3.402 4.875 3.640 1.00 . A A . 11 VAL CG1 1 1 20 5251 1 1 11 VAL CG2 C -1.257 4.822 4.889 1.00 . A A . 11 VAL CG2 1 1 20 5252 1 1 11 VAL H H -0.046 2.014 3.608 1.00 . A A . 11 VAL H 1 1 20 5253 1 1 11 VAL HA H -2.220 2.571 3.317 1.00 . A A . 11 VAL HA 1 1 20 5254 1 1 11 VAL HB H -1.497 5.477 2.866 1.00 . A A . 11 VAL HB 1 1 20 5255 1 1 11 VAL HG11 H -3.816 4.093 4.278 1.00 . A A . 11 VAL HG11 1 1 20 5256 1 1 11 VAL HG12 H -3.609 5.848 4.084 1.00 . A A . 11 VAL HG12 1 1 20 5257 1 1 11 VAL HG13 H -3.875 4.828 2.660 1.00 . A A . 11 VAL HG13 1 1 20 5258 1 1 11 VAL HG21 H -0.172 4.873 4.796 1.00 . A A . 11 VAL HG21 1 1 20 5259 1 1 11 VAL HG22 H -1.609 5.737 5.365 1.00 . A A . 11 VAL HG22 1 1 20 5260 1 1 11 VAL HG23 H -1.531 3.965 5.505 1.00 . A A . 11 VAL HG23 1 1 20 5261 1 1 11 VAL N N -0.183 2.882 3.106 1.00 . A A . 11 VAL N 1 1 20 5262 1 1 11 VAL O O -2.485 4.253 0.847 1.00 . A A . 11 VAL O 1 1 20 5263 1 1 12 ARG C C -2.154 0.629 -0.979 1.00 . A A . 12 ARG C 1 1 20 5264 1 1 12 ARG CA C -1.726 2.072 -0.733 1.00 . A A . 12 ARG CA 1 1 20 5265 1 1 12 ARG CB C -0.507 2.407 -1.595 1.00 . A A . 12 ARG CB 1 1 20 5266 1 1 12 ARG CD C 0.132 4.807 -1.108 1.00 . A A . 12 ARG CD 1 1 20 5267 1 1 12 ARG CG C -0.446 3.833 -2.118 1.00 . A A . 12 ARG CG 1 1 20 5268 1 1 12 ARG CZ C 1.631 6.302 -2.401 1.00 . A A . 12 ARG CZ 1 1 20 5269 1 1 12 ARG H H -0.955 1.541 1.188 1.00 . A A . 12 ARG H 1 1 20 5270 1 1 12 ARG HA H -2.538 2.731 -1.027 1.00 . A A . 12 ARG HA 1 1 20 5271 1 1 12 ARG HB2 H 0.396 2.217 -1.017 1.00 . A A . 12 ARG HB2 1 1 20 5272 1 1 12 ARG HB3 H -0.508 1.738 -2.457 1.00 . A A . 12 ARG HB3 1 1 20 5273 1 1 12 ARG HD2 H -0.610 4.996 -0.331 1.00 . A A . 12 ARG HD2 1 1 20 5274 1 1 12 ARG HD3 H 1.007 4.357 -0.639 1.00 . A A . 12 ARG HD3 1 1 20 5275 1 1 12 ARG HE H -0.168 6.824 -1.684 1.00 . A A . 12 ARG HE 1 1 20 5276 1 1 12 ARG HG2 H 0.192 3.839 -3.003 1.00 . A A . 12 ARG HG2 1 1 20 5277 1 1 12 ARG HG3 H -1.443 4.162 -2.409 1.00 . A A . 12 ARG HG3 1 1 20 5278 1 1 12 ARG HH11 H 2.442 4.475 -2.161 1.00 . A A . 12 ARG HH11 1 1 20 5279 1 1 12 ARG HH12 H 3.416 5.630 -3.057 1.00 . A A . 12 ARG HH12 1 1 20 5280 1 1 12 ARG HH21 H 1.103 8.192 -2.831 1.00 . A A . 12 ARG HH21 1 1 20 5281 1 1 12 ARG HH22 H 2.666 7.675 -3.451 1.00 . A A . 12 ARG HH22 1 1 20 5282 1 1 12 ARG N N -1.450 2.268 0.689 1.00 . A A . 12 ARG N 1 1 20 5283 1 1 12 ARG NE N 0.499 6.070 -1.749 1.00 . A A . 