NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
570718 | 2m7d | 19183 | cing | 4-filtered-FRED | STAR | entry | full | 252 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2m7d # This FRED archive file contains, for PDB entry <2m7d>: # # - 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_2m7d _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2m7d _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2129.27 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 $Trp_Cage_mini_protein A . 1 1 stop_ save_ save_Trp_Cage_mini_protein _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Trp Cage mini protein" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code DAYAQWLADXGWASXRPPPS _Entity.Number_of_monomers 20 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 ASP . 1 1 2 ALA . 1 1 3 TYR . 1 1 4 ALA . 1 1 5 GLN . 1 1 6 TRP . 1 1 7 LEU . 1 1 8 ALA . 1 1 9 ASP . 1 1 10 DAL $DAL 1 1 11 GLY . 1 1 12 TRP . 1 1 13 ALA . 1 1 14 SER . 1 1 15 DAL $DAL 1 1 16 ARG . 1 1 17 PRO . 1 1 18 PRO . 1 1 19 PRO . 1 1 20 SER . 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 ASP 1 1 1 1 ALA 2 2 1 1 TYR 3 3 1 1 ALA 4 4 1 1 GLN 5 5 1 1 TRP 6 6 1 1 LEU 7 7 1 1 ALA 8 8 1 1 ASP 9 9 1 1 DAL 10 10 1 1 GLY 11 11 1 1 TRP 12 12 1 1 ALA 13 13 1 1 SER 14 14 1 1 DAL 15 15 1 1 ARG 16 16 1 1 PRO 17 17 1 1 PRO 18 18 1 1 PRO 19 19 1 1 SER 20 20 1 1 stop_ save_ save_DAL _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID DAL _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 10 DAL HA . 10 . HA 1 1 1 1 2 1 1 11 GLY H . 11 . HN 1 1 2 1 1 1 1 10 DAL HA . 10 . HA 1 1 2 1 2 1 1 14 SER H . 14 . HN 1 1 3 1 1 1 1 11 GLY H . 11 . HN 1 1 3 1 2 1 1 11 GLY HA2 . 11 . HA2 1 1 4 1 1 1 1 11 GLY H . 11 . HN 1 1 4 1 2 1 1 11 GLY HA3 . 11 . HA1 1 1 5 1 1 1 1 11 GLY HA3 . 11 . HA1 1 1 5 1 2 1 1 12 TRP H . 12 . HN 1 1 6 1 1 1 1 11 GLY HA2 . 11 . HA2 1 1 6 1 2 1 1 12 TRP H . 12 . HN 1 1 7 1 1 1 1 11 GLY HA3 . 11 . HA1 1 1 7 1 2 1 1 12 TRP HD1 . 12 . HD1 1 1 8 1 1 1 1 11 GLY HA3 . 11 . HA1 1 1 8 1 2 1 1 13 ALA H . 13 . HN 1 1 9 1 1 1 1 6 TRP HZ2 . 6 . HZ2 1 1 9 1 2 1 1 11 GLY HA2 . 11 . HA2 1 1 10 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 10 1 2 1 1 11 GLY HA2 . 11 . HA2 1 1 11 1 1 1 1 6 TRP HH2 . 6 . HH2 1 1 11 1 2 1 1 11 GLY HA2 . 11 . HA2 1 1 12 1 1 1 1 6 TRP HH2 . 6 . HH2 1 1 12 1 2 1 1 11 GLY HA3 . 11 . HA1 1 1 13 1 1 1 1 6 TRP HZ3 . 6 . HZ3 1 1 13 1 2 1 1 11 GLY HA2 . 11 . HA2 1 1 14 1 1 1 1 7 LEU QD . 7 . HD2# 1 1 14 1 2 1 1 11 GLY HA3 . 11 . HA1 1 1 15 1 1 1 1 11 GLY HA2 . 11 . HA2 1 1 15 1 2 1 1 12 TRP HA . 12 . HA 1 1 16 1 1 1 1 12 TRP HB2 . 12 . HB2 1 1 16 1 2 1 1 12 TRP HD1 . 12 . HD1 1 1 17 1 1 1 1 12 TRP HA . 12 . HA 1 1 17 1 2 1 1 12 TRP HE3 . 12 . HE3 1 1 18 1 1 1 1 12 TRP HB3 . 12 . HB1 1 1 18 1 2 1 1 12 TRP HE3 . 12 . HE3 1 1 19 1 1 1 1 12 TRP H . 12 . HN 1 1 19 1 2 1 1 12 TRP HB2 . 12 . HB2 1 1 20 1 1 1 1 12 TRP H . 12 . HN 1 1 20 1 2 1 1 12 TRP HA . 12 . HA 1 1 21 1 1 1 1 12 TRP H . 12 . HN 1 1 21 1 2 1 1 12 TRP HD1 . 12 . HD1 1 1 22 1 1 1 1 12 TRP HB2 . 12 . HB2 1 1 22 1 2 1 1 13 ALA H . 13 . HN 1 1 23 1 1 1 1 12 TRP HA . 12 . HA 1 1 23 1 2 1 1 13 ALA H . 13 . HN 1 1 24 1 1 1 1 12 TRP HA . 12 . HA 1 1 24 1 2 1 1 14 SER H . 14 . HN 1 1 25 1 1 1 1 6 TRP HZ2 . 6 . HZ2 1 1 25 1 2 1 1 12 TRP HA . 12 . HA 1 1 26 1 1 1 1 6 TRP HZ2 . 6 . HZ2 1 1 26 1 2 1 1 12 TRP HB2 . 12 . HB2 1 1 27 1 1 1 1 6 TRP HH2 . 6 . HH2 1 1 27 1 2 1 1 12 TRP HE1 . 12 . HE1 1 1 28 1 1 1 1 6 TRP HZ2 . 6 . HZ2 1 1 28 1 2 1 1 12 TRP HE1 . 12 . HE1 1 1 29 1 1 1 1 6 TRP HE1 . 6 . HE1 1 1 29 1 2 1 1 12 TRP HA . 12 . HA 1 1 30 1 1 1 1 12 TRP HA . 12 . HA 1 1 30 1 2 1 1 12 TRP HB2 . 12 . HB2 1 1 31 1 1 1 1 12 TRP HA . 12 . HA 1 1 31 1 2 1 1 12 TRP HB3 . 12 . HB1 1 1 32 1 1 1 1 6 TRP HH2 . 6 . HH2 1 1 32 1 2 1 1 12 TRP HA . 12 . HA 1 1 33 1 1 1 1 12 TRP H . 12 . HN 1 1 33 1 2 1 1 13 ALA H . 13 . HN 1 1 34 1 1 1 1 13 ALA H . 13 . HN 1 1 34 1 2 1 1 13 ALA MB . 13 . HB# 1 1 35 1 1 1 1 13 ALA HA . 13 . HA 1 1 35 1 2 1 1 13 ALA MB . 13 . HB# 1 1 36 1 1 1 1 13 ALA H . 13 . HN 1 1 36 1 2 1 1 13 ALA HA . 13 . HA 1 1 37 1 1 1 1 13 ALA H . 13 . HN 1 1 37 1 2 1 1 14 SER H . 14 . HN 1 1 38 1 1 1 1 13 ALA MB . 13 . HB# 1 1 38 1 2 1 1 14 SER H . 14 . HN 1 1 39 1 1 1 1 13 ALA HA . 13 . HA 1 1 39 1 2 1 1 14 SER H . 14 . HN 1 1 40 1 1 1 1 14 SER HA . 14 . HA 1 1 40 1 2 1 1 14 SER HB2 . 14 . HB2 1 1 41 1 1 1 1 14 SER HA . 14 . HA 1 1 41 1 2 1 1 14 SER HB3 . 14 . HB1 1 1 42 1 1 1 1 14 SER H . 14 . HN 1 1 42 1 2 1 1 14 SER HA . 14 . HA 1 1 43 1 1 1 1 14 SER H . 14 . HN 1 1 43 1 2 1 1 14 SER HB3 . 14 . HB1 1 1 44 1 1 1 1 11 GLY H . 11 . HN 1 1 44 1 2 1 1 14 SER HG . 14 . HG 1 1 45 1 1 1 1 14 SER HA . 14 . HA 1 1 45 1 2 1 1 14 SER HG . 14 . HG 1 1 46 1 1 1 1 14 SER HB2 . 14 . HB2 1 1 46 1 2 1 1 14 SER HG . 14 . HG 1 1 47 1 1 1 1 14 SER HB3 . 14 . HB1 1 1 47 1 2 1 1 14 SER HG . 14 . HG 1 1 48 1 1 1 1 14 SER HA . 14 . HA 1 1 48 1 2 1 1 16 ARG H . 16 . HN 1 1 49 1 1 1 1 14 SER HB3 . 14 . HB1 1 1 49 1 2 1 1 16 ARG H . 16 . HN 1 1 50 1 1 1 1 9 ASP HB3 . 9 . HB1 1 1 50 1 2 1 1 14 SER HB3 . 14 . HB1 1 1 51 1 1 1 1 9 ASP HB3 . 9 . HB1 1 1 51 1 2 1 1 14 SER HB2 . 14 . HB2 1 1 52 1 1 1 1 12 TRP HE3 . 12 . HE3 1 1 52 1 2 1 1 15 DAL HA . 15 . HA 1 1 53 1 1 1 1 15 DAL HA . 15 . HA 1 1 53 1 2 1 1 16 ARG H . 16 . HN 1 1 54 1 1 1 1 16 ARG H . 16 . HN 1 1 54 1 2 1 1 16 ARG HB3 . 16 . HB1 1 1 55 1 1 1 1 16 ARG H . 16 . HN 1 1 55 1 2 1 1 16 ARG HG2 . 16 . HG2 1 1 56 1 1 1 1 16 ARG HA . 16 . HA 1 1 56 1 2 1 1 16 ARG HB3 . 16 . HB1 1 1 57 1 1 1 1 16 ARG HA . 16 . HA 1 1 57 1 2 1 1 16 ARG HB2 . 16 . HB2 1 1 58 1 1 1 1 16 ARG HD2 . 16 . HD2 1 1 58 1 2 1 1 16 ARG HG3 . 16 . HG1 1 1 59 1 1 1 1 16 ARG HD3 . 16 . HD1 1 1 59 1 2 1 1 16 ARG HG2 . 16 . HG2 1 1 60 1 1 1 1 16 ARG HB3 . 16 . HB1 1 1 60 1 2 1 1 16 ARG HD3 . 16 . HD1 1 1 61 1 1 1 1 16 ARG H . 16 . HN 1 1 61 1 2 1 1 16 ARG HA . 16 . HA 1 1 62 1 1 1 1 16 ARG HB2 . 16 . HB2 1 1 62 1 2 1 1 16 ARG HD2 . 16 . HD2 1 1 63 1 1 1 1 16 ARG HA . 16 . HA 1 1 63 1 2 1 1 17 PRO HD3 . 17 . HD1 1 1 64 1 1 1 1 16 ARG HA . 16 . HA 1 1 64 1 2 1 1 17 PRO HD2 . 17 . HD2 1 1 65 1 1 1 1 16 ARG HB2 . 16 . HB2 1 1 65 1 2 1 1 17 PRO HD2 . 17 . HD2 1 1 66 1 1 1 1 16 ARG HG3 . 16 . HG1 1 1 66 1 2 1 1 17 PRO HD2 . 17 . HD2 1 1 67 1 1 1 1 6 TRP HD1 . 6 . HD1 1 1 67 1 2 1 1 16 ARG HG3 . 16 . HG1 1 1 68 1 1 1 1 6 TRP HE1 . 6 . HE1 1 1 68 1 2 1 1 16 ARG HG3 . 16 . HG1 1 1 69 1 1 1 1 6 TRP HD1 . 6 . HD1 1 1 69 1 2 1 1 16 ARG HD3 . 16 . HD1 1 1 70 1 1 1 1 6 TRP HD1 . 6 . HD1 1 1 70 1 2 1 1 16 ARG HD2 . 16 . HD2 1 1 71 1 1 1 1 12 TRP HH2 . 12 . HH2 1 1 71 1 2 1 1 17 PRO HB3 . 17 . HB1 1 1 72 1 1 1 1 12 TRP HZ2 . 12 . HZ2 1 1 72 1 2 1 1 17 PRO HB3 . 17 . HB1 1 1 73 1 1 1 1 12 TRP HZ3 . 12 . HZ3 1 1 73 1 2 1 1 17 PRO HA . 17 . HA 1 1 74 1 1 1 1 12 TRP HE3 . 12 . HE3 1 1 74 1 2 1 1 17 PRO HA . 17 . HA 1 1 75 1 1 1 1 12 TRP HZ3 . 12 . HZ3 1 1 75 1 2 1 1 17 PRO HB3 . 17 . HB1 1 1 76 1 1 1 1 12 TRP HH2 . 12 . HH2 1 1 76 1 2 1 1 17 PRO HB2 . 17 . HB2 1 1 77 1 1 1 1 12 TRP HZ3 . 12 . HZ3 1 1 77 1 2 1 1 17 PRO HB2 . 17 . HB2 1 1 78 1 1 1 1 12 TRP HZ2 . 12 . HZ2 1 1 78 1 2 1 1 17 PRO HA . 17 . HA 1 1 79 1 1 1 1 16 ARG H . 16 . HN 1 1 79 1 2 1 1 17 PRO HD3 . 17 . HD1 1 1 80 1 1 1 1 16 ARG H . 16 . HN 1 1 80 1 2 1 1 17 PRO HD2 . 17 . HD2 1 1 81 1 1 1 1 17 PRO HA . 17 . HA 1 1 81 1 2 1 1 17 PRO HB3 . 17 . HB1 1 1 82 1 1 1 1 17 PRO HD2 . 17 . HD2 1 1 82 1 2 1 1 17 PRO HG2 . 17 . HG2 1 1 83 1 1 1 1 17 PRO HD3 . 17 . HD1 1 1 83 1 2 1 1 17 PRO HG3 . 17 . HG1 1 1 84 1 1 1 1 17 PRO HB3 . 17 . HB1 1 1 84 1 2 1 1 17 PRO HG2 . 17 . HG2 1 1 85 1 1 1 1 17 PRO HB2 . 17 . HB2 1 1 85 1 2 1 1 17 PRO HD2 . 17 . HD2 1 1 86 1 1 1 1 17 PRO HB2 . 17 . HB2 1 1 86 1 2 1 1 17 PRO HD3 . 17 . HD1 1 1 87 1 1 1 1 17 PRO HA . 17 . HA 1 1 87 1 2 1 1 17 PRO HG2 . 17 . HG2 1 1 88 1 1 1 1 17 PRO HB3 . 17 . HB1 1 1 88 1 2 1 1 17 PRO HD2 . 17 . HD2 1 1 89 1 1 1 1 17 PRO HB3 . 17 . HB1 1 1 89 1 2 1 1 17 PRO HD3 . 17 . HD1 1 1 90 1 1 1 1 17 PRO HA . 17 . HA 1 1 90 1 2 1 1 18 PRO HD3 . 18 . HD1 1 1 91 1 1 1 1 6 TRP HZ2 . 6 . HZ2 1 1 91 1 2 1 1 17 PRO HA . 17 . HA 1 1 92 1 1 1 1 6 TRP HE1 . 6 . HE1 1 1 92 1 2 1 1 17 PRO HA . 17 . HA 1 1 93 1 1 1 1 12 TRP HZ2 . 12 . HZ2 1 1 93 1 2 1 1 18 PRO QG . 18 . HG1 1 1 94 1 1 1 1 18 PRO HD3 . 18 . HD1 1 1 94 1 2 1 1 18 PRO QG . 18 . HG1 1 1 95 1 1 1 1 18 PRO HA . 18 . HA 1 1 95 1 2 1 1 18 PRO HD2 . 18 . HD2 1 1 96 1 1 1 1 18 PRO QB . 18 . HB2 1 1 96 1 2 1 1 18 PRO HD2 . 18 . HD2 1 1 97 1 1 1 1 18 PRO QB . 18 . HB1 1 1 97 1 2 1 1 18 PRO HD3 . 18 . HD1 1 1 98 1 1 1 1 18 PRO HA . 18 . HA 1 1 98 1 2 1 1 18 PRO QG . 18 . HG1 1 1 99 1 1 1 1 3 TYR QE . 3 . HE1 1 1 99 1 2 1 1 18 PRO QB . 18 . HB2 1 1 100 1 1 1 1 3 TYR QD . 3 . HD1 1 1 100 1 2 1 1 18 PRO QB . 18 . HB2 1 1 101 1 1 1 1 3 TYR QE . 3 . HE1 1 1 101 1 2 1 1 18 PRO QG . 18 . HG1 1 1 102 1 1 1 1 6 TRP HZ2 . 6 . HZ2 1 1 102 1 2 1 1 18 PRO HD3 . 18 . HD1 1 1 103 1 1 1 1 6 TRP HD1 . 6 . HD1 1 1 103 1 2 1 1 18 PRO HA . 18 . HA 1 1 104 1 1 1 1 6 TRP HE1 . 6 . HE1 1 1 104 1 2 1 1 18 PRO HA . 18 . HA 1 1 105 1 1 1 1 6 TRP HH2 . 6 . HH2 1 1 105 1 2 1 1 18 PRO HD3 . 18 . HD1 1 1 106 1 1 1 1 6 TRP HH2 . 6 . HH2 1 1 106 1 2 1 1 18 PRO QG . 18 . HG1 1 1 107 1 1 1 1 6 TRP HH2 . 6 . HH2 1 1 107 1 2 1 1 18 PRO QB . 18 . HB1 1 1 108 1 1 1 1 6 TRP HZ3 . 6 . HZ3 1 1 108 1 2 1 1 18 PRO QB . 18 . HB1 1 1 109 1 1 1 1 6 TRP HE1 . 6 . HE1 1 1 109 1 2 1 1 18 PRO HD3 . 18 . HD1 1 1 110 1 1 1 1 6 TRP HZ2 . 6 . HZ2 1 1 110 1 2 1 1 18 PRO QB . 18 . HB1 1 1 111 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 111 1 2 1 1 18 PRO QB . 18 . HB1 1 1 112 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 112 1 2 1 1 18 PRO HA . 18 . HA 1 1 113 1 1 1 1 18 PRO HA . 18 . HA 1 1 113 1 2 1 1 19 PRO QD . 19 . HD1 1 1 114 1 1 1 1 18 PRO QB . 18 . HB2 1 1 114 1 2 1 1 19 PRO QD . 19 . HD2 1 1 115 1 1 1 1 19 PRO HA . 19 . HA 1 1 115 1 2 1 1 19 PRO HB2 . 19 . HB2 1 1 116 1 1 1 1 19 PRO HA . 19 . HA 1 1 116 1 2 1 1 19 PRO HB3 . 19 . HB1 1 1 117 1 1 1 1 19 PRO HB3 . 19 . HB1 1 1 117 1 2 1 1 19 PRO HG3 . 19 . HG1 1 1 118 1 1 1 1 19 PRO QD . 19 . HD2 1 1 118 1 2 1 1 19 PRO HG2 . 19 . HG2 1 1 119 1 1 1 1 19 PRO HB2 . 19 . HB2 1 1 119 1 2 1 1 19 PRO HG2 . 19 . HG2 1 1 120 1 1 1 1 19 PRO HB3 . 19 . HB1 1 1 120 1 2 1 1 19 PRO QD . 19 . HD2 1 1 121 1 1 1 1 19 PRO HB2 . 19 . HB2 1 1 121 1 2 1 1 19 PRO QD . 19 . HD1 1 1 122 1 1 1 1 19 PRO HA . 19 . HA 1 1 122 1 2 1 1 20 SER H . 20 . HN 1 1 123 1 1 1 1 19 PRO HB3 . 19 . HB1 1 1 123 1 2 1 1 20 SER H . 20 . HN 1 1 124 1 1 1 1 19 PRO HB2 . 19 . HB2 1 1 124 1 2 1 1 20 SER H . 20 . HN 1 1 125 1 1 1 1 2 ALA MB . 2 . HB# 1 1 125 1 2 1 1 19 PRO HB3 . 19 . HB1 1 1 126 1 1 1 1 2 ALA MB . 2 . HB# 1 1 126 1 2 1 1 19 PRO HB2 . 19 . HB2 1 1 127 1 1 1 1 3 TYR QD . 3 . HD1 1 1 127 1 2 1 1 19 PRO QD . 19 . HD2 1 1 128 1 1 1 1 3 TYR QE . 3 . HE1 1 1 128 1 2 1 1 19 PRO QD . 19 . HD2 1 1 129 1 1 1 1 3 TYR QD . 3 . HD1 1 1 129 1 2 1 1 19 PRO HG2 . 19 . HG2 1 1 130 1 1 1 1 3 TYR QD . 3 . HD1 1 1 130 1 2 1 1 19 PRO HB3 . 19 . HB1 1 1 131 1 1 1 1 1 ASP HA . 1 . HA 1 1 131 1 2 1 1 1 ASP HB2 . 1 . HB2 1 1 132 1 1 1 1 1 ASP HA . 1 . HA 1 1 132 1 2 1 1 1 ASP HB3 . 1 . HB1 1 1 133 1 1 1 1 20 SER HA . 20 . HA 1 1 133 1 2 1 1 20 SER HB2 . 20 . HB2 1 1 134 1 1 1 1 20 SER H . 20 . HN 1 1 134 1 2 1 1 20 SER HA . 20 . HA 1 1 135 1 1 1 1 20 SER H . 20 . HN 1 1 135 1 2 1 1 20 SER QB . 20 . HB# 1 1 136 1 1 1 1 2 ALA HA . 2 . HA 1 1 136 1 2 1 1 2 ALA MB . 2 . HB# 1 1 137 1 1 1 1 2 ALA HA . 2 . HA 1 1 137 1 2 1 1 5 GLN HB3 . 5 . HB1 1 1 138 1 1 1 1 2 ALA HA . 2 . HA 1 1 138 1 2 1 1 5 GLN H . 5 . HN 1 1 139 1 1 1 1 2 ALA MB . 2 . HB# 1 1 139 1 2 1 1 5 GLN H . 5 . HN 1 1 140 1 1 1 1 2 ALA HA . 2 . HA 1 1 140 1 2 1 1 5 GLN HG3 . 5 . HG1 1 1 141 1 1 1 1 3 TYR HA . 3 . HA 1 1 141 1 2 1 1 19 PRO QD . 19 . HD2 1 1 142 1 1 1 1 3 TYR HA . 3 . HA 1 1 142 1 2 1 1 19 PRO HG2 . 19 . HG2 1 1 143 1 1 1 1 3 TYR HB2 . 3 . HB2 1 1 143 1 2 1 1 3 TYR QD . 3 . HD1 1 1 144 1 1 1 1 3 TYR HB3 . 3 . HB1 1 1 144 1 2 1 1 3 TYR QD . 3 . HD2 1 1 145 1 1 1 1 3 TYR HA . 3 . HA 1 1 145 1 2 1 1 3 TYR HB2 . 3 . HB2 1 1 146 1 1 1 1 3 TYR HA . 3 . HA 1 1 146 1 2 1 1 3 TYR QD . 3 . HD1 1 1 147 1 1 1 1 3 TYR HA . 3 . HA 1 1 147 1 2 1 1 3 TYR HB3 . 3 . HB1 1 1 148 1 1 1 1 3 TYR H . 3 . HN 1 1 148 1 2 1 1 3 TYR HB2 . 3 . HB2 1 1 149 1 1 1 1 3 TYR H . 3 . HN 1 1 149 1 2 1 1 3 TYR HB3 . 3 . HB1 1 1 150 1 1 1 1 3 TYR H . 3 . HN 1 1 150 1 2 1 1 3 TYR HA . 3 . HA 1 1 151 1 1 1 1 3 TYR HB3 . 3 . HB1 1 1 151 1 2 1 1 4 ALA H . 4 . HN 1 1 152 1 1 1 1 3 TYR HB2 . 3 . HB2 1 1 152 1 2 1 1 4 ALA H . 4 . HN 1 1 153 1 1 1 1 3 TYR HA . 3 . HA 1 1 153 1 2 1 1 4 ALA H . 4 . HN 1 1 154 1 1 1 1 3 TYR HA . 3 . HA 1 1 154 1 2 1 1 6 TRP HB3 . 6 . HB1 1 1 155 1 1 1 1 3 TYR HA . 3 . HA 1 1 155 1 2 1 1 6 TRP HB2 . 6 . HB2 1 1 156 1 1 1 1 3 TYR HA . 3 . HA 1 1 156 1 2 1 1 6 TRP HE3 . 6 . HE3 1 1 157 1 1 1 1 3 TYR HA . 3 . HA 1 1 157 1 2 1 1 7 LEU H . 7 . HN 1 1 158 1 1 1 1 3 TYR QD . 3 . HD2 1 1 158 1 2 1 1 4 ALA HA . 4 . HA 1 1 159 1 1 1 1 3 TYR QD . 3 . HD2 1 1 159 1 2 1 1 4 ALA H . 4 . HN 1 1 160 1 1 1 1 3 TYR H . 3 . HN 1 1 160 1 2 1 1 4 ALA H . 4 . HN 1 1 161 1 1 1 1 4 ALA HA . 4 . HA 1 1 161 1 2 1 1 4 ALA MB . 4 . HB# 1 1 162 1 1 1 1 4 ALA H . 4 . HN 1 1 162 1 2 1 1 4 ALA MB . 4 . HB# 1 1 163 1 1 1 1 4 ALA H . 4 . HN 1 1 163 1 2 1 1 4 ALA HA . 4 . HA 1 1 164 1 1 1 1 4 ALA MB . 4 . HB# 1 1 164 1 2 1 1 5 GLN H . 5 . HN 1 1 165 1 1 1 1 4 ALA H . 4 . HN 1 1 165 1 2 1 1 5 GLN H . 5 . HN 1 1 166 1 1 1 1 4 ALA HA . 4 . HA 1 1 166 1 2 1 1 5 GLN H . 5 . HN 1 1 167 1 1 1 1 4 ALA HA . 4 . HA 1 1 167 1 2 1 1 7 LEU QD . 7 . HD1# 1 1 168 1 1 1 1 4 ALA HA . 4 . HA 1 1 168 1 2 1 1 7 LEU H . 7 . HN 1 1 169 1 1 1 1 4 ALA HA . 4 . HA 1 1 169 1 2 1 1 7 LEU QB . 7 . HB2 1 1 170 1 1 1 1 4 ALA MB . 4 . HB# 1 1 170 1 2 1 1 5 GLN HA . 5 . HA 1 1 171 1 1 1 1 5 GLN HB3 . 5 . HB1 1 1 171 1 2 1 1 5 GLN HG3 . 5 . HG1 1 1 172 1 1 1 1 5 GLN H . 5 . HN 1 1 172 1 2 1 1 5 GLN QB . 5 . HB* 1 1 173 1 1 1 1 5 GLN H . 5 . HN 1 1 173 1 2 1 1 5 GLN HA . 5 . HA 1 1 174 1 1 1 1 5 GLN HE22 . 5 . HE22 1 1 174 1 2 1 1 5 GLN QG . 5 . HG# 1 1 175 1 1 1 1 5 GLN HA . 5 . HA 1 1 175 1 2 1 1 5 GLN HG3 . 5 . HG1 1 1 176 1 1 1 1 5 GLN HA . 5 . HA 1 1 176 1 2 1 1 5 GLN HB2 . 5 . HB2 1 1 177 1 1 1 1 5 GLN H . 5 . HN 1 1 177 1 2 1 1 5 GLN HG3 . 5 . HG1 1 1 178 1 1 1 1 5 GLN HE21 . 5 . HE21 1 1 178 1 2 1 1 5 GLN HG2 . 5 . HG2 1 1 179 1 1 1 1 5 GLN HA . 5 . HA 1 1 179 1 2 1 1 5 GLN HE22 . 5 . HE22 1 1 180 1 1 1 1 5 GLN HA . 5 . HA 1 1 180 1 2 1 1 6 TRP H . 6 . HN 1 1 181 1 1 1 1 5 GLN HB3 . 5 . HB1 1 1 181 1 2 1 1 6 TRP H . 6 . HN 1 1 182 1 1 1 1 5 GLN QG . 5 . HG# 1 1 182 1 2 1 1 6 TRP H . 6 . HN 1 1 183 1 1 1 1 5 GLN HA . 5 . HA 1 1 183 1 2 1 1 8 ALA H . 8 . HN 1 1 184 1 1 1 1 5 GLN HA . 5 . HA 1 1 184 1 2 1 1 9 ASP H . 9 . HN 1 1 185 1 1 1 1 6 TRP HH2 . 6 . HH2 1 1 185 1 2 1 1 12 TRP HZ2 . 12 . HZ2 1 1 186 1 1 1 1 6 TRP HZ2 . 6 . HZ2 1 1 186 1 2 1 1 12 TRP HZ2 . 12 . HZ2 1 1 187 1 1 1 1 6 TRP HZ2 . 6 . HZ2 1 1 187 1 2 1 1 12 TRP HE3 . 12 . HE3 1 1 188 1 1 1 1 6 TRP HH2 . 6 . HH2 1 1 188 1 2 1 1 12 TRP H . 12 . HN 1 1 189 1 1 1 1 6 TRP HE1 . 6 . HE1 1 1 189 1 2 1 1 16 ARG H . 16 . HN 1 1 190 1 1 1 1 6 TRP HD1 . 6 . HD1 1 1 190 1 2 1 1 16 ARG H . 16 . HN 1 1 191 1 1 1 1 6 TRP H . 6 . HN 1 1 191 1 2 1 1 6 TRP HB3 . 6 . HB1 1 1 192 1 1 1 1 6 TRP H . 6 . HN 1 1 192 1 2 1 1 6 TRP HB2 . 6 . HB2 1 1 193 1 1 1 1 6 TRP HB3 . 6 . HB1 1 1 193 1 2 1 1 6 TRP HE3 . 6 . HE3 1 1 194 1 1 1 1 6 TRP HB2 . 6 . HB2 1 1 194 1 2 1 1 6 TRP HD1 . 6 . HD1 1 1 195 1 1 1 1 6 TRP HA . 6 . HA 1 1 195 1 2 1 1 6 TRP HD1 . 6 . HD1 1 1 196 1 1 1 1 6 TRP H . 6 . HN 1 1 196 1 2 1 1 6 TRP HA . 6 . HA 1 1 197 1 1 1 1 6 TRP HB3 . 6 . HB1 1 1 197 1 2 1 1 6 TRP HD1 . 6 . HD1 1 1 198 1 1 1 1 6 TRP HA . 6 . HA 1 1 198 1 2 1 1 6 TRP HB2 . 6 . HB2 1 1 199 1 1 1 1 6 TRP HA . 6 . HA 1 1 199 1 2 1 1 6 TRP HB3 . 6 . HB1 1 1 200 1 1 1 1 6 TRP HB2 . 6 . HB2 1 1 200 1 2 1 1 6 TRP HE3 . 6 . HE3 1 1 201 1 1 1 1 6 TRP HA . 6 . HA 1 1 201 1 2 1 1 6 TRP HE3 . 6 . HE3 1 1 202 1 1 1 1 6 TRP H . 6 . HN 1 1 202 1 2 1 1 7 LEU H . 7 . HN 1 1 203 1 1 1 1 6 TRP HB3 . 6 . HB1 1 1 203 1 2 1 1 7 LEU H . 7 . HN 1 1 204 1 1 1 1 6 TRP HB2 . 6 . HB2 1 1 204 1 2 1 1 7 LEU H . 7 . HN 1 1 205 1 1 1 1 6 TRP HA . 6 . HA 1 1 205 1 2 1 1 9 ASP HB2 . 9 . HB2 1 1 206 1 1 1 1 6 TRP HA . 6 . HA 1 1 206 1 2 1 1 9 ASP HB3 . 9 . HB1 1 1 207 1 1 1 1 6 TRP HA . 6 . HA 1 1 207 1 2 1 1 9 ASP H . 9 . HN 1 1 208 1 1 1 1 7 LEU HA . 7 . HA 1 1 208 1 2 1 1 11 GLY H . 11 . HN 1 1 209 1 1 1 1 7 LEU HA . 7 . HA 1 1 209 1 2 1 1 11 GLY HA2 . 11 . HA2 1 1 210 1 1 1 1 7 LEU HA . 7 . HA 1 1 210 1 2 1 1 11 GLY HA3 . 11 . HA1 1 1 211 1 1 1 1 7 LEU QD . 7 . HD2# 1 1 211 1 2 1 1 11 GLY HA2 . 11 . HA2 1 1 212 1 1 1 1 3 TYR QE . 3 . HE2 1 1 212 1 2 1 1 7 LEU QD . 7 . HD1# 1 1 213 1 1 1 1 3 TYR QD . 3 . HD2 1 1 213 1 2 1 1 7 LEU QD . 7 . HD1# 1 1 214 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 214 1 2 1 1 7 LEU HG . 7 . HG 1 1 215 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 215 1 2 1 1 7 LEU QD . 7 . HD2# 1 1 216 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 216 1 2 1 1 7 LEU H . 7 . HN 1 1 217 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 217 1 2 1 1 7 LEU HA . 7 . HA 1 1 218 1 1 1 1 6 TRP HZ3 . 6 . HZ3 1 1 218 1 2 1 1 7 LEU HG . 7 . HG 1 1 219 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 219 1 2 1 1 7 LEU QB . 7 . HB2 1 1 220 1 1 1 1 6 TRP HH2 . 6 . HH2 1 1 220 1 2 1 1 7 LEU QD . 7 . HD2# 1 1 221 1 1 1 1 7 LEU H . 7 . HN 1 1 221 1 2 1 1 7 LEU HG . 7 . HG 1 1 222 1 1 1 1 7 LEU H . 7 . HN 1 1 222 1 2 1 1 7 LEU QB . 7 . HB2 1 1 223 1 1 1 1 7 LEU QB . 7 . HB2 1 1 223 1 2 1 1 7 LEU QD . 7 . HD1# 1 1 224 1 1 1 1 7 LEU H . 7 . HN 1 1 224 1 2 1 1 7 LEU HA . 7 . HA 1 1 225 1 1 1 1 7 LEU HA . 7 . HA 1 1 225 1 2 1 1 7 LEU QD . 7 . HD2# 1 1 226 1 1 1 1 7 LEU H . 7 . HN 1 1 226 1 2 1 1 7 LEU QD . 7 . HD1# 1 1 227 1 1 1 1 7 LEU HA . 7 . HA 1 1 227 1 2 1 1 7 LEU HG . 7 . HG 1 1 228 1 1 1 1 7 LEU QB . 7 . HB1 1 1 228 1 2 1 1 8 ALA H . 8 . HN 1 1 229 1 1 1 1 7 LEU HA . 7 . HA 1 1 229 1 2 1 1 8 ALA H . 8 . HN 1 1 230 1 1 1 1 7 LEU QD . 7 . HD1# 1 1 230 1 2 1 1 8 ALA H . 8 . HN 1 1 231 1 1 1 1 7 LEU H . 7 . HN 1 1 231 1 2 1 1 8 ALA H . 8 . HN 1 1 232 1 1 1 1 8 ALA H . 8 . HN 1 1 232 1 2 1 1 8 ALA HA . 8 . HA 1 1 233 1 1 1 1 8 ALA H . 8 . HN 1 1 233 1 2 1 1 9 ASP H . 9 . HN 1 1 234 1 1 1 1 8 ALA HA . 8 . HA 1 1 234 1 2 1 1 9 ASP H . 9 . HN 1 1 235 1 1 1 1 9 ASP H . 9 . HN 1 1 235 1 2 1 1 11 GLY H . 11 . HN 1 1 236 1 1 1 1 9 ASP HB3 . 9 . HB1 1 1 236 1 2 1 1 11 GLY H . 11 . HN 1 1 237 1 1 1 1 9 ASP HB2 . 9 . HB2 1 1 237 1 2 1 1 11 GLY H . 11 . HN 1 1 238 1 1 1 1 6 TRP HD1 . 6 . HD1 1 1 238 1 2 1 1 9 ASP HB2 . 9 . HB2 1 1 239 1 1 1 1 9 ASP H . 9 . HN 1 1 239 1 2 1 1 9 ASP HB2 . 9 . HB2 1 1 240 1 1 1 1 9 ASP H . 9 . HN 1 1 240 1 2 1 1 9 ASP HA . 9 . HA 1 1 241 1 1 1 1 9 ASP HA . 9 . HA 1 1 241 1 2 1 1 9 ASP HB3 . 9 . HB1 1 1 242 1 1 1 1 9 ASP H . 9 . HN 1 1 242 1 2 1 1 9 ASP HB3 . 9 . HB1 1 1 243 1 1 1 1 12 TRP H . 12 . HN 1 1 243 1 2 1 1 12 TRP HB3 . 12 . HB1 1 1 244 1 1 1 1 12 TRP HB3 . 12 . HB1 1 1 244 1 2 1 1 13 ALA H . 13 . HN 1 1 245 1 1 1 1 6 TRP HD1 . 6 . HD1 1 1 245 1 2 1 1 16 ARG HG2 . 16 . HG2 1 1 246 1 1 1 1 17 PRO HA . 17 . HA 1 1 246 1 2 1 1 18 PRO HD2 . 18 . HD2 1 1 247 1 1 1 1 6 TRP HZ2 . 6 . HZ2 1 1 247 1 2 1 1 18 PRO QG . 18 . HG1 1 1 248 1 1 1 1 5 GLN HG3 . 5 . HG1 1 1 248 1 2 1 1 16 ARG QH2 . 16 . HH2# 1 1 249 1 1 1 1 6 TRP HA . 6 . HA 1 1 249 1 2 1 1 16 ARG QH2 . 16 . HH2# 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.34 2.8 3.78 1 1 2 1 . . . . . 3.6 3.23 4.1 1 1 3 1 . . . . . 2.49 2.22 2.73 1 1 4 1 . . . . . 2.64 2.32 2.9 1 1 5 1 . . . . . 2.6 2.22 2.91 1 1 6 1 . . . . . 3.12 2.65 3.5 1 1 7 1 . . . . . 4.36 3.5 5.29 1 1 8 1 . . . . . 3.99 3.24 4.7 1 1 9 1 . . . . . 3.59 2.88 4.25 1 1 10 1 . . . . . 3.95 3.21 4.64 1 1 11 1 . . . . . 3.78 3.04 4.49 1 1 12 1 . . . . . 4.08 3.24 4.96 1 1 13 1 . . . . . 4.36 3.49 5.3 1 1 14 1 . . . . . 3.67 3.02 5.17 1 1 15 1 . . . . . 4.41 3.53 5.38 1 1 16 1 . . . . . . 2.55 3.18 1 1 17 1 . . . . . 2.62 2.31 3.38 1 1 18 1 . . . . . . 2.98 3.05 1 1 19 1 . . . . . 2.5 2.06 2.85 1 1 20 1 . . . . . 2.92 2.38 3.36 1 1 21 1 . . . . . 3.6 2.98 4.14 1 1 22 1 . . . . . 3.51 2.91 4.31 1 1 23 1 . . . . . 3.56 2.95 4.08 1 1 24 1 . . . . . 3.63 3.0 4.18 1 1 25 1 . . . . . 2.36 2.03 3.03 1 1 26 1 . . . . . 4.0 3.5 4.9 1 1 27 1 . . . . . 3.0 2.49 3.65 1 1 28 1 . . . . . 3.56 2.85 4.21 1 1 29 1 . . . . . 3.5 3.12 4.27 1 1 30 1 . . . . . 3.1 3.0 3.2 1 1 31 1 . . . . . 2.5 2.3 2.7 1 1 32 1 . . . . . 3.95 3.15 4.75 1 1 33 1 . . . . . 2.7 2.43 2.95 1 1 34 1 . . . . . 2.16 2.0 3.07 1 1 35 1 . . . . . 2.23 2.04 2.43 1 1 36 1 . . . . . 2.69 2.36 2.96 1 1 37 1 . . . . . 2.55 2.06 2.8 1 1 38 1 . . . . . 3.33 2.79 4.83 1 1 39 1 . . . . . 3.37 2.82 3.82 1 1 40 1 . . . . . 2.59 2.29 2.85 1 1 41 1 . . . . . 2.67 2.34 2.94 1 1 42 1 . . . . . 2.73 2.38 3.01 1 1 43 1 . . . . . 3.09 2.63 3.46 1 1 44 1 . . . . . 3.09 2.63 3.46 1 1 45 1 . . . . . 4.01 3.26 4.73 1 1 46 1 . . . . . 2.75 2.4 3.17 1 1 47 1 . . . . . 2.3 2.04 2.62 1 1 48 1 . . . . . 3.52 3.2 4.25 1 1 49 1 . . . . . 4.25 3.42 5.11 1 1 50 1 . . . . . 3.47 2.89 3.96 1 1 51 1 . . . . . 3.66 3.02 4.22 1 1 52 1 . . . . . 4.37 3.5 5.31 1 1 53 1 . . . . . 3.43 2.86 3.9 1 1 54 1 . . . . . 2.63 2.28 2.96 1 1 55 1 . . . . . 2.7 2.43 3.17 1 1 56 1 . . . . . 3.0 2.85 3.25 1 1 57 1 . . . . . 2.4 2.3 2.65 1 1 58 1 . . . . . 2.66 2.31 2.9 1 1 59 1 . . . . . 2.49 2.39 3.09 1 1 60 1 . . . . . 2.68 2.29 3.0 1 1 61 1 . . . . . 2.95 2.53 3.28 1 1 62 1 . . . . . 2.9 2.59 3.45 1 1 63 1 . . . . . 2.3 1.99 2.51 1 1 64 1 . . . . . 2.79 2.52 3.03 1 1 65 1 . . . . . 2.95 2.57 3.26 1 1 66 1 . . . . . 3.6 3.21 3.91 1 1 67 1 . . . . . 2.63 2.38 2.96 1 1 68 1 . . . . . 3.15 2.77 3.63 1 1 69 1 . . . . . 3.46 2.88 3.94 1 1 70 1 . . . . . 4.23 3.41 5.08 1 1 71 1 . . . . . 2.1 1.56 2.54 1 1 72 1 . . . . . 3.43 2.86 3.9 1 1 73 1 . . . . . 3.52 2.92 4.02 1 1 74 1 . . . . . 3.77 3.09 4.38 1 1 75 1 . . . . . 3.77 3.09 4.38 1 1 76 1 . . . . . 4.19 3.38 5.02 1 1 77 1 . . . . . 4.24 3.41 5.09 1 1 78 1 . . . . . 4.33 3.47 5.24 1 1 79 1 . . . . . 4.05 3.28 4.8 1 1 80 1 . . . . . 4.42 3.54 5.39 1 1 81 1 . . . . . 2.3 1.93 2.6 1 1 82 1 . . . . . 2.4 1.97 2.74 1 1 83 1 . . . . . 2.45 2.01 2.8 1 1 84 1 . . . . . 3.18 2.69 3.57 1 1 85 1 . . . . . 3.72 3.22 4.13 1 1 86 1 . . . . . 4.0 3.47 4.43 1 1 87 1 . . . . . 4.05 3.28 4.79 1 1 88 1 . . . . . 4.19 3.38 5.01 1 1 89 1 . . . . . 4.26 3.43 5.12 1 1 90 1 . . . . . 2.46 2.2 2.69 1 1 91 1 . . . . . 3.39 2.74 3.96 1 1 92 1 . . . . . 3.36 3.02 3.96 1 1 93 1 . . . . . 3.96 3.22 4.66 1 1 94 1 . . . . . 2.34 2.0 2.69 1 1 95 1 . . . . . 3.88 3.17 4.54 1 1 96 1 . . . . . 3.95 3.21 4.64 1 1 97 1 . . . . . 3.4 3.25 4.04 1 1 98 1 . . . . . 4.55 3.63 5.62 1 1 99 1 . . . . . 3.24 2.77 3.65 1 1 100 1 . . . . . 3.62 3.21 4.16 1 1 101 1 . . . . . 4.2 3.39 5.03 1 1 102 1 . . . . . 2.49 2.12 2.79 1 1 103 1 . . . . . 3.23 2.76 4.01 1 1 104 1 . . . . . 3.74 3.07 4.33 1 1 105 1 . . . . . 3.83 3.07 4.56 1 1 106 1 . . . . . 3.89 3.11 4.65 1 1 107 1 . . . . . 3.93 3.14 4.72 1 1 108 1 . . . . . 4.13 3.34 4.92 1 1 109 1 . . . . . 4.23 3.91 4.68 1 1 110 1 . . . . . 3.99 3.15 4.87 1 1 111 1 . . . . . 4.37 3.5 5.31 1 1 112 1 . . . . . 4.42 3.54 5.39 1 1 113 1 . . . . . . 2.23 2.4 1 1 114 1 . . . . . 3.39 3.31 3.85 1 1 115 1 . . . . . 2.93 2.52 3.26 1 1 116 1 . . . . . 2.4 1.91 2.8 1 1 117 1 . . . . . 2.3 2.03 2.77 1 1 118 1 . . . . . 2.3 2.03 2.77 1 1 119 1 . . . . . 2.31 2.02 2.73 1 1 120 1 . . . . . 4.35 3.49 5.28 1 1 121 1 . . . . . 4.46 3.56 5.47 1 1 122 1 . . . . . 2.21 2.03 2.4 1 1 123 1 . . . . . 3.54 2.93 4.05 1 1 124 1 . . . . . 3.71 3.05 4.29 1 1 125 1 . . . . . 3.82 3.13 4.45 1 1 126 1 . . . . . 3.85 3.15 4.49 1 1 127 1 . . . . . 2.98 2.55 3.32 1 1 128 1 . . . . . 3.18 2.69 3.57 1 1 129 1 . . . . . 3.51 2.91 4.01 1 1 130 1 . . . . . 3.7 3.13 4.64 1 1 131 1 . . . . . 2.8 2.08 3.46 1 1 132 1 . . . . . 3.0 2.15 3.89 1 1 133 1 . . . . . 2.5 2.13 2.87 1 1 134 1 . . . . . 3.29 2.77 3.72 1 1 135 1 . . . . . 3.36 2.81 3.81 1 1 136 1 . . . . . 2.5 2.23 2.74 1 1 137 1 . . . . . 3.0 2.41 3.5 1 1 138 1 . . . . . 3.52 2.92 4.02 1 1 139 1 . . . . . 