12 ARG NE 1 1 20 5284 1 1 12 ARG NH1 N 2.577 5.395 -2.549 1.00 . A A . 12 ARG NH1 1 1 20 5285 1 1 12 ARG NH2 N 1.819 7.490 -2.938 1.00 . A A . 12 ARG NH2 1 1 20 5286 1 1 12 ARG O O -1.369 -0.305 -0.816 1.00 . A A . 12 ARG O 1 1 20 5287 1 1 13 CYS C C -3.242 -1.846 -2.314 1.00 . A A . 13 CYS C 1 1 20 5288 1 1 13 CYS CA C -4.024 -0.870 -1.441 1.00 . A A . 13 CYS CA 1 1 20 5289 1 1 13 CYS CB C -5.452 -0.749 -1.980 1.00 . A A . 13 CYS CB 1 1 20 5290 1 1 13 CYS H H -3.944 1.251 -1.679 1.00 . A A . 13 CYS H 1 1 20 5291 1 1 13 CYS HA H -4.058 -1.275 -0.431 1.00 . A A . 13 CYS HA 1 1 20 5292 1 1 13 CYS HB2 H -5.993 -0.006 -1.396 1.00 . A A . 13 CYS HB2 1 1 20 5293 1 1 13 CYS HB3 H -5.406 -0.405 -3.012 1.00 . A A . 13 CYS HB3 1 1 20 5294 1 1 13 CYS N N -3.406 0.449 -1.386 1.00 . A A . 13 CYS N 1 1 20 5295 1 1 13 CYS O O -2.933 -1.561 -3.471 1.00 . A A . 13 CYS O 1 1 20 5296 1 1 13 CYS SG S -6.377 -2.318 -1.934 1.00 . A A . 13 CYS SG 1 1 20 5297 1 1 14 LEU C C -3.064 -5.383 -2.376 1.00 . A A . 14 LEU C 1 1 20 5298 1 1 14 LEU CA C -2.269 -4.084 -2.475 1.00 . A A . 14 LEU CA 1 1 20 5299 1 1 14 LEU CB C -0.859 -4.259 -1.903 1.00 . A A . 14 LEU CB 1 1 20 5300 1 1 14 LEU CD1 C 0.120 -6.087 -3.362 1.00 . A A . 14 LEU CD1 1 1 20 5301 1 1 14 LEU CD2 C 0.437 -3.688 -3.995 1.00 . A A . 14 LEU CD2 1 1 20 5302 1 1 14 LEU CG C 0.284 -4.667 -2.835 1.00 . A A . 14 LEU CG 1 1 20 5303 1 1 14 LEU H H -3.173 -3.171 -0.781 1.00 . A A . 14 LEU H 1 1 20 5304 1 1 14 LEU HA H -2.205 -3.809 -3.528 1.00 . A A . 14 LEU HA 1 1 20 5305 1 1 14 LEU HB2 H -0.576 -3.308 -1.450 1.00 . A A . 14 LEU HB2 1 1 20 5306 1 1 14 LEU HB3 H -0.908 -4.989 -1.096 1.00 . A A . 14 LEU HB3 1 1 20 5307 1 1 14 LEU HD11 H 0.026 -6.778 -2.526 1.00 . A A . 14 LEU HD11 1 1 20 5308 1 1 14 LEU HD12 H -0.770 -6.152 -3.988 1.00 . A A . 14 LEU HD12 1 1 20 5309 1 1 14 LEU HD13 H 0.995 -6.358 -3.952 1.00 . A A . 14 LEU HD13 1 1 20 5310 1 1 14 LEU HD21 H 0.350 -2.668 -3.625 1.00 . A A . 14 LEU HD21 1 1 20 5311 1 1 14 LEU HD22 H 1.414 -3.826 -4.458 1.00 . A A . 14 LEU HD22 1 1 20 5312 1 1 14 LEU HD23 H -0.340 -3.868 -4.738 1.00 . A A . 14 LEU HD23 1 1 20 5313 1 1 14 LEU HG H 1.199 -4.630 -2.246 1.00 . A A . 14 LEU HG 1 1 20 5314 1 1 14 LEU N N -2.935 -3.009 -1.749 1.00 . A A . 14 LEU N 1 1 20 5315 1 1 14 LEU O O -3.265 -6.071 -3.375 1.00 . A A . 14 LEU O 1 1 20 5316 1 1 15 ILE C C -5.626 -6.515 -0.243 1.00 . A A . 15 ILE C 1 1 20 5317 1 1 15 ILE CA C -4.317 -6.904 -0.924 1.00 . A A . 15 ILE CA 1 1 20 5318 1 1 15 ILE CB C -3.560 -7.926 -0.043 1.00 . A A . 15 ILE CB 1 1 20 5319 1 1 15 ILE CD1 C -1.301 -9.146 0.163 1.00 . A A . 15 ILE CD1 1 1 20 5320 1 1 15 ILE CG1 C -2.201 -8.255 -0.672 1.00 . A A . 15 ILE CG1 1 1 20 5321 1 1 15 ILE CG2 C -4.404 -9.186 0.133 1.00 . A A . 15 ILE CG2 1 1 20 5322 1 1 15 ILE H H -3.309 -5.114 -0.382 1.00 . A A . 15 ILE H 1 1 20 5323 1 1 15 ILE HA H -4.546 -7.374 -1.880 1.00 . A A . 15 ILE HA 1 1 20 5324 1 1 15 ILE HB H -3.389 -7.481 0.938 1.00 . A A . 15 ILE HB 1 1 20 5325 1 1 15 ILE HD11 H -1.719 -10.152 0.216 1.00 . A A . 15 ILE HD11 1 1 20 5326 1 1 15 ILE HD12 H -0.314 -9.193 -0.296 1.00 . A A . 15 ILE HD12 1 1 20 5327 1 1 15 ILE HD13 H -1.209 -8.735 1.168 1.00 . A A . 15 ILE HD13 1 1 20 5328 1 1 15 ILE HG12 H -2.372 -8.728 -1.637 1.00 . A A . 15 ILE HG12 1 1 20 5329 1 1 15 ILE HG13 H -1.659 -7.326 -0.849 1.00 . A A . 15 ILE HG13 1 1 20 5330 1 1 15 ILE HG21 H -4.613 -9.635 -0.840 1.00 . A A . 15 ILE HG21 1 1 20 5331 1 1 15 ILE HG22 H -3.879 -9.906 0.760 1.00 . A A . 15 ILE HG22 1 1 20 5332 1 1 15 ILE HG23 H -5.346 -8.927 0.618 1.00 . A A . 15 ILE HG23 1 1 20 5333 1 1 15 ILE N N -3.520 -5.706 -1.170 1.00 . A A . 15 ILE N 1 1 20 5334 1 1 15 ILE O O -5.614 -5.906 0.827 1.00 . A A . 15 ILE O 1 1 20 5335 1 1 16 TRP C C -8.277 -5.557 0.640 1.00 . A A . 16 TRP C 1 1 20 5336 1 1 16 TRP CA C -8.098 -6.636 -0.427 1.00 . A A . 16 TRP CA 1 1 20 5337 1 1 16 TRP CB C -8.729 -7.946 0.059 1.00 . A A . 16 TRP CB 1 1 20 5338 1 1 16 TRP CD1 C -7.659 -10.268 -0.076 1.00 . A A . 16 TRP CD1 1 1 20 5339 1 1 16 TRP CD2 C -8.310 -9.481 -2.053 1.00 . A A . 16 TRP CD2 1 1 20 5340 1 1 16 TRP CE2 C -7.673 -10.729 -2.248 1.00 . A A . 16 TRP CE2 1 1 20 5341 1 1 16 TRP CE3 C -8.785 -8.790 -3.176 1.00 . A A . 16 TRP CE3 1 1 20 5342 1 1 16 TRP CG C -8.250 -9.183 -0.649 1.00 . A A . 16 TRP CG 1 1 20 5343 1 1 16 TRP CH2 C -7.961 -10.586 -4.603 1.00 . A A . 16 TRP CH2 1 1 20 5344 1 1 16 TRP CZ2 C -7.486 -11.281 -3.520 1.00 . A A . 16 TRP CZ2 1 1 20 5345 1 1 16 TRP CZ3 C -8.613 -9.349 -4.443 1.00 . A A . 16 TRP CZ3 1 1 20 5346 1 1 16 TRP H H -6.633 -7.350 -1.773 1.00 . A A . 16 TRP H 1 1 20 5347 1 1 16 TRP HA H -8.676 -6.309 -1.292 1.00 . A A . 16 TRP HA 1 1 20 5348 1 1 16 TRP HB2 H -8.511 -8.068 1.119 1.00 . A A . 