3.8 3.11 5.3 1 1 140 1 . . . . . 4.09 3.31 4.85 1 1 141 1 . . . . . 3.06 2.48 3.54 1 1 142 1 . . . . . 2.7 2.19 3.22 1 1 143 1 . . . . . 2.41 2.2 2.92 1 1 144 1 . . . . . 2.47 2.21 3.0 1 1 145 1 . . . . . 2.63 2.31 2.89 1 1 146 1 . . . . . 3.2 2.86 3.68 1 1 147 1 . . . . . 3.09 2.63 3.46 1 1 148 1 . . . . . 2.9 2.33 3.37 1 1 149 1 . . . . . 3.58 2.87 4.24 1 1 150 1 . . . . . 2.9 2.0 3.9 1 1 151 1 . . . . . 3.01 2.37 3.36 1 1 152 1 . . . . . 3.16 2.68 3.55 1 1 153 1 . . . . . 3.56 2.95 4.08 1 1 154 1 . . . . . 3.47 2.89 3.96 1 1 155 1 . . . . . 3.6 2.98 4.13 1 1 156 1 . . . . . 3.73 3.06 4.32 1 1 157 1 . . . . . 3.66 3.02 4.22 1 1 158 1 . . . . . 3.52 2.92 4.02 1 1 159 1 . . . . . 3.57 2.96 4.09 1 1 160 1 . . . . . 3.42 2.76 4.01 1 1 161 1 . . . . . 2.35 2.12 2.57 1 1 162 1 . . . . . 2.44 2.19 2.67 1 1 163 1 . . . . . 2.8 2.43 3.1 1 1 164 1 . . . . . 2.96 2.54 3.3 1 1 165 1 . . . . . 2.97 2.55 3.31 1 1 166 1 . . . . . 3.91 3.19 4.58 1 1 167 1 . . . . . 2.84 2.46 3.45 1 1 168 1 . . . . . 3.2 2.7 3.6 1 1 169 1 . . . . . 3.28 2.99 3.7 1 1 170 1 . . . . . 4.05 3.28 4.79 1 1 171 1 . . . . . 2.54 2.25 2.79 1 1 172 1 . . . . . 2.69 2.35 2.96 1 1 173 1 . . . . . 2.76 2.4 3.05 1 1 174 1 . . . . . 2.82 2.44 3.72 1 1 175 1 . . . . . 2.83 2.45 3.13 1 1 176 1 . . . . . 2.6 2.25 2.96 1 1 177 1 . . . . . 3.53 3.05 4.31 1 1 178 1 . . . . . 2.75 2.24 3.46 1 1 179 1 . . . . . 4.16 3.36 4.96 1 1 180 1 . . . . . 3.56 3.31 3.92 1 1 181 1 . . . . . 2.6 2.29 3.01 1 1 182 1 . . . . . 4.11 3.33 4.88 1 1 183 1 . . . . . 3.21 2.71 3.61 1 1 184 1 . . . . . 4.18 3.37 5.0 1 1 185 1 . . . . . 2.65 2.26 3.36 1 1 186 1 . . . . . 3.8 3.38 4.73 1 1 187 1 . . . . . 3.54 2.84 4.18 1 1 188 1 . . . . . 4.05 3.22 4.91 1 1 189 1 . . . . . 3.64 3.0 4.19 1 1 190 1 . . . . . 4.44 3.55 5.43 1 1 191 1 . . . . . 2.47 2.21 2.7 1 1 192 1 . . . . . 2.59 2.29 2.85 1 1 193 1 . . . . . 2.68 2.35 2.95 1 1 194 1 . . . . . 2.68 2.35 2.95 1 1 195 1 . . . . . 2.75 2.4 3.04 1 1 196 1 . . . . . 2.89 2.49 3.21 1 1 197 1 . . . . . 3.0 2.57 3.85 1 1 198 1 . . . . . 2.5 2.4 2.6 1 1 199 1 . . . . . 3.1 2.9 3.3 1 1 200 1 . . . . . 3.11 2.64 3.98 1 1 201 1 . . . . . 4.3 3.45 5.2 1 1 202 1 . . . . . 2.68 2.35 2.95 1 1 203 1 . . . . . 2.86 2.47 3.17 1 1 204 1 . . . . . 3.3 2.77 3.73 1 1 205 1 . . . . . 3.1 2.62 3.45 1 1 206 1 . . . . . 3.5 3.17 3.93 1 1 207 1 . . . . . 3.48 2.89 3.97 1 1 208 1 . . . . . 2.9 2.5 3.22 1 1 209 1 . . . . . 3.02 2.36 3.3 1 1 210 1 . . . . . 3.89 3.17 4.55 1 1 211 1 . . . . . 4.0 3.05 5.2 1 1 212 1 . . . . . 2.95 2.61 4.15 1 1 213 1 . . . . . . 3.27 4.34 1 1 214 1 . . . . . 2.17 1.84 2.54 1 1 215 1 . . . . . 2.7 2.51 3.68 1 1 216 1 . . . . . 3.0 2.57 3.35 1 1 217 1 . . . . . 3.4 2.84 3.86 1 1 218 1 . . . . . 3.66 3.02 4.22 1 1 219 1 . . . . . 3.78 3.53 4.39 1 1 220 1 . . . . . 3.63 2.93 4.56 1 1 221 1 . . . . . 2.5 2.23 2.74 1 1 222 1 . . . . . 2.63 2.46 2.89 1 1 223 1 . . . . . . 2.75 3.23 1 1 224 1 . . . . . 2.7 2.36 2.98 1 1 225 1 . . . . . . 2.82 3.76 1 1 226 1 . . . . . 3.35 2.81 4.09 1 1 227 1 . . . . . 3.4 2.84 3.86 1 1 228 1 . . . . . 3.3 2.77 3.73 1 1 229 1 . . . . . 3.48 2.9 3.97 1 1 230 1 . . . . . 4.12 3.33 5.32 1 1 231 1 . . . . . 2.67 2.34 2.94 1 1 232 1 . . . . . 2.62 2.31 2.88 1 1 233 1 . . . . . 2.71 2.37 2.99 1 1 234 1 . . . . . 3.56 2.95 4.08 1 1 235 1 . . . . . 3.58 2.96 4.11 1 1 236 1 . . . . . 4.12 3.67 4.77 1 1 237 1 . . . . . 3.9 3.43 4.55 1 1 238 1 . . . . . 4.72 4.14 5.39 1 1 239 1 . . . . . 2.54 2.25 2.79 1 1 240 1 . . . . . 2.84 2.46 3.15 1 1 241 1 . . . . . 3.2 2.82 3.51 1 1 242 1 . . . . . 2.85 2.46 3.76 1 1 243 1 . . . . . 3.26 2.74 3.68 1 1 244 1 . . . . . 3.73 3.06 4.32 1 1 245 1 . . . . . 2.55 2.26 2.8 1 1 246 1 . . . . . 2.55 2.26 2.8 1 1 247 1 . . . . . 3.88 3.07 4.7 1 1 248 1 . . . . . 3.4 3.1 3.8 1 1 249 1 . . . . . 2.6 2.1 3.2 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _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 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 6 TRP HD1 . 6 . HD1 1 2 1 1 2 1 1 16 ARG HE . 16 . HE 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.19 2.7 3.59 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 3 2 1 . . . 1 3 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 6 TRP HE1 . 6 . HE1 1 3 1 1 2 1 1 16 ARG O . 16 . O 1 3 2 1 1 1 1 6 TRP NE1 . 6 . NE1 1 3 2 1 2 1 1 16 ARG C . 16 . C 1 3 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 . . . . . 2.0 1.9 2.2 1 3 2 1 . . . . . 4.0 3.75 4.35 1 3 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 ASP C C -6.568 -3.352 4.434 1.00 . A A . 1 ASP C 1 1 1 2 1 1 1 ASP CA C -6.722 -4.516 5.416 1.00 . A A . 1 ASP CA 1 1 1 3 1 1 1 ASP CB C -7.675 -4.135 6.561 1.00 . A A . 1 ASP CB 1 1 1 4 1 1 1 ASP CG C -7.255 -2.870 7.290 1.00 . A A . 1 ASP CG 1 1 1 5 1 1 1 ASP H1 H -5.139 -4.225 6.710 1.00 . A A . 1 ASP H1 1 1 1 6 1 1 1 ASP H2 H -4.718 -4.962 5.220 1.00 . A A . 1 ASP H2 1 1 1 7 1 1 1 ASP H3 H -5.536 -5.867 6.424 1.00 . A A . 1 ASP H3 1 1 1 8 1 1 1 ASP HA H -7.135 -5.362 4.885 1.00 . A A . 1 ASP HA 1 1 1 9 1 1 1 ASP HB2 H -8.664 -3.981 6.157 1.00 . A A . 1 ASP HB2 1 1 1 10 1 1 1 ASP HB3 H -7.707 -4.946 7.275 1.00 . A A . 1 ASP HB3 1 1 1 11 1 1 1 ASP N N -5.411 -4.929 5.995 1.00 . A A . 1 ASP N 1 1 1 12 1 1 1 ASP O O -7.195 -3.343 3.373 1.00 . A A . 1 ASP O 1 1 1 13 1 1 1 ASP OD1 O -6.317 -2.940 8.112 1.00 . A A . 1 ASP OD1 1 1 1 14 1 1 1 ASP OD2 O -7.865 -1.809 7.038 1.00 . A A . 1 ASP OD2 1 1 1 15 1 1 2 ALA C C -4.015 -0.851 3.916 1.00 . A A . 2 ALA C 1 1 1 16 1 1 2 ALA CA C -5.497 -1.210 3.943 1.00 . A A . 2 ALA CA 1 1 1 17 1 1 2 ALA CB C -6.326 -0.028 4.423 1.00 . A A . 2 ALA CB 1 1 1 18 1 1 2 ALA H H -5.262 -2.438 5.649 1.00 . A A . 2 ALA H 1 1 1 19 1 1 2 ALA HA H -5.814 -1.459 2.940 1.00 . A A . 2 ALA HA 1 1 1 20 1 1 2 ALA HB1 H -7.146 -0.386 5.027 1.00 . A A . 2 ALA HB1 1 1 1 21 1 1 2 ALA HB2 H -6.714 0.509 3.571 1.00 . A A . 2 ALA HB2 1 1 1 22 1 1 2 ALA HB3 H -5.707 0.631 5.012 1.00 . A A . 2 ALA HB3 1 1 1 23 1 1 2 ALA N N -5.733 -2.374 4.792 1.00 . A A . 2 ALA N 1 1 1 24 1 1 2 ALA O O -3.348 -1.024 2.895 1.00 . A A . 2 ALA O 1 1 1 25 1 1 3 TYR C C -1.208 -1.230 5.118 1.00 . A A . 3 TYR C 1 1 1 26 1 1 3 TYR CA C -2.093 0.014 5.154 1.00 . A A . 3 TYR CA 1 1 1 27 1 1 3 TYR CB C -1.842 0.819 6.431 1.00 . A A . 3 TYR CB 1 1 1 28 1 1 3 TYR CD1 C -0.875 3.089 5.857 1.00 . A A . 3 TYR CD1 1 1 1 29 1 1 3 TYR CD2 C 0.596 1.412 6.709 1.00 . A A . 3 TYR CD2 1 1 1 30 1 1 3 TYR CE1 C 0.181 3.975 5.777 1.00 . A A . 3 TYR CE1 1 1 1 31 1 1 3 TYR CE2 C 1.655 2.294 6.627 1.00 . A A . 3 TYR CE2 1 1 1 32 1 1 3 TYR CG C -0.685 1.790 6.325 1.00 . A A . 3 TYR CG 1 1 1 33 1 1 3 TYR CZ C 1.443 3.574 6.161 1.00 . A A . 3 TYR CZ 1 1 1 34 1 1 3 TYR H H -4.088 -0.250 5.826 1.00 . A A . 3 TYR H 1 1 1 35 1 1 3 TYR HA H -1.851 0.626 4.302 1.00 . A A . 3 TYR HA 1 1 1 36 1 1 3 TYR HB2 H -2.728 1.389 6.670 1.00 . A A . 3 TYR HB2 1 1 1 37 1 1 3 TYR HB3 H -1.630 0.138 7.242 1.00 . A A . 3 TYR HB3 1 1 1 38 1 1 3 TYR HD1 H -1.863 3.403 5.544 1.00 . A A . 3 TYR HD1 1 1 1 39 1 1 3 TYR HD2 H 0.760 0.408 7.073 1.00 . A A . 3 TYR HD2 1 1 1 40 1 1 3 TYR HE1 H 0.015 4.979 5.419 1.00 . A A . 3 TYR HE1 1 1 1 41 1 1 3 TYR HE2 H 2.644 1.979 6.928 1.00 . A A . 3 TYR HE2 1 1 1 42 1 1 3 TYR HH H 2.861 4.441 5.195 1.00 . A A . 3 TYR HH 1 1 1 43 1 1 3 TYR N N -3.503 -0.359 5.046 1.00 . A A . 3 TYR N 1 1 1 44 1 1 3 TYR O O -0.274 -1.309 4.318 1.00 . A A . 3 TYR O 1 1 1 45 1 1 3 TYR OH O 2.496 4.456 6.083 1.00 . A A . 3 TYR OH 1 1 1 46 1 1 4 ALA C C -0.944 -4.217 4.685 1.00 . A A . 4 ALA C 1 1 1 47 1 1 4 ALA CA C -0.769 -3.463 6.003 1.00 . A A . 4 ALA CA 1 1 1 48 1 1 4 ALA CB C -1.217 -4.323 7.177 1.00 . A A . 4 ALA CB 1 1 1 49 1 1 4 ALA H H -2.288 -2.103 6.568 1.00 . A A . 4 ALA H 1 1 1 50 1 1 4 ALA HA H 0.278 -3.223 6.133 1.00 . A A . 4 ALA HA 1 1 1 51 1 1 4 ALA HB1 H -2.196 -4.731 6.973 1.00 . A A . 4 ALA HB1 1 1 1 52 1 1 4 ALA HB2 H -1.258 -3.719 8.070 1.00 . A A . 4 ALA HB2 1 1 1 53 1 1 4 ALA HB3 H -0.514 -5.131 7.320 1.00 . A A . 4 ALA HB3 1 1 1 54 1 1 4 ALA N N -1.522 -2.213 5.968 1.00 . A A . 4 ALA N 1 1 1 55 1 1 4 ALA O O -0.017 -4.875 4.210 1.00 . A A . 4 ALA O 1 1 1 56 1 1 5 GLN C C -1.615 -4.089 1.697 1.00 . A A . 5 GLN C 1 1 1 57 1 1 5 GLN CA C -2.433 -4.736 2.814 1.00 . A A . 5 GLN CA 1 1 1 58 1 1 5 GLN CB C -3.931 -4.633 2.505 1.00 . A A . 5 GLN CB 1 1 1 59 1 1 5 GLN CD C -4.269 -6.730 1.133 1.00 . A A . 5 GLN CD 1 1 1 60 1 1 5 GLN CG C -4.322 -5.214 1.157 1.00 . A A . 5 GLN CG 1 1 1 61 1 1 5 GLN H H -2.828 -3.540 4.509 1.00 . A A . 5 GLN H 1 1 1 62 1 1 5 GLN HA H -2.157 -5.778 2.893 1.00 . A A . 5 GLN HA 1 1 1 63 1 1 5 GLN HB2 H -4.480 -5.159 3.271 1.00 . A A . 5 GLN HB2 1 1 1 64 1 1 5 GLN HB3 H -4.217 -3.591 2.521 1.00 . A A . 5 GLN HB3 1 1 1 65 1 1 5 GLN HE21 H -2.595 -6.688 0.055 1.00 . A A . 5 GLN HE21 1 1 1 66 1 1 5 GLN HE22 H -3.194 -8.259 0.452 1.00 . A A . 5 GLN HE22 1 1 1 67 1 1 5 GLN HG2 H -5.328 -4.901 0.923 1.00 . A A . 5 GLN HG2 1 1 1 68 1 1 5 GLN HG3 H -3.644 -4.832 0.409 1.00 . A A . 5 GLN HG3 1 1 1 69 1 1 5 GLN N N -2.137 -4.094 4.089 1.00 . A A . 5 GLN N 1 1 1 70 1 1 5 GLN NE2 N -3.249 -7.281 0.481 1.00 . A A . 5 GLN NE2 1 1 1 71 1 1 5 GLN O O -1.112 -4.776 0.809 1.00 . A A . 5 GLN O 1 1 1 72 1 1 5 GLN OE1 O -5.134 -7.401 1.696 1.00 . A A . 5 GLN OE1 1 1 1 73 1 1 6 TRP C C 0.746 -2.468 0.768 1.00 . A A . 6 TRP C 1 1 1 74 1 1 6 TRP CA C -0.708 -2.007 0.775 1.00 . A A . 6 TRP CA 1 1 1 75 1 1 6 TRP CB C -0.773 -0.507 1.083 1.00 . A A . 6 TRP CB 1 1 1 76 1 1 6 TRP CD1 C -0.327 0.628 -1.161 1.00 . A A . 6 TRP CD1 1 1 1 77 1 1 6 TRP CD2 C 1.263 0.984 0.371 1.00 . A A . 6 TRP CD2 1 1 1 78 1 1 6 TRP CE2 C 1.622 1.651 -0.814 1.00 . A A . 6 TRP CE2 1 1 1 79 1 1 6 TRP CE3 C 2.116 1.069 1.475 1.00 . A A . 6 TRP CE3 1 1 1 80 1 1 6 TRP CG C 0.010 0.332 0.124 1.00 . A A . 6 TRP CG 1 1 1 81 1 1 6 TRP CH2 C 3.608 2.465 0.164 1.00 . A A . 6 TRP CH2 1 1 1 82 1 1 6 TRP CZ2 C 2.793 2.393 -0.930 1.00 . A A . 6 TRP CZ2 1 1 1 83 1 1 6 TRP CZ3 C 3.280 1.811 1.362 1.00 . A A . 6 TRP CZ3 1 1 1 84 1 1 6 TRP H H -1.896 -2.276 2.506 1.00 . A A . 6 TRP H 1 1 1 85 1 1 6 TRP HA H -1.140 -2.190 -0.196 1.00 . A A . 6 TRP HA 1 1 1 86 1 1 6 TRP HB2 H -1.800 -0.184 1.046 1.00 . A A . 6 TRP HB2 1 1 1 87 1 1 6 TRP HB3 H -0.383 -0.332 2.072 1.00 . A A . 6 TRP HB3 1 1 1 88 1 1 6 TRP HD1 H -1.224 0.282 -1.648 1.00 . A A . 6 TRP HD1 1 1 1 89 1 1 6 TRP HE1 H 0.622 1.751 -2.648 1.00 . A A . 6 TRP HE1 1 1 1 90 1 1 6 TRP HE3 H 1.879 0.569 2.404 1.00 . A A . 6 TRP HE3 1 1 1 91 1 1 6 TRP HH2 H 4.523 3.040 0.119 1.00 . A A . 6 TRP HH2 1 1 1 92 1 1 6 TRP HZ2 H 3.062 2.896 -1.847 1.00 . A A . 6 TRP HZ2 1 1 1 93 1 1 6 TRP HZ3 H 3.952 1.890 2.204 1.00 . A A . 6 TRP HZ3 1 1 1 94 1 1 6 TRP N N -1.477 -2.761 1.764 1.00 . A A . 6 TRP N 1 1 1 95 1 1 6 TRP NE1 N 0.638 1.412 -1.731 1.00 . A A . 6 TRP NE1 1 1 1 96 1 1 6 TRP O O 1.311 -2.757 -0.288 1.00 . A A . 6 TRP O 1 1 1 97 1 1 7 LEU C C 2.881 -4.431 1.678 1.00 . A A . 7 LEU C 1 1 1 98 1 1 7 LEU CA C 2.720 -2.974 2.115 1.00 . A A . 7 LEU CA 1 1 1 99 1 1 7 LEU CB C 3.163 -2.801 3.571 1.00 . A A . 7 LEU CB 1 1 1 100 1 1 7 LEU CD1 C 3.118 -1.339 5.613 1.00 . A A . 7 LEU CD1 1 1 1 101 1 1 7 LEU CD2 C 4.312 -0.564 3.554 1.00 . A A . 7 LEU CD2 1 1 1 102 1 1 7 LEU CG C 3.129 -1.359 4.092 1.00 . A A . 7 LEU CG 1 1 1 103 1 1 7 LEU H H 0.820 -2.300 2.760 1.00 . A A . 7 LEU H 1 1 1 104 1 1 7 LEU HA H 3.336 -2.351 1.483 1.00 . A A . 7 LEU HA 1 1 1 105 1 1 7 LEU HB2 H 2.514 -3.401 4.193 1.00 . A A . 7 LEU HB2 1 1 1 106 1 1 7 LEU HB3 H 4.170 -3.173 3.668 1.00 . A A . 7 LEU HB3 1 1 1 107 1 1 7 LEU HD11 H 4.056 -1.722 5.986 1.00 . A A . 7 LEU HD11 1 1 1 108 1 1 7 LEU HD12 H 2.308 -1.954 5.975 1.00 . A A . 7 LEU HD12 1 1 1 109 1 1 7 LEU HD13 H 2.981 -0.325 5.958 1.00 . A A . 7 LEU HD13 1 1 1 110 1 1 7 LEU HD21 H 4.164 -0.362 2.502 1.00 . A A . 7 LEU HD21 1 1 1 111 1 1 7 LEU HD22 H 5.220 -1.133 3.687 1.00 . A A . 7 LEU HD22 1 1 1 112 1 1 7 LEU HD23 H 4.391 0.371 4.091 1.00 . A A . 7 LEU HD23 1 1 1 113 1 1 7 LEU HG H 2.222 -0.882 3.748 1.00 . A A . 7 LEU HG 1 1 1 114 1 1 7 LEU N N 1.336 -2.540 1.960 1.00 . A A . 7 LEU N 1 1 1 115 1 1 7 LEU O O 3.899 -4.802 1.090 1.00 . A A . 7 LEU O 1 1 1 116 1 1 8 ALA C C 1.612 -6.857 0.091 1.00 . A A . 8 ALA C 1 1 1 117 1 1 8 ALA CA C 1.873 -6.662 1.589 1.00 . A A . 8 ALA CA 1 1 1 118 1 1 8 ALA CB C 0.845 -7.431 2.409 1.00 . A A . 8 ALA CB 1 1 1 119 1 1 8 ALA H H 1.076 -4.885 2.423 1.00 . A A . 8 ALA H 1 1 1 120 1 1 8 ALA HA H 2.850 -7.057 1.825 1.00 . A A . 8 ALA HA 1 1 1 121 1 1 8 ALA HB1 H 0.606 -8.358 1.908 1.00 . A A . 8 ALA HB1 1 1 1 122 1 1 8 ALA HB2 H -0.051 -6.837 2.514 1.00 . A A . 8 ALA HB2 1 1 1 123 1 1 8 ALA HB3 H 1.252 -7.645 3.386 1.00 . A A . 8 ALA HB3 1 1 1 124 1 1 8 ALA N N 1.861 -5.247 1.960 1.00 . A A . 8 ALA N 1 1 1 125 1 1 8 ALA O O 1.923 -7.912 -0.463 1.00 . A A . 8 ALA O 1 1 1 126 1 1 9 ASP C C 1.959 -5.439 -2.837 1.00 . A A . 9 ASP C 1 1 1 127 1 1 9 ASP CA C 0.758 -5.896 -1.998 1.00 . A A . 9 ASP CA 1 1 1 128 1 1 9 ASP CB C -0.467 -5.034 -2.332 1.00 . A A . 9 ASP CB 1 1 1 129 1 1 9 ASP CG C -1.564 -5.828 -3.013 1.00 . A A . 9 ASP CG 1 1 1 130 1 1 9 ASP H H 0.829 -5.015 -0.071 1.00 . A A . 9 ASP H 1 1 1 131 1 1 9 ASP HA H 0.538 -6.924 -2.243 1.00 . A A . 9 ASP HA 1 1 1 132 1 1 9 ASP HB2 H -0.867 -4.614 -1.422 1.00 . A A . 9 ASP HB2 1 1 1 133 1 1 9 ASP HB3 H -0.167 -4.231 -2.991 1.00 . A A . 9 ASP HB3 1 1 1 134 1 1 9 ASP N N 1.049 -5.833 -0.563 1.00 . A A . 9 ASP N 1 1 1 135 1 1 9 ASP O O 1.819 -5.163 -4.031 1.00 . A A . 9 ASP O 1 1 1 136 1 1 9 ASP OD1 O -1.466 -6.046 -4.239 1.00 . A A . 9 ASP OD1 1 1 1 137 1 1 9 ASP OD2 O -2.521 -6.231 -2.319 1.00 . A A . 9 ASP OD2 1 1 1 138 1 1 10 DAL C C 4.741 -3.501 -2.535 1.00 . A A . 10 DAL C 1 1 1 139 1 1 10 DAL CA C 4.353 -4.937 -2.898 1.00 . A A . 10 DAL CA 1 1 1 140 1 1 10 DAL CB C 5.490 -5.884 -2.559 1.00 . A A . 10 DAL CB 1 1 1 141 1 1 10 DAL H H 3.191 -5.590 -1.261 1.00 . A A . 10 DAL H 1 1 1 142 1 1 10 DAL HA H 4.174 -4.994 -3.962 1.00 . A A . 10 DAL HA 1 1 1 143 1 1 10 DAL HB1 H 5.746 -5.773 -1.516 1.00 . A A . 10 DAL HB1 1 1 1 144 1 1 10 DAL HB2 H 6.349 -5.649 -3.169 1.00 . A A . 10 DAL HB2 1 1 1 145 1 1 10 DAL HB3 H 5.180 -6.901 -2.747 1.00 . A A . 10 DAL HB3 1 1 1 146 1 1 10 DAL N N 3.137 -5.360 -2.210 1.00 . A A . 10 DAL N 1 1 1 147 1 1 10 DAL O O 5.779 -3.005 -2.979 1.00 . A A . 10 DAL O 1 1 1 148 1 1 11 GLY C C 4.100 -0.498 -2.478 1.00 . A A . 11 GLY C 1 1 1 149 1 1 11 GLY CA C 4.186 -1.471 -1.322 1.00 . A A . 11 GLY CA 1 1 1 150 1 1 11 GLY H H 3.097 -3.280 -1.405 1.00 . A A . 11 GLY H 1 1 1 151 1 1 11 GLY HA2 H 3.473 -1.176 -0.566 1.00 . A A . 11 GLY HA2 1 1 1 152 1 1 11 GLY HA3 H 5.180 -1.426 -0.902 1.00 . A A . 11 GLY HA3 1 1 1 153 1 1 11 GLY N N 3.907 -2.837 -1.727 1.00 . A A . 11 GLY N 1 1 1 154 1 1 11 GLY O O 3.011 -0.043 -2.833 1.00 . A A . 11 GLY O 1 1 1 155 1 1 12 TRP C C 5.347 0.017 -5.539 1.00 . A A . 12 TRP C 1 1 1 156 1 1 12 TRP CA C 5.297 0.747 -4.194 1.00 . A A . 12 TRP CA 1 1 1 157 1 1 12 TRP CB C 6.483 1.699 -4.033 1.00 . A A . 12 TRP CB 1 1 1 158 1 1 12 TRP CD1 C 6.691 3.088 -1.896 1.00 . A A . 12 TRP CD1 1 1 1 159 1 1 12 TRP CD2 C 5.158 3.842 -3.345 1.00 . A A . 12 TRP CD2 1 1 1 160 1 1 12 TRP CE2 C 5.155 4.675 -2.213 1.00 . A A . 12 TRP CE2 1 1 1 161 1 1 12 TRP CE3 C 4.274 4.126 -4.395 1.00 . A A . 12 TRP CE3 1 1 1 162 1 1 12 TRP CG C 6.147 2.831 -3.121 1.00 . A A . 12 TRP CG 1 1 1 163 1 1 12 TRP CH2 C 3.450 6.021 -3.136 1.00 . A A . 12 TRP CH2 1 1 1 164 1 1 12 TRP CZ2 C 4.303 5.765 -2.096 1.00 . A A . 12 TRP CZ2 1 1 1 165 1 1 12 TRP CZ3 C 3.433 5.213 -4.280 1.00 . A A . 12 TRP CZ3 1 1 1 166 1 1 12 TRP H H 6.084 -0.578 -2.741 1.00 . A A . 12 TRP H 1 1 1 167 1 1 12 TRP HA H 4.387 1.332 -4.162 1.00 . A A . 12 TRP HA 1 1 1 168 1 1 12 TRP HB2 H 7.320 1.159 -3.612 1.00 . A A . 12 TRP HB2 1 1 1 169 1 1 12 TRP HB3 H 6.762 2.103 -4.994 1.00 . A A . 12 TRP HB3 1 1 1 170 1 1 12 TRP HD1 H 7.471 2.496 -1.440 1.00 . A A . 12 TRP HD1 1 1 1 171 1 1 12 TRP HE1 H 6.317 4.581 -0.468 1.00 . A A . 12 TRP HE1 1 1 1 172 1 1 12 TRP HE3 H 4.244 3.514 -5.285 1.00 . A A . 12 TRP HE3 1 1 1 173 1 1 12 TRP HH2 H 2.774 6.862 -3.087 1.00 . A A . 12 TRP HH2 1 1 1 174 1 1 12 TRP HZ2 H 4.298 6.387 -1.217 1.00 . A A . 12 TRP HZ2 1 1 1 175 1 1 12 TRP HZ3 H 2.748 5.448 -5.083 1.00 . A A . 12 TRP HZ3 1 1 1 176 1 1 12 TRP N N 5.249 -0.180 -3.069 1.00 . A A . 12 TRP N 1 1 1 177 1 1 12 TRP NE1 N 6.098 4.196 -1.343 1.00 . A A . 12 TRP NE1 1 1 1 178 1 1 12 TRP O O 5.599 0.633 -6.577 1.00 . A A . 12 TRP O 1 1 1 179 1 1 13 ALA C C 3.662 -2.039 -7.375 1.00 . A A . 13 ALA C 1 1 1 180 1 1 13 ALA CA C 5.049 -2.088 -6.741 1.00 . A A . 13 ALA CA 1 1 1 181 1 1 13 ALA CB C 5.459 -3.523 -6.451 1.00 . A A . 13 ALA CB 1 1 1 182 1 1 13 ALA H H 4.851 -1.722 -4.670 1.00 . A A . 13 ALA H 1 1 1 183 1 1 13 ALA HA H 5.762 -1.664 -7.429 1.00 . A A . 13 ALA HA 1 1 1 184 1 1 13 ALA HB1 H 5.407 -3.707 -5.389 1.00 . A A . 13 ALA HB1 1 1 1 185 1 1 13 ALA HB2 H 6.470 -3.680 -6.794 1.00 . A A . 13 ALA HB2 1 1 1 186 1 1 13 ALA HB3 H 4.795 -4.200 -6.968 1.00 . A A . 13 ALA HB3 1 1 1 187 1 1 13 ALA N N 5.071 -1.290 -5.520 1.00 . A A . 13 ALA N 1 1 1 188 1 1 13 ALA O O 3.527 -2.081 -8.600 1.00 . A A . 13 ALA O 1 1 1 189 1 1 14 SER C C 1.035 -0.582 -7.827 1.00 . A A . 14 SER C 1 1 1 190 1 1 14 SER CA C 1.251 -1.842 -6.984 1.00 . A A . 14 SER CA 1 1 1 191 1 1 14 SER CB C 0.292 -1.850 -5.783 1.00 . A A . 14 SER CB 1 1 1 192 1 1 14 SER H H 2.817 -1.883 -5.564 1.00 . A A . 14 SER H 1 1 1 193 1 1 14 SER HA H 1.052 -2.705 -7.599 1.00 . A A . 14 SER HA 1 1 1 194 1 1 14 SER HB2 H -0.612 -1.321 -6.043 1.00 . A A . 14 SER HB2 1 1 1 195 1 1 14 SER HB3 H 0.047 -2.871 -5.528 1.00 . A A . 14 SER HB3 1 1 1 196 1 1 14 SER HG H 1.203 -1.896 -4.042 1.00 . A A . 14 SER HG 1 1 1 197 1 1 14 SER N N 2.636 -1.926 -6.526 1.00 . A A . 14 SER N 1 1 1 198 1 1 14 SER O O 0.187 -0.564 -8.721 1.00 . A A . 14 SER O 1 1 1 199 1 1 14 SER OG O 0.874 -1.224 -4.648 1.00 . A A . 14 SER OG 1 1 1 200 1 1 15 DAL C C 0.887 2.766 -7.499 1.00 . A A . 15 DAL C 1 1 1 201 1 1 15 DAL CA C 1.713 1.732 -8.268 1.00 . A A . 15 DAL CA 1 1 1 202 1 1 15 DAL CB C 3.104 2.271 -8.562 1.00 . A A . 15 DAL CB 1 1 1 203 1 1 15 DAL H H 2.469 0.389 -6.814 1.00 . A A . 15 DAL H 1 1 1 204 1 1 15 DAL HA H 1.230 1.533 -9.211 1.00 . A A . 15 DAL HA 1 1 1 205 1 1 15 DAL HB1 H 3.814 1.825 -7.883 1.00 . A A . 15 DAL HB1 1 1 1 206 1 1 15 DAL HB2 H 3.109 3.343 -8.436 1.00 . A A . 15 DAL HB2 1 1 1 207 1 1 15 DAL HB3 H 3.373 2.027 -9.578 1.00 . A A . 15 DAL HB3 1 1 1 208 1 1 15 DAL N N 1.812 0.468 -7.537 1.00 . A A . 15 DAL N 1 1 1 209 1 1 15 DAL O O 1.042 3.973 -7.700 1.00 . A A . 15 DAL O 1 1 1 210 1 1 16 ARG C C -0.115 3.607 -4.546 1.00 . A A . 16 ARG C 1 1 1 211 1 1 16 ARG CA C -0.841 3.162 -5.817 1.00 . A A . 16 ARG CA 1 1 1 212 1 1 16 ARG CB C -2.147 2.430 -5.448 1.00 . A A . 16 ARG CB 1 1 1 213 1 1 16 ARG CD C -2.995 0.318 -4.375 1.00 . A A . 16 ARG CD 1 1 1 214 1 1 16 ARG CG C -1.997 1.463 -4.279 1.00 . A A . 16 ARG CG 1 1 1 215 1 1 16 ARG CZ C -3.489 -0.326 -2.037 1.00 . A A . 16 ARG CZ 1 1 1 216 1 1 16 ARG H H -0.066 1.315 -6.504 1.00 . A A . 16 ARG H 1 1 1 217 1 1 16 ARG HA H -1.073 4.039 -6.408 1.00 . A A . 16 ARG HA 1 1 1 218 1 1 16 ARG HB2 H -2.895 3.162 -5.186 1.00 . A A . 16 ARG HB2 1 1 1 219 1 1 16 ARG HB3 H -2.495 1.862 -6.306 1.00 . A A . 16 ARG HB3 1 1 1 220 1 1 16 ARG HD2 H -3.991 0.729 -4.439 1.00 . A A . 16 ARG HD2 1 1 1 221 1 1 16 ARG HD3 H -2.783 -0.248 -5.269 1.00 . A A . 16 ARG HD3 1 1 1 222 1 1 16 ARG HE H -2.434 -1.420 -3.336 1.00 . A A . 16 ARG HE 1 1 1 223 1 1 16 ARG HG2 H -0.996 1.056 -4.287 1.00 . A A . 16 ARG HG2 1 1 1 224 1 1 16 ARG HG3 H -2.164 1.999 -3.357 1.00 . A A . 16 ARG HG3 1 1 1 225 1 1 16 ARG HH11 H -4.240 1.482 -2.566 1.00 . A A . 16 ARG HH11 1 1 1 226 1 1 16 ARG HH12 H -4.574 0.988 -0.941 1.00 . A A . 16 ARG HH12 1 1 1 227 1 1 16 ARG HH21 H -2.881 -2.064 -1.196 1.00 . A A . 16 ARG HH21 1 1 1 228 1 1 16 ARG HH22 H -3.802 -1.023 -0.162 1.00 . A A . 16 ARG HH22 1 1 1 229 1 1 16 ARG N N 0.011 2.286 -6.619 1.00 . A A . 16 ARG N 1 1 1 230 1 1 16 ARG NE N -2.924 -0.579 -3.221 1.00 . A A . 16 ARG NE 1 1 1 231 1 1 16 ARG NH1 N -4.156 0.808 -1.832 1.00 . A A . 16 ARG NH1 1 1 1 232 1 1 16 ARG NH2 N -3.382 -1.210 -1.051 1.00 . A A . 16 ARG NH2 1 1 1 233 1 1 16 ARG O O 0.771 2.906 -4.058 1.00 . A A . 16 ARG O 1 1 1 234 1 1 17 PRO C C -0.489 4.722 -1.503 1.00 . A A . 17 PRO C 1 1 1 235 1 1 17 PRO CA C 0.138 5.303 -2.770 1.00 . A A . 17 PRO CA 1 1 1 236 1 1 17 PRO CB C -0.118 6.815 -2.846 1.00 . A A . 17 PRO CB 1 1 1 237 1 1 17 PRO CD C -1.503 5.696 -4.487 1.00 . A A . 17 PRO CD 1 1 1 238 1 1 17 PRO CG C -0.986 7.041 -4.050 1.00 . A A . 17 PRO CG 1 1 1 239 1 1 17 PRO HA H 1.199 5.116 -2.752 1.00 . A A . 17 PRO HA 1 1 1 240 1 1 17 PRO HB2 H -0.615 7.139 -1.944 1.00 . A A . 17 PRO HB2 1 1 1 241 1 1 17 PRO HB3 H 0.828 7.330 -2.942 1.00 . A A . 17 PRO HB3 1 1 1 242 1 1 17 PRO HD2 H -2.459 5.489 -4.034 1.00 . A A . 17 PRO HD2 1 1 1 243 1 1 17 PRO HD3 H -1.575 5.654 -5.561 1.00 . A A . 17 PRO HD3 1 1 1 244 1 1 17 PRO HG2 H -1.811 7.686 -3.787 1.00 . A A . 17 PRO HG2 1 1 1 245 1 1 17 PRO HG3 H -0.401 7.489 -4.840 1.00 . A A . 17 PRO HG3 1 1 1 246 1 1 17 PRO N N -0.477 4.780 -3.988 1.00 . A A . 17 PRO N 1 1 1 247 1 1 17 PRO O O -1.561 4.113 -1.548 1.00 . A A . 17 PRO O 1 1 1 248 1 1 18 PRO C C -1.632 4.990 1.365 1.00 . A A . 18 PRO C 1 1 1 249 1 1 18 PRO CA C -0.289 4.393 0.942 1.00 . A A . 18 PRO CA 1 1 1 250 1 1 18 PRO CB C 0.795 4.826 1.935 1.00 . A A . 18 PRO CB 1 1 1 251 1 1 18 PRO CD C 1.474 5.604 -0.229 1.00 . A A . 18 PRO CD 1 1 1 252 1 1 18 PRO CG C 1.586 5.881 1.240 1.00 . A A . 18 PRO CG 1 1 1 253 1 1 18 PRO HA H -0.363 3.314 0.934 1.00 . A A . 18 PRO HA 1 1 1 254 1 1 18 PRO HB2 H 0.326 5.217 2.822 1.00 . A A . 18 PRO HB2 1 1 1 255 1 1 18 PRO HB3 H 1.407 3.980 2.195 1.00 . A A . 18 PRO HB3 1 1 1 256 1 1 18 PRO HD2 H 1.462 6.528 -0.787 1.00 . A A . 18 PRO HD2 1 1 1 257 1 1 18 PRO HD3 H 2.287 4.975 -0.558 1.00 . A A . 18 PRO HD3 1 1 1 258 1 1 18 PRO HG2 H 1.177 6.854 1.468 1.00 . A A . 18 PRO HG2 1 1 1 259 1 1 18 PRO HG3 H 2.619 5.828 1.552 1.00 . A A . 18 PRO HG3 1 1 1 260 1 1 18 PRO N N 0.186 4.901 -0.351 1.00 . A A . 18 PRO N 1 1 1 261 1 1 18 PRO O O -1.906 6.166 1.117 1.00 . A A . 18 PRO O 1 1 1 262 1 1 19 PRO C C -3.702 5.410 3.806 1.00 . A A . 19 PRO C 1 1 1 263 1 1 19 PRO CA C -3.788 4.626 2.498 1.00 . A A . 19 PRO CA 1 1 1 264 1 1 19 PRO CB C -4.560 3.325 2.697 1.00 . A A . 19 PRO CB 1 1 1 265 1 1 19 PRO CD C -2.225 2.773 2.364 1.00 . A A . 19 PRO CD 1 1 1 266 1 1 19 PRO CG C -3.546 2.247 2.866 1.00 . A A . 19 PRO CG 1 1 1 267 1 1 19 PRO HA H -4.288 5.230 1.754 1.00 . A A . 19 PRO HA 1 1 1 268 1 1 19 PRO HB2 H -5.193 3.408 3.568 1.00 . A A . 19 PRO HB2 1 1 1 269 1 1 19 PRO HB3 H -5.160 3.145 1.836 1.00 . A A . 19 PRO HB3 1 1 1 270 1 1 19 PRO HD2 H -1.470 2.699 3.131 1.00 . A A . 19 PRO HD2 1 1 1 271 1 1 19 PRO HD3 H -1.926 2.223 1.487 1.00 . A A . 19 PRO HD3 1 1 1 272 1 1 19 PRO HG2 H -3.476 1.977 3.904 1.00 . A A . 19 PRO HG2 1 1 1 273 1 1 19 PRO HG3 H -3.843 1.386 2.285 1.00 . A A . 19 PRO HG3 1 1 1 274 1 1 19 PRO N N -2.483 4.181 2.026 1.00 . A A . 19 PRO N 1 1 1 275 1 1 19 PRO O O -3.244 4.891 4.824 1.00 . A A . 19 PRO O 1 1 1 276 1 1 20 SER C C -5.541 7.790 5.461 1.00 . A A . 20 SER C 1 1 1 277 1 1 20 SER CA C -4.127 7.529 4.945 1.00 . A A . 20 SER CA 1 1 1 278 1 1 20 SER CB C -3.429 8.856 4.622 1.00 . A A . 20 SER CB 1 1 1 279 1 1 20 SER H H -4.503 7.018 2.923 1.00 . A A . 20 SER H 1 1 1 280 1 1 20 SER HA H -3.567 7.020 5.715 1.00 . A A . 20 SER HA 1 1 1 281 1 1 20 SER HB2 H -3.552 9.535 5.452 1.00 . A A . 20 SER HB2 1 1 1 282 1 1 20 SER HB3 H -2.377 8.675 4.459 1.00 . A A . 20 SER HB3 1 1 1 283 1 1 20 SER HG H -3.415 9.262 2.705 1.00 . A A . 20 SER HG 1 1 1 284 1 1 20 SER N N -4.149 6.665 3.766 1.00 . A A . 20 SER N 1 1 1 285 1 1 20 SER O O -6.406 8.192 4.652 1.00 . A A . 20 SER O 1 1 1 286 1 1 20 SER OXT O -5.772 7.590 6.672 1.00 . A A . 20 SER OXT 1 1 1 287 1 1 20 SER OG O -3.975 9.456 3.459 1.00 . A A . 20 SER OG 1 1 2 288 1 1 1 ASP C C -6.807 -2.281 5.693 1.00 . A A . 1 ASP C 1 1 2 289 1 1 1 ASP CA C -7.492 -1.761 6.956 1.00 . A A . 1 ASP CA 1 1 2 290 1 1 1 ASP CB C -7.078 -2.604 8.166 1.00 . A A . 1 ASP CB 1 1 2 291 1 1 1 ASP CG C -5.736 -2.183 8.735 1.00 . A A . 1 ASP CG 1 1 2 292 1 1 1 ASP H1 H -9.381 -1.435 7.709 1.00 . A A . 1 ASP H1 1 1 2 293 1 1 1 ASP H2 H -9.249 -2.800 6.677 1.00 . A A . 1 ASP H2 1 1 2 294 1 1 1 ASP H3 H -9.242 -1.216 6.015 1.00 . A A . 1 ASP H3 1 1 2 295 1 1 1 ASP HA H -7.195 -0.735 7.120 1.00 . A A . 1 ASP HA 1 1 2 296 1 1 1 ASP HB2 H -7.824 -2.503 8.940 1.00 . A A . 1 ASP HB2 1 1 2 297 1 1 1 ASP HB3 H -7.014 -3.641 7.869 1.00 . A A . 1 ASP HB3 1 1 2 298 1 1 1 ASP N N -8.974 -1.807 6.827 1.00 . A A . 1 ASP N 1 1 2 299 1 1 1 ASP O O -6.917 -3.463 5.359 1.00 . A A . 1 ASP O 1 1 2 300 1 1 1 ASP OD1 O -4.700 -2.483 8.103 1.00 . A A . 1 ASP OD1 1 1 2 301 1 1 1 ASP OD2 O -5.721 -1.553 9.814 1.00 . A A . 1 ASP OD2 1 1 2 302 1 1 2 ALA C C -3.923 -1.336 3.803 1.00 . A A . 2 ALA C 1 1 2 303 1 1 2 ALA CA C -5.398 -1.756 3.770 1.00 . A A . 2 ALA CA 1 1 2 304 1 1 2 ALA CB C -6.096 -1.139 2.567 1.00 . A A . 2 ALA CB 1 1 2 305 1 1 2 ALA H H -6.055 -0.464 5.315 1.00 . A A . 2 ALA H 1 1 2 306 1 1 2 ALA HA H -5.448 -2.830 3.667 1.00 . A A . 2 ALA HA 1 1 2 307 1 1 2 ALA HB1 H -5.829 -1.687 1.676 1.00 . A A . 2 ALA HB1 1 1 2 308 1 1 2 ALA HB2 H -5.790 -0.109 2.462 1.00 . A A . 2 ALA HB2 1 1 2 309 1 1 2 ALA HB3 H -7.166 -1.183 2.710 1.00 . A A . 2 ALA HB3 1 1 2 310 1 1 2 ALA N N -6.102 -1.390 4.997 1.00 . A A . 2 ALA N 1 1 2 311 1 1 2 ALA O O -3.235 -1.410 2.783 1.00 . A A . 2 ALA O 1 1 2 312 1 1 3 TYR C C -1.097 -1.670 5.029 1.00 . A A . 3 TYR C 1 1 2 313 1 1 3 TYR CA C -2.042 -0.473 5.106 1.00 . A A . 3 TYR CA 1 1 2 314 1 1 3 TYR CB C -1.832 0.296 6.413 1.00 . A A . 3 TYR CB 1 1 2 315 1 1 3 TYR CD1 C -0.971 2.627 5.918 1.00 . A A . 3 TYR CD1 1 1 2 316 1 1 3 TYR CD2 C 0.576 0.992 6.714 1.00 . A A . 3 TYR CD2 1 1 2 317 1 1 3 TYR CE1 C 0.042 3.563 5.867 1.00 . A A . 3 TYR CE1 1 1 2 318 1 1 3 TYR CE2 C 1.594 1.925 6.662 1.00 . A A . 3 TYR CE2 1 1 2 319 1 1 3 TYR CG C -0.721 1.323 6.342 1.00 . A A . 3 TYR CG 1 1 2 320 1 1 3 TYR CZ C 1.322 3.209 6.238 1.00 . A A . 3 TYR CZ 1 1 2 321 1 1 3 TYR H H -4.025 -0.859 5.753 1.00 . A A . 3 TYR H 1 1 2 322 1 1 3 TYR HA H -1.821 0.180 4.281 1.00 . A A . 3 TYR HA 1 1 2 323 1 1 3 TYR HB2 H -2.743 0.814 6.670 1.00 . A A . 3 TYR HB2 1 1 2 324 1 1 3 TYR HB3 H -1.588 -0.403 7.199 1.00 . A A . 3 TYR HB3 1 1 2 325 1 1 3 TYR HD1 H -1.973 2.905 5.615 1.00 . A A . 3 TYR HD1 1 1 2 326 1 1 3 TYR HD2 H 0.787 -0.014 7.045 1.00 . A A . 3 TYR HD2 1 1 2 327 1 1 3 TYR HE1 H -0.171 4.569 5.543 1.00 . A A . 3 TYR HE1 1 1 2 328 1 1 3 TYR HE2 H 2.596 1.647 6.952 1.00 . A A . 3 TYR HE2 1 1 2 329 1 1 3 TYR HH H 2.712 4.157 5.305 1.00 . A A . 3 TYR HH 1 1 2 330 1 1 3 TYR N N -3.437 -0.897 4.970 1.00 . A A . 3 TYR N 1 1 2 331 1 1 3 TYR O O -0.184 -1.689 4.202 1.00 . A A . 3 TYR O 1 1 2 332 1 1 3 TYR OH O 2.333 4.142 6.188 1.00 . A A . 3 TYR OH 1 1 2 333 1 1 4 ALA C C -0.627 -4.599 4.525 1.00 . A A . 4 ALA C 1 1 2 334 1 1 4 ALA CA C -0.508 -3.883 5.870 1.00 . A A . 4 ALA CA 1 1 2 335 1 1 4 ALA CB C -0.909 -4.809 7.009 1.00 . A A . 4 ALA CB 1 1 2 336 1 1 4 ALA H H -2.084 -2.614 6.500 1.00 . A A . 4 ALA H 1 1 2 337 1 1 4 ALA HA H 0.523 -3.586 6.019 1.00 . A A . 4 ALA HA 1 1 2 338 1 1 4 ALA HB1 H -0.398 -5.755 6.902 1.00 . A A . 4 ALA HB1 1 1 2 339 1 1 4 ALA HB2 H -1.976 -4.972 6.981 1.00 . A A . 4 ALA HB2 1 1 2 340 1 1 4 ALA HB3 H -0.638 -4.359 7.952 1.00 . A A . 4 ALA HB3 1 1 2 341 1 1 4 ALA N N -1.332 -2.677 5.875 1.00 . A A . 4 ALA N 1 1 2 342 1 1 4 ALA O O 0.351 -5.150 4.018 1.00 . A A . 4 ALA O 1 1 2 343 1 1 5 GLN C C -1.320 -4.451 1.550 1.00 . A A . 5 GLN C 1 1 2 344 1 1 5 GLN CA C -2.088 -5.185 2.651 1.00 . A A . 5 GLN CA 1 1 2 345 1 1 5 GLN CB C -3.590 -5.174 2.348 1.00 . A A . 5 GLN CB 1 1 2 346 1 1 5 GLN CD C -3.926 -7.339 1.087 1.00 . A A . 5 GLN CD 1 1 2 347 1 1 5 GLN CG C -3.950 -5.823 1.023 1.00 . A A . 5 GLN CG 1 1 2 348 1 1 5 GLN H H -2.565 -4.096 4.394 1.00 . A A . 5 GLN H 1 1 2 349 1 1 5 GLN HA H -1.743 -6.207 2.696 1.00 . A A . 5 GLN HA 1 1 2 350 1 1 5 GLN HB2 H -4.107 -5.703 3.135 1.00 . A A . 5 GLN HB2 1 1 2 351 1 1 5 GLN HB3 H -3.934 -4.151 2.329 1.00 . A A . 5 GLN HB3 1 1 2 352 1 1 5 GLN HE21 H -2.000 -7.360 0.584 1.00 . A A . 5 GLN HE21 1 1 2 353 1 1 5 GLN HE22 H -2.726 -8.906 0.846 1.00 . A A . 5 GLN HE22 1 1 2 354 1 1 5 GLN HG2 H -4.941 -5.506 0.738 1.00 . A A . 5 GLN HG2 1 1 2 355 1 1 5 GLN HG3 H -3.241 -5.497 0.279 1.00 . A A . 5 GLN HG3 1 1 2 356 1 1 5 GLN N N -1.832 -4.565 3.945 1.00 . A A . 5 GLN N 1 1 2 357 1 1 5 GLN NE2 N -2.767 -7.928 0.811 1.00 . A A . 5 GLN NE2 1 1 2 358 1 1 5 GLN O O -0.777 -5.078 0.641 1.00 . A A . 5 GLN O 1 1 2 359 1 1 5 GLN OE1 O -4.938 -7.974 1.382 1.00 . A A . 5 GLN OE1 1 1 2 360 1 1 6 TRP C C 0.925 -2.670 0.653 1.00 . A A . 6 TRP C 1 1 2 361 1 1 6 TRP CA C -0.551 -2.291 0.684 1.00 . A A . 6 TRP CA 1 1 2 362 1 1 6 TRP CB C -0.694 -0.806 1.039 1.00 . A A . 6 TRP CB 1 1 2 363 1 1 6 TRP CD1 C -0.330 0.431 -1.168 1.00 . A A . 6 TRP CD1 1 1 2 364 1 1 6 TRP CD2 C 1.253 0.818 0.364 1.00 . A A . 6 TRP CD2 1 1 2 365 1 1 6 TRP CE2 C 1.562 1.548 -0.796 1.00 . A A . 6 TRP CE2 1 1 2 366 1 1 6 TRP CE3 C 2.111 0.909 1.465 1.00 . A A . 6 TRP CE3 1 1 2 367 1 1 6 TRP CG C 0.035 0.107 0.103 1.00 . A A . 6 TRP CG 1 1 2 368 1 1 6 TRP CH2 C 3.511 2.435 0.196 1.00 . A A . 6 TRP CH2 1 1 2 369 1 1 6 TRP CZ2 C 2.690 2.359 -0.893 1.00 . A A . 6 TRP CZ2 1 1 2 370 1 1 6 TRP CZ3 C 3.232 1.718 1.369 1.00 . A A . 6 TRP CZ3 1 1 2 371 1 1 6 TRP H H -1.713 -2.682 2.411 1.00 . A A . 6 TRP H 1 1 2 372 1 1 6 TRP HA H -0.980 -2.466 -0.290 1.00 . A A . 6 TRP HA 1 1 2 373 1 1 6 TRP HB2 H -1.737 -0.539 1.020 1.00 . A A . 6 TRP HB2 1 1 2 374 1 1 6 TRP HB3 H -0.306 -0.642 2.031 1.00 . A A . 6 TRP HB3 1 1 2 375 1 1 6 TRP HD1 H -1.211 0.054 -1.662 1.00 . A A . 6 TRP HD1 1 1 2 376 1 1 6 TRP HE1 H 0.540 1.663 -2.617 1.00 . A A . 6 TRP HE1 1 1 2 377 1 1 6 TRP HE3 H 1.913 0.361 2.375 1.00 . A A . 6 TRP HE3 1 1 2 378 1 1 6 TRP HH2 H 4.392 3.061 0.166 1.00 . A A . 6 TRP HH2 1 1 2 379 1 1 6 TRP HZ2 H 2.920 2.913 -1.791 1.00 . A A . 6 TRP HZ2 1 1 2 380 1 1 6 TRP HZ3 H 3.908 1.801 2.208 1.00 . A A . 6 TRP HZ3 1 1 2 381 1 1 6 TRP N N -1.268 -3.118 1.654 1.00 . A A . 6 TRP N 1 1 2 382 1 1 6 TRP NE1 N 0.583 1.291 -1.715 1.00 . A A . 6 TRP NE1 1 1 2 383 1 1 6 TRP O O 1.500 -2.889 -0.414 1.00 . A A . 6 TRP O 1 1 2 384 1 1 7 LEU C C 3.174 -4.544 1.492 1.00 . A A . 7 LEU C 1 1 2 385 1 1 7 LEU CA C 2.930 -3.114 1.978 1.00 . A A . 7 LEU CA 1 1 2 386 1 1 7 LEU CB C 3.366 -2.964 3.438 1.00 . A A . 7 LEU CB 1 1 2 387 1 1 7 LEU CD1 C 3.259 -1.575 5.526 1.00 . A A . 7 LEU CD1 1 1 2 388 1 1 7 LEU CD2 C 4.379 -0.662 3.482 1.00 . A A . 7 LEU CD2 1 1 2 389 1 1 7 LEU CG C 3.253 -1.544 4.005 1.00 . A A . 7 LEU CG 1 1 2 390 1 1 7 LEU H H 0.998 -2.570 2.650 1.00 . A A . 7 LEU H 1 1 2 391 1 1 7 LEU HA H 3.507 -2.437 1.367 1.00 . A A . 7 LEU HA 1 1 2 392 1 1 7 LEU HB2 H 2.755 -3.620 4.042 1.00 . A A . 7 LEU HB2 1 1 2 393 1 1 7 LEU HB3 H 4.393 -3.281 3.523 1.00 . A A . 7 LEU HB3 1 1 2 394 1 1 7 LEU HD11 H 2.503 -2.262 5.875 1.00 . A A . 7 LEU HD11 1 1 2 395 1 1 7 LEU HD12 H 3.049 -0.586 5.906 1.00 . A A . 7 LEU HD12 1 1 2 396 1 1 7 LEU HD13 H 4.228 -1.897 5.876 1.00 . A A . 7 LEU HD13 1 1 2 397 1 1 7 LEU HD21 H 4.407 0.258 4.046 1.00 . A A . 7 LEU HD21 1 1 2 398 1 1 7 LEU HD22 H 4.208 -0.438 2.438 1.00 . A A . 7 LEU HD22 1 1 2 399 1 1 7 LEU HD23 H 5.321 -1.179 3.589 1.00 . A A . 7 LEU HD23 1 1 2 400 1 1 7 LEU HG H 2.315 -1.112 3.687 1.00 . A A . 7 LEU HG 1 1 2 401 1 1 7 LEU N N 1.523 -2.753 1.841 1.00 . A A . 7 LEU N 1 1 2 402 1 1 7 LEU O O 4.208 -4.835 0.889 1.00 . A A . 7 LEU O 1 1 2 403 1 1 8 ALA C C 2.042 -6.988 -0.173 1.00 . A A . 8 ALA C 1 1 2 404 1 1 8 ALA CA C 2.301 -6.827 1.330 1.00 . A A . 8 ALA CA 1 1 2 405 1 1 8 ALA CB C 1.327 -7.685 2.128 1.00 . A A . 8 ALA CB 1 1 2 406 1 1 8 ALA H H 1.403 -5.131 2.226 1.00 . A A . 8 ALA H 1 1 2 407 1 1 8 ALA HA H 3.302 -7.170 1.548 1.00 . A A . 8 ALA HA 1 1 2 408 1 1 8 ALA HB1 H 1.847 -8.143 2.957 1.00 . A A . 8 ALA HB1 1 1 2 409 1 1 8 ALA HB2 H 0.919 -8.455 1.490 1.00 . A A . 8 ALA HB2 1 1 2 410 1 1 8 ALA HB3 H 0.525 -7.066 2.503 1.00 . A A . 8 ALA HB3 1 1 2 411 1 1 8 ALA N N 2.206 -5.429 1.749 1.00 . A A . 8 ALA N 1 1 2 412 1 1 8 ALA O O 2.406 -8.007 -0.762 1.00 . A A . 8 ALA O 1 1 2 413 1 1 9 ASP C C 2.285 -5.449 -3.057 1.00 . A A . 9 ASP C 1 1 2 414 1 1 9 ASP CA C 1.123 -6.011 -2.226 1.00 . A A . 9 ASP CA 1 1 2 415 1 1 9 ASP CB C -0.161 -5.224 -2.528 1.00 . A A . 9 ASP CB 1 1 2 416 1 1 9 ASP CG C -1.355 -6.129 -2.759 1.00 . A A . 9 ASP CG 1 1 2 417 1 1 9 ASP H H 1.159 -5.188 -0.272 1.00 . A A . 9 ASP H 1 1 2 418 1 1 9 ASP HA H 0.972 -7.045 -2.503 1.00 . A A . 9 ASP HA 1 1 2 419 1 1 9 ASP HB2 H -0.385 -4.574 -1.696 1.00 . A A . 9 ASP HB2 1 1 2 420 1 1 9 ASP HB3 H -0.012 -4.622 -3.415 1.00 . A A . 9 ASP HB3 1 1 2 421 1 1 9 ASP N N 1.420 -5.976 -0.791 1.00 . A A . 9 ASP N 1 1 2 422 1 1 9 ASP O O 2.116 -5.139 -4.239 1.00 . A A . 9 ASP O 1 1 2 423 1 1 9 ASP OD1 O -1.585 -6.523 -3.922 1.00 . A A . 9 ASP OD1 1 1 2 424 1 1 9 ASP OD2 O -2.060 -6.444 -1.778 1.00 . A A . 9 ASP OD2 1 1 2 425 1 1 10 DAL C C 4.941 -3.352 -2.707 1.00 . A A . 10 DAL C 1 1 2 426 1 1 10 DAL CA C 4.642 -4.796 -3.118 1.00 . A A . 10 DAL CA 1 1 2 427 1 1 10 DAL CB C 5.839 -5.681 -2.821 1.00 . A A . 10 DAL CB 1 1 2 428 1 1 10 DAL H H 3.540 -5.580 -1.497 1.00 . A A . 10 DAL H 1 1 2 429 1 1 10 DAL HA H 4.457 -4.828 -4.182 1.00 . A A . 10 DAL HA 1 1 2 430 1 1 10 DAL HB1 H 6.684 -5.354 -3.407 1.00 . A A . 10 DAL HB1 1 1 2 431 1 1 10 DAL HB2 H 5.601 -6.704 -3.070 1.00 . A A . 10 DAL HB2 1 1 2 432 1 1 10 DAL HB3 H 6.080 -5.612 -1.770 1.00 . A A . 10 DAL HB3 1 1 2 433 1 1 10 DAL N N 3.462 -5.319 -2.437 1.00 . A A . 10 DAL N 1 1 2 434 1 1 10 DAL O O 5.947 -2.779 -3.132 1.00 . A A . 10 DAL O 1 1 2 435 1 1 11 GLY C C 4.112 -0.396 -2.553 1.00 . A A . 11 GLY C 1 1 2 436 1 1 11 GLY CA C 4.259 -1.401 -1.430 1.00 . A A . 11 GLY CA 1 1 2 437 1 1 11 GLY H H 3.286 -3.271 -1.576 1.00 . A A . 11 GLY H 1 1 2 438 1 1 11 GLY HA2 H 3.529 -1.177 -0.666 1.00 . A A . 11 GLY HA2 1 1 2 439 1 1 11 GLY HA3 H 5.248 -1.309 -1.006 1.00 . A A . 11 GLY HA3 1 1 2 440 1 1 11 GLY N N 4.067 -2.768 -1.881 1.00 . A A . 11 GLY N 1 1 2 441 1 1 11 GLY O O 2.998 0.001 -2.896 1.00 . A A . 11 GLY O 1 1 2 442 1 1 12 TRP C C 5.306 0.304 -5.590 1.00 . A A . 12 TRP C 1 1 2 443 1 1 12 TRP CA C 5.234 0.981 -4.219 1.00 . A A . 12 TRP CA 1 1 2 444 1 1 12 TRP CB C 6.378 1.979 -4.034 1.00 . A A . 12 TRP CB 1 1 2 445 1 1 12 TRP CD1 C 6.545 3.288 -1.843 1.00 . A A . 12 TRP CD1 1 1 2 446 1 1 12 TRP CD2 C 4.975 4.041 -3.253 1.00 . A A . 12 TRP CD2 1 1 2 447 1 1 12 TRP CE2 C 4.947 4.826 -2.088 1.00 . A A . 12 TRP CE2 1 1 2 448 1 1 12 TRP CE3 C 4.074 4.332 -4.286 1.00 . A A . 12 TRP CE3 1 1 2 449 1 1 12 TRP CG C 6.004 3.060 -3.074 1.00 . A A . 12 TRP CG 1 1 2 450 1 1 12 TRP CH2 C 3.186 6.142 -2.947 1.00 . A A . 12 TRP CH2 1 1 2 451 1 1 12 TRP CZ2 C 4.055 5.877 -1.922 1.00 . A A . 12 TRP CZ2 1 1 2 452 1 1 12 TRP CZ3 C 3.192 5.381 -4.123 1.00 . A A . 12 TRP CZ3 1 1 2 453 1 1 12 TRP H H 6.097 -0.342 -2.809 1.00 . A A . 12 TRP H 1 1 2 454 1 1 12 TRP HA H 4.299 1.522 -4.159 1.00 . A A . 12 TRP HA 1 1 2 455 1 1 12 TRP HB2 H 7.243 1.463 -3.642 1.00 . A A . 12 TRP HB2 1 1 2 456 1 1 12 TRP HB3 H 6.626 2.432 -4.981 1.00 . A A . 12 TRP HB3 1 1 2 457 1 1 12 TRP HD1 H 7.350 2.709 -1.415 1.00 . A A . 12 TRP HD1 1 1 2 458 1 1 12 TRP HE1 H 6.123 4.707 -0.354 1.00 . A A . 12 TRP HE1 1 1 2 459 1 1 12 TRP HE3 H 4.061 3.756 -5.200 1.00 . A A . 12 TRP HE3 1 1 2 460 1 1 12 TRP HH2 H 2.478 6.953 -2.860 1.00 . A A . 12 TRP HH2 1 1 2 461 1 1 12 TRP HZ2 H 4.031 6.461 -1.018 1.00 . A A . 12 TRP HZ2 1 1 2 462 1 1 12 TRP HZ3 H 2.495 5.623 -4.913 1.00 . A A . 12 TRP HZ3 1 1 2 463 1 1 12 TRP N N 5.241 0.014 -3.127 1.00 . A A . 12 TRP N 1 1 2 464 1 1 12 TRP NE1 N 5.914 4.348 -1.242 1.00 . A A . 12 TRP NE1 1 1 2 465 1 1 12 TRP O O 5.430 0.980 -6.613 1.00 . A A . 12 TRP O 1 1 2 466 1 1 13 ALA C C 3.824 -1.793 -7.491 1.00 . A A . 13 ALA C 1 1 2 467 1 1 13 ALA CA C 5.213 -1.777 -6.861 1.00 . A A . 13 ALA CA 1 1 2 468 1 1 13 ALA CB C 5.720 -3.192 -6.634 1.00 . A A . 13 ALA CB 1 1 2 469 1 1 13 ALA H H 5.072 -1.514 -4.770 1.00 . A A . 13 ALA H 1 1 2 470 1 1 13 ALA HA H 5.893 -1.279 -7.535 1.00 . A A . 13 ALA HA 1 1 2 471 1 1 13 ALA HB1 H 4.917 -3.894 -6.800 1.00 . A A . 13 ALA HB1 1 1 2 472 1 1 13 ALA HB2 H 6.079 -3.288 -5.620 1.00 . A A . 13 ALA HB2 1 1 2 473 1 1 13 ALA HB3 H 6.526 -3.396 -7.322 1.00 . A A . 13 ALA HB3 1 1 2 474 1 1 13 ALA N N 5.193 -1.027 -5.611 1.00 . A A . 13 ALA N 1 1 2 475 1 1 13 ALA O O 3.688 -1.799 -8.716 1.00 . A A . 13 ALA O 1 1 2 476 1 1 14 SER C C 1.126 -0.483 -7.906 1.00 . A A . 14 SER C 1 1 2 477 1 1 14 SER CA C 1.407 -1.757 -7.104 1.00 . A A . 14 SER CA 1 1 2 478 1 1 14 SER CB C 0.441 -1.866 -5.915 1.00 . A A . 14 SER CB 1 1 2 479 1 1 14 SER H H 2.968 -1.751 -5.677 1.00 . A A . 14 SER H 1 1 2 480 1 1 14 SER HA H 1.264 -2.607 -7.752 1.00 . A A . 14 SER HA 1 1 2 481 1 1 14 SER HB2 H -0.499 -1.402 -6.171 1.00 . A A . 14 SER HB2 1 1 2 482 1 1 14 SER HB3 H 0.273 -2.908 -5.687 1.00 . A A . 14 SER HB3 1 1 2 483 1 1 14 SER HG H 1.361 -1.882 -4.178 1.00 . A A . 14 SER HG 1 1 2 484 1 1 14 SER N N 2.792 -1.773 -6.641 1.00 . A A . 14 SER N 1 1 2 485 1 1 14 SER O O 0.296 -0.484 -8.816 1.00 . A A . 14 SER O 1 1 2 486 1 1 14 SER OG O 0.964 -1.225 -4.760 1.00 . A A . 14 SER OG 1 1 2 487 1 1 15 DAL C C 0.805 2.847 -7.448 1.00 . A A . 15 DAL C 1 1 2 488 1 1 15 DAL CA C 1.678 1.879 -8.249 1.00 . A A . 15 DAL CA 1 1 2 489 1 1 15 DAL CB C 3.042 2.492 -8.521 1.00 . A A . 15 DAL CB 1 1 2 490 1 1 15 DAL H H 2.482 0.531 -6.829 1.00 . A A . 15 DAL H 1 1 2 491 1 1 15 DAL HA H 1.206 1.692 -9.201 1.00 . A A . 15 DAL HA 1 1 2 492 1 1 15 DAL HB1 H 3.048 2.926 -9.509 1.00 . A A . 15 DAL HB1 1 1 2 493 1 1 15 DAL HB2 H 3.800 1.725 -8.460 1.00 . A A . 15 DAL HB2 1 1 2 494 1 1 15 DAL HB3 H 3.246 3.259 -7.788 1.00 . A A . 15 DAL HB3 1 1 2 495 1 1 15 DAL N N 1.834 0.598 -7.563 1.00 . A A . 15 DAL N 1 1 2 496 1 1 15 DAL O O 0.913 4.067 -7.600 1.00 . A A . 15 DAL O 1 1 2 497 1 1 16 ARG C C -0.255 3.531 -4.476 1.00 . A A . 16 ARG C 1 1 2 498 1 1 16 ARG CA C -0.951 3.106 -5.771 1.00 . A A . 16 ARG CA 1 1 2 499 1 1 16 ARG CB C -2.237 2.316 -5.450 1.00 . A A . 16 ARG CB 1 1 2 500 1 1 16 ARG CD C -3.212 0.303 -4.298 1.00 . A A . 16 ARG CD 1 1 2 501 1 1 16 ARG CG C -2.086 1.331 -4.298 1.00 . A A . 16 ARG CG 1 1 2 502 1 1 16 ARG CZ C -2.756 -1.614 -2.796 1.00 . A A . 16 ARG CZ 1 1 2 503 1 1 16 ARG H H -0.097 1.318 -6.523 1.00 . A A . 16 ARG H 1 1 2 504 1 1 16 ARG HA H -1.207 3.996 -6.332 1.00 . A A . 16 ARG HA 1 1 2 505 1 1 16 ARG HB2 H -3.018 3.016 -5.193 1.00 . A A . 16 ARG HB2 1 1 2 506 1 1 16 ARG HB3 H -2.543 1.756 -6.329 1.00 . A A . 16 ARG HB3 1 1 2 507 1 1 16 ARG HD2 H -4.146 0.815 -4.476 1.00 . A A . 16 ARG HD2 1 1 2 508 1 1 16 ARG HD3 H -3.037 -0.405 -5.094 1.00 . A A . 16 ARG HD3 1 1 2 509 1 1 16 ARG HE H -3.818 0.009 -2.307 1.00 . A A . 16 ARG HE 1 1 2 510 1 1 16 ARG HG2 H -1.138 0.817 -4.395 1.00 . A A . 16 ARG HG2 1 1 2 511 1 1 16 ARG HG3 H -2.109 1.877 -3.366 1.00 . A A . 16 ARG HG3 1 1 2 512 1 1 16 ARG HH11 H -1.907 -1.796 -4.627 1.00 . A A . 16 ARG HH11 1 1 2 513 1 1 16 ARG HH12 H -1.634 -3.121 -3.550 1.00 . A A . 16 ARG HH12 1 1 2 514 1 1 16 ARG HH21 H -3.450 -1.742 -0.898 1.00 . A A . 16 ARG HH21 1 1 2 515 1 1 16 ARG HH22 H -2.511 -3.094 -1.437 1.00 . A A . 16 ARG HH22 1 1 2 516 1 1 16 ARG N N -0.059 2.296 -6.597 1.00 . A A . 16 ARG N 1 1 2 517 1 1 16 ARG NE N -3.307 -0.418 -3.027 1.00 . A A . 16 ARG NE 1 1 2 518 1 1 16 ARG NH1 N -2.041 -2.227 -3.736 1.00 . A A . 16 ARG NH1 1 1 2 519 1 1 16 ARG NH2 N -2.918 -2.197 -1.613 1.00 . A A . 16 ARG NH2 1 1 2 520 1 1 16 ARG O O 0.657 2.850 -4.007 1.00 . A A . 16 ARG O 1 1 2 521 1 1 17 PRO C C -0.685 4.510 -1.390 1.00 . A A . 17 PRO C 1 1 2 522 1 1 17 PRO CA C -0.088 5.170 -2.634 1.00 . A A . 17 PRO CA 1 1 2 523 1 1 17 PRO CB C -0.422 6.669 -2.651 1.00 . A A . 17 PRO CB 1 1 2 524 1 1 17 PRO CD C -1.732 5.554 -4.353 1.00 . A A . 17 PRO CD 1 1 2 525 1 1 17 PRO CG C -1.281 6.903 -3.859 1.00 . A A . 17 PRO CG 1 1 2 526 1 1 17 PRO HA H 0.981 5.039 -2.619 1.00 . A A . 17 PRO HA 1 1 2 527 1 1 17 PRO HB2 H -0.949 6.927 -1.744 1.00 . A A . 17 PRO HB2 1 1 2 528 1 1 17 PRO HB3 H 0.498 7.237 -2.706 1.00 . A A . 17 PRO HB3 1 1 2 529 1 1 17 PRO HD2 H -2.684 5.287 -3.921 1.00 . A A . 17 PRO HD2 1 1 2 530 1 1 17 PRO HD3 H -1.789 5.550 -5.429 1.00 . A A . 17 PRO HD3 1 1 2 531 1 1 17 PRO HG2 H -2.136 7.502 -3.587 1.00 . A A . 17 PRO HG2 1 1 2 532 1 1 17 PRO HG3 H -0.704 7.405 -4.623 1.00 . A A . 17 PRO HG3 1 1 2 533 1 1 17 PRO N N -0.672 4.666 -3.877 1.00 . A A . 17 PRO N 1 1 2 534 1 1 17 PRO O O -1.715 3.837 -1.463 1.00 . A A . 17 PRO O 1 1 2 535 1 1 18 PRO C C -1.840 4.643 1.500 1.00 . A A . 18 PRO C 1 1 2 536 1 1 18 PRO CA C -0.477 4.121 1.046 1.00 . A A . 18 PRO CA 1 1 2 537 1 1 18 PRO CB C 0.591 4.560 2.050 1.00 . A A . 18 PRO CB 1 1 2 538 1 1 18 PRO CD C 1.210 5.477 -0.076 1.00 . A A . 18 PRO CD 1 1 2 539 1 1 18 PRO CG C 1.312 5.694 1.405 1.00 . A A . 18 PRO CG 1 1 2 540 1 1 18 PRO HA H -0.505 3.041 0.999 1.00 . A A . 18 PRO HA 1 1 2 541 1 1 18 PRO HB2 H 0.112 4.877 2.961 1.00 . A A . 18 PRO HB2 1 1 2 542 1 1 18 PRO HB3 H 1.252 3.738 2.260 1.00 . A A . 18 PRO HB3 1 1 2 543 1 1 18 PRO HD2 H 1.135 6.424 -0.590 1.00 . A A . 18 PRO HD2 1 1 2 544 1 1 18 PRO HD3 H 2.062 4.920 -0.434 1.00 . A A . 18 PRO HD3 1 1 2 545 1 1 18 PRO HG2 H 0.842 6.628 1.678 1.00 . A A . 18 PRO HG2 1 1 2 546 1 1 18 PRO HG3 H 2.347 5.692 1.713 1.00 . A A . 18 PRO HG3 1 1 2 547 1 1 18 PRO N N -0.029 4.697 -0.228 1.00 . A A . 18 PRO N 1 1 2 548 1 1 18 PRO O O -2.168 5.813 1.293 1.00 . A A . 18 PRO O 1 1 2 549 1 1 19 PRO C C -3.903 4.879 3.978 1.00 . A A . 19 PRO C 1 1 2 550 1 1 19 PRO CA C -3.964 4.142 2.641 1.00 . A A . 19 PRO CA 1 1 2 551 1 1 19 PRO CB C -4.675 2.800 2.796 1.00 . A A . 19 PRO CB 1 1 2 552 1 1 19 PRO CD C -2.319 2.369 2.427 1.00 . A A . 19 PRO CD 1 1 2 553 1 1 19 PRO CG C -3.612 1.762 2.911 1.00 . A A . 19 PRO CG 1 1 2 554 1 1 19 PRO HA H -4.498 4.750 1.925 1.00 . A A . 19 PRO HA 1 1 2 555 1 1 19 PRO HB2 H -5.299 2.820 3.675 1.00 . A A . 19 PRO HB2 1 1 2 556 1 1 19 PRO HB3 H -5.276 2.628 1.934 1.00 . A A . 19 PRO HB3 1 1 2 557 1 1 19 PRO HD2 H -1.558 2.303 3.188 1.00 . A A . 19 PRO HD2 1 1 2 558 1 1 19 PRO HD3 H -1.998 1.867 1.530 1.00 . A A . 19 PRO HD3 1 1 2 559 1 1 19 PRO HG2 H -3.523 1.449 3.935 1.00 . A A . 19 PRO HG2 1 1 2 560 1 1 19 PRO HG3 H -3.874 0.916 2.292 1.00 . A A . 19 PRO HG3 1 1 2 561 1 1 19 PRO N N -2.646 3.775 2.141 1.00 . A A . 19 PRO N 1 1 2 562 1 1 19 PRO O O -3.443 4.332 4.980 1.00 . A A . 19 PRO O 1 1 2 563 1 1 20 SER C C -5.365 8.108 5.066 1.00 . A A . 20 SER C 1 1 2 564 1 1 20 SER CA C -4.380 6.946 5.192 1.00 . A A . 20 SER CA 1 1 2 565 1 1 20 SER CB C -2.974 7.479 5.482 1.00 . A A . 20 SER CB 1 1 2 566 1 1 20 SER H H -4.731 6.500 3.147 1.00 . A A . 20 SER H 1 1 2 567 1 1 20 SER HA H -4.690 6.317 6.012 1.00 . A A . 20 SER HA 1 1 2 568 1 1 20 SER HB2 H -2.361 7.363 4.602 1.00 . A A . 20 SER HB2 1 1 2 569 1 1 20 SER HB3 H -3.034 8.526 5.744 1.00 . A A . 20 SER HB3 1 1 2 570 1 1 20 SER HG H -2.633 7.169 7.388 1.00 . A A . 20 SER HG 1 1 2 571 1 1 20 SER N N -4.375 6.124 3.980 1.00 . A A . 20 SER N 1 1 2 572 1 1 20 SER O O -5.264 8.870 4.079 1.00 . A A . 20 SER O 1 1 2 573 1 1 20 SER OXT O -6.231 8.246 5.955 1.00 . A A . 20 SER OXT 1 1 2 574 1 1 20 SER OG O -2.370 6.773 6.553 1.00 . A A . 20 SER OG 1 1 3 575 1 1 1 ASP C C -6.442 -3.206 5.219 1.00 . A A . 1 ASP C 1 1 3 576 1 1 1 ASP CA C -6.705 -3.882 6.563 1.00 . A A . 1 ASP CA 1 1 3 577 1 1 1 ASP CB C -5.633 -4.940 6.838 1.00 . A A . 1 ASP CB 1 1 3 578 1 1 1 ASP CG C -5.204 -4.963 8.293 1.00 . A A . 1 ASP CG 1 1 3 579 1 1 1 ASP H1 H -8.758 -3.801 6.419 1.00 . A A . 1 ASP H1 1 1 3 580 1 1 1 ASP H2 H -8.165 -4.968 7.529 1.00 . A A . 1 ASP H2 1 1 3 581 1 1 1 ASP H3 H -8.061 -5.256 5.840 1.00 . A A . 1 ASP H3 1 1 3 582 1 1 1 ASP HA H -6.674 -3.135 7.342 1.00 . A A . 1 ASP HA 1 1 3 583 1 1 1 ASP HB2 H -6.022 -5.914 6.582 1.00 . A A . 1 ASP HB2 1 1 3 584 1 1 1 ASP HB3 H -4.765 -4.732 6.229 1.00 . A A . 1 ASP HB3 1 1 3 585 1 1 1 ASP N N -8.042 -4.536 6.590 1.00 . A A . 1 ASP N 1 1 3 586 1 1 1 ASP O O -6.849 -3.709 4.169 1.00 . A A . 1 ASP O 1 1 3 587 1 1 1 ASP OD1 O -5.821 -5.709 9.082 1.00 . A A . 1 ASP OD1 1 1 3 588 1 1 1 ASP OD2 O -4.251 -4.235 8.643 1.00 . A A . 1 ASP OD2 1 1 3 589 1 1 2 ALA C C -3.947 -0.978 3.988 1.00 . A A . 2 ALA C 1 1 3 590 1 1 2 ALA CA C -5.435 -1.310 4.053 1.00 . A A . 2 ALA CA 1 1 3 591 1 1 2 ALA CB C -6.262 -0.038 3.988 1.00 . A A . 2 ALA CB 1 1 3 592 1 1 2 ALA H H -5.462 -1.717 6.131 1.00 . A A . 2 ALA H 1 1 3 593 1 1 2 ALA HA H -5.693 -1.922 3.200 1.00 . A A . 2 ALA HA 1 1 3 594 1 1 2 ALA HB1 H -7.278 -0.254 4.282 1.00 . A A . 2 ALA HB1 1 1 3 595 1 1 2 ALA HB2 H -6.253 0.345 2.978 1.00 . A A . 2 ALA HB2 1 1 3 596 1 1 2 ALA HB3 H -5.842 0.698 4.656 1.00 . A A . 2 ALA HB3 1 1 3 597 1 1 2 ALA N N -5.758 -2.063 5.262 1.00 . A A . 2 ALA N 1 1 3 598 1 1 2 ALA O O -3.282 -1.281 2.998 1.00 . A A . 2 ALA O 1 1 3 599 1 1 3 TYR C C -1.132 -1.230 5.084 1.00 . A A . 3 TYR C 1 1 3 600 1 1 3 TYR CA C -2.014 0.015 5.115 1.00 . A A . 3 TYR CA 1 1 3 601 1 1 3 TYR CB C -1.727 0.845 6.370 1.00 . A A . 3 TYR CB 1 1 3 602 1 1 3 TYR CD1 C 0.729 1.404 6.525 1.00 . A A . 3 TYR CD1 1 1 3 603 1 1 3 TYR CD2 C -0.765 3.115 5.792 1.00 . A A . 3 TYR CD2 1 1 3 604 1 1 3 TYR CE1 C 1.794 2.276 6.404 1.00 . A A . 3 TYR CE1 1 1 3 605 1 1 3 TYR CE2 C 0.296 3.992 5.673 1.00 . A A . 3 TYR CE2 1 1 3 606 1 1 3 TYR CG C -0.566 1.804 6.220 1.00 . A A . 3 TYR CG 1 1 3 607 1 1 3 TYR CZ C 1.572 3.568 5.979 1.00 . A A . 3 TYR CZ 1 1 3 608 1 1 3 TYR H H -4.016 -0.142 5.808 1.00 . A A . 3 TYR H 1 1 3 609 1 1 3 TYR HA H -1.791 0.608 4.245 1.00 . A A . 3 TYR HA 1 1 3 610 1 1 3 TYR HB2 H -2.602 1.427 6.619 1.00 . A A . 3 TYR HB2 1 1 3 611 1 1 3 TYR HB3 H -1.502 0.178 7.190 1.00 . A A . 3 TYR HB3 1 1 3 612 1 1 3 TYR HD1 H 0.901 0.390 6.857 1.00 . A A . 3 TYR HD1 1 1 3 613 1 1 3 TYR HD2 H -1.765 3.447 5.541 1.00 . A A . 3 TYR HD2 1 1 3 614 1 1 3 TYR HE1 H 2.793 1.944 6.643 1.00 . A A . 3 TYR HE1 1 1 3 615 1 1 3 TYR HE2 H 0.122 5.006 5.348 1.00 . A A . 3 TYR HE2 1 1 3 616 1 1 3 TYR HH H 2.787 4.872 6.704 1.00 . A A . 3 TYR HH 1 1 3 617 1 1 3 TYR N N -3.430 -0.355 5.050 1.00 . A A . 3 TYR N 1 1 3 618 1 1 3 TYR O O -0.171 -1.296 4.314 1.00 . A A . 3 TYR O 1 1 3 619 1 1 3 TYR OH O 2.630 4.441 5.860 1.00 . A A . 3 TYR OH 1 1 3 620 1 1 4 ALA C C -0.907 -4.242 4.633 1.00 . A A . 4 ALA C 1 1 3 621 1 1 4 ALA CA C -0.730 -3.477 5.944 1.00 . A A . 4 ALA CA 1 1 3 622 1 1 4 ALA CB C -1.176 -4.326 7.126 1.00 . A A . 4 ALA CB 1 1 3 623 1 1 4 ALA H H -2.264 -2.120 6.480 1.00 . A A . 4 ALA H 1 1 3 624 1 1 4 ALA HA H 0.318 -3.238 6.071 1.00 . A A . 4 ALA HA 1 1 3 625 1 1 4 ALA HB1 H -0.641 -5.264 7.118 1.00 . A A . 4 ALA HB1 1 1 3 626 1 1 4 ALA HB2 H -2.236 -4.515 7.054 1.00 . A A . 4 ALA HB2 1 1 3 627 1 1 4 ALA HB3 H -0.966 -3.800 8.046 1.00 . A A . 4 ALA HB3 1 1 3 628 1 1 4 ALA N N -1.478 -2.224 5.904 1.00 . A A . 4 ALA N 1 1 3 629 1 1 4 ALA O O 0.012 -4.926 4.178 1.00 . A A . 4 ALA O 1 1 3 630 1 1 5 GLN C C -1.561 -4.108 1.625 1.00 . A A . 5 GLN C 1 1 3 631 1 1 5 GLN CA C -2.374 -4.757 2.745 1.00 . A A . 5 GLN CA 1 1 3 632 1 1 5 GLN CB C -3.872 -4.679 2.431 1.00 . A A . 5 GLN CB 1 1 3 633 1 1 5 GLN CD C -3.953 -6.742 0.966 1.00 . A A . 5 GLN CD 1 1 3 634 1 1 5 GLN CG C -4.241 -5.255 1.073 1.00 . A A . 5 GLN CG 1 1 3 635 1 1 5 GLN H H -2.776 -3.527 4.418 1.00 . A A . 5 GLN H 1 1 3 636 1 1 5 GLN HA H -2.085 -5.794 2.832 1.00 . A A . 5 GLN HA 1 1 3 637 1 1 5 GLN HB2 H -4.416 -5.223 3.189 1.00 . A A . 5 GLN HB2 1 1 3 638 1 1 5 GLN HB3 H -4.179 -3.644 2.454 1.00 . A A . 5 GLN HB3 1 1 3 639 1 1 5 GLN HE21 H -2.535 -6.402 -0.392 1.00 . A A . 5 GLN HE21 1 1 3 640 1 1 5 GLN HE22 H -2.793 -8.058 0.027 1.00 . A A . 5 GLN HE22 1 1 3 641 1 1 5 GLN HG2 H -5.295 -5.095 0.903 1.00 . A A . 5 GLN HG2 1 1 3 642 1 1 5 GLN HG3 H -3.673 -4.737 0.317 1.00 . A A . 5 GLN HG3 1 1 3 643 1 1 5 GLN N N -2.088 -4.101 4.016 1.00 . A A . 