16 TRP HB2 1 1 20 5349 1 1 16 TRP HB3 H -9.810 -7.871 -0.057 1.00 . A A . 16 TRP HB3 1 1 20 5350 1 1 16 TRP HD1 H -7.481 -10.371 0.985 1.00 . A A . 16 TRP HD1 1 1 20 5351 1 1 16 TRP HE1 H -6.844 -12.073 -0.809 1.00 . A A . 16 TRP HE1 1 1 20 5352 1 1 16 TRP HE3 H -9.271 -7.832 -3.063 1.00 . A A . 16 TRP HE3 1 1 20 5353 1 1 16 TRP HH2 H -7.830 -10.993 -5.596 1.00 . A A . 16 TRP HH2 1 1 20 5354 1 1 16 TRP HZ2 H -6.973 -12.223 -3.644 1.00 . A A . 16 TRP HZ2 1 1 20 5355 1 1 16 TRP HZ3 H -8.977 -8.821 -5.312 1.00 . A A . 16 TRP HZ3 1 1 20 5356 1 1 16 TRP N N -6.731 -6.868 -0.891 1.00 . A A . 16 TRP N 1 1 20 5357 1 1 16 TRP NE1 N -7.306 -11.199 -1.016 1.00 . A A . 16 TRP NE1 1 1 20 5358 1 1 16 TRP O O -8.420 -5.843 1.828 1.00 . A A . 16 TRP O 1 1 20 5359 1 1 17 CYS C C -10.083 -3.073 1.390 1.00 . A A . 17 CYS C 1 1 20 5360 1 1 17 CYS CA C -8.591 -3.190 1.101 1.00 . A A . 17 CYS CA 1 1 20 5361 1 1 17 CYS CB C -8.094 -1.870 0.505 1.00 . A A . 17 CYS CB 1 1 20 5362 1 1 17 CYS H H -8.120 -4.096 -0.767 1.00 . A A . 17 CYS H 1 1 20 5363 1 1 17 CYS HA H -8.073 -3.364 2.043 1.00 . A A . 17 CYS HA 1 1 20 5364 1 1 17 CYS HB2 H -8.667 -1.054 0.946 1.00 . A A . 17 CYS HB2 1 1 20 5365 1 1 17 CYS HB3 H -7.049 -1.741 0.780 1.00 . A A . 17 CYS HB3 1 1 20 5366 1 1 17 CYS N N -8.294 -4.302 0.205 1.00 . A A . 17 CYS N 1 1 20 5367 1 1 17 CYS O O -10.938 -3.555 0.646 1.00 . A A . 17 CYS O 1 1 20 5368 1 1 17 CYS SG S -8.225 -1.757 -1.309 1.00 . A A . 17 CYS SG 1 1 20 5369 1 1 18 ASP C C -12.430 -1.192 1.712 1.00 . A A . 18 ASP C 1 1 20 5370 1 1 18 ASP CA C -11.801 -2.034 2.806 1.00 . A A . 18 ASP CA 1 1 20 5371 1 1 18 ASP CB C -11.909 -1.308 4.156 1.00 . A A . 18 ASP CB 1 1 20 5372 1 1 18 ASP CG C -13.353 -1.028 4.487 1.00 . A A . 18 ASP CG 1 1 20 5373 1 1 18 ASP H H -9.686 -2.072 3.123 1.00 . A A . 18 ASP H 1 1 20 5374 1 1 18 ASP HA H -12.389 -2.953 2.850 1.00 . A A . 18 ASP HA 1 1 20 5375 1 1 18 ASP HB2 H -11.469 -1.921 4.946 1.00 . A A . 18 ASP HB2 1 1 20 5376 1 1 18 ASP HB3 H -11.363 -0.365 4.112 1.00 . A A . 18 ASP HB3 1 1 20 5377 1 1 18 ASP N N -10.411 -2.385 2.497 1.00 . A A . 18 ASP N 1 1 20 5378 1 1 18 ASP O O -11.901 -0.140 1.403 1.00 . A A . 18 ASP O 1 1 20 5379 1 1 18 ASP OD1 O -13.612 -0.475 5.536 1.00 . A A . 18 ASP OD1 1 1 20 5380 1 1 18 ASP OD2 O -14.207 -1.376 3.698 1.00 . A A . 18 ASP OD2 1 1 stop_ save_
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