5 GLN N 1 1 3 644 1 1 5 GLN NE2 N -2.997 -7.104 0.114 1.00 . A A . 5 GLN NE2 1 1 3 645 1 1 5 GLN O O -1.054 -4.795 0.738 1.00 . A A . 5 GLN O 1 1 3 646 1 1 5 GLN OE1 O -4.582 -7.558 1.640 1.00 . A A . 5 GLN OE1 1 1 3 647 1 1 6 TRP C C 0.787 -2.487 0.682 1.00 . A A . 6 TRP C 1 1 3 648 1 1 6 TRP CA C -0.665 -2.022 0.699 1.00 . A A . 6 TRP CA 1 1 3 649 1 1 6 TRP CB C -0.726 -0.523 1.016 1.00 . A A . 6 TRP CB 1 1 3 650 1 1 6 TRP CD1 C -0.278 0.609 -1.228 1.00 . A A . 6 TRP CD1 1 1 3 651 1 1 6 TRP CD2 C 1.300 0.987 0.310 1.00 . A A . 6 TRP CD2 1 1 3 652 1 1 6 TRP CE2 C 1.656 1.656 -0.875 1.00 . A A . 6 TRP CE2 1 1 3 653 1 1 6 TRP CE3 C 2.148 1.085 1.418 1.00 . A A . 6 TRP CE3 1 1 3 654 1 1 6 TRP CG C 0.055 0.321 0.059 1.00 . A A . 6 TRP CG 1 1 3 655 1 1 6 TRP CH2 C 3.629 2.495 0.109 1.00 . A A . 6 TRP CH2 1 1 3 656 1 1 6 TRP CZ2 C 2.819 2.412 -0.988 1.00 . A A . 6 TRP CZ2 1 1 3 657 1 1 6 TRP CZ3 C 3.304 1.841 1.306 1.00 . A A . 6 TRP CZ3 1 1 3 658 1 1 6 TRP H H -1.851 -2.295 2.430 1.00 . A A . 6 TRP H 1 1 3 659 1 1 6 TRP HA H -1.104 -2.199 -0.271 1.00 . A A . 6 TRP HA 1 1 3 660 1 1 6 TRP HB2 H -1.753 -0.198 0.985 1.00 . A A . 6 TRP HB2 1 1 3 661 1 1 6 TRP HB3 H -0.332 -0.354 2.005 1.00 . A A . 6 TRP HB3 1 1 3 662 1 1 6 TRP HD1 H -1.168 0.251 -1.718 1.00 . A A . 6 TRP HD1 1 1 3 663 1 1 6 TRP HE1 H 0.663 1.742 -2.713 1.00 . A A . 6 TRP HE1 1 1 3 664 1 1 6 TRP HE3 H 1.914 0.585 2.347 1.00 . A A . 6 TRP HE3 1 1 3 665 1 1 6 TRP HH2 H 4.537 3.082 0.066 1.00 . A A . 6 TRP HH2 1 1 3 666 1 1 6 TRP HZ2 H 3.085 2.917 -1.904 1.00 . A A . 6 TRP HZ2 1 1 3 667 1 1 6 TRP HZ3 H 3.973 1.928 2.150 1.00 . A A . 6 TRP HZ3 1 1 3 668 1 1 6 TRP N N -1.430 -2.779 1.689 1.00 . A A . 6 TRP N 1 1 3 669 1 1 6 TRP NE1 N 0.679 1.404 -1.796 1.00 . A A . 6 TRP NE1 1 1 3 670 1 1 6 TRP O O 1.343 -2.782 -0.377 1.00 . A A . 6 TRP O 1 1 3 671 1 1 7 LEU C C 2.928 -4.447 1.565 1.00 . A A . 7 LEU C 1 1 3 672 1 1 7 LEU CA C 2.771 -2.995 2.016 1.00 . A A . 7 LEU CA 1 1 3 673 1 1 7 LEU CB C 3.220 -2.837 3.471 1.00 . A A . 7 LEU CB 1 1 3 674 1 1 7 LEU CD1 C 3.285 -1.366 5.502 1.00 . A A . 7 LEU CD1 1 1 3 675 1 1 7 LEU CD2 C 4.465 -0.654 3.412 1.00 . A A . 7 LEU CD2 1 1 3 676 1 1 7 LEU CG C 3.261 -1.393 3.982 1.00 . A A . 7 LEU CG 1 1 3 677 1 1 7 LEU H H 0.878 -2.313 2.674 1.00 . A A . 7 LEU H 1 1 3 678 1 1 7 LEU HA H 3.385 -2.367 1.387 1.00 . A A . 7 LEU HA 1 1 3 679 1 1 7 LEU HB2 H 2.541 -3.399 4.096 1.00 . A A . 7 LEU HB2 1 1 3 680 1 1 7 LEU HB3 H 4.206 -3.259 3.572 1.00 . A A . 7 LEU HB3 1 1 3 681 1 1 7 LEU HD11 H 4.237 -1.734 5.855 1.00 . A A . 7 LEU HD11 1 1 3 682 1 1 7 LEU HD12 H 2.492 -1.992 5.886 1.00 . A A . 7 LEU HD12 1 1 3 683 1 1 7 LEU HD13 H 3.141 -0.352 5.846 1.00 . A A . 7 LEU HD13 1 1 3 684 1 1 7 LEU HD21 H 4.225 -0.276 2.429 1.00 . A A . 7 LEU HD21 1 1 3 685 1 1 7 LEU HD22 H 5.304 -1.331 3.342 1.00 . A A . 7 LEU HD22 1 1 3 686 1 1 7 LEU HD23 H 4.722 0.170 4.061 1.00 . A A . 7 LEU HD23 1 1 3 687 1 1 7 LEU HG H 2.369 -0.879 3.656 1.00 . A A . 7 LEU HG 1 1 3 688 1 1 7 LEU N N 1.386 -2.556 1.870 1.00 . A A . 7 LEU N 1 1 3 689 1 1 7 LEU O O 3.942 -4.814 0.969 1.00 . A A . 7 LEU O 1 1 3 690 1 1 8 ALA C C 1.693 -6.855 -0.043 1.00 . A A . 8 ALA C 1 1 3 691 1 1 8 ALA CA C 1.919 -6.676 1.463 1.00 . A A . 8 ALA CA 1 1 3 692 1 1 8 ALA CB C 0.864 -7.444 2.249 1.00 . A A . 8 ALA CB 1 1 3 693 1 1 8 ALA H H 1.127 -4.907 2.317 1.00 . A A . 8 ALA H 1 1 3 694 1 1 8 ALA HA H 2.887 -7.082 1.720 1.00 . A A . 8 ALA HA 1 1 3 695 1 1 8 ALA HB1 H 0.695 -8.403 1.783 1.00 . A A . 8 ALA HB1 1 1 3 696 1 1 8 ALA HB2 H -0.058 -6.881 2.261 1.00 . A A . 8 ALA HB2 1 1 3 697 1 1 8 ALA HB3 H 1.208 -7.592 3.262 1.00 . A A . 8 ALA HB3 1 1 3 698 1 1 8 ALA N N 1.909 -5.265 1.846 1.00 . A A . 8 ALA N 1 1 3 699 1 1 8 ALA O O 2.043 -7.895 -0.605 1.00 . A A . 8 ALA O 1 1 3 700 1 1 9 ASP C C 2.054 -5.409 -2.950 1.00 . A A . 9 ASP C 1 1 3 701 1 1 9 ASP CA C 0.847 -5.890 -2.132 1.00 . A A . 9 ASP CA 1 1 3 702 1 1 9 ASP CB C -0.384 -5.043 -2.474 1.00 . A A . 9 ASP CB 1 1 3 703 1 1 9 ASP CG C -1.338 -5.759 -3.409 1.00 . A A . 9 ASP CG 1 1 3 704 1 1 9 ASP H H 0.857 -5.035 -0.193 1.00 . A A . 9 ASP H 1 1 3 705 1 1 9 ASP HA H 0.644 -6.918 -2.392 1.00 . A A . 9 ASP HA 1 1 3 706 1 1 9 ASP HB2 H -0.914 -4.804 -1.564 1.00 . A A . 9 ASP HB2 1 1 3 707 1 1 9 ASP HB3 H -0.064 -4.126 -2.948 1.00 . A A . 9 ASP HB3 1 1 3 708 1 1 9 ASP N N 1.112 -5.839 -0.692 1.00 . A A . 9 ASP N 1 1 3 709 1 1 9 ASP O O 1.923 -5.107 -4.138 1.00 . A A . 9 ASP O 1 1 3 710 1 1 9 ASP OD1 O -2.230 -6.478 -2.911 1.00 . A A . 9 ASP OD1 1 1 3 711 1 1 9 ASP OD2 O -1.194 -5.601 -4.640 1.00 . A A . 9 ASP OD2 1 1 3 712 1 1 10 DAL C C 4.821 -3.463 -2.611 1.00 . A A . 10 DAL C 1 1 3 713 1 1 10 DAL CA C 4.448 -4.902 -2.983 1.00 . A A . 10 DAL CA 1 1 3 714 1 1 10 DAL CB C 5.590 -5.841 -2.638 1.00 . A A . 10 DAL CB 1 1 3 715 1 1 10 DAL H H 3.276 -5.594 -1.369 1.00 . A A . 10 DAL H 1 1 3 716 1 1 10 DAL HA H 4.281 -4.955 -4.049 1.00 . A A . 10 DAL HA 1 1 3 717 1 1 10 DAL HB1 H 5.297 -6.858 -2.854 1.00 . A A . 10 DAL HB1 1 1 3 718 1 1 10 DAL HB2 H 5.822 -5.748 -1.588 1.00 . A A . 10 DAL HB2 1 1 3 719 1 1 10 DAL HB3 H 6.459 -5.583 -3.224 1.00 . A A . 10 DAL HB3 1 1 3 720 1 1 10 DAL N N 3.227 -5.341 -2.312 1.00 . A A . 10 DAL N 1 1 3 721 1 1 10 DAL O O 5.853 -2.955 -3.053 1.00 . A A . 10 DAL O 1 1 3 722 1 1 11 GLY C C 4.163 -0.466 -2.539 1.00 . A A . 11 GLY C 1 1 3 723 1 1 11 GLY CA C 4.250 -1.444 -1.387 1.00 . A A . 11 GLY CA 1 1 3 724 1 1 11 GLY H H 3.177 -3.263 -1.477 1.00 . A A . 11 GLY H 1 1 3 725 1 1 11 GLY HA2 H 3.531 -1.157 -0.633 1.00 . A A . 11 GLY HA2 1 1 3 726 1 1 11 GLY HA3 H 5.242 -1.395 -0.961 1.00 . A A . 11 GLY HA3 1 1 3 727 1 1 11 GLY N N 3.982 -2.812 -1.798 1.00 . A A . 11 GLY N 1 1 3 728 1 1 11 GLY O O 3.072 -0.025 -2.904 1.00 . A A . 11 GLY O 1 1 3 729 1 1 12 TRP C C 5.429 0.086 -5.582 1.00 . A A . 12 TRP C 1 1 3 730 1 1 12 TRP CA C 5.363 0.806 -4.233 1.00 . A A . 12 TRP CA 1 1 3 731 1 1 12 TRP CB C 6.539 1.766 -4.058 1.00 . A A . 12 TRP CB 1 1 3 732 1 1 12 TRP CD1 C 6.713 3.170 -1.927 1.00 . A A . 12 TRP CD1 1 1 3 733 1 1 12 TRP CD2 C 5.179 3.893 -3.390 1.00 . A A . 12 TRP CD2 1 1 3 734 1 1 12 TRP CE2 C 5.155 4.732 -2.263 1.00 . A A . 12 TRP CE2 1 1 3 735 1 1 12 TRP CE3 C 4.298 4.156 -4.447 1.00 . A A . 12 TRP CE3 1 1 3 736 1 1 12 TRP CG C 6.182 2.899 -3.153 1.00 . A A . 12 TRP CG 1 1 3 737 1 1 12 TRP CH2 C 3.436 6.046 -3.205 1.00 . A A . 12 TRP CH2 1 1 3 738 1 1 12 TRP CZ2 C 4.286 5.809 -2.158 1.00 . A A . 12 TRP CZ2 1 1 3 739 1 1 12 TRP CZ3 C 3.439 5.231 -4.344 1.00 . A A . 12 TRP CZ3 1 1 3 740 1 1 12 TRP H H 6.151 -0.515 -2.778 1.00 . A A . 12 TRP H 1 1 3 741 1 1 12 TRP HA H 4.448 1.382 -4.205 1.00 . A A . 12 TRP HA 1 1 3 742 1 1 12 TRP HB2 H 7.374 1.235 -3.624 1.00 . A A . 12 TRP HB2 1 1 3 743 1 1 12 TRP HB3 H 6.828 2.171 -5.016 1.00 . A A . 12 TRP HB3 1 1 3 744 1 1 12 TRP HD1 H 7.500 2.594 -1.463 1.00 . A A . 12 TRP HD1 1 1 3 745 1 1 12 TRP HE1 H 6.308 4.666 -0.510 1.00 . A A . 12 TRP HE1 1 1 3 746 1 1 12 TRP HE3 H 4.283 3.539 -5.334 1.00 . A A . 12 TRP HE3 1 1 3 747 1 1 12 TRP HH2 H 2.747 6.877 -3.166 1.00 . A A . 12 TRP HH2 1 1 3 748 1 1 12 TRP HZ2 H 4.265 6.435 -1.283 1.00 . A A . 12 TRP HZ2 1 1 3 749 1 1 12 TRP HZ3 H 2.756 5.451 -5.152 1.00 . A A . 12 TRP HZ3 1 1 3 750 1 1 12 TRP N N 5.315 -0.128 -3.114 1.00 . A A . 12 TRP N 1 1 3 751 1 1 12 TRP NE1 N 6.101 4.272 -1.384 1.00 . A A . 12 TRP NE1 1 1 3 752 1 1 12 TRP O O 5.660 0.716 -6.616 1.00 . A A . 12 TRP O 1 1 3 753 1 1 13 ALA C C 3.809 -1.998 -7.439 1.00 . A A . 13 ALA C 1 1 3 754 1 1 13 ALA CA C 5.193 -2.018 -6.798 1.00 . A A . 13 ALA CA 1 1 3 755 1 1 13 ALA CB C 5.638 -3.445 -6.520 1.00 . A A . 13 ALA CB 1 1 3 756 1 1 13 ALA H H 4.990 -1.675 -4.723 1.00 . A A . 13 ALA H 1 1 3 757 1 1 13 ALA HA H 5.899 -1.571 -7.480 1.00 . A A . 13 ALA HA 1 1 3 758 1 1 13 ALA HB1 H 5.684 -3.607 -5.454 1.00 . A A . 13 ALA HB1 1 1 3 759 1 1 13 ALA HB2 H 6.614 -3.603 -6.951 1.00 . A A . 13 ALA HB2 1 1 3 760 1 1 13 ALA HB3 H 4.933 -4.134 -6.960 1.00 . A A . 13 ALA HB3 1 1 3 761 1 1 13 ALA N N 5.193 -1.229 -5.571 1.00 . A A . 13 ALA N 1 1 3 762 1 1 13 ALA O O 3.682 -2.038 -8.664 1.00 . A A . 13 ALA O 1 1 3 763 1 1 14 SER C C 1.161 -0.599 -7.912 1.00 . A A . 14 SER C 1 1 3 764 1 1 14 SER CA C 1.393 -1.856 -7.068 1.00 . A A . 14 SER CA 1 1 3 765 1 1 14 SER CB C 0.419 -1.888 -5.879 1.00 . A A . 14 SER CB 1 1 3 766 1 1 14 SER H H 2.946 -1.866 -5.633 1.00 . A A . 14 SER H 1 1 3 767 1 1 14 SER HA H 1.220 -2.722 -7.687 1.00 . A A . 14 SER HA 1 1 3 768 1 1 14 SER HB2 H -0.498 -1.390 -6.155 1.00 . A A . 14 SER HB2 1 1 3 769 1 1 14 SER HB3 H 0.205 -2.915 -5.620 1.00 . A A . 14 SER HB3 1 1 3 770 1 1 14 SER HG H 1.329 -1.890 -4.137 1.00 . A A . 14 SER HG 1 1 3 771 1 1 14 SER N N 2.774 -1.911 -6.597 1.00 . A A . 14 SER N 1 1 3 772 1 1 14 SER O O 0.327 -0.599 -8.819 1.00 . A A . 14 SER O 1 1 3 773 1 1 14 SER OG O 0.966 -1.235 -4.742 1.00 . A A . 14 SER OG 1 1 3 774 1 1 15 DAL C C 0.943 2.748 -7.575 1.00 . A A . 15 DAL C 1 1 3 775 1 1 15 DAL CA C 1.794 1.730 -8.339 1.00 . A A . 15 DAL CA 1 1 3 776 1 1 15 DAL CB C 3.178 2.296 -8.624 1.00 . A A . 15 DAL CB 1 1 3 777 1 1 15 DAL H H 2.559 0.403 -6.876 1.00 . A A . 15 DAL H 1 1 3 778 1 1 15 DAL HA H 1.321 1.523 -9.286 1.00 . A A . 15 DAL HA 1 1 3 779 1 1 15 DAL HB1 H 3.924 1.685 -8.138 1.00 . A A . 15 DAL HB1 1 1 3 780 1 1 15 DAL HB2 H 3.240 3.306 -8.248 1.00 . A A . 15 DAL HB2 1 1 3 781 1 1 15 DAL HB3 H 3.351 2.297 -9.689 1.00 . A A . 15 DAL HB3 1 1 3 782 1 1 15 DAL N N 1.910 0.468 -7.609 1.00 . A A . 15 DAL N 1 1 3 783 1 1 15 DAL O O 1.078 3.958 -7.771 1.00 . A A . 15 DAL O 1 1 3 784 1 1 16 ARG C C -0.098 3.562 -4.632 1.00 . A A . 16 ARG C 1 1 3 785 1 1 16 ARG CA C -0.807 3.107 -5.909 1.00 . A A . 16 ARG CA 1 1 3 786 1 1 16 ARG CB C -2.105 2.353 -5.552 1.00 . A A . 16 ARG CB 1 1 3 787 1 1 16 ARG CD C -3.065 0.358 -4.358 1.00 . A A . 16 ARG CD 1 1 3 788 1 1 16 ARG CG C -1.958 1.402 -4.370 1.00 . A A . 16 ARG CG 1 1 3 789 1 1 16 ARG CZ C -3.484 -0.093 -1.961 1.00 . A A . 16 ARG CZ 1 1 3 790 1 1 16 ARG H H 0.007 1.276 -6.594 1.00 . A A . 16 ARG H 1 1 3 791 1 1 16 ARG HA H -1.049 3.981 -6.500 1.00 . A A . 16 ARG HA 1 1 3 792 1 1 16 ARG HB2 H -2.871 3.074 -5.311 1.00 . A A . 16 ARG HB2 1 1 3 793 1 1 16 ARG HB3 H -2.428 1.769 -6.410 1.00 . A A . 16 ARG HB3 1 1 3 794 1 1 16 ARG HD2 H -4.018 0.863 -4.405 1.00 . A A . 16 ARG HD2 1 1 3 795 1 1 16 ARG HD3 H -2.951 -0.274 -5.226 1.00 . A A . 16 ARG HD3 1 1 3 796 1 1 16 ARG HE H -2.648 -1.376 -3.247 1.00 . A A . 16 ARG HE 1 1 3 797 1 1 16 ARG HG2 H -1.004 0.899 -4.440 1.00 . A A . 16 ARG HG2 1 1 3 798 1 1 16 ARG HG3 H -2.001 1.972 -3.453 1.00 . A A . 16 ARG HG3 1 1 3 799 1 1 16 ARG HH11 H -4.055 1.757 -2.559 1.00 . A A . 16 ARG HH11 1 1 3 800 1 1 16 ARG HH12 H -4.342 1.398 -0.890 1.00 . A A . 16 ARG HH12 1 1 3 801 1 1 16 ARG HH21 H -3.023 -1.841 -1.050 1.00 . A A . 16 ARG HH21 1 1 3 802 1 1 16 ARG HH22 H -3.755 -0.646 -0.032 1.00 . A A . 16 ARG HH22 1 1 3 803 1 1 16 ARG N N 0.067 2.248 -6.705 1.00 . A A . 16 ARG N 1 1 3 804 1 1 16 ARG NE N -3.029 -0.477 -3.157 1.00 . A A . 16 ARG NE 1 1 3 805 1 1 16 ARG NH1 N -4.003 1.121 -1.790 1.00 . A A . 16 ARG NH1 1 1 3 806 1 1 16 ARG NH2 N -3.415 -0.929 -0.929 1.00 . A A . 16 ARG NH2 1 1 3 807 1 1 16 ARG O O 0.798 2.877 -4.140 1.00 . A A . 16 ARG O 1 1 3 808 1 1 17 PRO C C -0.509 4.678 -1.585 1.00 . A A . 17 PRO C 1 1 3 809 1 1 17 PRO CA C 0.114 5.264 -2.853 1.00 . A A . 17 PRO CA 1 1 3 810 1 1 17 PRO CB C -0.169 6.771 -2.934 1.00 . A A . 17 PRO CB 1 1 3 811 1 1 17 PRO CD C -1.523 5.627 -4.582 1.00 . A A . 17 PRO CD 1 1 3 812 1 1 17 PRO CG C -1.029 6.980 -4.146 1.00 . A A . 17 PRO CG 1 1 3 813 1 1 17 PRO HA H 1.178 5.097 -2.830 1.00 . A A . 17 PRO HA 1 1 3 814 1 1 17 PRO HB2 H -0.680 7.086 -2.036 1.00 . A A . 17 PRO HB2 1 1 3 815 1 1 17 PRO HB3 H 0.769 7.304 -3.020 1.00 . A A . 17 PRO HB3 1 1 3 816 1 1 17 PRO HD2 H -2.478 5.405 -4.134 1.00 . A A . 17 PRO HD2 1 1 3 817 1 1 17 PRO HD3 H -1.587 5.581 -5.656 1.00 . A A . 17 PRO HD3 1 1 3 818 1 1 17 PRO HG2 H -1.865 7.614 -3.892 1.00 . A A . 17 PRO HG2 1 1 3 819 1 1 17 PRO HG3 H -0.444 7.434 -4.932 1.00 . A A . 17 PRO HG3 1 1 3 820 1 1 17 PRO N N -0.485 4.729 -4.075 1.00 . A A . 17 PRO N 1 1 3 821 1 1 17 PRO O O -1.571 4.053 -1.631 1.00 . A A . 17 PRO O 1 1 3 822 1 1 18 PRO C C -1.653 4.950 1.295 1.00 . A A . 18 PRO C 1 1 3 823 1 1 18 PRO CA C -0.306 4.365 0.866 1.00 . A A . 18 PRO CA 1 1 3 824 1 1 18 PRO CB C 0.777 4.815 1.851 1.00 . A A . 18 PRO CB 1 1 3 825 1 1 18 PRO CD C 1.438 5.597 -0.311 1.00 . A A . 18 PRO CD 1 1 3 826 1 1 18 PRO CG C 1.533 5.894 1.155 1.00 . A A . 18 PRO CG 1 1 3 827 1 1 18 PRO HA H -0.368 3.286 0.865 1.00 . A A . 18 PRO HA 1 1 3 828 1 1 18 PRO HB2 H 0.308 5.189 2.746 1.00 . A A . 18 PRO HB2 1 1 3 829 1 1 18 PRO HB3 H 1.411 3.983 2.098 1.00 . A A . 18 PRO HB3 1 1 3 830 1 1 18 PRO HD2 H 1.416 6.515 -0.880 1.00 . A A . 18 PRO HD2 1 1 3 831 1 1 18 PRO HD3 H 2.263 4.977 -0.625 1.00 . A A . 18 PRO HD3 1 1 3 832 1 1 18 PRO HG2 H 1.087 6.853 1.372 1.00 . A A . 18 PRO HG2 1 1 3 833 1 1 18 PRO HG3 H 2.566 5.881 1.473 1.00 . A A . 18 PRO HG3 1 1 3 834 1 1 18 PRO N N 0.161 4.873 -0.432 1.00 . A A . 18 PRO N 1 1 3 835 1 1 18 PRO O O -1.955 6.111 1.012 1.00 . A A . 18 PRO O 1 1 3 836 1 1 19 PRO C C -3.685 5.405 3.770 1.00 . A A . 19 PRO C 1 1 3 837 1 1 19 PRO CA C -3.779 4.583 2.485 1.00 . A A . 19 PRO CA 1 1 3 838 1 1 19 PRO CB C -4.522 3.273 2.737 1.00 . A A . 19 PRO CB 1 1 3 839 1 1 19 PRO CD C -2.182 2.756 2.383 1.00 . A A . 19 PRO CD 1 1 3 840 1 1 19 PRO CG C -3.484 2.222 2.926 1.00 . A A . 19 PRO CG 1 1 3 841 1 1 19 PRO HA H -4.304 5.155 1.734 1.00 . A A . 19 PRO HA 1 1 3 842 1 1 19 PRO HB2 H -5.143 3.371 3.613 1.00 . A A . 19 PRO HB2 1 1 3 843 1 1 19 PRO HB3 H -5.130 3.051 1.891 1.00 . A A . 19 PRO HB3 1 1 3 844 1 1 19 PRO HD2 H -1.413 2.723 3.139 1.00 . A A . 19 PRO HD2 1 1 3 845 1 1 19 PRO HD3 H -1.886 2.182 1.520 1.00 . A A . 19 PRO HD3 1 1 3 846 1 1 19 PRO HG2 H -3.392 1.990 3.970 1.00 . A A . 19 PRO HG2 1 1 3 847 1 1 19 PRO HG3 H -3.772 1.335 2.380 1.00 . A A . 19 PRO HG3 1 1 3 848 1 1 19 PRO N N -2.475 4.148 2.001 1.00 . A A . 19 PRO N 1 1 3 849 1 1 19 PRO O O -2.956 5.046 4.695 1.00 . A A . 19 PRO O 1 1 3 850 1 1 20 SER C C -5.540 6.986 5.967 1.00 . A A . 20 SER C 1 1 3 851 1 1 20 SER CA C -4.436 7.386 4.988 1.00 . A A . 20 SER CA 1 1 3 852 1 1 20 SER CB C -4.613 8.849 4.564 1.00 . A A . 20 SER CB 1 1 3 853 1 1 20 SER H H -4.991 6.741 3.047 1.00 . A A . 20 SER H 1 1 3 854 1 1 20 SER HA H -3.482 7.280 5.483 1.00 . A A . 20 SER HA 1 1 3 855 1 1 20 SER HB2 H -4.802 9.455 5.438 1.00 . A A . 20 SER HB2 1 1 3 856 1 1 20 SER HB3 H -3.710 9.192 4.079 1.00 . A A . 20 SER HB3 1 1 3 857 1 1 20 SER HG H -5.364 9.131 2.776 1.00 . A A . 20 SER HG 1 1 3 858 1 1 20 SER N N -4.430 6.510 3.817 1.00 . A A . 20 SER N 1 1 3 859 1 1 20 SER O O -6.711 6.891 5.537 1.00 . A A . 20 SER O 1 1 3 860 1 1 20 SER OXT O -5.224 6.768 7.155 1.00 . A A . 20 SER OXT 1 1 3 861 1 1 20 SER OG O -5.700 8.999 3.665 1.00 . A A . 20 SER OG 1 1 4 862 1 1 1 ASP C C -5.847 -2.599 5.800 1.00 . A A . 1 ASP C 1 1 4 863 1 1 1 ASP CA C -6.168 -3.965 6.403 1.00 . A A . 1 ASP CA 1 1 4 864 1 1 1 ASP CB C -7.148 -3.812 7.572 1.00 . A A . 1 ASP CB 1 1 4 865 1 1 1 ASP CG C -7.798 -5.126 7.961 1.00 . A A . 1 ASP CG 1 1 4 866 1 1 1 ASP H1 H -5.190 -5.607 7.173 1.00 . A A . 1 ASP H1 1 1 4 867 1 1 1 ASP H2 H -4.577 -4.096 7.708 1.00 . A A . 1 ASP H2 1 1 4 868 1 1 1 ASP H3 H -4.245 -4.645 6.116 1.00 . A A . 1 ASP H3 1 1 4 869 1 1 1 ASP HA H -6.618 -4.588 5.643 1.00 . A A . 1 ASP HA 1 1 4 870 1 1 1 ASP HB2 H -6.617 -3.427 8.430 1.00 . A A . 1 ASP HB2 1 1 4 871 1 1 1 ASP HB3 H -7.925 -3.115 7.293 1.00 . A A . 1 ASP HB3 1 1 4 872 1 1 1 ASP N N -4.934 -4.639 6.894 1.00 . A A . 1 ASP N 1 1 4 873 1 1 1 ASP O O -5.534 -1.652 6.524 1.00 . A A . 1 ASP O 1 1 4 874 1 1 1 ASP OD1 O -8.830 -5.482 7.353 1.00 . A A . 1 ASP OD1 1 1 4 875 1 1 1 ASP OD2 O -7.275 -5.800 8.874 1.00 . A A . 1 ASP OD2 1 1 4 876 1 1 2 ALA C C -4.154 -0.935 3.769 1.00 . A A . 2 ALA C 1 1 4 877 1 1 2 ALA CA C -5.646 -1.271 3.741 1.00 . A A . 2 ALA CA 1 1 4 878 1 1 2 ALA CB C -6.474 -0.116 4.294 1.00 . A A . 2 ALA CB 1 1 4 879 1 1 2 ALA H H -6.180 -3.309 3.957 1.00 . A A . 2 ALA H 1 1 4 880 1 1 2 ALA HA H -5.940 -1.426 2.712 1.00 . A A . 2 ALA HA 1 1 4 881 1 1 2 ALA HB1 H -6.476 0.697 3.584 1.00 . A A . 2 ALA HB1 1 1 4 882 1 1 2 ALA HB2 H -6.047 0.221 5.226 1.00 . A A . 2 ALA HB2 1 1 4 883 1 1 2 ALA HB3 H -7.487 -0.449 4.462 1.00 . A A . 2 ALA HB3 1 1 4 884 1 1 2 ALA N N -5.927 -2.512 4.468 1.00 . A A . 2 ALA N 1 1 4 885 1 1 2 ALA O O -3.459 -1.107 2.767 1.00 . A A . 2 ALA O 1 1 4 886 1 1 3 TYR C C -1.379 -1.366 5.023 1.00 . A A . 3 TYR C 1 1 4 887 1 1 3 TYR CA C -2.251 -0.113 5.067 1.00 . A A . 3 TYR CA 1 1 4 888 1 1 3 TYR CB C -2.016 0.662 6.367 1.00 . A A . 3 TYR CB 1 1 4 889 1 1 3 TYR CD1 C -1.030 2.932 5.830 1.00 . A A . 3 TYR CD1 1 1 4 890 1 1 3 TYR CD2 C 0.413 1.250 6.719 1.00 . A A . 3 TYR CD2 1 1 4 891 1 1 3 TYR CE1 C 0.029 3.817 5.784 1.00 . A A . 3 TYR CE1 1 1 4 892 1 1 3 TYR CE2 C 1.475 2.131 6.671 1.00 . A A . 3 TYR CE2 1 1 4 893 1 1 3 TYR CG C -0.856 1.631 6.298 1.00 . A A . 3 TYR CG 1 1 4 894 1 1 3 TYR CZ C 1.278 3.413 6.204 1.00 . A A . 3 TYR CZ 1 1 4 895 1 1 3 TYR H H -4.267 -0.351 5.684 1.00 . A A . 3 TYR H 1 1 4 896 1 1 3 TYR HA H -1.982 0.514 4.235 1.00 . A A . 3 TYR HA 1 1 4 897 1 1 3 TYR HB2 H -2.903 1.229 6.606 1.00 . A A . 3 TYR HB2 1 1 4 898 1 1 3 TYR HB3 H -1.817 -0.039 7.165 1.00 . A A . 3 TYR HB3 1 1 4 899 1 1 3 TYR HD1 H -2.009 3.248 5.489 1.00 . A A . 3 TYR HD1 1 1 4 900 1 1 3 TYR HD2 H 0.565 0.244 7.083 1.00 . A A . 3 TYR HD2 1 1 4 901 1 1 3 TYR HE1 H -0.126 4.822 5.426 1.00 . A A . 3 TYR HE1 1 1 4 902 1 1 3 TYR HE2 H 2.454 1.814 6.998 1.00 . A A . 3 TYR HE2 1 1 4 903 1 1 3 TYR HH H 2.748 4.255 5.294 1.00 . A A . 3 TYR HH 1 1 4 904 1 1 3 TYR N N -3.664 -0.462 4.919 1.00 . A A . 3 TYR N 1 1 4 905 1 1 3 TYR O O -0.437 -1.442 4.232 1.00 . A A . 3 TYR O 1 1 4 906 1 1 3 TYR OH O 2.334 4.294 6.159 1.00 . A A . 3 TYR OH 1 1 4 907 1 1 4 ALA C C -1.117 -4.342 4.548 1.00 . A A . 4 ALA C 1 1 4 908 1 1 4 ALA CA C -0.969 -3.613 5.883 1.00 . A A . 4 ALA CA 1 1 4 909 1 1 4 ALA CB C -1.446 -4.494 7.030 1.00 . A A . 4 ALA CB 1 1 4 910 1 1 4 ALA H H -2.483 -2.245 6.450 1.00 . A A . 4 ALA H 1 1 4 911 1 1 4 ALA HA H 0.077 -3.383 6.041 1.00 . A A . 4 ALA HA 1 1 4 912 1 1 4 ALA HB1 H -2.341 -5.021 6.732 1.00 . A A . 4 ALA HB1 1 1 4 913 1 1 4 ALA HB2 H -1.661 -3.879 7.891 1.00 . A A . 4 ALA HB2 1 1 4 914 1 1 4 ALA HB3 H -0.675 -5.207 7.281 1.00 . A A . 4 ALA HB3 1 1 4 915 1 1 4 ALA N N -1.711 -2.356 5.856 1.00 . A A . 4 ALA N 1 1 4 916 1 1 4 ALA O O -0.185 -5.004 4.087 1.00 . A A . 4 ALA O 1 1 4 917 1 1 5 GLN C C -1.713 -4.148 1.540 1.00 . A A . 5 GLN C 1 1 4 918 1 1 5 GLN CA C -2.559 -4.812 2.627 1.00 . A A . 5 GLN CA 1 1 4 919 1 1 5 GLN CB C -4.049 -4.702 2.284 1.00 . A A . 5 GLN CB 1 1 4 920 1 1 5 GLN CD C -4.219 -6.687 0.725 1.00 . A A . 5 GLN CD 1 1 4 921 1 1 5 GLN CG C -4.396 -5.188 0.886 1.00 . A A . 5 GLN CG 1 1 4 922 1 1 5 GLN H H -2.986 -3.638 4.332 1.00 . A A . 5 GLN H 1 1 4 923 1 1 5 GLN HA H -2.287 -5.855 2.694 1.00 . A A . 5 GLN HA 1 1 4 924 1 1 5 GLN HB2 H -4.614 -5.288 2.995 1.00 . A A . 5 GLN HB2 1 1 4 925 1 1 5 GLN HB3 H -4.350 -3.668 2.367 1.00 . A A . 5 GLN HB3 1 1 4 926 1 1 5 GLN HE21 H -6.129 -6.996 1.194 1.00 . A A . 5 GLN HE21 1 1 4 927 1 1 5 GLN HE22 H -5.203 -8.411 0.845 1.00 . A A . 5 GLN HE22 1 1 4 928 1 1 5 GLN HG2 H -5.425 -4.937 0.676 1.00 . A A . 5 GLN HG2 1 1 4 929 1 1 5 GLN HG3 H -3.753 -4.686 0.178 1.00 . A A . 5 GLN HG3 1 1 4 930 1 1 5 GLN N N -2.290 -4.193 3.921 1.00 . A A . 5 GLN N 1 1 4 931 1 1 5 GLN NE2 N -5.292 -7.440 0.944 1.00 . A A . 5 GLN NE2 1 1 4 932 1 1 5 GLN O O -1.194 -4.821 0.650 1.00 . A A . 5 GLN O 1 1 4 933 1 1 5 GLN OE1 O -3.129 -7.163 0.408 1.00 . A A . 5 GLN OE1 1 1 4 934 1 1 6 TRP C C 0.676 -2.515 0.695 1.00 . A A . 6 TRP C 1 1 4 935 1 1 6 TRP CA C -0.777 -2.053 0.676 1.00 . A A . 6 TRP CA 1 1 4 936 1 1 6 TRP CB C -0.848 -0.559 1.007 1.00 . A A . 6 TRP CB 1 1 4 937 1 1 6 TRP CD1 C -0.358 0.611 -1.208 1.00 . A A . 6 TRP CD1 1 1 4 938 1 1 6 TRP CD2 C 1.200 0.945 0.360 1.00 . A A . 6 TRP CD2 1 1 4 939 1 1 6 TRP CE2 C 1.581 1.632 -0.806 1.00 . A A . 6 TRP CE2 1 1 4 940 1 1 6 TRP CE3 C 2.031 1.013 1.483 1.00 . A A . 6 TRP CE3 1 1 4 941 1 1 6 TRP CG C -0.046 0.295 0.077 1.00 . A A . 6 TRP CG 1 1 4 942 1 1 6 TRP CH2 C 3.545 2.433 0.225 1.00 . A A . 6 TRP CH2 1 1 4 943 1 1 6 TRP CZ2 C 2.752 2.379 -0.885 1.00 . A A . 6 TRP CZ2 1 1 4 944 1 1 6 TRP CZ3 C 3.195 1.759 1.404 1.00 . A A . 6 TRP CZ3 1 1 4 945 1 1 6 TRP H H -2.004 -2.348 2.375 1.00 . A A . 6 TRP H 1 1 4 946 1 1 6 TRP HA H -1.186 -2.219 -0.308 1.00 . A A . 6 TRP HA 1 1 4 947 1 1 6 TRP HB2 H -1.874 -0.235 0.955 1.00 . A A . 6 TRP HB2 1 1 4 948 1 1 6 TRP HB3 H -0.478 -0.399 2.007 1.00 . A A . 6 TRP HB3 1 1 4 949 1 1 6 TRP HD1 H -1.244 0.271 -1.719 1.00 . A A . 6 TRP HD1 1 1 4 950 1 1 6 TRP HE1 H 0.617 1.763 -2.657 1.00 . A A . 6 TRP HE1 1 1 4 951 1 1 6 TRP HE3 H 1.777 0.496 2.398 1.00 . A A . 6 TRP HE3 1 1 4 952 1 1 6 TRP HH2 H 4.458 3.011 0.208 1.00 . A A . 6 TRP HH2 1 1 4 953 1 1 6 TRP HZ2 H 3.038 2.898 -1.788 1.00 . A A . 6 TRP HZ2 1 1 4 954 1 1 6 TRP HZ3 H 3.851 1.823 2.260 1.00 . A A . 6 TRP HZ3 1 1 4 955 1 1 6 TRP N N -1.571 -2.821 1.634 1.00 . A A . 6 TRP N 1 1 4 956 1 1 6 TRP NE1 N 0.616 1.408 -1.746 1.00 . A A . 6 TRP NE1 1 1 4 957 1 1 6 TRP O O 1.266 -2.785 -0.353 1.00 . A A . 6 TRP O 1 1 4 958 1 1 7 LEU C C 2.789 -4.496 1.625 1.00 . A A . 7 LEU C 1 1 4 959 1 1 7 LEU CA C 2.618 -3.045 2.079 1.00 . A A . 7 LEU CA 1 1 4 960 1 1 7 LEU CB C 3.026 -2.893 3.548 1.00 . A A . 7 LEU CB 1 1 4 961 1 1 7 LEU CD1 C 2.941 -1.463 5.610 1.00 . A A . 7 LEU CD1 1 1 4 962 1 1 7 LEU CD2 C 4.164 -0.650 3.584 1.00 . A A . 7 LEU CD2 1 1 4 963 1 1 7 LEU CG C 2.977 -1.460 4.089 1.00 . A A . 7 LEU CG 1 1 4 964 1 1 7 LEU H H 0.704 -2.383 2.690 1.00 . A A . 7 LEU H 1 1 4 965 1 1 7 LEU HA H 3.247 -2.414 1.472 1.00 . A A . 7 LEU HA 1 1 4 966 1 1 7 LEU HB2 H 2.364 -3.503 4.146 1.00 . A A . 7 LEU HB2 1 1 4 967 1 1 7 LEU HB3 H 4.030 -3.265 3.663 1.00 . A A . 7 LEU HB3 1 1 4 968 1 1 7 LEU HD11 H 3.902 -1.774 5.993 1.00 . A A . 7 LEU HD11 1 1 4 969 1 1 7 LEU HD12 H 2.179 -2.149 5.950 1.00 . A A . 7 LEU HD12 1 1 4 970 1 1 7 LEU HD13 H 2.715 -0.469 5.967 1.00 . A A . 7 LEU HD13 1 1 4 971 1 1 7 LEU HD21 H 4.023 -0.417 2.538 1.00 . A A . 7 LEU HD21 1 1 4 972 1 1 7 LEU HD22 H 5.071 -1.225 3.705 1.00 . A A . 7 LEU HD22 1 1 4 973 1 1 7 LEU HD23 H 4.241 0.267 4.149 1.00 . A A . 7 LEU HD23 1 1 4 974 1 1 7 LEU HG H 2.074 -0.982 3.739 1.00 . A A . 7 LEU HG 1 1 4 975 1 1 7 LEU N N 1.237 -2.608 1.899 1.00 . A A . 7 LEU N 1 1 4 976 1 1 7 LEU O O 3.818 -4.857 1.051 1.00 . A A . 7 LEU O 1 1 4 977 1 1 8 ALA C C 1.567 -6.899 -0.024 1.00 . A A . 8 ALA C 1 1 4 978 1 1 8 ALA CA C 1.785 -6.726 1.485 1.00 . A A . 8 ALA CA 1 1 4 979 1 1 8 ALA CB C 0.734 -7.503 2.264 1.00 . A A . 8 ALA CB 1 1 4 980 1 1 8 ALA H H 0.970 -4.962 2.328 1.00 . A A . 8 ALA H 1 1 4 981 1 1 8 ALA HA H 2.755 -7.126 1.743 1.00 . A A . 8 ALA HA 1 1 4 982 1 1 8 ALA HB1 H -0.241 -7.076 2.078 1.00 . A A . 8 ALA HB1 1 1 4 983 1 1 8 ALA HB2 H 0.955 -7.450 3.319 1.00 . A A . 8 ALA HB2 1 1 4 984 1 1 8 ALA HB3 H 0.740 -8.536 1.947 1.00 . A A . 8 ALA HB3 1 1 4 985 1 1 8 ALA N N 1.764 -5.317 1.875 1.00 . A A . 8 ALA N 1 1 4 986 1 1 8 ALA O O 1.882 -7.952 -0.582 1.00 . A A . 8 ALA O 1 1 4 987 1 1 9 ASP C C 2.006 -5.420 -2.920 1.00 . A A . 9 ASP C 1 1 4 988 1 1 9 ASP CA C 0.786 -5.903 -2.124 1.00 . A A . 9 ASP CA 1 1 4 989 1 1 9 ASP CB C -0.438 -5.048 -2.480 1.00 . A A . 9 ASP CB 1 1 4 990 1 1 9 ASP CG C -1.544 -5.861 -3.122 1.00 . A A . 9 ASP CG 1 1 4 991 1 1 9 ASP H H 0.810 -5.047 -0.185 1.00 . A A . 9 ASP H 1 1 4 992 1 1 9 ASP HA H 0.584 -6.929 -2.392 1.00 . A A . 9 ASP HA 1 1 4 993 1 1 9 ASP HB2 H -0.829 -4.593 -1.583 1.00 . A A . 9 ASP HB2 1 1 4 994 1 1 9 ASP HB3 H -0.140 -4.271 -3.170 1.00 . A A . 9 ASP HB3 1 1 4 995 1 1 9 ASP N N 1.035 -5.861 -0.680 1.00 . A A . 9 ASP N 1 1 4 996 1 1 9 ASP O O 1.895 -5.110 -4.108 1.00 . A A . 9 ASP O 1 1 4 997 1 1 9 ASP OD1 O -1.507 -6.042 -4.358 1.00 . A A . 9 ASP OD1 1 1 4 998 1 1 9 ASP OD2 O -2.447 -6.318 -2.390 1.00 . A A . 9 ASP OD2 1 1 4 999 1 1 10 DAL C C 4.765 -3.482 -2.514 1.00 . A A . 10 DAL C 1 1 4 1000 1 1 10 DAL CA C 4.401 -4.916 -2.908 1.00 . A A . 10 DAL CA 1 1 4 1001 1 1 10 DAL CB C 5.536 -5.858 -2.547 1.00 . A A . 10 DAL CB 1 1 4 1002 1 1 10 DAL H H 3.199 -5.617 -1.319 1.00 . A A . 10 DAL H 1 1 4 1003 1 1 10 DAL HA H 4.255 -4.961 -3.977 1.00 . A A . 10 DAL HA 1 1 4 1004 1 1 10 DAL HB1 H 6.407 -5.616 -3.138 1.00 . A A . 10 DAL HB1 1 1 4 1005 1 1 10 DAL HB2 H 5.237 -6.876 -2.744 1.00 . A A . 10 DAL HB2 1 1 4 1006 1 1 10 DAL HB3 H 5.770 -5.747 -1.498 1.00 . A A . 10 DAL HB3 1 1 4 1007 1 1 10 DAL N N 3.168 -5.360 -2.262 1.00 . A A . 10 DAL N 1 1 4 1008 1 1 10 DAL O O 5.812 -2.972 -2.919 1.00 . A A . 10 DAL O 1 1 4 1009 1 1 11 GLY C C 4.098 -0.484 -2.440 1.00 . A A . 11 GLY C 1 1 4 1010 1 1 11 GLY CA C 4.156 -1.472 -1.295 1.00 . A A . 11 GLY CA 1 1 4 1011 1 1 11 GLY H H 3.085 -3.288 -1.435 1.00 . A A . 11 GLY H 1 1 4 1012 1 1 11 GLY HA2 H 3.417 -1.192 -0.558 1.00 . A A . 11 GLY HA2 1 1 4 1013 1 1 11 GLY HA3 H 5.136 -1.425 -0.843 1.00 . A A . 11 GLY HA3 1 1 4 1014 1 1 11 GLY N N 3.901 -2.835 -1.726 1.00 . A A . 11 GLY N 1 1 4 1015 1 1 11 GLY O O 3.018 -0.032 -2.822 1.00 . A A . 11 GLY O 1 1 4 1016 1 1 12 TRP C C 5.435 0.081 -5.452 1.00 . A A . 12 TRP C 1 1 4 1017 1 1 12 TRP CA C 5.342 0.792 -4.099 1.00 . A A . 12 TRP CA 1 1 4 1018 1 1 12 TRP CB C 6.520 1.743 -3.889 1.00 . A A . 12 TRP CB 1 1 4 1019 1 1 12 TRP CD1 C 6.666 3.099 -1.726 1.00 . A A . 12 TRP CD1 1 1 4 1020 1 1 12 TRP CD2 C 5.173 3.873 -3.205 1.00 . A A . 12 TRP CD2 1 1 4 1021 1 1 12 TRP CE2 C 5.138 4.690 -2.062 1.00 . A A . 12 TRP CE2 1 1 4 1022 1 1 12 TRP CE3 C 4.319 4.172 -4.275 1.00 . A A . 12 TRP CE3 1 1 4 1023 1 1 12 TRP CG C 6.157 2.860 -2.969 1.00 . A A . 12 TRP CG 1 1 4 1024 1 1 12 TRP CH2 C 3.457 6.048 -3.012 1.00 . A A . 12 TRP CH2 1 1 4 1025 1 1 12 TRP CZ2 C 4.281 5.777 -1.952 1.00 . A A . 12 TRP CZ2 1 1 4 1026 1 1 12 TRP CZ3 C 3.473 5.256 -4.167 1.00 . A A . 12 TRP CZ3 1 1 4 1027 1 1 12 TRP H H 6.090 -0.548 -2.641 1.00 . A A . 12 TRP H 1 1 4 1028 1 1 12 TRP HA H 4.430 1.374 -4.087 1.00 . A A . 12 TRP HA 1 1 4 1029 1 1 12 TRP HB2 H 7.345 1.198 -3.453 1.00 . A A . 12 TRP HB2 1 1 4 1030 1 1 12 TRP HB3 H 6.825 2.163 -4.836 1.00 . A A . 12 TRP HB3 1 1 4 1031 1 1 12 TRP HD1 H 7.434 2.501 -1.257 1.00 . A A . 12 TRP HD1 1 1 4 1032 1 1 12 TRP HE1 H 6.252 4.571 -0.287 1.00 . A A . 12 TRP HE1 1 1 4 1033 1 1 12 TRP HE3 H 4.314 3.573 -5.174 1.00 . A A . 12 TRP HE3 1 1 4 1034 1 1 12 TRP HH2 H 2.779 6.887 -2.969 1.00 . A A . 12 TRP HH2 1 1 4 1035 1 1 12 TRP HZ2 H 4.250 6.385 -1.065 1.00 . A A . 12 TRP HZ2 1 1 4 1036 1 1 12 TRP HZ3 H 2.811 5.504 -4.986 1.00 . A A . 12 TRP HZ3 1 1 4 1037 1 1 12 TRP N N 5.264 -0.151 -2.990 1.00 . A A . 12 TRP N 1 1 4 1038 1 1 12 TRP NE1 N 6.058 4.198 -1.173 1.00 . A A . 12 TRP NE1 1 1 4 1039 1 1 12 TRP O O 5.700 0.716 -6.475 1.00 . A A . 12 TRP O 1 1 4 1040 1 1 13 ALA C C 3.835 -1.961 -7.367 1.00 . A A . 13 ALA C 1 1 4 1041 1 1 13 ALA CA C 5.202 -2.011 -6.691 1.00 . A A . 13 ALA CA 1 1 4 1042 1 1 13 ALA CB C 5.613 -3.447 -6.412 1.00 . A A . 13 ALA CB 1 1 4 1043 1 1 13 ALA H H 4.949 -1.680 -4.620 1.00 . A A . 13 ALA H 1 1 4 1044 1 1 13 ALA HA H 5.932 -1.571 -7.351 1.00 . A A . 13 ALA HA 1 1 4 1045 1 1 13 ALA HB1 H 5.916 -3.542 -5.380 1.00 . A A . 13 ALA HB1 1 1 4 1046 1 1 13 ALA HB2 H 6.438 -3.712 -7.054 1.00 . A A . 13 ALA HB2 1 1 4 1047 1 1 13 ALA HB3 H 4.779 -4.106 -6.605 1.00 . A A . 13 ALA HB3 1 1 4 1048 1 1 13 ALA N N 5.181 -1.231 -5.459 1.00 . A A . 13 ALA N 1 1 4 1049 1 1 13 ALA O O 3.738 -1.990 -8.595 1.00 . A A . 13 ALA O 1 1 4 1050 1 1 14 SER C C 1.214 -0.508 -7.877 1.00 . A A . 14 SER C 1 1 4 1051 1 1 14 SER CA C 1.413 -1.781 -7.050 1.00 . A A . 14 SER CA 1 1 4 1052 1 1 14 SER CB C 0.414 -1.817 -5.883 1.00 . A A . 14 SER CB 1 1 4 1053 1 1 14 SER H H 2.933 -1.830 -5.581 1.00 . A A . 14 SER H 1 1 4 1054 1 1 14 SER HA H 1.241 -2.634 -7.686 1.00 . A A . 14 SER HA 1 1 4 1055 1 1 14 SER HB2 H -0.485 -1.289 -6.164 1.00 . A A . 14 SER HB2 1 1 4 1056 1 1 14 SER HB3 H 0.168 -2.844 -5.654 1.00 . A A . 14 SER HB3 1 1 4 1057 1 1 14 SER HG H 1.272 -1.887 -4.115 1.00 . A A . 14 SER HG 1 1 4 1058 1 1 14 SER N N 2.782 -1.863 -6.549 1.00 . A A . 14 SER N 1 1 4 1059 1 1 14 SER O O 0.393 -0.480 -8.796 1.00 . A A . 14 SER O 1 1 4 1060 1 1 14 SER OG O 0.953 -1.207 -4.718 1.00 . A A . 14 SER OG 1 1 4 1061 1 1 15 DAL C C 1.035 2.834 -7.498 1.00 . A A . 15 DAL C 1 1 4 1062 1 1 15 DAL CA C 1.889 1.817 -8.260 1.00 . A A . 15 DAL CA 1 1 4 1063 1 1 15 DAL CB C 3.284 2.370 -8.508 1.00 . A A . 15 DAL CB 1 1 4 1064 1 1 15 DAL H H 2.612 0.456 -6.806 1.00 . A A . 15 DAL H 1 1 4 1065 1 1 15 DAL HA H 1.433 1.630 -9.220 1.00 . A A . 15 DAL HA 1 1 4 1066 1 1 15 DAL HB1 H 4.019 1.687 -8.109 1.00 . A A . 15 DAL HB1 1 1 4 1067 1 1 15 DAL HB2 H 3.383 3.329 -8.023 1.00 . A A . 15 DAL HB2 1 1 4 1068 1 1 15 DAL HB3 H 3.439 2.485 -9.570 1.00 . A A . 15 DAL HB3 1 1 4 1069 1 1 15 DAL N N 1.976 0.542 -7.547 1.00 . A A . 15 DAL N 1 1 4 1070 1 1 15 DAL O O 1.186 4.044 -7.677 1.00 . A A . 15 DAL O 1 1 4 1071 1 1 16 ARG C C -0.053 3.624 -4.563 1.00 . A A . 16 ARG C 1 1 4 1072 1 1 16 ARG CA C -0.742 3.192 -5.858 1.00 . A A . 16 ARG CA 1 1 4 1073 1 1 16 ARG CB C -2.052 2.444 -5.534 1.00 . A A . 16 ARG CB 1 1 4 1074 1 1 16 ARG CD C -2.924 0.320 -4.502 1.00 . A A . 16 ARG CD 1 1 4 1075 1 1 16 ARG CG C -1.926 1.462 -4.375 1.00 . A A . 16 ARG CG 1 1 4 1076 1 1 16 ARG CZ C -3.510 -0.294 -2.175 1.00 . A A . 16 ARG CZ 1 1 4 1077 1 1 16 ARG H H 0.065 1.360 -6.552 1.00 . A A . 16 ARG H 1 1 4 1078 1 1 16 ARG HA H -0.965 4.075 -6.443 1.00 . A A . 16 ARG HA 1 1 4 1079 1 1 16 ARG HB2 H -2.812 3.168 -5.282 1.00 . A A . 16 ARG HB2 1 1 4 1080 1 1 16 ARG HB3 H -2.374 1.886 -6.408 1.00 . A A . 16 ARG HB3 1 1 4 1081 1 1 16 ARG HD2 H -3.915 0.735 -4.613 1.00 . A A . 16 ARG HD2 1 1 4 1082 1 1 16 ARG HD3 H -2.678 -0.255 -5.382 1.00 . A A . 16 ARG HD3 1 1 4 1083 1 1 16 ARG HE H -2.430 -1.418 -3.429 1.00 . A A . 16 ARG HE 1 1 4 1084 1 1 16 ARG HG2 H -0.926 1.052 -4.369 1.00 . A A . 16 ARG HG2 1 1 4 1085 1 1 16 ARG HG3 H -2.108 1.987 -3.448 1.00 . A A . 16 ARG HG3 1 1 4 1086 1 1 16 ARG HH11 H -4.212 1.520 -2.746 1.00 . A A . 16 ARG HH11 1 1 4 1087 1 1 16 ARG HH12 H -4.610 1.047 -1.129 1.00 . A A . 16 ARG HH12 1 1 4 1088 1 1 16 ARG HH21 H -2.962 -2.034 -1.299 1.00 . A A . 16 ARG HH21 1 1 4 1089 1 1 16 ARG HH22 H -3.900 -0.969 -0.307 1.00 . A A . 16 ARG HH22 1 1 4 1090 1 1 16 ARG N N 0.138 2.333 -6.650 1.00 . A A . 16 ARG N 1 1 4 1091 1 1 16 ARG NE N -2.909 -0.567 -3.338 1.00 . A A . 16 ARG NE 1 1 4 1092 1 1 16 ARG NH1 N -4.164 0.852 -2.003 1.00 . A A . 16 ARG NH1 1 1 4 1093 1 1 16 ARG NH2 N -3.453 -1.171 -1.178 1.00 . A A . 16 ARG NH2 1 1 4 1094 1 1 16 ARG O O 0.827 2.923 -4.062 1.00 . A A . 16 ARG O 1 1 4 1095 1 1 17 PRO C C -0.510 4.690 -1.510 1.00 . A A . 17 PRO C 1 1 4 1096 1 1 17 PRO CA C 0.139 5.296 -2.755 1.00 . A A . 17 PRO CA 1 1 4 1097 1 1 17 PRO CB C -0.131 6.806 -2.814 1.00 . A A . 17 PRO CB 1 1 4 1098 1 1 17 PRO CD C -1.462 5.700 -4.508 1.00 . A A . 17 PRO CD 1 1 4 1099 1 1 17 PRO CG C -0.972 7.043 -4.034 1.00 . A A . 17 PRO CG 1 1 4 1100 1 1 17 PRO HA H 1.201 5.120 -2.714 1.00 . A A . 17 PRO HA 1 1 4 1101 1 1 17 PRO HB2 H -0.652 7.110 -1.919 1.00 . A A . 17 PRO HB2 1 1 4 1102 1 1 17 PRO HB3 H 0.813 7.332 -2.878 1.00 . A A . 17 PRO HB3 1 1 4 1103 1 1 17 PRO HD2 H -2.428 5.475 -4.085 1.00 . A A . 17 PRO HD2 1 1 4 1104 1 1 17 PRO HD3 H -1.503 5.675 -5.584 1.00 . A A . 17 PRO HD3 1 1 4 1105 1 1 17 PRO HG2 H -1.811 7.674 -3.780 1.00 . A A . 17 PRO HG2 1 1 4 1106 1 1 17 PRO HG3 H -0.374 7.513 -4.802 1.00 . A A . 17 PRO HG3 1 1 4 1107 1 1 17 PRO N N -0.440 4.786 -3.996 1.00 . A A . 17 PRO N 1 1 4 1108 1 1 17 PRO O O -1.571 4.067 -1.589 1.00 . A A . 17 PRO O 1 1 4 1109 1 1 18 PRO C C -1.717 4.915 1.343 1.00 . A A . 18 PRO C 1 1 4 1110 1 1 18 PRO CA C -0.363 4.333 0.935 1.00 . A A . 18 PRO CA 1 1 4 1111 1 1 18 PRO CB C 0.698 4.756 1.956 1.00 . A A . 18 PRO CB 1 1 4 1112 1 1 18 PRO CD C 1.410 5.583 -0.178 1.00 . A A . 18 PRO CD 1 1 4 1113 1 1 18 PRO CG C 1.488 5.835 1.298 1.00 . A A . 18 PRO CG 1 1 4 1114 1 1 18 PRO HA H -0.430 3.255 0.910 1.00 . A A . 18 PRO HA 1 1 4 1115 1 1 18 PRO HB2 H 0.209 5.123 2.843 1.00 . A A . 18 PRO HB2 1 1 4 1116 1 1 18 PRO HB3 H 1.314 3.912 2.209 1.00 . A A . 18 PRO HB3 1 1 4 1117 1 1 18 PRO HD2 H 1.396 6.518 -0.719 1.00 . A A . 18 PRO HD2 1 1 4 1118 1 1 18 PRO HD3 H 2.239 4.973 -0.501 1.00 . A A . 18 PRO HD3 1 1 4 1119 1 1 18 PRO HG2 H 1.061 6.798 1.535 1.00 . A A . 18 PRO HG2 1 1 4 1120 1 1 18 PRO HG3 H 2.515 5.790 1.631 1.00 . A A . 18 PRO HG3 1 1 4 1121 1 1 18 PRO N N 0.135 4.864 -0.340 1.00 . A A . 18 PRO N 1 1 4 1122 1 1 18 PRO O O -1.995 6.092 1.105 1.00 . A A . 18 PRO O 1 1 4 1123 1 1 19 PRO C C -3.840 5.260 3.766 1.00 . A A . 19 PRO C 1 1 4 1124 1 1 19 PRO CA C -3.891 4.515 2.432 1.00 . A A . 19 PRO CA 1 1 4 1125 1 1 19 PRO CB C -4.657 3.203 2.575 1.00 . A A . 19 PRO CB 1 1 4 1126 1 1 19 PRO CD C -2.309 2.678 2.297 1.00 . A A . 19 PRO CD 1 1 4 1127 1 1 19 PRO CG C -3.638 2.133 2.759 1.00 . A A . 19 PRO CG 1 1 4 1128 1 1 19 PRO HA H -4.378 5.138 1.696 1.00 . A A . 19 PRO HA 1 1 4 1129 1 1 19 PRO HB2 H -5.321 3.261 3.423 1.00 . A A . 19 PRO HB2 1 1 4 1130 1 1 19 PRO HB3 H -5.223 3.035 1.689 1.00 . A A . 19 PRO HB3 1 1 4 1131 1 1 19 PRO HD2 H -1.572 2.598 3.081 1.00 . A A . 19 PRO HD2 1 1 4 1132 1 1 19 PRO HD3 H -1.984 2.146 1.419 1.00 . A A . 19 PRO HD3 1 1 4 1133 1 1 19 PRO HG2 H -3.592 1.852 3.795 1.00 . A A . 19 PRO HG2 1 1 4 1134 1 1 19 PRO HG3 H -3.911 1.276 2.160 1.00 . A A . 19 PRO HG3 1 1 4 1135 1 1 19 PRO N N -2.573 4.090 1.977 1.00 . A A . 19 PRO N 1 1 4 1136 1 1 19 PRO O O -3.373 4.723 4.770 1.00 . A A . 19 PRO O 1 1 4 1137 1 1 20 SER C C -5.679 8.049 5.126 1.00 . A A . 20 SER C 1 1 4 1138 1 1 20 SER CA C -4.343 7.324 4.972 1.00 . A A . 20 SER CA 1 1 4 1139 1 1 20 SER CB C -3.196 8.339 4.938 1.00 . A A . 20 SER CB 1 1 4 1140 1 1 20 SER H H -4.688 6.870 2.931 1.00 . A A . 20 SER H 1 1 4 1141 1 1 20 SER HA H -4.205 6.669 5.819 1.00 . A A . 20 SER HA 1 1 4 1142 1 1 20 SER HB2 H -2.306 7.861 4.554 1.00 . A A . 20 SER HB2 1 1 4 1143 1 1 20 SER HB3 H -3.467 9.164 4.295 1.00 . A A . 20 SER HB3 1 1 4 1144 1 1 20 SER HG H -2.018 8.622 6.479 1.00 . A A . 20 SER HG 1 1 4 1145 1 1 20 SER N N -4.328 6.500 3.764 1.00 . A A . 20 SER N 1 1 4 1146 1 1 20 SER O O -6.096 8.739 4.170 1.00 . A A . 20 SER O 1 1 4 1147 1 1 20 SER OXT O -6.299 7.919 6.203 1.00 . A A . 20 SER OXT 1 1 4 1148 1 1 20 SER OG O -2.921 8.841 6.235 1.00 . A A . 20 SER OG 1 1 5 1149 1 1 1 ASP C C -5.672 -2.953 5.732 1.00 . A A . 1 ASP C 1 1 5 1150 1 1 1 ASP CA C -6.223 -3.239 7.129 1.00 . A A . 1 ASP CA 1 1 5 1151 1 1 1 ASP CB C -7.714 -3.585 7.050 1.00 . A A . 1 ASP CB 1 1 5 1152 1 1 1 ASP CG C -7.953 -5.043 6.708 1.00 . A A . 1 ASP CG 1 1 5 1153 1 1 1 ASP H1 H -6.251 -2.384 9.003 1.00 . A A . 1 ASP H1 1 1 5 1154 1 1 1 ASP H2 H -6.724 -1.331 7.733 1.00 . A A . 1 ASP H2 1 1 5 1155 1 1 1 ASP H3 H -5.070 -1.737 7.944 1.00 . A A . 1 ASP H3 1 1 5 1156 1 1 1 ASP HA H -5.688 -4.076 7.551 1.00 . A A . 1 ASP HA 1 1 5 1157 1 1 1 ASP HB2 H -8.175 -3.378 8.004 1.00 . A A . 1 ASP HB2 1 1 5 1158 1 1 1 ASP HB3 H -8.179 -2.974 6.290 1.00 . A A . 1 ASP HB3 1 1 5 1159 1 1 1 ASP N N -6.052 -2.067 8.033 1.00 . A A . 1 ASP N 1 1 5 1160 1 1 1 ASP O O -4.864 -3.723 5.208 1.00 . A A . 1 ASP O 1 1 5 1161 1 1 1 ASP OD1 O -7.887 -5.391 5.510 1.00 . A A . 1 ASP OD1 1 1 5 1162 1 1 1 ASP OD2 O -8.206 -5.837 7.639 1.00 . A A . 1 ASP OD2 1 1 5 1163 1 1 2 ALA C C -4.167 -1.128 3.791 1.00 . A A . 2 ALA C 1 1 5 1164 1 1 2 ALA CA C -5.660 -1.451 3.801 1.00 . A A . 2 ALA CA 1 1 5 1165 1 1 2 ALA CB C -6.456 -0.258 3.300 1.00 . A A . 2 ALA CB 1 1 5 1166 1 1 2 ALA H H -6.753 -1.270 5.607 1.00 . A A . 2 ALA H 1 1 5 1167 1 1 2 ALA HA H -5.842 -2.281 3.133 1.00 . A A . 2 ALA HA 1 1 5 1168 1 1 2 ALA HB1 H -6.371 -0.196 2.225 1.00 . A A . 2 ALA HB1 1 1 5 1169 1 1 2 ALA HB2 H -6.067 0.645 3.745 1.00 . A A . 2 ALA HB2 1 1 5 1170 1 1 2 ALA HB3 H -7.493 -0.377 3.573 1.00 . A A . 2 ALA HB3 1 1 5 1171 1 1 2 ALA N N -6.111 -1.842 5.136 1.00 . A A . 2 ALA N 1 1 5 1172 1 1 2 ALA O O -3.465 -1.444 2.832 1.00 . A A . 2 ALA O 1 1 5 1173 1 1 3 TYR C C -1.392 -1.374 4.964 1.00 . A A . 3 TYR C 1 1 5 1174 1 1 3 TYR CA C -2.278 -0.130 4.988 1.00 . A A . 3 TYR CA 1 1 5 1175 1 1 3 TYR CB C -2.040 0.672 6.272 1.00 . A A . 3 TYR CB 1 1 5 1176 1 1 3 TYR CD1 C -1.059 2.948 5.750 1.00 . A A . 3 TYR CD1 1 1 5 1177 1 1 3 TYR CD2 C 0.398 1.243 6.572 1.00 . A A . 3 TYR CD2 1 1 5 1178 1 1 3 TYR CE1 C 0.002 3.830 5.697 1.00 . A A . 3 TYR CE1 1 1 5 1179 1 1 3 TYR CE2 C 1.462 2.121 6.516 1.00 . A A . 3 TYR CE2 1 1 5 1180 1 1 3 TYR CG C -0.879 1.637 6.189 1.00 . A A . 3 TYR CG 1 1 5 1181 1 1 3 TYR CZ C 1.260 3.412 6.079 1.00 . A A . 3 TYR CZ 1 1 5 1182 1 1 3 TYR H H -4.307 -0.274 5.597 1.00 . A A . 3 TYR H 1 1 5 1183 1 1 3 TYR HA H -2.023 0.482 4.140 1.00 . A A . 3 TYR HA 1 1 5 1184 1 1 3 TYR HB2 H -2.925 1.246 6.500 1.00 . A A . 3 TYR HB2 1 1 5 1185 1 1 3 TYR HB3 H -1.845 -0.013 7.084 1.00 . A A . 3 TYR HB3 1 1 5 1186 1 1 3 TYR HD1 H -2.045 3.275 5.439 1.00 . A A . 3 TYR HD1 1 1 5 1187 1 1 3 TYR HD2 H 0.554 0.230 6.912 1.00 . A A . 3 TYR HD2 1 1 5 1188 1 1 3 TYR HE1 H -0.156 4.843 5.361 1.00 . A A . 3 TYR HE1 1 1 5 1189 1 1 3 TYR HE2 H 2.447 1.794 6.814 1.00 . A A . 3 TYR HE2 1 1 5 1190 1 1 3 TYR HH H 2.390 4.757 6.863 1.00 . A A . 3 TYR HH 1 1 5 1191 1 1 3 TYR N N -3.691 -0.496 4.867 1.00 . A A . 3 TYR N 1 1 5 1192 1 1 3 TYR O O -0.389 -1.414 4.249 1.00 . A A . 3 TYR O 1 1 5 1193 1 1 3 TYR OH O 2.318 4.290 6.026 1.00 . A A . 3 TYR OH 1 1 5 1194 1 1 4 ALA C C -1.142 -4.384 4.440 1.00 . A A . 4 ALA C 1 1 5 1195 1 1 4 ALA CA C -1.033 -3.647 5.775 1.00 . A A . 4 ALA CA 1 1 5 1196 1 1 4 ALA CB C -1.533 -4.526 6.913 1.00 . A A . 4 ALA CB 1 1 5 1197 1 1 4 ALA H H -2.598 -2.306 6.265 1.00 . A A . 4 ALA H 1 1 5 1198 1 1 4 ALA HA H 0.008 -3.411 5.959 1.00 . A A . 4 ALA HA 1 1 5 1199 1 1 4 ALA HB1 H -2.471 -4.981 6.632 1.00 . A A . 4 ALA HB1 1 1 5 1200 1 1 4 ALA HB2 H -1.676 -3.923 7.797 1.00 . A A . 4 ALA HB2 1 1 5 1201 1 1 4 ALA HB3 H -0.806 -5.299 7.118 1.00 . A A . 4 ALA HB3 1 1 5 1202 1 1 4 ALA N N -1.781 -2.394 5.730 1.00 . A A . 4 ALA N 1 1 5 1203 1 1 4 ALA O O -0.191 -5.037 4.006 1.00 . A A . 4 ALA O 1 1 5 1204 1 1 5 GLN C C -1.680 -4.212 1.414 1.00 . A A . 5 GLN C 1 1 5 1205 1 1 5 GLN CA C -2.526 -4.893 2.489 1.00 . A A . 5 GLN CA 1 1 5 1206 1 1 5 GLN CB C -4.011 -4.828 2.117 1.00 . A A . 5 GLN CB 1 1 5 1207 1 1 5 GLN CD C -4.196 -6.978 0.797 1.00 . A A . 5 GLN CD 1 1 5 1208 1 1 5 GLN CG C -4.334 -5.466 0.777 1.00 . A A . 5 GLN CG 1 1 5 1209 1 1 5 GLN H H -3.018 -3.711 4.170 1.00 . A A . 5 GLN H 1 1 5 1210 1 1 5 GLN HA H -2.225 -5.927 2.569 1.00 . A A . 5 GLN HA 1 1 5 1211 1 1 5 GLN HB2 H -4.583 -5.334 2.880 1.00 . A A . 5 GLN HB2 1 1 5 1212 1 1 5 GLN HB3 H -4.315 -3.793 2.081 1.00 . A A . 5 GLN HB3 1 1 5 1213 1 1 5 GLN HE21 H -2.426 -6.862 -0.108 1.00 . A A . 5 GLN HE21 1 1 5 1214 1 1 5 GLN HE22 H -2.976 -8.456 0.267 1.00 . A A . 5 GLN HE22 1 1 5 1215 1 1 5 GLN HG2 H -5.350 -5.216 0.509 1.00 . A A . 5 GLN HG2 1 1 5 1216 1 1 5 GLN HG3 H -3.658 -5.066 0.037 1.00 . A A . 5 GLN HG3 1 1 5 1217 1 1 5 GLN N N -2.301 -4.258 3.782 1.00 . A A . 5 GLN N 1 1 5 1218 1 1 5 GLN NE2 N -3.087 -7.482 0.265 1.00 . A A . 5 GLN NE2 1 1 5 1219 1 1 5 GLN O O -1.139 -4.874 0.529 1.00 . A A . 5 GLN O 1 1 5 1220 1 1 5 GLN OE1 O -5.078 -7.685 1.287 1.00 . A A . 5 GLN OE1 1 1 5 1221 1 1 6 TRP C C 0.689 -2.548 0.605 1.00 . A A . 6 TRP C 1 1 5 1222 1 1 6 TRP CA C -0.769 -2.103 0.569 1.00 . A A . 6 TRP CA 1 1 5 1223 1 1 6 TRP CB C -0.865 -0.611 0.906 1.00 . A A . 6 TRP CB 1 1 5 1224 1 1 6 TRP CD1 C -0.377 0.577 -1.300 1.00 . A A . 6 TRP CD1 1 1 5 1225 1 1 6 TRP CD2 C 1.169 0.919 0.280 1.00 . A A . 6 TRP CD2 1 1 5 1226 1 1 6 TRP CE2 C 1.549 1.618 -0.879 1.00 . A A . 6 TRP CE2 1 1 5 1227 1 1 6 TRP CE3 C 1.993 0.989 1.408 1.00 . A A . 6 TRP CE3 1 1 5 1228 1 1 6 TRP CG C -0.068 0.258 -0.014 1.00 . A A . 6 TRP CG 1 1 5 1229 1 1 6 TRP CH2 C 3.499 2.433 0.169 1.00 . A A . 6 TRP CH2 1 1 5 1230 1 1 6 TRP CZ2 C 2.713 2.378 -0.947 1.00 . A A . 6 TRP CZ2 1 1 5 1231 1 1 6 TRP CZ3 C 3.150 1.748 1.341 1.00 . A A . 6 TRP CZ3 1 1 5 1232 1 1 6 TRP H H -2.010 -2.422 2.251 1.00 . A A . 6 TRP H 1 1 5 1233 1 1 6 TRP HA H -1.164 -2.270 -0.421 1.00 . A A . 6 TRP HA 1 1 5 1234 1 1 6 TRP HB2 H -1.896 -0.302 0.847 1.00 . A A . 6 TRP HB2 1 1 5 1235 1 1 6 TRP HB3 H -0.506 -0.451 1.910 1.00 . A A . 6 TRP HB3 1 1 5 1236 1 1 6 TRP HD1 H -1.256 0.230 -1.817 1.00 . A A . 6 TRP HD1 1 1 5 1237 1 1 6 TRP HE1 H 0.592 1.750 -2.735 1.00 . A A . 6 TRP HE1 1 1 5 1238 1 1 6 TRP HE3 H 1.739 0.464 2.318 1.00 . A A . 6 TRP HE3 1 1 5 1239 1 1 6 TRP HH2 H 4.406 3.021 0.161 1.00 . A A . 6 TRP HH2 1 1 5 1240 1 1 6 TRP HZ2 H 2.998 2.907 -1.845 1.00 . A A . 6 TRP HZ2 1 1 5 1241 1 1 6 TRP HZ3 H 3.801 1.812 2.201 1.00 . A A . 6 TRP HZ3 1 1 5 1242 1 1 6 TRP N N -1.561 -2.885 1.513 1.00 . A A . 6 TRP N 1 1 5 1243 1 1 6 TRP NE1 N 0.590 1.389 -1.827 1.00 . A A . 6 TRP NE1 1 1 5 1244 1 1 6 TRP O O 1.298 -2.803 -0.435 1.00 . A A . 6 TRP O 1 1 5 1245 1 1 7 LEU C C 2.807 -4.518 1.559 1.00 . A A . 7 LEU C 1 1 5 1246 1 1 7 LEU CA C 2.615 -3.070 2.014 1.00 . A A . 7 LEU CA 1 1 5 1247 1 1 7 LEU CB C 3.004 -2.916 3.487 1.00 . A A . 7 LEU CB 1 1 5 1248 1 1 7 LEU CD1 C 2.972 -1.461 5.529 1.00 . A A . 7 LEU CD1 1 1 5 1249 1 1 7 LEU CD2 C 4.182 -0.697 3.474 1.00 . A A . 7 LEU CD2 1 1 5 1250 1 1 7 LEU CG C 2.988 -1.477 4.009 1.00 . A A . 7 LEU CG 1 1 5 1251 1 1 7 LEU H H 0.684 -2.433 2.603 1.00 . A A . 7 LEU H 1 1 5 1252 1 1 7 LEU HA H 3.245 -2.431 1.415 1.00 . A A . 7 LEU HA 1 1 5 1253 1 1 7 LEU HB2 H 2.316 -3.501 4.081 1.00 . A A . 7 LEU HB2 1 1 5 1254 1 1 7 LEU HB3 H 3.997 -3.315 3.622 1.00 . A A . 7 LEU HB3 1 1 5 1255 1 1 7 LEU HD11 H 3.927 -1.801 5.903 1.00 . A A . 7 LEU HD11 1 1 5 1256 1 1 7 LEU HD12 H 2.191 -2.115 5.887 1.00 . A A . 7 LEU HD12 1 1 5 1257 1 1 7 LEU HD13 H 2.786 -0.455 5.876 1.00 . A A . 7 LEU HD13 1 1 5 1258 1 1 7 LEU HD21 H 5.078 -1.292 3.577 1.00 . A A . 7 LEU HD21 1 1 5 1259 1 1 7 LEU HD22 H 4.293 0.220 4.034 1.00 . A A . 7 LEU HD22 1 1 5 1260 1 1 7 LEU HD23 H 4.023 -0.463 2.431 1.00 . A A . 7 LEU HD23 1 1 5 1261 1 1 7 LEU HG H 2.088 -0.988 3.664 1.00 . A A . 7 LEU HG 1 1 5 1262 1 1 7 LEU N N 1.233 -2.646 1.817 1.00 . A A . 7 LEU N 1 1 5 1263 1 1 7 LEU O O 3.847 -4.866 0.998 1.00 . A A . 7 LEU O 1 1 5 1264 1 1 8 ALA C C 1.643 -6.925 -0.118 1.00 . A A . 8 ALA C 1 1 5 1265 1 1 8 ALA CA C 1.831 -6.758 1.395 1.00 . A A . 8 ALA CA 1 1 5 1266 1 1 8 ALA CB C 0.773 -7.552 2.149 1.00 . A A . 8 ALA CB 1 1 5 1267 1 1 8 ALA H H 0.983 -5.006 2.234 1.00 . A A . 8 ALA H 1 1 5 1268 1 1 8 ALA HA H 2.800 -7.149 1.670 1.00 . A A . 8 ALA HA 1 1 5 1269 1 1 8 ALA HB1 H 1.078 -8.586 2.216 1.00 . A A . 8 ALA HB1 1 1 5 1270 1 1 8 ALA HB2 H -0.169 -7.488 1.623 1.00 . A A . 8 ALA HB2 1 1 5 1271 1 1 8 ALA HB3 H 0.657 -7.146 3.143 1.00 . A A . 8 ALA HB3 1 1 5 1272 1 1 8 ALA N N 1.788 -5.351 1.792 1.00 . A A . 8 ALA N 1 1 5 1273 1 1 8 ALA O O 1.972 -7.974 -0.675 1.00 . A A . 8 ALA O 1 1 5 1274 1 1 9 ASP C C 2.122 -5.413 -2.999 1.00 . A A . 9 ASP C 1 1 5 1275 1 1 9 ASP CA C 0.896 -5.920 -2.227 1.00 . A A . 9 ASP CA 1 1 5 1276 1 1 9 ASP CB C -0.335 -5.082 -2.600 1.00 . A A . 9 ASP CB 1 1 5 1277 1 1 9 ASP CG C -1.454 -5.923 -3.184 1.00 . A A . 9 ASP CG 1 1 5 1278 1 1 9 ASP H H 0.881 -5.075 -0.283 1.00 . A A . 9 ASP H 1 1 5 1279 1 1 9 ASP HA H 0.715 -6.947 -2.506 1.00 . A A . 9 ASP HA 1 1 5 1280 1 1 9 ASP HB2 H -0.710 -4.584 -1.718 1.00 . A A . 9 ASP HB2 1 1 5 1281 1 1 9 ASP HB3 H -0.050 -4.339 -3.331 1.00 . A A . 9 ASP HB3 1 1 5 1282 1 1 9 ASP N N 1.119 -5.885 -0.779 1.00 . A A . 9 ASP N 1 1 5 1283 1 1 9 ASP O O 2.023 -5.086 -4.184 1.00 . A A . 9 ASP O 1 1 5 1284 1 1 9 ASP OD1 O -1.384 -6.250 -4.387 1.00 . A A . 9 ASP OD1 1 1 5 1285 1 1 9 ASP OD2 O -2.399 -6.253 -2.438 1.00 . A A . 9 ASP OD2 1 1 5 1286 1 1 10 DAL C C 4.840 -3.442 -2.547 1.00 . A A . 10 DAL C 1 1 5 1287 1 1 10 DAL CA C 4.510 -4.883 -2.947 1.00 . A A . 10 DAL CA 1 1 5 1288 1 1 10 DAL CB C 5.656 -5.803 -2.564 1.00 . A A . 10 DAL CB 1 1 5 1289 1 1 10 DAL H H 3.294 -5.620 -1.384 1.00 . A A . 10 DAL H 1 1 5 1290 1 1 10 DAL HA H 4.385 -4.931 -4.018 1.00 . A A . 10 DAL HA 1 1 5 1291 1 1 10 DAL HB1 H 6.538 -5.534 -3.126 1.00 . A A . 10 DAL HB1 1 1 5 1292 1 1 10 DAL HB2 H 5.387 -6.826 -2.782 1.00 . A A . 10 DAL HB2 1 1 5 1293 1 1 10 DAL HB3 H 5.857 -5.700 -1.507 1.00 . A A . 10 DAL HB3 1 1 5 1294 1 1 10 DAL N N 3.274 -5.349 -2.324 1.00 . A A . 10 DAL N 1 1 5 1295 1 1 10 DAL O O 5.884 -2.913 -2.934 1.00 . A A . 10 DAL O 1 1 5 1296 1 1 11 GLY C C 4.121 -0.455 -2.484 1.00 . A A . 11 GLY C 1 1 5 1297 1 1 11 GLY CA C 4.171 -1.444 -1.338 1.00 . A A . 11 GLY CA 1 1 5 1298 1 1 11 GLY H H 3.138 -3.280 -1.497 1.00 . A A . 11 GLY H 1 1 5 1299 1 1 11 GLY HA2 H 3.411 -1.178 -0.618 1.00 . A A . 11 GLY HA2 1 1 5 1300 1 1 11 GLY HA3 H 5.140 -1.380 -0.865 1.00 . A A . 11 GLY HA3 1 1 5 1301 1 1 11 GLY N N 3.950 -2.811 -1.774 1.00 . A A . 11 GLY N 1 1 5 1302 1 1 11 GLY O O 3.042 -0.021 -2.890 1.00 . A A . 11 GLY O 1 1 5 1303 1 1 12 TRP C C 5.509 0.142 -5.465 1.00 . A A . 12 TRP C 1 1 5 1304 1 1 12 TRP CA C 5.380 0.847 -4.112 1.00 . A A . 12 TRP CA 1 1 5 1305 1 1 12 TRP CB C 6.542 1.812 -3.878 1.00 . A A . 12 TRP CB 1 1 5 1306 1 1 12 TRP CD1 C 6.632 3.158 -1.705 1.00 . A A . 12 TRP CD1 1 1 5 1307 1 1 12 TRP CD2 C 5.163 3.928 -3.211 1.00 . A A . 12 TRP CD2 1 1 5 1308 1 1 12 TRP CE2 C 5.097 4.737 -2.064 1.00 . A A . 12 TRP CE2 1 1 5 1309 1 1 12 TRP CE3 C 4.327 4.225 -4.296 1.00 . A A . 12 TRP CE3 1 1 5 1310 1 1 12 TRP CG C 6.150 2.922 -2.960 1.00 . A A . 12 TRP CG 1 1 5 1311 1 1 12 TRP CH2 C 3.425 6.086 -3.040 1.00 . A A . 12 TRP CH2 1 1 5 1312 1 1 12 TRP CZ2 C 4.230 5.816 -1.966 1.00 . A A . 12 TRP CZ2 1 1 5 1313 1 1 12 TRP CZ3 C 3.470 5.302 -4.199 1.00 . A A . 12 TRP CZ3 1 1 5 1314 1 1 12 TRP H H 6.118 -0.482 -2.638 1.00 . A A . 12 TRP H 1 1 5 1315 1 1 12 TRP HA H 4.461 1.417 -4.116 1.00 . A A . 12 TRP HA 1 1 5 1316 1 1 12 TRP HB2 H 7.366 1.276 -3.429 1.00 . A A . 12 TRP HB2 1 1 5 1317 1 1 12 TRP HB3 H 6.858 2.239 -4.818 1.00 . A A . 12 TRP HB3 1 1 5 1318 1 1 12 TRP HD1 H 7.395 2.564 -1.224 1.00 . A A . 12 TRP HD1 1 1 5 1319 1 1 12 TRP HE1 H 6.177 4.619 -0.268 1.00 . A A . 12 TRP HE1 1 1 5 1320 1 1 12 TRP HE3 H 4.346 3.632 -5.199 1.00 . A A . 12 TRP HE3 1 1 5 1321 1 1 12 TRP HH2 H 2.739 6.920 -3.006 1.00 . A A . 12 TRP HH2 1 1 5 1322 1 1 12 TRP HZ2 H 4.176 6.418 -1.075 1.00 . A A . 12 TRP HZ2 1 1 5 1323 1 1 12 TRP HZ3 H 2.823 5.549 -5.029 1.00 . A A . 12 TRP HZ3 1 1 5 1324 1 1 12 TRP N N 5.293 -0.100 -3.006 1.00 . A A . 12 TRP N 1 1 5 1325 1 1 12 TRP NE1 N 6.003 4.248 -1.159 1.00 . A A . 12 TRP NE1 1 1 5 1326 1 1 12 TRP O O 5.756 0.788 -6.485 1.00 . A A . 12 TRP O 1 1 5 1327 1 1 13 ALA C C 4.013 -1.923 -7.415 1.00 . A A . 13 ALA C 1 1 5 1328 1 1 13 ALA CA C 5.365 -1.954 -6.710 1.00 . A A . 13 ALA CA 1 1 5 1329 1 1 13 ALA CB C 5.792 -3.385 -6.427 1.00 . A A . 13 ALA CB 1 1 5 1330 1 1 13 ALA H H 5.087 -1.639 -4.639 1.00 . A A . 13 ALA H 1 1 5 1331 1 1 13 ALA HA H 6.103 -1.501 -7.352 1.00 . A A . 13 ALA HA 1 1 5 1332 1 1 13 ALA HB1 H 6.595 -3.655 -7.095 1.00 . A A . 13 ALA HB1 1 1 5 1333 1 1 13 ALA HB2 H 4.955 -4.049 -6.583 1.00 . A A . 13 ALA HB2 1 1 5 1334 1 1 13 ALA HB3 H 6.131 -3.466 -5.405 1.00 . A A . 13 ALA HB3 1 1 5 1335 1 1 13 ALA N N 5.306 -1.179 -5.476 1.00 . A A . 13 ALA N 1 1 5 1336 1 1 13 ALA O O 3.942 -1.954 -8.645 1.00 . A A . 13 ALA O 1 1 5 1337 1 1 14 SER C C 1.378 -0.500 -7.971 1.00 . A A . 14 SER C 1 1 5 1338 1 1 14 SER CA C 1.583 -1.776 -7.149 1.00 . A A . 14 SER CA 1 1 5 1339 1 1 14 SER CB C 0.560 -1.840 -6.004 1.00 . A A . 14 SER CB 1 1 5 1340 1 1 14 SER H H 3.072 -1.803 -5.649 1.00 . A A . 14 SER H 1 1 5 1341 1 1 14 SER HA H 1.440 -2.627 -7.795 1.00 . A A . 14 SER HA 1 1 5 1342 1 1 14 SER HB2 H -0.346 -1.337 -6.305 1.00 . A A . 14 SER HB2 1 1 5 1343 1 1 14 SER HB3 H 0.339 -2.873 -5.780 1.00 . A A . 14 SER HB3 1 1 5 1344 1 1 14 SER HG H 1.372 -1.887 -4.214 1.00 . A A . 14 SER HG 1 1 5 1345 1 1 14 SER N N 2.942 -1.838 -6.620 1.00 . A A . 14 SER N 1 1 5 1346 1 1 14 SER O O 0.572 -0.479 -8.902 1.00 . A A . 14 SER O 1 1 5 1347 1 1 14 SER OG O 1.058 -1.216 -4.828 1.00 . A A . 14 SER OG 1 1 5 1348 1 1 15 DAL C C 1.134 2.833 -7.579 1.00 . A A . 15 DAL C 1 1 5 1349 1 1 15 DAL CA C 2.022 1.836 -8.330 1.00 . A A . 15 DAL CA 1 1 5 1350 1 1 15 DAL CB C 3.411 2.416 -8.548 1.00 . A A . 15 DAL CB 1 1 5 1351 1 1 15 DAL H H 2.745 0.479 -6.872 1.00 . A A . 15 DAL H 1 1 5 1352 1 1 15 DAL HA H 1.587 1.646 -9.299 1.00 . A A . 15 DAL HA 1 1 5 1353 1 1 15 DAL HB1 H 3.577 2.556 -9.605 1.00 . A A . 15 DAL HB1 1 1 5 1354 1 1 15 DAL HB2 H 4.151 1.737 -8.154 1.00 . A A . 15 DAL HB2 1 1 5 1355 1 1 15 DAL HB3 H 3.488 3.367 -8.042 1.00 . A A . 15 DAL HB3 1 1 5 1356 1 1 15 DAL N N 2.118 0.559 -7.623 1.00 . A A . 15 DAL N 1 1 5 1357 1 1 15 DAL O O 1.262 4.046 -7.755 1.00 . A A . 15 DAL O 1 1 5 1358 1 1 16 ARG C C -0.013 3.592 -4.657 1.00 . A A . 16 ARG C 1 1 5 1359 1 1 16 ARG CA C -0.674 3.150 -5.965 1.00 . A A . 16 ARG CA 1 1 5 1360 1 1 16 ARG CB C -1.973 2.375 -5.663 1.00 . A A . 16 ARG CB 1 1 5 1361 1 1 16 ARG CD C -2.739 0.169 -4.720 1.00 . A A . 16 ARG CD 1 1 5 1362 1 1 16 ARG CG C -1.838 1.379 -4.516 1.00 . A A . 16 ARG CG 1 1 5 1363 1 1 16 ARG CZ C -3.453 -0.497 -2.444 1.00 . A A . 16 ARG CZ 1 1 5 1364 1 1 16 ARG H H 0.183 1.337 -6.648 1.00 . A A . 16 ARG H 1 1 5 1365 1 1 16 ARG HA H -0.905 4.031 -6.550 1.00 . A A . 16 ARG HA 1 1 5 1366 1 1 16 ARG HB2 H -2.748 3.081 -5.407 1.00 . A A . 16 ARG HB2 1 1 5 1367 1 1 16 ARG HB3 H -2.276 1.824 -6.548 1.00 . A A . 16 ARG HB3 1 1 5 1368 1 1 16 ARG HD2 H -3.746 0.513 -4.905 1.00 . A A . 16 ARG HD2 1 1 5 1369 1 1 16 ARG HD3 H -2.385 -0.382 -5.578 1.00 . A A . 16 ARG HD3 1 1 5 1370 1 1 16 ARG HE H -2.202 -1.533 -3.610 1.00 . A A . 16 ARG HE 1 1 5 1371 1 1 16 ARG HG2 H -0.812 1.044 -4.461 1.00 . A A . 16 ARG HG2 1 1 5 1372 1 1 16 ARG HG3 H -2.110 1.869 -3.592 1.00 . A A . 16 ARG HG3 1 1 5 1373 1 1 16 ARG HH11 H -4.242 1.263 -3.068 1.00 . A A . 16 ARG HH11 1 1 5 1374 1 1 16 ARG HH12 H -4.725 0.754 -1.486 1.00 . A A . 16 ARG HH12 1 1 5 1375 1 1 16 ARG HH21 H -2.848 -2.198 -1.527 1.00 . A A . 16 ARG HH21 1 1 5 1376 1 1 16 ARG HH22 H -3.934 -1.208 -0.610 1.00 . A A . 16 ARG HH22 1 1 5 1377 1 1 16 ARG N N 0.236 2.312 -6.744 1.00 . A A . 16 ARG N 1 1 5 1378 1 1 16 ARG NE N -2.748 -0.721 -3.557 1.00 . A A . 16 ARG NE 1 1 5 1379 1 1 16 ARG NH1 N -4.202 0.597 -2.323 1.00 . A A . 16 ARG NH1 1 1 5 1380 1 1 16 ARG NH2 N -3.408 -1.373 -1.445 1.00 . A A . 16 ARG NH2 1 1 5 1381 1 1 16 ARG O O 0.870 2.904 -4.144 1.00 . A A . 16 ARG O 1 1 5 1382 1 1 17 PRO C C -0.537 4.645 -1.607 1.00 . A A . 17 PRO C 1 1 5 1383 1 1 17 PRO CA C 0.122 5.262 -2.841 1.00 . A A . 17 PRO CA 1 1 5 1384 1 1 17 PRO CB C -0.172 6.768 -2.901 1.00 . A A . 17 PRO CB 1 1 5 1385 1 1 17 PRO CD C -1.457 5.644 -4.619 1.00 . A A . 17 PRO CD 1 1 5 1386 1 1 17 PRO CG C -0.997 6.994 -4.135 1.00 . A A . 17 PRO CG 1 1 5 1387 1 1 17 PRO HA H 1.187 5.105 -2.784 1.00 . A A . 17 PRO HA 1 1 5 1388 1 1 17 PRO HB2 H -0.714 7.060 -2.014 1.00 . A A . 17 PRO HB2 1 1 5 1389 1 1 17 PRO HB3 H 0.762 7.310 -2.947 1.00 . A A . 17 PRO HB3 1 1 5 1390 1 1 17 PRO HD2 H -2.426 5.402 -4.213 1.00 . A A . 17 PRO HD2 1 1 5 1391 1 1 17 PRO HD3 H -1.480 5.621 -5.696 1.00 . A A . 17 PRO HD3 1 1 5 1392 1 1 17 PRO HG2 H -1.850 7.610 -3.894 1.00 . A A . 17 PRO HG2 1 1 5 1393 1 1 17 PRO HG3 H -0.394 7.475 -4.891 1.00 . A A . 17 PRO HG3 1 1 5 1394 1 1 17 PRO N N -0.428 4.745 -4.093 1.00 . A A . 17 PRO N 1 1 5 1395 1 1 17 PRO O O -1.587 4.005 -1.703 1.00 . A A . 17 PRO O 1 1 5 1396 1 1 18 PRO C C -1.781 4.874 1.245 1.00 . A A . 18 PRO C 1 1 5 1397 1 1 18 PRO CA C -0.425 4.293 0.842 1.00 . A A . 18 PRO CA 1 1 5 1398 1 1 18 PRO CB C 0.626 4.711 1.873 1.00 . A A . 18 PRO CB 1 1 5 1399 1 1 18 PRO CD C 1.345 5.572 -0.244 1.00 . A A . 18 PRO CD 1 1 5 1400 1 1 18 PRO CG C 1.404 5.810 1.236 1.00 . A A . 18 PRO CG 1 1 5 1401 1 1 18 PRO HA H -0.491 3.215 0.812 1.00 . A A . 18 PRO HA 1 1 5 1402 1 1 18 PRO HB2 H 0.130 5.055 2.764 1.00 . A A . 18 PRO HB2 1 1 5 1403 1 1 18 PRO HB3 H 1.253 3.871 2.113 1.00 . A A . 18 PRO HB3 1 1 5 1404 1 1 18 PRO HD2 H 1.320 6.511 -0.776 1.00 . A A . 18 PRO HD2 1 1 5 1405 1 1 18 PRO HD3 H 2.189 4.980 -0.564 1.00 . A A . 18 PRO HD3 1 1 5 1406 1 1 18 PRO HG2 H 0.956 6.763 1.478 1.00 . A A . 18 PRO HG2 1 1 5 1407 1 1 18 PRO HG3 H 2.427 5.780 1.579 1.00 . A A . 18 PRO HG3 1 1 5 1408 1 1 18 PRO N N 0.085 4.831 -0.426 1.00 . A A . 18 PRO N 1 1 5 1409 1 1 18 PRO O O -2.068 6.044 0.986 1.00 . A A . 18 PRO O 1 1 5 1410 1 1 19 PRO C C -3.878 5.255 3.682 1.00 . A A . 19 PRO C 1 1 5 1411 1 1 19 PRO CA C -3.941 4.485 2.363 1.00 . A A . 19 PRO CA 1 1 5 1412 1 1 19 PRO CB C -4.699 3.171 2.540 1.00 . A A . 19 PRO CB 1 1 5 1413 1 1 19 PRO CD C -2.350 2.655 2.257 1.00 . A A . 19 PRO CD 1 1 5 1414 1 1 19 PRO CG C -3.673 2.110 2.736 1.00 . A A . 19 PRO CG 1 1 5 1415 1 1 19 PRO HA H -4.439 5.091 1.620 1.00 . A A . 19 PRO HA 1 1 5 1416 1 1 19 PRO HB2 H -5.356 3.242 3.393 1.00 . A A . 19 PRO HB2 1 1 5 1417 1 1 19 PRO HB3 H -5.272 2.981 1.662 1.00 . A A . 19 PRO HB3 1 1 5 1418 1 1 19 PRO HD2 H -1.610 2.598 3.040 1.00 . A A . 19 PRO HD2 1 1 5 1419 1 1 19 PRO HD3 H -2.023 2.105 1.390 1.00 . A A . 19 PRO HD3 1 1 5 1420 1 1 19 PRO HG2 H -3.620 1.847 3.776 1.00 . A A . 19 PRO HG2 1 1 5 1421 1 1 19 PRO HG3 H -3.944 1.240 2.154 1.00 . A A . 19 PRO HG3 1 1 5 1422 1 1 19 PRO N N -2.626 4.057 1.904 1.00 . A A . 19 PRO N 1 1 5 1423 1 1 19 PRO O O -2.972 5.046 4.491 1.00 . A A . 19 PRO O 1 1 5 1424 1 1 20 SER C C -5.428 6.124 6.288 1.00 . A A . 20 SER C 1 1 5 1425 1 1 20 SER CA C -4.903 6.949 5.113 1.00 . A A . 20 SER CA 1 1 5 1426 1 1 20 SER CB C -5.781 8.188 4.903 1.00 . A A . 20 SER CB 1 1 5 1427 1 1 20 SER H H -5.541 6.268 3.209 1.00 . A A . 20 SER H 1 1 5 1428 1 1 20 SER HA H -3.897 7.270 5.340 1.00 . A A . 20 SER HA 1 1 5 1429 1 1 20 SER HB2 H -5.915 8.695 5.847 1.00 . A A . 20 SER HB2 1 1 5 1430 1 1 20 SER HB3 H -5.298 8.854 4.203 1.00 . A A . 20 SER HB3 1 1 5 1431 1 1 20 SER HG H -7.731 8.371 4.817 1.00 . A A . 20 SER HG 1 1 5 1432 1 1 20 SER N N -4.847 6.146 3.891 1.00 . A A . 20 SER N 1 1 5 1433 1 1 20 SER O O -4.763 6.113 7.344 1.00 . A A . 20 SER O 1 1 5 1434 1 1 20 SER OXT O -6.498 5.493 6.142 1.00 . A A . 20 SER OXT 1 1 5 1435 1 1 20 SER OG O -7.057 7.836 4.392 1.00 . A A . 20 SER OG 1 1 6 1436 1 1 1 ASP C C -6.599 -2.333 5.773 1.00 . A A . 1 ASP C 1 1 6 1437 1 1 1 ASP CA C -7.252 -1.921 7.093 1.00 . A A . 1 ASP CA 1 1 6 1438 1 1 1 ASP CB C -6.214 -1.921 8.225 1.00 . A A . 1 ASP CB 1 1 6 1439 1 1 1 ASP CG C -5.327 -3.156 8.216 1.00 . A A . 1 ASP CG 1 1 6 1440 1 1 1 ASP H1 H -7.977 -3.801 7.529 1.00 . A A . 1 ASP H1 1 1 6 1441 1 1 1 ASP H2 H -9.087 -2.777 6.713 1.00 . A A . 1 ASP H2 1 1 6 1442 1 1 1 ASP H3 H -8.748 -2.525 8.376 1.00 . A A . 1 ASP H3 1 1 6 1443 1 1 1 ASP HA H -7.656 -0.924 6.986 1.00 . A A . 1 ASP HA 1 1 6 1444 1 1 1 ASP HB2 H -5.584 -1.050 8.124 1.00 . A A . 1 ASP HB2 1 1 6 1445 1 1 1 ASP HB3 H -6.728 -1.877 9.174 1.00 . A A . 1 ASP HB3 1 1 6 1446 1 1 1 ASP N N -8.366 -2.839 7.461 1.00 . A A . 1 ASP N 1 1 6 1447 1 1 1 ASP O O -6.540 -3.520 5.442 1.00 . A A . 1 ASP O 1 1 6 1448 1 1 1 ASP OD1 O -5.760 -4.202 8.743 1.00 . A A . 1 ASP OD1 1 1 6 1449 1 1 1 ASP OD2 O -4.200 -3.074 7.680 1.00 . A A . 1 ASP OD2 1 1 6 1450 1 1 2 ALA C C -3.961 -1.235 3.779 1.00 . A A . 2 ALA C 1 1 6 1451 1 1 2 ALA CA C -5.451 -1.597 3.746 1.00 . A A . 2 ALA CA 1 1 6 1452 1 1 2 ALA CB C -6.154 -0.825 2.639 1.00 . A A . 2 ALA CB 1 1 6 1453 1 1 2 ALA H H -6.181 -0.421 5.349 1.00 . A A . 2 ALA H 1 1 6 1454 1 1 2 ALA HA H -5.546 -2.650 3.528 1.00 . A A . 2 ALA HA 1 1 6 1455 1 1 2 ALA HB1 H -5.962 0.231 2.759 1.00 . A A . 2 ALA HB1 1 1 6 1456 1 1 2 ALA HB2 H -7.217 -1.006 2.693 1.00 . A A . 2 ALA HB2 1 1 6 1457 1 1 2 ALA HB3 H -5.781 -1.152 1.680 1.00 . A A . 2 ALA HB3 1 1 6 1458 1 1 2 ALA N N -6.106 -1.344 5.027 1.00 . A A . 2 ALA N 1 1 6 1459 1 1 2 ALA O O -3.263 -1.396 2.777 1.00 . A A . 2 ALA O 1 1 6 1460 1 1 3 TYR C C -1.159 -1.586 4.998 1.00 . A A . 3 TYR C 1 1 6 1461 1 1 3 TYR CA C -2.070 -0.363 5.064 1.00 . A A . 3 TYR CA 1 1 6 1462 1 1 3 TYR CB C -1.842 0.407 6.369 1.00 . A A . 3 TYR CB 1 1 6 1463 1 1 3 TYR CD1 C -0.933 2.718 5.872 1.00 . A A . 3 TYR CD1 1 1 6 1464 1 1 3 TYR CD2 C 0.582 1.049 6.659 1.00 . A A . 3 TYR CD2 1 1 6 1465 1 1 3 TYR CE1 C 0.101 3.632 5.817 1.00 . A A . 3 TYR CE1 1 1 6 1466 1 1 3 TYR CE2 C 1.619 1.959 6.604 1.00 . A A . 3 TYR CE2 1 1 6 1467 1 1 3 TYR CG C -0.710 1.409 6.294 1.00 . A A . 3 TYR CG 1 1 6 1468 1 1 3 TYR CZ C 1.374 3.249 6.183 1.00 . A A . 3 TYR CZ 1 1 6 1469 1 1 3 TYR H H -4.077 -0.634 5.692 1.00 . A A . 3 TYR H 1 1 6 1470 1 1 3 TYR HA H -1.827 0.281 4.237 1.00 . A A . 3 TYR HA 1 1 6 1471 1 1 3 TYR HB2 H -2.741 0.947 6.625 1.00 . A A . 3 TYR HB2 1 1 6 1472 1 1 3 TYR HB3 H -1.614 -0.295 7.158 1.00 . A A . 3 TYR HB3 1 1 6 1473 1 1 3 TYR HD1 H -1.930 3.018 5.575 1.00 . A A . 3 TYR HD1 1 1 6 1474 1 1 3 TYR HD2 H 0.773 0.038 6.987 1.00 . A A . 3 TYR HD2 1 1 6 1475 1 1 3 TYR HE1 H -0.091 4.643 5.495 1.00 . A A . 3 TYR HE1 1 1 6 1476 1 1 3 TYR HE2 H 2.617 1.659 6.890 1.00 . A A . 3 TYR HE2 1 1 6 1477 1 1 3 TYR HH H 2.456 4.636 6.960 1.00 . A A . 3 TYR HH 1 1 6 1478 1 1 3 TYR N N -3.477 -0.744 4.926 1.00 . A A . 3 TYR N 1 1 6 1479 1 1 3 TYR O O -0.219 -1.621 4.201 1.00 . A A . 3 TYR O 1 1 6 1480 1 1 3 TYR OH O 2.404 4.159 6.128 1.00 . A A . 3 TYR OH 1 1 6 1481 1 1 4 ALA C C -0.771 -4.542 4.486 1.00 . A A . 4 ALA C 1 1 6 1482 1 1 4 ALA CA C -0.659 -3.825 5.830 1.00 . A A . 4 ALA CA 1 1 6 1483 1 1 4 ALA CB C -1.107 -4.738 6.962 1.00 . A A . 4 ALA CB 1 1 6 1484 1 1 4 ALA H H -2.218 -2.517 6.424 1.00 . A A . 4 ALA H 1 1 6 1485 1 1 4 ALA HA H 0.376 -3.557 5.998 1.00 . A A . 4 ALA HA 1 1 6 1486 1 1 4 ALA HB1 H -0.932 -4.248 7.909 1.00 . A A . 4 ALA HB1 1 1 6 1487 1 1 4 ALA HB2 H -0.545 -5.660 6.925 1.00 . A A . 4 ALA HB2 1 1 6 1488 1 1 4 ALA HB3 H -2.160 -4.952 6.857 1.00 . A A . 4 ALA HB3 1 1 6 1489 1 1 4 ALA N N -1.449 -2.596 5.821 1.00 . A A . 4 ALA N 1 1 6 1490 1 1 4 ALA O O 0.202 -5.126 4.004 1.00 . A A . 4 ALA O 1 1 6 1491 1 1 5 GLN C C -1.399 -4.369 1.492 1.00 . A A . 5 GLN C 1 1 6 1492 1 1 5 GLN CA C -2.195 -5.095 2.577 1.00 . A A . 5 GLN CA 1 1 6 1493 1 1 5 GLN CB C -3.691 -5.078 2.242 1.00 . A A . 5 GLN CB 1 1 6 1494 1 1 5 GLN CD C -3.937 -7.134 0.777 1.00 . A A . 5 GLN CD 1 1 6 1495 1 1 5 GLN CG C -4.018 -5.618 0.858 1.00 . A A . 5 GLN CG 1 1 6 1496 1 1 5 GLN H H -2.690 -3.981 4.302 1.00 . A A . 5 GLN H 1 1 6 1497 1 1 5 GLN HA H -1.856 -6.119 2.632 1.00 . A A . 5 GLN HA 1 1 6 1498 1 1 5 GLN HB2 H -4.218 -5.676 2.971 1.00 . A A . 5 GLN HB2 1 1 6 1499 1 1 5 GLN HB3 H -4.048 -4.061 2.301 1.00 . A A . 5 GLN HB3 1 1 6 1500 1 1 5 GLN HE21 H -5.273 -7.155 -0.699 1.00 . A A . 5 GLN HE21 1 1 6 1501 1 1 5 GLN HE22 H -4.672 -8.698 -0.207 1.00 . A A . 5 GLN HE22 1 1 6 1502 1 1 5 GLN HG2 H -5.019 -5.313 0.595 1.00 . A A . 5 GLN HG2 1 1 6 1503 1 1 5 GLN HG3 H -3.319 -5.196 0.152 1.00 . A A . 5 GLN HG3 1 1 6 1504 1 1 5 GLN N N -1.959 -4.475 3.875 1.00 . A A . 5 GLN N 1 1 6 1505 1 1 5 GLN NE2 N -4.705 -7.721 -0.135 1.00 . A A . 5 GLN NE2 1 1 6 1506 1 1 5 GLN O O -0.854 -5.000 0.588 1.00 . A A . 5 GLN O 1 1 6 1507 1 1 5 GLN OE1 O -3.190 -7.771 1.521 1.00 . A A . 5 GLN OE1 1 1 6 1508 1 1 6 TRP C C 0.892 -2.622 0.642 1.00 . A A . 6 TRP C 1 1 6 1509 1 1 6 TRP CA C -0.578 -2.220 0.651 1.00 . A A . 6 TRP CA 1 1 6 1510 1 1 6 TRP CB C -0.706 -0.736 1.011 1.00 . A A . 6 TRP CB 1 1 6 1511 1 1 6 TRP CD1 C -0.326 0.492 -1.195 1.00 . A A . 6 TRP CD1 1 1 6 1512 1 1 6 TRP CD2 C 1.259 0.862 0.339 1.00 . A A . 6 TRP CD2 1 1 6 1513 1 1 6 TRP CE2 C 1.580 1.585 -0.823 1.00 . A A . 6 TRP CE2 1 1 6 1514 1 1 6 TRP CE3 C 2.115 0.944 1.440 1.00 . A A . 6 TRP CE3 1 1 6 1515 1 1 6 TRP CG C 0.033 0.167 0.076 1.00 . A A . 6 TRP CG 1 1 6 1516 1 1 6 TRP CH2 C 3.537 2.446 0.172 1.00 . A A . 6 TRP CH2 1 1 6 1517 1 1 6 TRP CZ2 C 2.718 2.380 -0.919 1.00 . A A . 6 TRP CZ2 1 1 6 1518 1 1 6 TRP CZ3 C 3.246 1.737 1.346 1.00 . A A . 6 TRP CZ3 1 1 6 1519 1 1 6 TRP H H -1.771 -2.598 2.358 1.00 . A A . 6 TRP H 1 1 6 1520 1 1 6 TRP HA H -0.994 -2.385 -0.331 1.00 . A A . 6 TRP HA 1 1 6 1521 1 1 6 TRP HB2 H -1.747 -0.457 0.992 1.00 . A A . 6 TRP HB2 1 1 6 1522 1 1 6 TRP HB3 H -0.316 -0.578 2.003 1.00 . A A . 6 TRP HB3 1 1 6 1523 1 1 6 TRP HD1 H -1.211 0.126 -1.688 1.00 . A A . 6 TRP HD1 1 1 6 1524 1 1 6 TRP HE1 H 0.561 1.710 -2.645 1.00 . A A . 6 TRP HE1 1 1 6 1525 1 1 6 TRP HE3 H 1.906 0.402 2.353 1.00 . A A . 6 TRP HE3 1 1 6 1526 1 1 6 TRP HH2 H 4.427 3.059 0.142 1.00 . A A . 6 TRP HH2 1 1 6 1527 1 1 6 TRP HZ2 H 2.959 2.926 -1.819 1.00 . A A . 6 TRP HZ2 1 1 6 1528 1 1 6 TRP HZ3 H 3.921 1.813 2.186 1.00 . A A . 6 TRP HZ3 1 1 6 1529 1 1 6 TRP N N -1.323 -3.039 1.605 1.00 . A A . 6 TRP N 1 1 6 1530 1 1 6 TRP NE1 N 0.599 1.339 -1.742 1.00 . A A . 6 TRP NE1 1 1 6 1531 1 1 6 TRP O O 1.482 -2.839 -0.417 1.00 . A A . 6 TRP O 1 1 6 1532 1 1 7 LEU C C 3.090 -4.550 1.522 1.00 . A A . 7 LEU C 1 1 6 1533 1 1 7 LEU CA C 2.866 -3.113 1.995 1.00 . A A . 7 LEU CA 1 1 6 1534 1 1 7 LEU CB C 3.286 -2.960 3.459 1.00 . A A . 7 LEU CB 1 1 6 1535 1 1 7 LEU CD1 C 3.249 -1.532 5.522 1.00 . A A . 7 LEU CD1 1 1 6 1536 1 1 7 LEU CD2 C 4.348 -0.681 3.439 1.00 . A A . 7 LEU CD2 1 1 6 1537 1 1 7 LEU CG C 3.214 -1.529 4.002 1.00 . A A . 7 LEU CG 1 1 6 1538 1 1 7 LEU H H 0.933 -2.545 2.641 1.00 . A A . 7 LEU H 1 1 6 1539 1 1 7 LEU HA H 3.463 -2.450 1.387 1.00 . A A . 7 LEU HA 1 1 6 1540 1 1 7 LEU HB2 H 2.641 -3.584 4.062 1.00 . A A . 7 LEU HB2 1 1 6 1541 1 1 7 LEU HB3 H 4.299 -3.312 3.565 1.00 . A A . 7 LEU HB3 1 1 6 1542 1 1 7 LEU HD11 H 2.580 -2.293 5.896 1.00 . A A . 7 LEU HD11 1 1 6 1543 1 1 7 LEU HD12 H 2.937 -0.566 5.890 1.00 . A A . 7 LEU HD12 1 1 6 1544 1 1 7 LEU HD13 H 4.254 -1.738 5.859 1.00 . A A . 7 LEU HD13 1 1 6 1545 1 1 7 LEU HD21 H 4.163 -0.478 2.393 1.00 . A A . 7 LEU HD21 1 1 6 1546 1 1 7 LEU HD22 H 5.282 -1.213 3.543 1.00 . A A . 7 LEU HD22 1 1 6 1547 1 1 7 LEU HD23 H 4.403 0.252 3.981 1.00 . A A . 7 LEU HD23 1 1 6 1548 1 1 7 LEU HG H 2.279 -1.083 3.694 1.00 . A A . 7 LEU HG 1 1 6 1549 1 1 7 LEU N N 1.468 -2.727 1.838 1.00 . A A . 7 LEU N 1 1 6 1550 1 1 7 LEU O O 4.128 -4.865 0.937 1.00 . A A . 7 LEU O 1 1 6 1551 1 1 8 ALA C C 1.930 -6.985 -0.144 1.00 . A A . 8 ALA C 1 1 6 1552 1 1 8 ALA CA C 2.175 -6.817 1.360 1.00 . A A . 8 ALA CA 1 1 6 1553 1 1 8 ALA CB C 1.178 -7.650 2.155 1.00 . A A . 8 ALA CB 1 1 6 1554 1 1 8 ALA H H 1.296 -5.097 2.231 1.00 . A A . 8 ALA H 1 1 6 1555 1 1 8 ALA HA H 3.168 -7.175 1.592 1.00 . A A . 8 ALA HA 1 1 6 1556 1 1 8 ALA HB1 H 1.326 -8.696 1.932 1.00 . A A . 8 ALA HB1 1 1 6 1557 1 1 8 ALA HB2 H 0.173 -7.362 1.885 1.00 . A A . 8 ALA HB2 1 1 6 1558 1 1 8 ALA HB3 H 1.330 -7.482 3.211 1.00 . A A . 8 ALA HB3 1 1 6 1559 1 1 8 ALA N N 2.101 -5.414 1.769 1.00 . A A . 8 ALA N 1 1 6 1560 1 1 8 ALA O O 2.269 -8.021 -0.718 1.00 . A A . 8 ALA O 1 1 6 1561 1 1 9 ASP C C 2.240 -5.452 -3.039 1.00 . A A . 9 ASP C 1 1 6 1562 1 1 9 ASP CA C 1.066 -6.002 -2.218 1.00 . A A . 9 ASP CA 1 1 6 1563 1 1 9 ASP CB C -0.210 -5.206 -2.534 1.00 . A A . 9 ASP CB 1 1 6 1564 1 1 9 ASP CG C -1.410 -6.105 -2.758 1.00 . A A . 9 ASP CG 1 1 6 1565 1 1 9 ASP H H 1.103 -5.161 -0.273 1.00 . A A . 9 ASP H 1 1 6 1566 1 1 9 ASP HA H 0.909 -7.036 -2.492 1.00 . A A . 9 ASP HA 1 1 6 1567 1 1 9 ASP HB2 H -0.430 -4.544 -1.711 1.00 . A A . 9 ASP HB2 1 1 6 1568 1 1 9 ASP HB3 H -0.052 -4.617 -3.428 1.00 . A A . 9 ASP HB3 1 1 6 1569 1 1 9 ASP N N 1.346 -5.962 -0.780 1.00 . A A . 9 ASP N 1 1 6 1570 1 1 9 ASP O O 2.085 -5.144 -4.223 1.00 . A A . 9 ASP O 1 1 6 1571 1 1 9 ASP OD1 O -2.070 -6.471 -1.763 1.00 . A A . 9 ASP OD1 1 1 6 1572 1 1 9 ASP OD2 O -1.688 -6.443 -3.927 1.00 . A A . 9 ASP OD2 1 1 6 1573 1 1 10 DAL C C 4.910 -3.375 -2.677 1.00 . A A . 10 DAL C 1 1 6 1574 1 1 10 DAL CA C 4.602 -4.820 -3.081 1.00 . A A . 10 DAL CA 1 1 6 1575 1 1 10 DAL CB C 5.790 -5.712 -2.767 1.00 . A A . 10 DAL CB 1 1 6 1576 1 1 10 DAL H H 3.479 -5.591 -1.467 1.00 . A A . 10 DAL H 1 1 6 1577 1 1 10 DAL HA H 4.428 -4.857 -4.146 1.00 . A A . 10 DAL HA 1 1 6 1578 1 1 10 DAL HB1 H 6.638 -5.405 -3.359 1.00 . A A . 10 DAL HB1 1 1 6 1579 1 1 10 DAL HB2 H 5.540 -6.737 -2.996 1.00 . A A . 10 DAL HB2 1 1 6 1580 1 1 10 DAL HB3 H 6.031 -5.625 -1.718 1.00 . A A . 10 DAL HB3 1 1 6 1581 1 1 10 DAL N N 3.412 -5.331 -2.408 1.00 . A A . 10 DAL N 1 1 6 1582 1 1 10 DAL O O 5.924 -2.814 -3.096 1.00 . A A . 10 DAL O 1 1 6 1583 1 1 11 GLY C C 4.118 -0.411 -2.550 1.00 . A A . 11 GLY C 1 1 6 1584 1 1 11 GLY CA C 4.234 -1.409 -1.419 1.00 . A A . 11 GLY CA 1 1 6 1585 1 1 11 GLY H H 3.246 -3.272 -1.561 1.00 . A A . 11 GLY H 1 1 6 1586 1 1 11 GLY HA2 H 3.494 -1.171 -0.669 1.00 . A A . 11 GLY HA2 1 1 6 1587 1 1 11 GLY HA3 H 5.217 -1.325 -0.979 1.00 . A A . 11 GLY HA3 1 1 6 1588 1 1 11 GLY N N 4.034 -2.778 -1.862 1.00 . A A . 11 GLY N 1 1 6 1589 1 1 11 GLY O O 3.014 0.001 -2.910 1.00 . A A . 11 GLY O 1 1 6 1590 1 1 12 TRP C C 5.364 0.250 -5.577 1.00 . A A . 12 TRP C 1 1 6 1591 1 1 12 TRP CA C 5.281 0.938 -4.212 1.00 . A A . 12 TRP CA 1 1 6 1592 1 1 12 TRP CB C 6.435 1.922 -4.016 1.00 . A A . 12 TRP CB 1 1 6 1593 1 1 12 TRP CD1 C 6.592 3.244 -1.833 1.00 . A A . 12 TRP CD1 1 1 6 1594 1 1 12 TRP CD2 C 5.045 4.002 -3.264 1.00 . A A . 12 TRP CD2 1 1 6 1595 1 1 12 TRP CE2 C 5.013 4.797 -2.105 1.00 . A A . 12 TRP CE2 1 1 6 1596 1 1 12 TRP CE3 C 4.159 4.296 -4.309 1.00 . A A . 12 TRP CE3 1 1 6 1597 1 1 12 TRP CG C 6.061 3.013 -3.068 1.00 . A A . 12 TRP CG 1 1 6 1598 1 1 12 TRP CH2 C 3.274 6.124 -2.993 1.00 . A A . 12 TRP CH2 1 1 6 1599 1 1 12 TRP CZ2 C 4.129 5.858 -1.957 1.00 . A A . 12 TRP CZ2 1 1 6 1600 1 1 12 TRP CZ3 C 3.286 5.354 -4.163 1.00 . A A . 12 TRP CZ3 1 1 6 1601 1 1 12 TRP H H 6.107 -0.388 -2.782 1.00 . A A . 12 TRP H 1 1 6 1602 1 1 12 TRP HA H 4.352 1.491 -4.170 1.00 . A A . 12 TRP HA 1 1 6 1603 1 1 12 TRP HB2 H 7.287 1.397 -3.610 1.00 . A A . 12 TRP HB2 1 1 6 1604 1 1 12 TRP HB3 H 6.702 2.366 -4.963 1.00 . A A . 12 TRP HB3 1 1 6 1605 1 1 12 TRP HD1 H 7.387 2.660 -1.393 1.00 . A A . 12 TRP HD1 1 1 6 1606 1 1 12 TRP HE1 H 6.171 4.678 -0.358 1.00 . A A . 12 TRP HE1 1 1 6 1607 1 1 12 TRP HE3 H 4.150 3.713 -5.219 1.00 . A A . 12 TRP HE3 1 1 6 1608 1 1 12 TRP HH2 H 2.574 6.943 -2.920 1.00 . A A . 12 TRP HH2 1 1 6 1609 1 1 12 TRP HZ2 H 4.101 6.449 -1.058 1.00 . A A . 12 TRP HZ2 1 1 6 1610 1 1 12 TRP HZ3 H 2.599 5.597 -4.962 1.00 . A A . 12 TRP HZ3 1 1 6 1611 1 1 12 TRP N N 5.260 -0.022 -3.114 1.00 . A A . 12 TRP N 1 1 6 1612 1 1 12 TRP NE1 N 5.966 4.315 -1.246 1.00 . A A . 12 TRP NE1 1 1 6 1613 1 1 12 TRP O O 5.523 0.915 -6.602 1.00 . A A . 12 TRP O 1 1 6 1614 1 1 13 ALA C C 3.864 -1.837 -7.480 1.00 . A A . 13 ALA C 1 1 6 1615 1 1 13 ALA CA C 5.246 -1.839 -6.835 1.00 . A A . 13 ALA CA 1 1 6 1616 1 1 13 ALA CB C 5.723 -3.261 -6.589 1.00 . A A . 13 ALA CB 1 1 6 1617 1 1 13 ALA H H 5.073 -1.555 -4.748 1.00 . A A . 13 ALA H 1 1 6 1618 1 1 13 ALA HA H 5.943 -1.359 -7.503 1.00 . A A . 13 ALA HA 1 1 6 1619 1 1 13 ALA HB1 H 6.751 -3.351 -6.905 1.00 . A A . 13 ALA HB1 1 1 6 1620 1 1 13 ALA HB2 H 5.112 -3.948 -7.154 1.00 . A A . 13 ALA HB2 1 1 6 1621 1 1 13 ALA HB3 H 5.647 -3.491 -5.537 1.00 . A A . 13 ALA HB3 1 1 6 1622 1 1 13 ALA N N 5.222 -1.079 -5.590 1.00 . A A . 13 ALA N 1 1 6 1623 1 1 13 ALA O O 3.742 -1.849 -8.706 1.00 . A A . 13 ALA O 1 1 6 1624 1 1 14 SER C C 1.184 -0.492 -7.921 1.00 . A A . 14 SER C 1 1 6 1625 1 1 14 SER CA C 1.446 -1.767 -7.113 1.00 . A A . 14 SER CA 1 1 6 1626 1 1 14 SER CB C 0.471 -1.862 -5.929 1.00 . A A . 14 SER CB 1 1 6 1627 1 1 14 SER H H 2.995 -1.776 -5.674 1.00 . A A . 14 SER H 1 1 6 1628 1 1 14 SER HA H 1.298 -2.618 -7.758 1.00 . A A . 14 SER HA 1 1 6 1629 1 1 14 SER HB2 H -0.468 -1.404 -6.198 1.00 . A A . 14 SER HB2 1 1 6 1630 1 1 14 SER HB3 H 0.305 -2.902 -5.688 1.00 . A A . 14 SER HB3 1 1 6 1631 1 1 14 SER HG H 1.351 -1.856 -4.171 1.00 . A A . 14 SER HG 1 1 6 1632 1 1 14 SER N N 2.826 -1.799 -6.639 1.00 . A A . 14 SER N 1 1 6 1633 1 1 14 SER O O 0.355 -0.487 -8.832 1.00 . A A . 14 SER O 1 1 6 1634 1 1 14 SER OG O 0.985 -1.205 -4.779 1.00 . A A . 14 SER OG 1 1 6 1635 1 1 15 DAL C C 0.888 2.839 -7.491 1.00 . A A . 15 DAL C 1 1 6 1636 1 1 15 DAL CA C 1.761 1.862 -8.281 1.00 . A A . 15 DAL CA 1 1 6 1637 1 1 15 DAL CB C 3.131 2.465 -8.546 1.00 . A A . 15 DAL CB 1 1 6 1638 1 1 15 DAL H H 2.553 0.514 -6.852 1.00 . A A . 15 DAL H 1 1 6 1639 1 1 15 DAL HA H 1.294 1.671 -9.234 1.00 . A A . 15 DAL HA 1 1 6 1640 1 1 15 DAL HB1 H 3.875 1.684 -8.540 1.00 . A A . 15 DAL HB1 1 1 6 1641 1 1 15 DAL HB2 H 3.360 3.190 -7.779 1.00 . A A . 15 DAL HB2 1 1 6 1642 1 1 15 DAL HB3 H 3.125 2.950 -9.511 1.00 . A A . 15 DAL HB3 1 1 6 1643 1 1 15 DAL N N 1.905 0.583 -7.585 1.00 . A A . 15 DAL N 1 1 6 1644 1 1 15 DAL O O 1.001 4.057 -7.652 1.00 . A A . 15 DAL O 1 1 6 1645 1 1 16 ARG C C -0.181 3.553 -4.529 1.00 . A A . 16 ARG C 1 1 6 1646 1 1 16 ARG CA C -0.875 3.121 -5.823 1.00 . A A . 16 ARG CA 1 1 6 1647 1 1 16 ARG CB C -2.162 2.336 -5.498 1.00 . A A . 16 ARG CB 1 1 6 1648 1 1 16 ARG CD C -3.026 0.210 -4.461 1.00 . A A . 16 ARG CD 1 1 6 1649 1 1 16 ARG CG C -2.006 1.339 -4.355 1.00 . A A . 16 ARG CG 1 1 6 1650 1 1 16 ARG CZ C -2.868 -1.342 -2.535 1.00 . A A . 16 ARG CZ 1 1 6 1651 1 1 16 ARG H H -0.024 1.323 -6.555 1.00 . A A . 16 ARG H 1 1 6 1652 1 1 16 ARG HA H -1.126 4.007 -6.391 1.00 . A A . 16 ARG HA 1 1 6 1653 1 1 16 ARG HB2 H -2.938 3.037 -5.228 1.00 . A A . 16 ARG HB2 1 1 6 1654 1 1 16 ARG HB3 H -2.478 1.784 -6.378 1.00 . A A . 16 ARG HB3 1 1 6 1655 1 1 16 ARG HD2 H -3.902 0.584 -4.971 1.00 . A A . 16 ARG HD2 1 1 6 1656 1 1 16 ARG HD3 H -2.599 -0.601 -5.035 1.00 . A A . 16 ARG HD3 1 1 6 1657 1 1 16 ARG HE H -4.167 0.169 -2.697 1.00 . A A . 16 ARG HE 1 1 6 1658 1 1 16 ARG HG2 H -1.008 0.922 -4.386 1.00 . A A . 16 ARG HG2 1 1 6 1659 1 1 16 ARG HG3 H -2.152 1.857 -3.418 1.00 . A A . 16 ARG HG3 1 1 6 1660 1 1 16 ARG HH11 H -1.497 -1.703 -3.985 1.00 . A A . 16 ARG HH11 1 1 6 1661 1 1 16 ARG HH12 H -1.439 -2.775 -2.628 1.00 . A A . 16 ARG HH12 1 1 6 1662 1 1 16 ARG HH21 H -4.078 -1.245 -0.916 1.00 . A A . 16 ARG HH21 1 1 6 1663 1 1 16 ARG HH22 H -2.906 -2.519 -0.888 1.00 . A A . 16 ARG HH22 1 1 6 1664 1 1 16 ARG N N 0.018 2.300 -6.639 1.00 . A A . 16 ARG N 1 1 6 1665 1 1 16 ARG NE N -3.430 -0.294 -3.147 1.00 . A A . 16 ARG NE 1 1 6 1666 1 1 16 ARG NH1 N -1.851 -1.993 -3.097 1.00 . A A . 16 ARG NH1 1 1 6 1667 1 1 16 ARG NH2 N -3.320 -1.734 -1.349 1.00 . A A . 16 ARG NH2 1 1 6 1668 1 1 16 ARG O O 0.726 2.871 -4.051 1.00 . A A . 16 ARG O 1 1 6 1669 1 1 17 PRO C C -0.619 4.559 -1.453 1.00 . A A . 17 PRO C 1 1 6 1670 1 1 17 PRO CA C -0.012 5.205 -2.699 1.00 . A A . 17 PRO CA 1 1 6 1671 1 1 17 PRO CB C -0.335 6.707 -2.729 1.00 . A A . 17 PRO CB 1 1 6 1672 1 1 17 PRO CD C -1.648 5.586 -4.426 1.00 . A A . 17 PRO CD 1 1 6 1673 1 1 17 PRO CG C -1.193 6.936 -3.939 1.00 . A A . 17 PRO CG 1 1 6 1674 1 1 17 PRO HA H 1.056 5.067 -2.678 1.00 . A A . 17 PRO HA 1 1 6 1675 1 1 17 PRO HB2 H -0.860 6.976 -1.825 1.00 . A A . 17 PRO HB2 1 1 6 1676 1 1 17 PRO HB3 H 0.589 7.267 -2.789 1.00 . A A . 17 PRO HB3 1 1 6 1677 1 1 17 PRO HD2 H -2.602 5.327 -3.997 1.00 . A A . 17 PRO HD2 1 1 6 1678 1 1 17 PRO HD3 H -1.701 5.576 -5.503 1.00 . A A . 17 PRO HD3 1 1 6 1679 1 1 17 PRO HG2 H -2.047 7.538 -3.669 1.00 . A A . 17 PRO HG2 1 1 6 1680 1 1 17 PRO HG3 H -0.615 7.433 -4.705 1.00 . A A . 17 PRO HG3 1 1 6 1681 1 1 17 PRO N N -0.594 4.695 -3.940 1.00 . A A . 17 PRO N 1 1 6 1682 1 1 17 PRO O O -1.653 3.893 -1.526 1.00 . A A . 17 PRO O 1 1 6 1683 1 1 18 PRO C C -1.791 4.725 1.425 1.00 . A A . 18 PRO C 1 1 6 1684 1 1 18 PRO CA C -0.430 4.186 0.986 1.00 . A A . 18 PRO CA 1 1 6 1685 1 1 18 PRO CB C 0.636 4.621 1.995 1.00 . A A . 18 PRO CB 1 1 6 1686 1 1 18 PRO CD C 1.275 5.523 -0.132 1.00 . A A . 18 PRO CD 1 1 6 1687 1 1 18 PRO CG C 1.368 5.747 1.348 1.00 . A A . 18 PRO CG 1 1 6 1688 1 1 18 PRO HA H -0.468 3.107 0.945 1.00 . A A . 18 PRO HA 1 1 6 1689 1 1 18 PRO HB2 H 0.154 4.945 2.902 1.00 . A A . 18 PRO HB2 1 1 6 1690 1 1 18 PRO HB3 H 1.290 3.795 2.210 1.00 . A A . 18 PRO HB3 1 1 6 1691 1 1 18 PRO HD2 H 1.209 6.468 -0.651 1.00 . A A . 18 PRO HD2 1 1 6 1692 1 1 18 PRO HD3 H 2.125 4.959 -0.483 1.00 . A A . 18 PRO HD3 1 1 6 1693 1 1 18 PRO HG2 H 0.904 6.685 1.613 1.00 . A A . 18 PRO HG2 1 1 6 1694 1 1 18 PRO HG3 H 2.402 5.739 1.663 1.00 . A A . 18 PRO HG3 1 1 6 1695 1 1 18 PRO N N 0.032 4.750 -0.289 1.00 . A A . 18 PRO N 1 1 6 1696 1 1 18 PRO O O -2.111 5.894 1.197 1.00 . A A . 18 PRO O 1 1 6 1697 1 1 19 PRO C C -3.858 5.016 3.890 1.00 . A A . 19 PRO C 1 1 6 1698 1 1 19 PRO CA C -3.923 4.258 2.565 1.00 . A A . 19 PRO CA 1 1 6 1699 1 1 19 PRO CB C -4.643 2.923 2.739 1.00 . A A . 19 PRO CB 1 1 6 1700 1 1 19 PRO CD C -2.289 2.470 2.390 1.00 . A A . 19 PRO CD 1 1 6 1701 1 1 19 PRO CG C -3.587 1.882 2.883 1.00 . A A . 19 PRO CG 1 1 6 1702 1 1 19 PRO HA H -4.450 4.859 1.837 1.00 . A A . 19 PRO HA 1 1 6 1703 1 1 19 PRO HB2 H -5.275 2.962 3.612 1.00 . A A . 19 PRO HB2 1 1 6 1704 1 1 19 PRO HB3 H -5.238 2.737 1.875 1.00 . A A . 19 PRO HB3 1 1 6 1705 1 1 19 PRO HD2 H -1.531 2.413 3.154 1.00 . A A . 19 PRO HD2 1 1 6 1706 1 1 19 PRO HD3 H -1.970 1.950 1.503 1.00 . A A . 19 PRO HD3 1 1 6 1707 1 1 19 PRO HG2 H -3.504 1.591 3.914 1.00 . A A . 19 PRO HG2 1 1 6 1708 1 1 19 PRO HG3 H -3.851 1.023 2.283 1.00 . A A . 19 PRO HG3 1 1 6 1709 1 1 19 PRO N N -2.605 3.873 2.078 1.00 . A A . 19 PRO N 1 1 6 1710 1 1 19 PRO O O -3.356 4.498 4.888 1.00 . A A . 19 PRO O 1 1 6 1711 1 1 20 SER C C -5.799 7.476 5.477 1.00 . A A . 20 SER C 1 1 6 1712 1 1 20 SER CA C -4.375 7.083 5.085 1.00 . A A . 20 SER CA 1 1 6 1713 1 1 20 SER CB C -3.524 8.339 4.862 1.00 . A A . 20 SER CB 1 1 6 1714 1 1 20 SER H H -4.757 6.599 3.058 1.00 . A A . 20 SER H 1 1 6 1715 1 1 20 SER HA H -3.942 6.508 5.891 1.00 . A A . 20 SER HA 1 1 6 1716 1 1 20 SER HB2 H -3.681 9.027 5.680 1.00 . A A . 20 SER HB2 1 1 6 1717 1 1 20 SER HB3 H -2.481 8.060 4.823 1.00 . A A . 20 SER HB3 1 1 6 1718 1 1 20 SER HG H -3.265 8.714 2.956 1.00 . A A . 20 SER HG 1 1 6 1719 1 1 20 SER N N -4.371 6.245 3.887 1.00 . A A . 20 SER N 1 1 6 1720 1 1 20 SER O O -6.536 7.990 4.608 1.00 . A A . 20 SER O 1 1 6 1721 1 1 20 SER OXT O -6.166 7.266 6.653 1.00 . A A . 20 SER OXT 1 1 6 1722 1 1 20 SER OG O -3.870 8.987 3.649 1.00 . A A . 20 SER OG 1 1 7 1723 1 1 1 ASP C C -5.745 -2.366 6.105 1.00 . A A . 1 ASP C 1 1 7 1724 1 1 1 ASP CA C -6.047 -3.642 6.891 1.00 . A A . 1 ASP CA 1 1 7 1725 1 1 1 ASP CB C -4.980 -4.704 6.603 1.00 . A A . 1 ASP CB 1 1 7 1726 1 1 1 ASP CG C -4.718 -5.599 7.799 1.00 . A A . 1 ASP CG 1 1 7 1727 1 1 1 ASP H1 H -7.583 -4.982 7.190 1.00 . A A . 1 ASP H1 1 1 7 1728 1 1 1 ASP H2 H -7.344 -4.527 5.553 1.00 . A A . 1 ASP H2 1 1 7 1729 1 1 1 ASP H3 H -8.084 -3.435 6.651 1.00 . A A . 1 ASP H3 1 1 7 1730 1 1 1 ASP HA H -6.041 -3.411 7.945 1.00 . A A . 1 ASP HA 1 1 7 1731 1 1 1 ASP HB2 H -5.308 -5.321 5.780 1.00 . A A . 1 ASP HB2 1 1 7 1732 1 1 1 ASP HB3 H -4.056 -4.214 6.334 1.00 . A A . 1 ASP HB3 1 1 7 1733 1 1 1 ASP N N -7.384 -4.196 6.539 1.00 . A A . 1 ASP N 1 1 7 1734 1 1 1 ASP O O -5.497 -1.314 6.696 1.00 . A A . 1 ASP O 1 1 7 1735 1 1 1 ASP OD1 O -3.958 -5.182 8.698 1.00 . A A . 1 ASP OD1 1 1 7 1736 1 1 1 ASP OD2 O -5.273 -6.717 7.837 1.00 . A A . 1 ASP OD2 1 1 7 1737 1 1 2 ALA C C -4.008 -0.987 3.867 1.00 . A A . 2 ALA C 1 1 7 1738 1 1 2 ALA CA C -5.496 -1.334 3.885 1.00 . A A . 2 ALA CA 1 1 7 1739 1 1 2 ALA CB C -6.327 -0.122 4.288 1.00 . A A . 2 ALA CB 1 1 7 1740 1 1 2 ALA H H -5.970 -3.341 4.367 1.00 . A A . 2 ALA H 1 1 7 1741 1 1 2 ALA HA H -5.792 -1.622 2.886 1.00 . A A . 2 ALA HA 1 1 7 1742 1 1 2 ALA HB1 H -6.494 0.503 3.424 1.00 . A A . 2 ALA HB1 1 1 7 1743 1 1 2 ALA HB2 H -5.801 0.441 5.044 1.00 . A A . 2 ALA HB2 1 1 7 1744 1 1 2 ALA HB3 H -7.277 -0.453 4.681 1.00 . A A . 2 ALA HB3 1 1 7 1745 1 1 2 ALA N N -5.767 -2.471 4.770 1.00 . A A . 2 ALA N 1 1 7 1746 1 1 2 ALA O O -3.329 -1.203 2.863 1.00 . A A . 2 ALA O 1 1 7 1747 1 1 3 TYR C C -1.207 -1.327 5.056 1.00 . A A . 3 TYR C 1 1 7 1748 1 1 3 TYR CA C -2.093 -0.083 5.092 1.00 . A A . 3 TYR CA 1 1 7 1749 1 1 3 TYR CB C -1.843 0.722 6.371 1.00 . A A . 3 TYR CB 1 1 7 1750 1 1 3 TYR CD1 C 0.603 1.296 6.612 1.00 . A A . 3 TYR CD1 1 1 7 1751 1 1 3 TYR CD2 C -0.879 3.006 5.848 1.00 . A A . 3 TYR CD2 1 1 7 1752 1 1 3 TYR CE1 C 1.664 2.176 6.535 1.00 . A A . 3 TYR CE1 1 1 7 1753 1 1 3 TYR CE2 C 0.179 3.890 5.773 1.00 . A A . 3 TYR CE2 1 1 7 1754 1 1 3 TYR CG C -0.685 1.691 6.269 1.00 . A A . 3 TYR CG 1 1 7 1755 1 1 3 TYR CZ C 1.447 3.471 6.115 1.00 . A A . 3 TYR CZ 1 1 7 1756 1 1 3 TYR H H -4.098 -0.307 5.751 1.00 . A A . 3 TYR H 1 1 7 1757 1 1 3 TYR HA H -1.849 0.528 4.242 1.00 . A A . 3 TYR HA 1 1 7 1758 1 1 3 TYR HB2 H -2.728 1.294 6.608 1.00 . A A . 3 TYR HB2 1 1 7 1759 1 1 3 TYR HB3 H -1.636 0.040 7.182 1.00 . A A . 3 TYR HB3 1 1 7 1760 1 1 3 TYR HD1 H 0.771 0.280 6.939 1.00 . A A . 3 TYR HD1 1 1 7 1761 1 1 3 TYR HD2 H -1.874 3.335 5.569 1.00 . A A . 3 TYR HD2 1 1 7 1762 1 1 3 TYR HE1 H 2.657 1.848 6.801 1.00 . A A . 3 TYR HE1 1 1 7 1763 1 1 3 TYR HE2 H 0.009 4.906 5.452 1.00 . A A . 3 TYR HE2 1 1 7 1764 1 1 3 TYR HH H 2.869 4.337 5.154 1.00 . A A . 3 TYR HH 1 1 7 1765 1 1 3 TYR N N -3.505 -0.452 4.983 1.00 . A A . 3 TYR N 1 1 7 1766 1 1 3 TYR O O -0.253 -1.390 4.278 1.00 . A A . 3 TYR O 1 1 7 1767 1 1 3 TYR OH O 2.502 4.352 6.041 1.00 . A A . 3 TYR OH 1 1 7 1768 1 1 4 ALA C C -0.954 -4.322 4.585 1.00 . A A . 4 ALA C 1 1 7 1769 1 1 4 ALA CA C -0.788 -3.575 5.907 1.00 . A A . 4 ALA CA 1 1 7 1770 1 1 4 ALA CB C -1.236 -4.445 7.073 1.00 . A A . 4 ALA CB 1 1 7 1771 1 1 4 ALA H H -2.324 -2.226 6.460 1.00 . A A . 4 ALA H 1 1 7 1772 1 1 4 ALA HA H 0.258 -3.333 6.044 1.00 . A A . 4 ALA HA 1 1 7 1773 1 1 4 ALA HB1 H -2.163 -4.939 6.819 1.00 . A A . 4 ALA HB1 1 1 7 1774 1 1 4 ALA HB2 H -1.385 -3.829 7.947 1.00 . A A . 4 ALA HB2 1 1 7 1775 1 1 4 ALA HB3 H -0.479 -5.187 7.281 1.00 . A A . 4 ALA HB3 1 1 7 1776 1 1 4 ALA N N -1.542 -2.325 5.878 1.00 . A A . 4 ALA N 1 1 7 1777 1 1 4 ALA O O -0.024 -4.978 4.114 1.00 . A A . 4 ALA O 1 1 7 1778 1 1 5 GLN C C -1.614 -4.173 1.588 1.00 . A A . 5 GLN C 1 1 7 1779 1 1 5 GLN CA C -2.430 -4.833 2.701 1.00 . A A . 5 GLN CA 1 1 7 1780 1 1 5 GLN CB C -3.928 -4.741 2.389 1.00 . A A . 5 GLN CB 1 1 7 1781 1 1 5 GLN CD C -4.099 -6.806 0.940 1.00 . A A . 5 GLN CD 1 1 7 1782 1 1 5 GLN CG C -4.307 -5.306 1.030 1.00 . A A . 5 GLN CG 1 1 7 1783 1 1 5 GLN H H -2.837 -3.643 4.399 1.00 . A A . 5 GLN H 1 1 7 1784 1 1 5 GLN HA H -2.146 -5.872 2.774 1.00 . A A . 5 GLN HA 1 1 7 1785 1 1 5 GLN HB2 H -4.475 -5.285 3.145 1.00 . A A . 5 GLN HB2 1 1 7 1786 1 1 5 GLN HB3 H -4.227 -3.704 2.419 1.00 . A A . 5 GLN HB3 1 1 7 1787 1 1 5 GLN HE21 H -5.905 -7.135 1.711 1.00 . A A . 5 GLN HE21 1 1 7 1788 1 1 5 GLN HE22 H -4.988 -8.545 1.317 1.00 . A A . 5 GLN HE22 1 1 7 1789 1 1 5 GLN HG2 H -5.349 -5.090 0.842 1.00 . A A . 5 GLN HG2 1 1 7 1790 1 1 5 GLN HG3 H -3.701 -4.826 0.277 1.00 . A A . 5 GLN HG3 1 1 7 1791 1 1 5 GLN N N -2.142 -4.195 3.980 1.00 . A A . 5 GLN N 1 1 7 1792 1 1 5 GLN NE2 N -5.098 -7.573 1.366 1.00 . A A . 5 GLN NE2 1 1 7 1793 1 1 5 GLN O O -1.110 -4.851 0.692 1.00 . A A . 5 GLN O 1 1 7 1794 1 1 5 GLN OE1 O -3.050 -7.273 0.494 1.00 . A A . 5 GLN OE1 1 1 7 1795 1 1 6 TRP C C 0.741 -2.541 0.674 1.00 . A A . 6 TRP C 1 1 7 1796 1 1 6 TRP CA C -0.712 -2.079 0.689 1.00 . A A . 6 TRP CA 1 1 7 1797 1 1 6 TRP CB C -0.777 -0.585 1.019 1.00 . A A . 6 TRP CB 1 1 7 1798 1 1 6 TRP CD1 C -0.329 0.588 -1.207 1.00 . A A . 6 TRP CD1 1 1 7 1799 1 1 6 TRP CD2 C 1.252 0.930 0.338 1.00 . A A . 6 TRP CD2 1 1 7 1800 1 1 6 TRP CE2 C 1.610 1.620 -0.833 1.00 . A A . 6 TRP CE2 1 1 7 1801 1 1 6 TRP CE3 C 2.101 1.003 1.447 1.00 . A A . 6 TRP CE3 1 1 7 1802 1 1 6 TRP CG C 0.005 0.274 0.075 1.00 . A A . 6 TRP CG 1 1 7 1803 1 1 6 TRP CH2 C 3.587 2.432 0.167 1.00 . A A . 6 TRP CH2 1 1 7 1804 1 1 6 TRP CZ2 C 2.776 2.374 -0.931 1.00 . A A . 6 TRP CZ2 1 1 7 1805 1 1 6 TRP CZ3 C 3.260 1.756 1.350 1.00 . A A . 6 TRP CZ3 1 1 7 1806 1 1 6 TRP H H -1.898 -2.370 2.417 1.00 . A A . 6 TRP H 1 1 7 1807 1 1 6 TRP HA H -1.146 -2.249 -0.285 1.00 . A A . 6 TRP HA 1 1 7 1808 1 1 6 TRP HB2 H -1.805 -0.262 0.988 1.00 . A A . 6 TRP HB2 1 1 7 1809 1 1 6 TRP HB3 H -0.387 -0.426 2.011 1.00 . A A . 6 TRP HB3 1 1 7 1810 1 1 6 TRP HD1 H -1.220 0.244 -1.704 1.00 . A A . 6 TRP HD1 1 1 7 1811 1 1 6 TRP HE1 H 0.616 1.746 -2.670 1.00 . A A . 6 TRP HE1 1 1 7 1812 1 1 6 TRP HE3 H 1.865 0.485 2.367 1.00 . A A . 6 TRP HE3 1 1 7 1813 1 1 6 TRP HH2 H 4.497 3.015 0.135 1.00 . A A . 6 TRP HH2 1 1 7 1814 1 1 6 TRP HZ2 H 3.044 2.896 -1.838 1.00 . A A . 6 TRP HZ2 1 1 7 1815 1 1 6 TRP HZ3 H 3.929 1.824 2.196 1.00 . A A . 6 TRP HZ3 1 1 7 1816 1 1 6 TRP N N -1.479 -2.846 1.669 1.00 . A A . 6 TRP N 1 1 7 1817 1 1 6 TRP NE1 N 0.631 1.391 -1.759 1.00 . A A . 6 TRP NE1 1 1 7 1818 1 1 6 TRP O O 1.306 -2.814 -0.386 1.00 . A A . 6 TRP O 1 1 7 1819 1 1 7 LEU C C 2.873 -4.522 1.555 1.00 . A A . 7 LEU C 1 1 7 1820 1 1 7 LEU CA C 2.712 -3.072 2.015 1.00 . A A . 7 LEU CA 1 1 7 1821 1 1 7 LEU CB C 3.155 -2.921 3.473 1.00 . A A . 7 LEU CB 1 1 7 1822 1 1 7 LEU CD1 C 3.171 -1.477 5.526 1.00 . A A . 7 LEU CD1 1 1 7 1823 1 1 7 LEU CD2 C 4.316 -0.691 3.442 1.00 . A A . 7 LEU CD2 1 1 7 1824 1 1 7 LEU CG C 3.143 -1.484 4.005 1.00 . A A . 7 LEU CG 1 1 7 1825 1 1 7 LEU H H 0.813 -2.407 2.669 1.00 . A A . 7 LEU H 1 1 7 1826 1 1 7 LEU HA H 3.328 -2.441 1.393 1.00 . A A . 7 LEU HA 1 1 7 1827 1 1 7 LEU HB2 H 2.496 -3.516 4.088 1.00 . A A . 7 LEU HB2 1 1 7 1828 1 1 7 LEU HB3 H 4.155 -3.309 3.569 1.00 . A A . 7 LEU HB3 1 1 7 1829 1 1 7 LEU HD11 H 2.431 -2.168 5.903 1.00 . A A . 7 LEU HD11 1 1 7 1830 1 1 7 LEU HD12 H 2.951 -0.483 5.885 1.00 . A A . 7 LEU HD12 1 1 7 1831 1 1 7 LEU HD13 H 4.150 -1.776 5.869 1.00 . A A . 7 LEU HD13 1 1 7 1832 1 1 7 LEU HD21 H 4.400 0.249 3.967 1.00 . A A . 7 LEU HD21 1 1 7 1833 1 1 7 LEU HD22 H 4.152 -0.501 2.391 1.00 . A A . 7 LEU HD22 1 1 7 1834 1 1 7 LEU HD23 H 5.227 -1.257 3.568 1.00 . A A . 7 LEU HD23 1 1 7 1835 1 1 7 LEU HG H 2.230 -0.999 3.689 1.00 . A A . 7 LEU HG 1 1 7 1836 1 1 7 LEU N N 1.329 -2.634 1.865 1.00 . A A . 7 LEU N 1 1 7 1837 1 1 7 LEU O O 3.890 -4.883 0.959 1.00 . A A . 7 LEU O 1 1 7 1838 1 1 8 ALA C C 1.630 -6.918 -0.077 1.00 . A A . 8 ALA C 1 1 7 1839 1 1 8 ALA CA C 1.868 -6.752 1.428 1.00 . A A . 8 ALA CA 1 1 7 1840 1 1 8 ALA CB C 0.824 -7.533 2.217 1.00 . A A . 8 ALA CB 1 1 7 1841 1 1 8 ALA H H 1.069 -4.990 2.292 1.00 . A A . 8 ALA H 1 1 7 1842 1 1 8 ALA HA H 2.840 -7.154 1.672 1.00 . A A . 8 ALA HA 1 1 7 1843 1 1 8 ALA HB1 H 0.386 -8.290 1.584 1.00 . A A . 8 ALA HB1 1 1 7 1844 1 1 8 ALA HB2 H 0.053 -6.859 2.560 1.00 . A A . 8 ALA HB2 1 1 7 1845 1 1 8 ALA HB3 H 1.295 -8.004 3.068 1.00 . A A . 8 ALA HB3 1 1 7 1846 1 1 8 ALA N N 1.854 -5.344 1.824 1.00 . A A . 8 ALA N 1 1 7 1847 1 1 8 ALA O O 1.937 -7.968 -0.644 1.00 . A A . 8 ALA O 1 1 7 1848 1 1 9 ASP C C 2.028 -5.420 -2.973 1.00 . A A . 9 ASP C 1 1 7 1849 1 1 9 ASP CA C 0.821 -5.911 -2.161 1.00 . A A . 9 ASP CA 1 1 7 1850 1 1 9 ASP CB C -0.411 -5.059 -2.495 1.00 . A A . 9 ASP CB 1 1 7 1851 1 1 9 ASP CG C -1.553 -5.885 -3.053 1.00 . A A . 9 ASP CG 1 1 7 1852 1 1 9 ASP H H 0.872 -5.065 -0.218 1.00 . A A . 9 ASP H 1 1 7 1853 1 1 9 ASP HA H 0.618 -6.937 -2.432 1.00 . A A . 9 ASP HA 1 1 7 1854 1 1 9 ASP HB2 H -0.756 -4.564 -1.600 1.00 . A A . 9 ASP HB2 1 1 7 1855 1 1 9 ASP HB3 H -0.139 -4.314 -3.228 1.00 . A A . 9 ASP HB3 1 1 7 1856 1 1 9 ASP N N 1.090 -5.876 -0.721 1.00 . A A . 9 ASP N 1 1 7 1857 1 1 9 ASP O O 1.895 -5.094 -4.155 1.00 . A A . 9 ASP O 1 1 7 1858 1 1 9 ASP OD1 O -1.586 -6.097 -4.283 1.00 . A A . 9 ASP OD1 1 1 7 1859 1 1 9 ASP OD2 O -2.414 -6.319 -2.259 1.00 . A A . 9 ASP OD2 1 1 7 1860 1 1 10 DAL C C 4.777 -3.476 -2.613 1.00 . A A . 10 DAL C 1 1 7 1861 1 1 10 DAL CA C 4.421 -4.915 -2.999 1.00 . A A . 10 DAL CA 1 1 7 1862 1 1 10 DAL CB C 5.570 -5.846 -2.651 1.00 . A A . 10 DAL CB 1 1 7 1863 1 1 10 DAL H H 3.249 -5.637 -1.397 1.00 . A A . 10 DAL H 1 1 7 1864 1 1 10 DAL HA H 4.261 -4.964 -4.066 1.00 . A A . 10 DAL HA 1 1 7 1865 1 1 10 DAL HB1 H 5.785 -5.767 -1.596 1.00 . A A . 10 DAL HB1 1 1 7 1866 1 1 10 DAL HB2 H 6.444 -5.567 -3.220 1.00 . A A . 10 DAL HB2 1 1 7 1867 1 1 10 DAL HB3 H 5.295 -6.862 -2.888 1.00 . A A . 10 DAL HB3 1 1 7 1868 1 1 10 DAL N N 3.201 -5.367 -2.336 1.00 . A A . 10 DAL N 1 1 7 1869 1 1 10 DAL O O 5.811 -2.956 -3.037 1.00 . A A . 10 DAL O 1 1 7 1870 1 1 11 GLY C C 4.084 -0.484 -2.528 1.00 . A A . 11 GLY C 1 1 7 1871 1 1 11 GLY CA C 4.167 -1.471 -1.384 1.00 . A A . 11 GLY CA 1 1 7 1872 1 1 11 GLY H H 3.114 -3.299 -1.504 1.00 . A A . 11 GLY H 1 1 7 1873 1 1 11 GLY HA2 H 3.436 -1.198 -0.637 1.00 . A A . 11 GLY HA2 1 1 7 1874 1 1 11 GLY HA3 H 5.153 -1.415 -0.946 1.00 . A A . 11 GLY HA3 1 1 7 1875 1 1 11 GLY N N 3.920 -2.838 -1.810 1.00 . A A . 11 GLY N 1 1 7 1876 1 1 11 GLY O O 2.994 -0.045 -2.898 1.00 . A A . 11 GLY O 1 1 7 1877 1 1 12 TRP C C 5.358 0.097 -5.556 1.00 . A A . 12 TRP C 1 1 7 1878 1 1 12 TRP CA C 5.295 0.806 -4.201 1.00 . A A . 12 TRP CA 1 1 7 1879 1 1 12 TRP CB C 6.481 1.752 -4.017 1.00 . A A . 12 TRP CB 1 1 7 1880 1 1 12 TRP CD1 C 6.682 3.077 -1.840 1.00 . A A . 12 TRP CD1 1 1 7 1881 1 1 12 TRP CD2 C 5.181 3.900 -3.286 1.00 . A A . 12 TRP CD2 1 1 7 1882 1 1 12 TRP CE2 C 5.180 4.701 -2.131 1.00 . A A . 12 TRP CE2 1 1 7 1883 1 1 12 TRP CE3 C 4.315 4.230 -4.338 1.00 . A A . 12 TRP CE3 1 1 7 1884 1 1 12 TRP CG C 6.150 2.865 -3.078 1.00 . A A . 12 TRP CG 1 1 7 1885 1 1 12 TRP CH2 C 3.512 6.104 -3.035 1.00 . A A . 12 TRP CH2 1 1 7 1886 1 1 12 TRP CZ2 C 4.347 5.803 -1.993 1.00 . A A . 12 TRP CZ2 1 1 7 1887 1 1 12 TRP CZ3 C 3.493 5.329 -4.201 1.00 . A A . 12 TRP CZ3 1 1 7 1888 1 1 12 TRP H H 6.074 -0.524 -2.750 1.00 . A A . 12 TRP H 1 1 7 1889 1 1 12 TRP HA H 4.385 1.391 -4.169 1.00 . A A . 12 TRP HA 1 1 7 1890 1 1 12 TRP HB2 H 7.316 1.202 -3.608 1.00 . A A . 12 TRP HB2 1 1 7 1891 1 1 12 TRP HB3 H 6.760 2.178 -4.968 1.00 . A A . 12 TRP HB3 1 1 7 1892 1 1 12 TRP HD1 H 7.446 2.459 -1.391 1.00 . A A . 12 TRP HD1 1 1 7 1893 1 1 12 TRP HE1 H 6.320 4.538 -0.376 1.00 . A A . 12 TRP HE1 1 1 7 1894 1 1 12 TRP HE3 H 4.283 3.644 -5.245 1.00 . A A . 12 TRP HE3 1 1 7 1895 1 1 12 TRP HH2 H 2.850 6.956 -2.969 1.00 . A A . 12 TRP HH2 1 1 7 1896 1 1 12 TRP HZ2 H 4.344 6.399 -1.097 1.00 . A A . 12 TRP HZ2 1 1 7 1897 1 1 12 TRP HZ3 H 2.822 5.601 -5.005 1.00 . A A . 12 TRP HZ3 1 1 7 1898 1 1 12 TRP N N 5.239 -0.137 -3.091 1.00 . A A . 12 TRP N 1 1 7 1899 1 1 12 TRP NE1 N 6.104 4.180 -1.263 1.00 . A A . 12 TRP NE1 1 1 7 1900 1 1 12 TRP O O 5.511 0.746 -6.593 1.00 . A A . 12 TRP O 1 1 7 1901 1 1 13 ALA C C 3.841 -1.957 -7.443 1.00 . A A . 13 ALA C 1 1 7 1902 1 1 13 ALA CA C 5.214 -2.008 -6.782 1.00 . A A . 13 ALA CA 1 1 7 1903 1 1 13 ALA CB C 5.629 -3.446 -6.513 1.00 . A A . 13 ALA CB 1 1 7 1904 1 1 13 ALA H H 5.064 -1.695 -4.698 1.00 . A A . 13 ALA H 1 1 7 1905 1 1 13 ALA HA H 5.937 -1.567 -7.449 1.00 . A A . 13 ALA HA 1 1 7 1906 1 1 13 ALA HB1 H 5.991 -3.534 -5.500 1.00 . A A . 13 ALA HB1 1 1 7 1907 1 1 13 ALA HB2 H 6.412 -3.725 -7.201 1.00 . A A . 13 ALA HB2 1 1 7 1908 1 1 13 ALA HB3 H 4.779 -4.099 -6.650 1.00 . A A . 13 ALA HB3 1 1 7 1909 1 1 13 ALA N N 5.207 -1.231 -5.548 1.00 . A A . 13 ALA N 1 1 7 1910 1 1 13 ALA O O 3.730 -1.973 -8.670 1.00 . A A . 13 ALA O 1 1 7 1911 1 1 14 SER C C 1.222 -0.516 -7.927 1.00 . A A . 14 SER C 1 1 7 1912 1 1 14 SER CA C 1.423 -1.789 -7.101 1.00 . A A . 14 SER CA 1 1 7 1913 1 1 14 SER CB C 0.435 -1.822 -5.925 1.00 . A A . 14 SER CB 1 1 7 1914 1 1 14 SER H H 2.958 -1.848 -5.647 1.00 . A A . 14 SER H 1 1 7 1915 1 1 14 SER HA H 1.244 -2.642 -7.735 1.00 . A A . 14 SER HA 1 1 7 1916 1 1 14 SER HB2 H -0.470 -1.304 -6.202 1.00 . A A . 14 SER HB2 1 1 7 1917 1 1 14 SER HB3 H 0.199 -2.849 -5.685 1.00 . A A . 14 SER HB3 1 1 7 1918 1 1 14 SER HG H 1.292 -1.872 -4.157 1.00 . A A . 14 SER HG 1 1 7 1919 1 1 14 SER N N 2.797 -1.872 -6.613 1.00 . A A . 14 SER N 1 1 7 1920 1 1 14 SER O O 0.403 -0.490 -8.848 1.00 . A A . 14 SER O 1 1 7 1921 1 1 14 SER OG O 0.979 -1.199 -4.770 1.00 . A A . 14 SER OG 1 1 7 1922 1 1 15 DAL C C 1.052 2.829 -7.533 1.00 . A A . 15 DAL C 1 1 7 1923 1 1 15 DAL CA C 1.891 1.809 -8.305 1.00 . A A . 15 DAL CA 1 1 7 1924 1 1 15 DAL CB C 3.285 2.356 -8.568 1.00 . A A . 15 DAL CB 1 1 7 1925 1 1 15 DAL H H 2.613 0.449 -6.850 1.00 . A A . 15 DAL H 1 1 7 1926 1 1 15 DAL HA H 1.424 1.626 -9.260 1.00 . A A . 15 DAL HA 1 1 7 1927 1 1 15 DAL HB1 H 3.998 1.546 -8.549 1.00 . A A . 15 DAL HB1 1 1 7 1928 1 1 15 DAL HB2 H 3.538 3.078 -7.807 1.00 . A A . 15 DAL HB2 1 1 7 1929 1 1 15 DAL HB3 H 3.304 2.830 -9.537 1.00 . A A . 15 DAL HB3 1 1 7 1930 1 1 15 DAL N N 1.979 0.535 -7.594 1.00 . A A . 15 DAL N 1 1 7 1931 1 1 15 DAL O O 1.215 4.040 -7.705 1.00 . A A . 15 DAL O 1 1 7 1932 1 1 16 ARG C C -0.021 3.605 -4.583 1.00 . A A . 16 ARG C 1 1 7 1933 1 1 16 ARG CA C -0.715 3.193 -5.884 1.00 . A A . 16 ARG CA 1 1 7 1934 1 1 16 ARG CB C -2.036 2.461 -5.570 1.00 . A A . 16 ARG CB 1 1 7 1935 1 1 16 ARG CD C -2.998 0.389 -4.506 1.00 . A A . 16 ARG CD 1 1 7 1936 1 1 16 ARG CG C -1.935 1.480 -4.408 1.00 . A A . 16 ARG CG 1 1 7 1937 1 1 16 ARG CZ C -2.948 -1.122 -2.541 1.00 . A A . 16 ARG CZ 1 1 7 1938 1 1 16 ARG H H 0.072 1.358 -6.593 1.00 . A A . 16 ARG H 1 1 7 1939 1 1 16 ARG HA H -0.925 4.085 -6.461 1.00 . A A . 16 ARG HA 1 1 7 1940 1 1 16 ARG HB2 H -2.790 3.194 -5.326 1.00 . A A . 16 ARG HB2 1 1 7 1941 1 1 16 ARG HB3 H -2.357 1.905 -6.447 1.00 . A A . 16 ARG HB3 1 1 7 1942 1 1 16 ARG HD2 H -3.846 0.784 -5.046 1.00 . A A . 16 ARG HD2 1 1 7 1943 1 1 16 ARG HD3 H -2.592 -0.453 -5.049 1.00 . A A . 16 ARG HD3 1 1 7 1944 1 1 16 ARG HE H -4.175 0.442 -2.766 1.00 . A A . 16 ARG HE 1 1 7 1945 1 1 16 ARG HG2 H -0.953 1.023 -4.417 1.00 . A A . 16 ARG HG2 1 1 7 1946 1 1 16 ARG HG3 H -2.073 2.021 -3.482 1.00 . A A . 16 ARG HG3 1 1 7 1947 1 1 16 ARG HH11 H -1.568 -1.580 -3.953 1.00 . A A . 16 ARG HH11 1 1 7 1948 1 1 16 ARG HH12 H -1.585 -2.619 -2.570 1.00 . A A . 16 ARG HH12 1 1 7 1949 1 1 16 ARG HH21 H -4.187 -0.936 -0.950 1.00 . A A . 16 ARG HH21 1 1 7 1950 1 1 16 ARG HH22 H -3.071 -2.258 -0.870 1.00 . A A . 16 ARG HH22 1 1 7 1951 1 1 16 ARG N N 0.153 2.332 -6.684 1.00 . A A . 16 ARG N 1 1 7 1952 1 1 16 ARG NE N -3.450 -0.065 -3.189 1.00 . A A . 16 ARG NE 1 1 7 1953 1 1 16 ARG NH1 N -1.952 -1.832 -3.066 1.00 . A A . 16 ARG NH1 1 1 7 1954 1 1 16 ARG NH2 N -3.442 -1.467 -1.356 1.00 . A A . 16 ARG NH2 1 1 7 1955 1 1 16 ARG O O 0.850 2.888 -4.090 1.00 . A A . 16 ARG O 1 1 7 1956 1 1 17 PRO C C -0.456 4.650 -1.519 1.00 . A A . 17 PRO C 1 1 7 1957 1 1 17 PRO CA C 0.195 5.259 -2.762 1.00 . A A . 17 PRO CA 1 1 7 1958 1 1 17 PRO CB C -0.060 6.773 -2.807 1.00 . A A . 17 PRO CB 1 1 7 1959 1 1 17 PRO CD C -1.403 5.699 -4.512 1.00 . A A . 17 PRO CD 1 1 7 1960 1 1 17 PRO CG C -0.898 7.031 -4.025 1.00 . A A . 17 PRO CG 1 1 7 1961 1 1 17 PRO HA H 1.256 5.073 -2.727 1.00 . A A . 17 PRO HA 1 1 7 1962 1 1 17 PRO HB2 H -0.580 7.073 -1.909 1.00 . A A . 17 PRO HB2 1 1 7 1963 1 1 17 PRO HB3 H 0.888 7.291 -2.865 1.00 . A A . 17 PRO HB3 1 1 7 1964 1 1 17 PRO HD2 H -2.372 5.483 -4.095 1.00 . A A . 17 PRO HD2 1 1 7 1965 1 1 17 PRO HD3 H -1.441 5.685 -5.589 1.00 . A A . 17 PRO HD3 1 1 7 1966 1 1 17 PRO HG2 H -1.730 7.668 -3.765 1.00 . A A . 17 PRO HG2 1 1 7 1967 1 1 17 PRO HG3 H -0.294 7.503 -4.787 1.00 . A A . 17 PRO HG3 1 1 7 1968 1 1 17 PRO N N -0.393 4.767 -4.007 1.00 . A A . 17 PRO N 1 1 7 1969 1 1 17 PRO O O -1.507 4.011 -1.602 1.00 . A A . 17 PRO O 1 1 7 1970 1 1 18 PRO C C -1.677 4.892 1.341 1.00 . A A . 18 PRO C 1 1 7 1971 1 1 18 PRO CA C -0.324 4.309 0.931 1.00 . A A . 18 PRO CA 1 1 7 1972 1 1 18 PRO CB C 0.739 4.728 1.951 1.00 . A A . 18 PRO CB 1 1 7 1973 1 1 18 PRO CD C 1.440 5.579 -0.177 1.00 . A A . 18 PRO CD 1 1 7 1974 1 1 18 PRO CG C 1.513 5.823 1.301 1.00 . A A . 18 PRO CG 1 1 7 1975 1 1 18 PRO HA H -0.392 3.230 0.905 1.00 . A A . 18 PRO HA 1 1 7 1976 1 1 18 PRO HB2 H 0.252 5.077 2.846 1.00 . A A . 18 PRO HB2 1 1 7 1977 1 1 18 PRO HB3 H 1.366 3.886 2.188 1.00 . A A . 18 PRO HB3 1 1 7 1978 1 1 18 PRO HD2 H 1.410 6.518 -0.711 1.00 . A A . 18 PRO HD2 1 1 7 1979 1 1 18 PRO HD3 H 2.279 4.986 -0.504 1.00 . A A . 18 PRO HD3 1 1 7 1980 1 1 18 PRO HG2 H 1.071 6.778 1.544 1.00 . A A . 18 PRO HG2 1 1 7 1981 1 1 18 PRO HG3 H 2.540 5.791 1.634 1.00 . A A . 18 PRO HG3 1 1 7 1982 1 1 18 PRO N N 0.177 4.840 -0.345 1.00 . A A . 18 PRO N 1 1 7 1983 1 1 18 PRO O O -1.971 6.057 1.065 1.00 . A A . 18 PRO O 1 1 7 1984 1 1 19 PRO C C -3.753 5.321 3.781 1.00 . A A . 19 PRO C 1 1 7 1985 1 1 19 PRO CA C -3.825 4.512 2.487 1.00 . A A . 19 PRO CA 1 1 7 1986 1 1 19 PRO CB C -4.571 3.199 2.715 1.00 . A A . 19 PRO CB 1 1 7 1987 1 1 19 PRO CD C -2.226 2.688 2.391 1.00 . A A . 19 PRO CD 1 1 7 1988 1 1 19 PRO CG C -3.537 2.145 2.903 1.00 . A A . 19 PRO CG 1 1 7 1989 1 1 19 PRO HA H -4.338 5.092 1.734 1.00 . A A . 19 PRO HA 1 1 7 1990 1 1 19 PRO HB2 H -5.202 3.287 3.585 1.00 . A A . 19 PRO HB2 1 1 7 1991 1 1 19 PRO HB3 H -5.170 2.988 1.860 1.00 . A A . 19 PRO HB3 1 1 7 1992 1 1 19 PRO HD2 H -1.471 2.647 3.160 1.00 . A A . 19 PRO HD2 1 1 7 1993 1 1 19 PRO HD3 H -1.914 2.126 1.527 1.00 . A A . 19 PRO HD3 1 1 7 1994 1 1 19 PRO HG2 H -3.463 1.895 3.944 1.00 . A A . 19 PRO HG2 1 1 7 1995 1 1 19 PRO HG3 H -3.816 1.268 2.336 1.00 . A A . 19 PRO HG3 1 1 7 1996 1 1 19 PRO N N -2.512 4.083 2.022 1.00 . A A . 19 PRO N 1 1 7 1997 1 1 19 PRO O O -2.914 5.056 4.644 1.00 . A A . 19 PRO O 1 1 7 1998 1 1 20 SER C C -6.077 7.742 5.310 1.00 . A A . 20 SER C 1 1 7 1999 1 1 20 SER CA C -4.679 7.163 5.095 1.00 . A A . 20 SER CA 1 1 7 2000 1 1 20 SER CB C -3.655 8.296 4.974 1.00 . A A . 20 SER CB 1 1 7 2001 1 1 20 SER H H -5.280 6.470 3.183 1.00 . A A . 20 SER H 1 1 7 2002 1 1 20 SER HA H -4.424 6.551 5.948 1.00 . A A . 20 SER HA 1 1 7 2003 1 1 20 SER HB2 H -3.829 9.021 5.755 1.00 . A A . 20 SER HB2 1 1 7 2004 1 1 20 SER HB3 H -2.659 7.889 5.078 1.00 . A A . 20 SER HB3 1 1 7 2005 1 1 20 SER HG H -3.116 8.566 3.109 1.00 . A A . 20 SER HG 1 1 7 2006 1 1 20 SER N N -4.639 6.310 3.907 1.00 . A A . 20 SER N 1 1 7 2007 1 1 20 SER O O -6.605 7.606 6.434 1.00 . A A . 20 SER O 1 1 7 2008 1 1 20 SER OXT O -6.633 8.327 4.355 1.00 . A A . 20 SER OXT 1 1 7 2009 1 1 20 SER OG O -3.753 8.947 3.718 1.00 . A A . 20 SER OG 1 1 8 2010 1 1 1 ASP C C -6.540 -3.234 4.736 1.00 . A A . 1 ASP C 1 1 8 2011 1 1 1 ASP CA C -6.706 -4.267 5.850 1.00 . A A . 1 ASP CA 1 1 8 2012 1 1 1 ASP CB C -6.674 -5.686 5.269 1.00 . A A . 1 ASP CB 1 1 8 2013 1 1 1 ASP CG C -5.804 -6.625 6.082 1.00 . A A . 1 ASP CG 1 1 8 2014 1 1 1 ASP H1 H -8.040 -4.790 7.330 1.00 . A A . 1 ASP H1 1 1 8 2015 1 1 1 ASP H2 H -8.766 -4.200 5.891 1.00 . A A . 1 ASP H2 1 1 8 2016 1 1 1 ASP H3 H -7.991 -3.115 6.972 1.00 . A A . 1 ASP H3 1 1 8 2017 1 1 1 ASP HA H -5.896 -4.155 6.555 1.00 . A A . 1 ASP HA 1 1 8 2018 1 1 1 ASP HB2 H -7.678 -6.083 5.248 1.00 . A A . 1 ASP HB2 1 1 8 2019 1 1 1 ASP HB3 H -6.287 -5.647 4.261 1.00 . A A . 1 ASP HB3 1 1 8 2020 1 1 1 ASP N N -7.991 -4.076 6.576 1.00 . A A . 1 ASP N 1 1 8 2021 1 1 1 ASP O O -7.200 -3.314 3.698 1.00 . A A . 1 ASP O 1 1 8 2022 1 1 1 ASP OD1 O -6.331 -7.257 7.023 1.00 . A A . 1 ASP OD1 1 1 8 2023 1 1 1 ASP OD2 O -4.597 -6.729 5.778 1.00 . A A . 1 ASP OD2 1 1 8 2024 1 1 2 ALA C C -3.912 -0.852 3.942 1.00 . A A . 2 ALA C 1 1 8 2025 1 1 2 ALA CA C -5.395 -1.212 3.982 1.00 . A A . 2 ALA CA 1 1 8 2026 1 1 2 ALA CB C -6.233 0.017 4.294 1.00 . A A . 2 ALA CB 1 1 8 2027 1 1 2 ALA H H -5.160 -2.257 5.809 1.00 . A A . 2 ALA H 1 1 8 2028 1 1 2 ALA HA H -5.689 -1.582 3.010 1.00 . A A . 2 ALA HA 1 1 8 2029 1 1 2 ALA HB1 H -6.093 0.293 5.328 1.00 . A A . 2 ALA HB1 1 1 8 2030 1 1 2 ALA HB2 H -7.275 -0.204 4.117 1.00 . A A . 2 ALA HB2 1 1 8 2031 1 1 2 ALA HB3 H -5.925 0.833 3.658 1.00 . A A . 2 ALA HB3 1 1 8 2032 1 1 2 ALA N N -5.653 -2.265 4.961 1.00 . A A . 2 ALA N 1 1 8 2033 1 1 2 ALA O O -3.245 -1.067 2.930 1.00 . A A . 2 ALA O 1 1 8 2034 1 1 3 TYR C C -1.100 -1.167 5.108 1.00 . A A . 3 TYR C 1 1 8 2035 1 1 3 TYR CA C -1.992 0.072 5.137 1.00 . A A . 3 TYR CA 1 1 8 2036 1 1 3 TYR CB C -1.728 0.900 6.399 1.00 . A A . 3 TYR CB 1 1 8 2037 1 1 3 TYR CD1 C -0.751 3.161 5.807 1.00 . A A . 3 TYR CD1 1 1 8 2038 1 1 3 TYR CD2 C 0.722 1.466 6.615 1.00 . A A . 3 TYR CD2 1 1 8 2039 1 1 3 TYR CE1 C 0.313 4.037 5.702 1.00 . A A . 3 TYR CE1 1 1 8 2040 1 1 3 TYR CE2 C 1.789 2.337 6.508 1.00 . A A . 3 TYR CE2 1 1 8 2041 1 1 3 TYR CG C -0.564 1.859 6.266 1.00 . A A . 3 TYR CG 1 1 8 2042 1 1 3 TYR CZ C 1.580 3.621 6.052 1.00 . A A . 3 TYR CZ 1 1 8 2043 1 1 3 TYR H H -3.987 -0.165 5.824 1.00 . A A . 3 TYR H 1 1 8 2044 1 1 3 TYR HA H -1.762 0.672 4.272 1.00 . A A . 3 TYR HA 1 1 8 2045 1 1 3 TYR HB2 H -2.607 1.481 6.632 1.00 . A A . 3 TYR HB2 1 1 8 2046 1 1 3 TYR HB3 H -1.516 0.232 7.222 1.00 . A A . 3 TYR HB3 1 1 8 2047 1 1 3 TYR HD1 H -1.745 3.488 5.522 1.00 . A A . 3 TYR HD1 1 1 8 2048 1 1 3 TYR HD2 H 0.885 0.459 6.971 1.00 . A A . 3 TYR HD2 1 1 8 2049 1 1 3 TYR HE1 H 0.149 5.044 5.352 1.00 . A A . 3 TYR HE1 1 1 8 2050 1 1 3 TYR HE2 H 2.782 2.010 6.781 1.00 . A A . 3 TYR HE2 1 1 8 2051 1 1 3 TYR HH H 2.752 4.963 6.777 1.00 . A A . 3 TYR HH 1 1 8 2052 1 1 3 TYR N N -3.402 -0.308 5.049 1.00 . A A . 3 TYR N 1 1 8 2053 1 1 3 TYR O O -0.165 -1.244 4.310 1.00 . A A . 3 TYR O 1 1 8 2054 1 1 3 TYR OH O 2.640 4.492 5.947 1.00 . A A . 3 TYR OH 1 1 8 2055 1 1 4 ALA C C -0.848 -4.174 4.705 1.00 . A A . 4 ALA C 1 1 8 2056 1 1 4 ALA CA C -0.652 -3.393 6.003 1.00 . A A . 4 ALA CA 1 1 8 2057 1 1 4 ALA CB C -1.069 -4.233 7.202 1.00 . A A . 4 ALA CB 1 1 8 2058 1 1 4 ALA H H -2.179 -2.038 6.559 1.00 . A A . 4 ALA H 1 1 8 2059 1 1 4 ALA HA H 0.396 -3.144 6.108 1.00 . A A . 4 ALA HA 1 1 8 2060 1 1 4 ALA HB1 H -0.553 -5.181 7.175 1.00 . A A . 4 ALA HB1 1 1 8 2061 1 1 4 ALA HB2 H -2.136 -4.403 7.170 1.00 . A A . 4 ALA HB2 1 1 8 2062 1 1 4 ALA HB3 H -0.815 -3.711 8.113 1.00 . A A . 4 ALA HB3 1 1 8 2063 1 1 4 ALA N N -1.411 -2.147 5.961 1.00 . A A . 4 ALA N 1 1 8 2064 1 1 4 ALA O O 0.070 -4.846 4.232 1.00 . A A . 4 ALA O 1 1 8 2065 1 1 5 GLN C C -1.571 -4.100 1.720 1.00 . A A . 5 GLN C 1 1 8 2066 1 1 5 GLN CA C -2.362 -4.732 2.866 1.00 . A A . 5 GLN CA 1 1 8 2067 1 1 5 GLN CB C -3.866 -4.652 2.585 1.00 . A A . 5 GLN CB 1 1 8 2068 1 1 5 GLN CD C -4.137 -6.843 1.347 1.00 . A A . 5 GLN CD 1 1 8 2069 1 1 5 GLN CG C -4.283 -5.332 1.293 1.00 . A A . 5 GLN CG 1 1 8 2070 1 1 5 GLN H H -2.734 -3.494 4.536 1.00 . A A . 5 GLN H 1 1 8 2071 1 1 5 GLN HA H -2.073 -5.768 2.961 1.00 . A A . 5 GLN HA 1 1 8 2072 1 1 5 GLN HB2 H -4.397 -5.120 3.400 1.00 . A A . 5 GLN HB2 1 1 8 2073 1 1 5 GLN HB3 H -4.156 -3.613 2.530 1.00 . A A . 5 GLN HB3 1 1 8 2074 1 1 5 GLN HE21 H -3.384 -6.868 -0.496 1.00 . A A . 5 GLN HE21 1 1 8 2075 1 1 5 GLN HE22 H -3.529 -8.406 0.278 1.00 . A A . 5 GLN HE22 1 1 8 2076 1 1 5 GLN HG2 H -5.316 -5.092 1.091 1.00 . A A . 5 GLN HG2 1 1 8 2077 1 1 5 GLN HG3 H -3.665 -4.953 0.494 1.00 . A A . 5 GLN HG3 1 1 8 2078 1 1 5 GLN N N -2.048 -4.060 4.121 1.00 . A A . 5 GLN N 1 1 8 2079 1 1 5 GLN NE2 N -3.632 -7.432 0.268 1.00 . A A . 5 GLN NE2 1 1 8 2080 1 1 5 GLN O O -1.096 -4.800 0.825 1.00 . A A . 5 GLN O 1 1 8 2081 1 1 5 GLN OE1 O -4.475 -7.475 2.349 1.00 . A A . 5 GLN OE1 1 1 8 2082 1 1 6 TRP C C 0.778 -2.483 0.730 1.00 . A A . 6 TRP C 1 1 8 2083 1 1 6 TRP CA C -0.676 -2.029 0.757 1.00 . A A . 6 TRP CA 1 1 8 2084 1 1 6 TRP CB C -0.743 -0.526 1.047 1.00 . A A . 6 TRP CB 1 1 8 2085 1 1 6 TRP CD1 C -0.335 0.595 -1.213 1.00 . A A . 6 TRP CD1 1 1 8 2086 1 1 6 TRP CD2 C 1.276 0.973 0.293 1.00 . A A . 6 TRP CD2 1 1 8 2087 1 1 6 TRP CE2 C 1.611 1.637 -0.900 1.00 . A A . 6 TRP CE2 1 1 8 2088 1 1 6 TRP CE3 C 2.145 1.071 1.385 1.00 . A A . 6 TRP CE3 1 1 8 2089 1 1 6 TRP CG C 0.023 0.310 0.069 1.00 . A A . 6 TRP CG 1 1 8 2090 1 1 6 TRP CH2 C 3.606 2.473 0.043 1.00 . A A . 6 TRP CH2 1 1 8 2091 1 1 6 TRP CZ2 C 2.774 2.389 -1.037 1.00 . A A . 6 TRP CZ2 1 1 8 2092 1 1 6 TRP CZ3 C 3.302 1.822 1.249 1.00 . A A . 6 TRP CZ3 1 1 8 2093 1 1 6 TRP H H -1.818 -2.279 2.520 1.00 . A A . 6 TRP H 1 1 8 2094 1 1 6 TRP HA H -1.125 -2.227 -0.204 1.00 . A A . 6 TRP HA 1 1 8 2095 1 1 6 TRP HB2 H -1.771 -0.208 1.021 1.00 . A A . 6 TRP HB2 1 1 8 2096 1 1 6 TRP HB3 H -0.340 -0.337 2.030 1.00 . A A . 6 TRP HB3 1 1 8 2097 1 1 6 TRP HD1 H -1.237 0.239 -1.685 1.00 . A A . 6 TRP HD1 1 1 8 2098 1 1 6 TRP HE1 H 0.581 1.721 -2.720 1.00 . A A . 6 TRP HE1 1 1 8 2099 1 1 6 TRP HE3 H 1.928 0.573 2.320 1.00 . A A . 6 TRP HE3 1 1 8 2100 1 1 6 TRP HH2 H 4.515 3.055 -0.019 1.00 . A A . 6 TRP HH2 1 1 8 2101 1 1 6 TRP HZ2 H 3.025 2.891 -1.961 1.00 . A A . 6 TRP HZ2 1 1 8 2102 1 1 6 TRP HZ3 H 3.988 1.909 2.080 1.00 . A A . 6 TRP HZ3 1 1 8 2103 1 1 6 TRP N N -1.422 -2.772 1.771 1.00 . A A . 6 TRP N 1 1 8 2104 1 1 6 TRP NE1 N 0.614 1.386 -1.802 1.00 . A A . 6 TRP NE1 1 1 8 2105 1 1 6 TRP O O 1.327 -2.780 -0.332 1.00 . A A . 6 TRP O 1 1 8 2106 1 1 7 LEU C C 2.944 -4.418 1.615 1.00 . A A . 7 LEU C 1 1 8 2107 1 1 7 LEU CA C 2.777 -2.961 2.049 1.00 . A A . 7 LEU CA 1 1 8 2108 1 1 7 LEU CB C 3.242 -2.776 3.497 1.00 . A A . 7 LEU CB 1 1 8 2109 1 1 7 LEU CD1 C 3.282 -1.289 5.519 1.00 . A A . 7 LEU CD1 1 1 8 2110 1 1 7 LEU CD2 C 4.387 -0.539 3.403 1.00 . A A . 7 LEU CD2 1 1 8 2111 1 1 7 LEU CG C 3.229 -1.328 4.000 1.00 . A A . 7 LEU CG 1 1 8 2112 1 1 7 LEU H H 0.885 -2.290 2.719 1.00 . A A . 7 LEU H 1 1 8 2113 1 1 7 LEU HA H 3.378 -2.336 1.405 1.00 . A A . 7 LEU HA 1 1 8 2114 1 1 7 LEU HB2 H 2.598 -3.363 4.136 1.00 . A A . 7 LEU HB2 1 1 8 2115 1 1 7 LEU HB3 H 4.248 -3.156 3.584 1.00 . A A . 7 LEU HB3 1 1 8 2116 1 1 7 LEU HD11 H 3.023 -0.298 5.862 1.00 . A A . 7 LEU HD11 1 1 8 2117 1 1 7 LEU HD12 H 4.280 -1.536 5.851 1.00 . A A . 7 LEU HD12 1 1 8 2118 1 1 7 LEU HD13 H 2.581 -2.005 5.922 1.00 . A A . 7 LEU HD13 1 1 8 2119 1 1 7 LEU HD21 H 4.437 0.434 3.870 1.00 . A A . 7 LEU HD21 1 1 8 2120 1 1 7 LEU HD22 H 4.232 -0.420 2.340 1.00 . A A . 7 LEU HD22 1 1 8 2121 1 1 7 LEU HD23 H 5.312 -1.069 3.575 1.00 . A A . 7 LEU HD23 1 1 8 2122 1 1 7 LEU HG H 2.308 -0.857 3.689 1.00 . A A . 7 LEU HG 1 1 8 2123 1 1 7 LEU N N 1.388 -2.537 1.913 1.00 . A A . 7 LEU N 1 1 8 2124 1 1 7 LEU O O 3.955 -4.781 1.011 1.00 . A A . 7 LEU O 1 1 8 2125 1 1 8 ALA C C 1.694 -6.854 0.046 1.00 . A A . 8 ALA C 1 1 8 2126 1 1 8 ALA CA C 1.958 -6.658 1.544 1.00 . A A . 8 ALA CA 1 1 8 2127 1 1 8 ALA CB C 0.938 -7.435 2.365 1.00 . A A . 8 ALA CB 1 1 8 2128 1 1 8 ALA H H 1.155 -4.888 2.387 1.00 . A A . 8 ALA H 1 1 8 2129 1 1 8 ALA HA H 2.939 -7.046 1.777 1.00 . A A . 8 ALA HA 1 1 8 2130 1 1 8 ALA HB1 H 0.956 -7.085 3.387 1.00 . A A . 8 ALA HB1 1 1 8 2131 1 1 8 ALA HB2 H 1.183 -8.487 2.342 1.00 . A A . 8 ALA HB2 1 1 8 2132 1 1 8 ALA HB3 H -0.048 -7.286 1.951 1.00 . A A . 8 ALA HB3 1 1 8 2133 1 1 8 ALA N N 1.936 -5.243 1.914 1.00 . A A . 8 ALA N 1 1 8 2134 1 1 8 ALA O O 2.012 -7.907 -0.511 1.00 . A A . 8 ALA O 1 1 8 2135 1 1 9 ASP C C 2.010 -5.433 -2.887 1.00 . A A . 9 ASP C 1 1 8 2136 1 1 9 ASP CA C 0.819 -5.899 -2.037 1.00 . A A . 9 ASP CA 1 1 8 2137 1 1 9 ASP CB C -0.415 -5.048 -2.364 1.00 . A A . 9 ASP CB 1 1 8 2138 1 1 9 ASP CG C -1.499 -5.845 -3.064 1.00 . A A . 9 ASP CG 1 1 8 2139 1 1 9 ASP H H 0.891 -5.021 -0.110 1.00 . A A . 9 ASP H 1 1 8 2140 1 1 9 ASP HA H 0.606 -6.929 -2.281 1.00 . A A . 9 ASP HA 1 1 8 2141 1 1 9 ASP HB2 H -0.825 -4.648 -1.449 1.00 . A A . 9 ASP HB2 1 1 8 2142 1 1 9 ASP HB3 H -0.123 -4.231 -3.008 1.00 . A A . 9 ASP HB3 1 1 8 2143 1 1 9 ASP N N 1.118 -5.835 -0.604 1.00 . A A . 9 ASP N 1 1 8 2144 1 1 9 ASP O O 1.855 -5.155 -4.078 1.00 . A A . 9 ASP O 1 1 8 2145 1 1 9 ASP OD1 O -1.431 -5.976 -4.304 1.00 . A A . 9 ASP OD1 1 1 8 2146 1 1 9 ASP OD2 O -2.414 -6.338 -2.372 1.00 . A A . 9 ASP OD2 1 1 8 2147 1 1 10 DAL C C 4.782 -3.479 -2.619 1.00 . A A . 10 DAL C 1 1 8 2148 1 1 10 DAL CA C 4.401 -4.919 -2.975 1.00 . A A . 10 DAL CA 1 1 8 2149 1 1 10 DAL CB C 5.551 -5.856 -2.647 1.00 . A A . 10 DAL CB 1 1 8 2150 1 1 10 DAL H H 3.261 -5.582 -1.325 1.00 . A A . 10 DAL H 1 1 8 2151 1 1 10 DAL HA H 4.211 -4.979 -4.037 1.00 . A A . 10 DAL HA 1 1 8 2152 1 1 10 DAL HB1 H 6.408 -5.601 -3.252 1.00 . A A . 10 DAL HB1 1 1 8 2153 1 1 10 DAL HB2 H 5.255 -6.874 -2.851 1.00 . A A . 10 DAL HB2 1 1 8 2154 1 1 10 DAL HB3 H 5.804 -5.756 -1.602 1.00 . A A . 10 DAL HB3 1 1 8 2155 1 1 10 DAL N N 3.195 -5.350 -2.273 1.00 . A A . 10 DAL N 1 1 8 2156 1 1 10 DAL O O 5.814 -2.979 -3.071 1.00 . A A . 10 DAL O 1 1 8 2157 1 1 11 GLY C C 4.127 -0.480 -2.569 1.00 . A A . 11 GLY C 1 1 8 2158 1 1 11 GLY CA C 4.220 -1.449 -1.409 1.00 . A A . 11 GLY CA 1 1 8 2159 1 1 11 GLY H H 3.144 -3.266 -1.480 1.00 . A A . 11 GLY H 1 1 8 2160 1 1 11 GLY HA2 H 3.506 -1.156 -0.653 1.00 . A A . 11 GLY HA2 1 1 8 2161 1 1 11 GLY HA3 H 5.214 -1.398 -0.990 1.00 . A A . 11 GLY HA3 1 1 8 2162 1 1 11 GLY N N 3.949 -2.819 -1.809 1.00 . A A . 11 GLY N 1 1 8 2163 1 1 11 GLY O O 3.034 -0.045 -2.933 1.00 . A A . 11 GLY O 1 1 8 2164 1 1 12 TRP C C 5.378 0.053 -5.621 1.00 . A A . 12 TRP C 1 1 8 2165 1 1 12 TRP CA C 5.318 0.784 -4.277 1.00 . A A . 12 TRP CA 1 1 8 2166 1 1 12 TRP CB C 6.495 1.744 -4.115 1.00 . A A . 12 TRP CB 1 1 8 2167 1 1 12 TRP CD1 C 6.688 3.137 -1.979 1.00 . A A . 12 TRP CD1 1 1 8 2168 1 1 12 TRP CD2 C 5.154 3.879 -3.433 1.00 . A A . 12 TRP CD2 1 1 8 2169 1 1 12 TRP CE2 C 5.143 4.714 -2.303 1.00 . A A . 12 TRP CE2 1 1 8 2170 1 1 12 TRP CE3 C 4.272 4.155 -4.486 1.00 . A A . 12 TRP CE3 1 1 8 2171 1 1 12 TRP CG C 6.149 2.876 -3.205 1.00 . A A . 12 TRP CG 1 1 8 2172 1 1 12 TRP CH2 C 3.432 6.047 -3.232 1.00 . A A . 12 TRP CH2 1 1 8 2173 1 1 12 TRP CZ2 C 4.284 5.798 -2.190 1.00 . A A . 12 TRP CZ2 1 1 8 2174 1 1 12 TRP CZ3 C 3.423 5.237 -4.375 1.00 . A A . 12 TRP CZ3 1 1 8 2175 1 1 12 TRP H H 6.114 -0.525 -2.815 1.00 . A A . 12 TRP H 1 1 8 2176 1 1 12 TRP HA H 4.403 1.360 -4.249 1.00 . A A . 12 TRP HA 1 1 8 2177 1 1 12 TRP HB2 H 7.334 1.213 -3.690 1.00 . A A . 12 TRP HB2 1 1 8 2178 1 1 12 TRP HB3 H 6.773 2.150 -5.076 1.00 . A A . 12 TRP HB3 1 1 8 2179 1 1 12 TRP HD1 H 7.471 2.552 -1.520 1.00 . A A . 12 TRP HD1 1 1 8 2180 1 1 12 TRP HE1 H 6.302 4.631 -0.555 1.00 . A A . 12 TRP HE1 1 1 8 2181 1 1 12 TRP HE3 H 4.248 3.542 -5.375 1.00 . A A . 12 TRP HE3 1 1 8 2182 1 1 12 TRP HH2 H 2.750 6.884 -3.186 1.00 . A A . 12 TRP HH2 1 1 8 2183 1 1 12 TRP HZ2 H 4.272 6.421 -1.312 1.00 . A A . 12 TRP HZ2 1 1 8 2184 1 1 12 TRP HZ3 H 2.739 5.468 -5.181 1.00 . A A . 12 TRP HZ3 1 1 8 2185 1 1 12 TRP N N 5.276 -0.142 -3.151 1.00 . A A . 12 TRP N 1 1 8 2186 1 1 12 TRP NE1 N 6.088 4.242 -1.429 1.00 . A A . 12 TRP NE1 1 1 8 2187 1 1 12 TRP O O 5.587 0.677 -6.663 1.00 . A A . 12 TRP O 1 1 8 2188 1 1 13 ALA C C 3.767 -2.033 -7.454 1.00 . A A . 13 ALA C 1 1 8 2189 1 1 13 ALA CA C 5.152 -2.062 -6.816 1.00 . A A . 13 ALA CA 1 1 8 2190 1 1 13 ALA CB C 5.580 -3.493 -6.528 1.00 . A A . 13 ALA CB 1 1 8 2191 1 1 13 ALA H H 4.970 -1.706 -4.743 1.00 . A A . 13 ALA H 1 1 8 2192 1 1 13 ALA HA H 5.861 -1.628 -7.503 1.00 . A A . 13 ALA HA 1 1 8 2193 1 1 13 ALA HB1 H 4.819 -4.175 -6.878 1.00 . A A . 13 ALA HB1 1 1 8 2194 1 1 13 ALA HB2 H 5.716 -3.621 -5.464 1.00 . A A . 13 ALA HB2 1 1 8 2195 1 1 13 ALA HB3 H 6.508 -3.696 -7.038 1.00 . A A . 13 ALA HB3 1 1 8 2196 1 1 13 ALA N N 5.158 -1.265 -5.597 1.00 . A A . 13 ALA N 1 1 8 2197 1 1 13 ALA O O 3.635 -2.083 -8.678 1.00 . A A . 13 ALA O 1 1 8 2198 1 1 14 SER C C 1.120 -0.608 -7.913 1.00 . A A . 14 SER C 1 1 8 2199 1 1 14 SER CA C 1.355 -1.866 -7.072 1.00 . A A . 14 SER CA 1 1 8 2200 1 1 14 SER CB C 0.389 -1.897 -5.877 1.00 . A A . 14 SER CB 1 1 8 2201 1 1 14 SER H H 2.914 -1.880 -5.646 1.00 . A A . 14 SER H 1 1 8 2202 1 1 14 SER HA H 1.175 -2.730 -7.690 1.00 . A A . 14 SER HA 1 1 8 2203 1 1 14 SER HB2 H -0.536 -1.412 -6.150 1.00 . A A . 14 SER HB2 1 1 8 2204 1 1 14 SER HB3 H 0.188 -2.925 -5.607 1.00 . A A . 14 SER HB3 1 1 8 2205 1 1 14 SER HG H 1.280 -1.877 -4.125 1.00 . A A . 14 SER HG 1 1 8 2206 1 1 14 SER N N 2.737 -1.929 -6.608 1.00 . A A . 14 SER N 1 1 8 2207 1 1 14 SER O O 0.273 -0.603 -8.807 1.00 . A A . 14 SER O 1 1 8 2208 1 1 14 SER OG O 0.936 -1.229 -4.749 1.00 . A A . 14 SER OG 1 1 8 2209 1 1 15 DAL C C 0.911 2.736 -7.591 1.00 . A A . 15 DAL C 1 1 8 2210 1 1 15 DAL CA C 1.757 1.715 -8.357 1.00 . A A . 15 DAL CA 1 1 8 2211 1 1 15 DAL CB C 3.137 2.282 -8.656 1.00 . A A . 15 DAL CB 1 1 8 2212 1 1 15 DAL H H 2.540 0.389 -6.900 1.00 . A A . 15 DAL H 1 1 8 2213 1 1 15 DAL HA H 1.276 1.503 -9.299 1.00 . A A . 15 DAL HA 1 1 8 2214 1 1 15 DAL HB1 H 3.242 2.421 -9.721 1.00 . A A . 15 DAL HB1 1 1 8 2215 1 1 15 DAL HB2 H 3.893 1.594 -8.306 1.00 . A A . 15 DAL HB2 1 1 8 2216 1 1 15 DAL HB3 H 3.255 3.231 -8.155 1.00 . A A . 15 DAL HB3 1 1 8 2217 1 1 15 DAL N N 1.880 0.455 -7.623 1.00 . A A . 15 DAL N 1 1 8 2218 1 1 15 DAL O O 1.037 3.945 -7.801 1.00 . A A . 15 DAL O 1 1 8 2219 1 1 16 ARG C C -0.101 3.568 -4.636 1.00 . A A . 16 ARG C 1 1 8 2220 1 1 16 ARG CA C -0.821 3.104 -5.904 1.00 . A A . 16 ARG CA 1 1 8 2221 1 1 16 ARG CB C -2.112 2.347 -5.526 1.00 . A A . 16 ARG CB 1 1 8 2222 1 1 16 ARG CD C -2.814 0.141 -4.533 1.00 . A A . 16 ARG CD 1 1 8 2223 1 1 16 ARG CG C -1.931 1.370 -4.369 1.00 . A A . 16 ARG CG 1 1 8 2224 1 1 16 ARG CZ C -3.406 -0.581 -2.237 1.00 . A A . 16 ARG CZ 1 1 8 2225 1 1 16 ARG H H -0.007 1.270 -6.582 1.00 . A A . 16 ARG H 1 1 8 2226 1 1 16 ARG HA H -1.072 3.974 -6.499 1.00 . A A . 16 ARG HA 1 1 8 2227 1 1 16 ARG HB2 H -2.867 3.066 -5.245 1.00 . A A . 16 ARG HB2 1 1 8 2228 1 1 16 ARG HB3 H -2.464 1.784 -6.385 1.00 . A A . 16 ARG HB3 1 1 8 2229 1 1 16 ARG HD2 H -3.837 0.462 -4.659 1.00 . A A . 16 ARG HD2 1 1 8 2230 1 1 16 ARG HD3 H -2.496 -0.394 -5.415 1.00 . A A . 16 ARG HD3 1 1 8 2231 1 1 16 ARG HE H -2.160 -1.548 -3.467 1.00 . A A . 16 ARG HE 1 1 8 2232 1 1 16 ARG HG2 H -0.897 1.055 -4.337 1.00 . A A . 16 ARG HG2 1 1 8 2233 1 1 16 ARG HG3 H -2.187 1.868 -3.446 1.00 . A A . 16 ARG HG3 1 1 8 2234 1 1 16 ARG HH11 H -4.287 1.156 -2.799 1.00 . A A . 16 ARG HH11 1 1 8 2235 1 1 16 ARG HH12 H -4.686 0.604 -1.208 1.00 . A A . 16 ARG HH12 1 1 8 2236 1 1 16 ARG HH21 H -2.699 -2.270 -1.374 1.00 . A A . 16 ARG HH21 1 1 8 2237 1 1 16 ARG HH22 H -3.784 -1.338 -0.398 1.00 . A A . 16 ARG HH22 1 1 8 2238 1 1 16 ARG N N 0.048 2.241 -6.704 1.00 . A A . 16 ARG N 1 1 8 2239 1 1 16 ARG NE N -2.736 -0.760 -3.381 1.00 . A A . 16 ARG NE 1 1 8 2240 1 1 16 ARG NH1 N -4.191 0.481 -2.069 1.00 . A A . 16 ARG NH1 1 1 8 2241 1 1 16 ARG NH2 N -3.287 -1.469 -1.256 1.00 . A A . 16 ARG NH2 1 1 8 2242 1 1 16 ARG O O 0.794 2.882 -4.142 1.00 . A A . 16 ARG O 1 1 8 2243 1 1 17 PRO C C -0.486 4.691 -1.597 1.00 . A A . 17 PRO C 1 1 8 2244 1 1 17 PRO CA C 0.127 5.278 -2.868 1.00 . A A . 17 PRO CA 1 1 8 2245 1 1 17 PRO CB C -0.162 6.784 -2.944 1.00 . A A . 17 PRO CB 1 1 8 2246 1 1 17 PRO CD C -1.521 5.638 -4.588 1.00 . A A . 17 PRO CD 1 1 8 2247 1 1 17 PRO CG C -1.029 6.992 -4.151 1.00 . A A . 17 PRO CG 1 1 8 2248 1 1 17 PRO HA H 1.192 5.115 -2.851 1.00 . A A . 17 PRO HA 1 1 8 2249 1 1 17 PRO HB2 H -0.672 7.094 -2.043 1.00 . A A . 17 PRO HB2 1 1 8 2250 1 1 17 PRO HB3 H 0.773 7.321 -3.032 1.00 . A A . 17 PRO HB3 1 1 8 2251 1 1 17 PRO HD2 H -2.475 5.414 -4.139 1.00 . A A . 17 PRO HD2 1 1 8 2252 1 1 17 PRO HD3 H -1.586 5.593 -5.663 1.00 . A A . 17 PRO HD3 1 1 8 2253 1 1 17 PRO HG2 H -1.866 7.623 -3.892 1.00 . A A . 17 PRO HG2 1 1 8 2254 1 1 17 PRO HG3 H -0.449 7.450 -4.939 1.00 . A A . 17 PRO HG3 1 1 8 2255 1 1 17 PRO N N -0.480 4.740 -4.084 1.00 . A A . 17 PRO N 1 1 8 2256 1 1 17 PRO O O -1.543 4.058 -1.639 1.00 . A A . 17 PRO O 1 1 8 2257 1 1 18 PRO C C -1.619 4.989 1.288 1.00 . A A . 18 PRO C 1 1 8 2258 1 1 18 PRO CA C -0.285 4.385 0.850 1.00 . A A . 18 PRO CA 1 1 8 2259 1 1 18 PRO CB C 0.809 4.807 1.834 1.00 . A A . 18 PRO CB 1 1 8 2260 1 1 18 PRO CD C 1.455 5.629 -0.323 1.00 . A A . 18 PRO CD 1 1 8 2261 1 1 18 PRO CG C 1.576 5.887 1.150 1.00 . A A . 18 PRO CG 1 1 8 2262 1 1 18 PRO HA H -0.366 3.306 0.839 1.00 . A A . 18 PRO HA 1 1 8 2263 1 1 18 PRO HB2 H 0.349 5.173 2.737 1.00 . A A . 18 PRO HB2 1 1 8 2264 1 1 18 PRO HB3 H 1.433 3.964 2.066 1.00 . A A . 18 PRO HB3 1 1 8 2265 1 1 18 PRO HD2 H 1.414 6.562 -0.866 1.00 . A A . 18 PRO HD2 1 1 8 2266 1 1 18 PRO HD3 H 2.281 5.027 -0.669 1.00 . A A . 18 PRO HD3 1 1 8 2267 1 1 18 PRO HG2 H 1.152 6.849 1.395 1.00 . A A . 18 PRO HG2 1 1 8 2268 1 1 18 PRO HG3 H 2.612 5.846 1.452 1.00 . A A . 18 PRO HG3 1 1 8 2269 1 1 18 PRO N N 0.183 4.894 -0.445 1.00 . A A . 18 PRO N 1 1 8 2270 1 1 18 PRO O O -1.902 6.157 1.014 1.00 . A A . 18 PRO O 1 1 8 2271 1 1 19 PRO C C -3.624 5.469 3.771 1.00 . A A . 19 PRO C 1 1 8 2272 1 1 19 PRO CA C -3.743 4.654 2.484 1.00 . A A . 19 PRO CA 1 1 8 2273 1 1 19 PRO CB C -4.508 3.356 2.734 1.00 . A A . 19 PRO CB 1 1 8 2274 1 1 19 PRO CD C -2.180 2.800 2.363 1.00 . A A . 19 PRO CD 1 1 8 2275 1 1 19 PRO CG C -3.487 2.286 2.911 1.00 . A A . 19 PRO CG 1 1 8 2276 1 1 19 PRO HA H -4.261 5.241 1.739 1.00 . A A . 19 PRO HA 1 1 8 2277 1 1 19 PRO HB2 H -5.124 3.460 3.613 1.00 . A A . 19 PRO HB2 1 1 8 2278 1 1 19 PRO HB3 H -5.124 3.150 1.889 1.00 . A A . 19 PRO HB3 1 1 8 2279 1 1 19 PRO HD2 H -1.407 2.750 3.114 1.00 . A A . 19 PRO HD2 1 1 8 2280 1 1 19 PRO HD3 H -1.899 2.226 1.495 1.00 . A A . 19 PRO HD3 1 1 8 2281 1 1 19 PRO HG2 H -3.392 2.046 3.954 1.00 . A A . 19 PRO HG2 1 1 8 2282 1 1 19 PRO HG3 H -3.794 1.407 2.362 1.00 . A A . 19 PRO HG3 1 1 8 2283 1 1 19 PRO N N -2.450 4.198 1.991 1.00 . A A . 19 PRO N 1 1 8 2284 1 1 19 PRO O O -2.719 5.247 4.577 1.00 . A A . 19 PRO O 1 1 8 2285 1 1 20 SER C C -5.306 6.597 6.293 1.00 . A A . 20 SER C 1 1 8 2286 1 1 20 SER CA C -4.547 7.264 5.147 1.00 . A A . 20 SER CA 1 1 8 2287 1 1 20 SER CB C -5.166 8.630 4.829 1.00 . A A . 20 SER CB 1 1 8 2288 1 1 20 SER H H -5.242 6.543 3.279 1.00 . A A . 20 SER H 1 1 8 2289 1 1 20 SER HA H -3.520 7.409 5.450 1.00 . A A . 20 SER HA 1 1 8 2290 1 1 20 SER HB2 H -5.302 9.184 5.747 1.00 . A A . 20 SER HB2 1 1 8 2291 1 1 20 SER HB3 H -4.504 9.178 4.174 1.00 . A A . 20 SER HB3 1 1 8 2292 1 1 20 SER HG H -6.345 8.728 3.267 1.00 . A A . 20 SER HG 1 1 8 2293 1 1 20 SER N N -4.545 6.414 3.957 1.00 . A A . 20 SER N 1 1 8 2294 1 1 20 SER O O -4.737 6.500 7.400 1.00 . A A . 20 SER O 1 1 8 2295 1 1 20 SER OXT O -6.464 6.179 6.075 1.00 . A A . 20 SER OXT 1 1 8 2296 1 1 20 SER OG O -6.425 8.487 4.193 1.00 . A A . 20 SER OG 1 1 9 2297 1 1 1 ASP C C -6.318 -3.385 4.709 1.00 . A A . 1 ASP C 1 1 9 2298 1 1 1 ASP CA C -6.526 -4.385 5.846 1.00 . A A . 1 ASP CA 1 1 9 2299 1 1 1 ASP CB C -6.055 -5.782 5.423 1.00 . A A . 1 ASP CB 1 1 9 2300 1 1 1 ASP CG C -4.801 -6.217 6.157 1.00 . A A . 1 ASP CG 1 1 9 2301 1 1 1 ASP H1 H -8.499 -4.800 5.416 1.00 . A A . 1 ASP H1 1 1 9 2302 1 1 1 ASP H2 H -8.264 -3.511 6.524 1.00 . A A . 1 ASP H2 1 1 9 2303 1 1 1 ASP H3 H -8.035 -5.134 7.032 1.00 . A A . 1 ASP H3 1 1 9 2304 1 1 1 ASP HA H -5.955 -4.064 6.705 1.00 . A A . 1 ASP HA 1 1 9 2305 1 1 1 ASP HB2 H -6.837 -6.497 5.631 1.00 . A A . 1 ASP HB2 1 1 9 2306 1 1 1 ASP HB3 H -5.849 -5.780 4.363 1.00 . A A . 1 ASP HB3 1 1 9 2307 1 1 1 ASP N N -7.960 -4.465 6.240 1.00 . A A . 1 ASP N 1 1 9 2308 1 1 1 ASP O O -6.758 -3.614 3.580 1.00 . A A . 1 ASP O 1 1 9 2309 1 1 1 ASP OD1 O -4.924 -6.736 7.287 1.00 . A A . 1 ASP OD1 1 1 9 2310 1 1 1 ASP OD2 O -3.696 -6.039 5.603 1.00 . A A . 1 ASP OD2 1 1 9 2311 1 1 2 ALA C C -3.892 -0.891 3.980 1.00 . A A . 2 ALA C 1 1 9 2312 1 1 2 ALA CA C -5.379 -1.233 4.029 1.00 . A A . 2 ALA CA 1 1 9 2313 1 1 2 ALA CB C -6.199 0.010 4.337 1.00 . A A . 2 ALA CB 1 1 9 2314 1 1 2 ALA H H -5.325 -2.151 5.936 1.00 . A A . 2 ALA H 1 1 9 2315 1 1 2 ALA HA H -5.683 -1.605 3.061 1.00 . A A . 2 ALA HA 1 1 9 2316 1 1 2 ALA HB1 H -5.964 0.358 5.331 1.00 . A A . 2 ALA HB1 1 1 9 2317 1 1 2 ALA HB2 H -7.250 -0.229 4.278 1.00 . A A . 2 ALA HB2 1 1 9 2318 1 1 2 ALA HB3 H -5.964 0.783 3.620 1.00 . A A . 2 ALA HB3 1 1 9 2319 1 1 2 ALA N N -5.647 -2.274 5.018 1.00 . A A . 2 ALA N 1 1 9 2320 1 1 2 ALA O O -3.231 -1.121 2.967 1.00 . A A . 2 ALA O 1 1 9 2321 1 1 3 TYR C C -1.077 -1.224 5.122 1.00 . A A . 3 TYR C 1 1 9 2322 1 1 3 TYR CA C -1.957 0.023 5.164 1.00 . A A . 3 TYR CA 1 1 9 2323 1 1 3 TYR CB C -1.682 0.837 6.433 1.00 . A A . 3 TYR CB 1 1 9 2324 1 1 3 TYR CD1 C -0.709 3.101 5.848 1.00 . A A . 3 TYR CD1 1 1 9 2325 1 1 3 TYR CD2 C 0.766 1.408 6.659 1.00 . A A . 3 TYR CD2 1 1 9 2326 1 1 3 TYR CE1 C 0.352 3.980 5.749 1.00 . A A . 3 TYR CE1 1 1 9 2327 1 1 3 TYR CE2 C 1.831 2.283 6.558 1.00 . A A . 3 TYR CE2 1 1 9 2328 1 1 3 TYR CG C -0.520 1.798 6.305 1.00 . A A . 3 TYR CG 1 1 9 2329 1 1 3 TYR CZ C 1.619 3.567 6.104 1.00 . A A . 3 TYR CZ 1 1 9 2330 1 1 3 TYR H H -3.953 -0.190 5.856 1.00 . A A . 3 TYR H 1 1 9 2331 1 1 3 TYR HA H -1.725 0.627 4.304 1.00 . A A . 3 TYR HA 1 1 9 2332 1 1 3 TYR HB2 H -2.560 1.416 6.678 1.00 . A A . 3 TYR HB2 1 1 9 2333 1 1 3 TYR HB3 H -1.466 0.160 7.246 1.00 . A A . 3 TYR HB3 1 1 9 2334 1 1 3 TYR HD1 H -1.702 3.425 5.559 1.00 . A A . 3 TYR HD1 1 1 9 2335 1 1 3 TYR HD2 H 0.930 0.401 7.014 1.00 . A A . 3 TYR HD2 1 1 9 2336 1 1 3 TYR HE1 H 0.186 4.987 5.400 1.00 . A A . 3 TYR HE1 1 1 9 2337 1 1 3 TYR HE2 H 2.823 1.958 6.835 1.00 . A A . 3 TYR HE2 1 1 9 2338 1 1 3 TYR HH H 2.754 4.945 6.821 1.00 . A A . 3 TYR HH 1 1 9 2339 1 1 3 TYR N N -3.372 -0.345 5.081 1.00 . A A . 3 TYR N 1 1 9 2340 1 1 3 TYR O O -0.150 -1.306 4.314 1.00 . A A . 3 TYR O 1 1 9 2341 1 1 3 TYR OH O 2.676 4.442 6.006 1.00 . A A . 3 TYR OH 1 1 9 2342 1 1 4 ALA C C -0.840 -4.222 4.697 1.00 . A A . 4 ALA C 1 1 9 2343 1 1 4 ALA CA C -0.641 -3.456 6.005 1.00 . A A . 4 ALA CA 1 1 9 2344 1 1 4 ALA CB C -1.072 -4.303 7.193 1.00 . A A . 4 ALA CB 1 1 9 2345 1 1 4 ALA H H -2.150 -2.088 6.580 1.00 . A A . 4 ALA H 1 1 9 2346 1 1 4 ALA HA H 0.409 -3.219 6.116 1.00 . A A . 4 ALA HA 1 1 9 2347 1 1 4 ALA HB1 H -2.088 -4.639 7.047 1.00 . A A . 4 ALA HB1 1 1 9 2348 1 1 4 ALA HB2 H -1.016 -3.712 8.095 1.00 . A A . 4 ALA HB2 1 1 9 2349 1 1 4 ALA HB3 H -0.419 -5.158 7.282 1.00 . A A . 4 ALA HB3 1 1 9 2350 1 1 4 ALA N N -1.389 -2.203 5.974 1.00 . A A . 4 ALA N 1 1 9 2351 1 1 4 ALA O O 0.065 -4.917 4.233 1.00 . A A . 4 ALA O 1 1 9 2352 1 1 5 GLN C C -1.543 -4.084 1.698 1.00 . A A . 5 GLN C 1 1 9 2353 1 1 5 GLN CA C -2.345 -4.720 2.832 1.00 . A A . 5 GLN CA 1 1 9 2354 1 1 5 GLN CB C -3.846 -4.611 2.545 1.00 . A A . 5 GLN CB 1 1 9 2355 1 1 5 GLN CD C -4.405 -6.792 1.397 1.00 . A A . 5 GLN CD 1 1 9 2356 1 1 5 GLN CG C -4.270 -5.287 1.253 1.00 . A A . 5 GLN CG 1 1 9 2357 1 1 5 GLN H H -2.702 -3.487 4.508 1.00 . A A . 5 GLN H 1 1 9 2358 1 1 5 GLN HA H -2.073 -5.762 2.915 1.00 . A A . 5 GLN HA 1 1 9 2359 1 1 5 GLN HB2 H -4.390 -5.066 3.359 1.00 . A A . 5 GLN HB2 1 1 9 2360 1 1 5 GLN HB3 H -4.114 -3.567 2.484 1.00 . A A . 5 GLN HB3 1 1 9 2361 1 1 5 GLN HE21 H -2.526 -7.050 0.789 1.00 . A A . 5 GLN HE21 1 1 9 2362 1 1 5 GLN HE22 H -3.397 -8.492 1.174 1.00 . A A . 5 GLN HE22 1 1 9 2363 1 1 5 GLN HG2 H -5.224 -4.884 0.946 1.00 . A A . 5 GLN HG2 1 1 9 2364 1 1 5 GLN HG3 H -3.531 -5.076 0.497 1.00 . A A . 5 GLN HG3 1 1 9 2365 1 1 5 GLN N N -2.028 -4.068 4.097 1.00 . A A . 5 GLN N 1 1 9 2366 1 1 5 GLN NE2 N -3.334 -7.518 1.089 1.00 . A A . 5 GLN NE2 1 1 9 2367 1 1 5 GLN O O -1.067 -4.777 0.799 1.00 . A A . 5 GLN O 1 1 9 2368 1 1 5 GLN OE1 O -5.459 -7.297 1.784 1.00 . A A . 5 GLN OE1 1 1 9 2369 1 1 6 TRP C C 0.818 -2.476 0.734 1.00 . A A . 6 TRP C 1 1 9 2370 1 1 6 TRP CA C -0.633 -2.011 0.760 1.00 . A A . 6 TRP CA 1 1 9 2371 1 1 6 TRP CB C -0.692 -0.512 1.065 1.00 . A A . 6 TRP CB 1 1 9 2372 1 1 6 TRP CD1 C -0.282 0.621 -1.188 1.00 . A A . 6 TRP CD1 1 1 9 2373 1 1 6 TRP CD2 C 1.332 0.978 0.320 1.00 . A A . 6 TRP CD2 1 1 9 2374 1 1 6 TRP CE2 C 1.670 1.648 -0.869 1.00 . A A . 6 TRP CE2 1 1 9 2375 1 1 6 TRP CE3 C 2.202 1.063 1.410 1.00 . A A . 6 TRP CE3 1 1 9 2376 1 1 6 TRP CG C 0.075 0.326 0.092 1.00 . A A . 6 TRP CG 1 1 9 2377 1 1 6 TRP CH2 C 3.670 2.462 0.078 1.00 . A A . 6 TRP CH2 1 1 9 2378 1 1 6 TRP CZ2 C 2.838 2.392 -1.002 1.00 . A A . 6 TRP CZ2 1 1 9 2379 1 1 6 TRP CZ3 C 3.363 1.806 1.278 1.00 . A A . 6 TRP CZ3 1 1 9 2380 1 1 6 TRP H H -1.788 -2.270 2.513 1.00 . A A . 6 TRP H 1 1 9 2381 1 1 6 TRP HA H -1.080 -2.196 -0.205 1.00 . A A . 6 TRP HA 1 1 9 2382 1 1 6 TRP HB2 H -1.719 -0.188 1.045 1.00 . A A . 6 TRP HB2 1 1 9 2383 1 1 6 TRP HB3 H -0.285 -0.335 2.048 1.00 . A A . 6 TRP HB3 1 1 9 2384 1 1 6 TRP HD1 H -1.185 0.274 -1.662 1.00 . A A . 6 TRP HD1 1 1 9 2385 1 1 6 TRP HE1 H 0.640 1.751 -2.687 1.00 . A A . 6 TRP HE1 1 1 9 2386 1 1 6 TRP HE3 H 1.982 0.560 2.342 1.00 . A A . 6 TRP HE3 1 1 9 2387 1 1 6 TRP HH2 H 4.583 3.038 0.019 1.00 . A A . 6 TRP HH2 1 1 9 2388 1 1 6 TRP HZ2 H 3.091 2.898 -1.922 1.00 . A A . 6 TRP HZ2 1 1 9 2389 1 1 6 TRP HZ3 H 4.050 1.884 2.109 1.00 . A A . 6 TRP HZ3 1 1 9 2390 1 1 6 TRP N N -1.389 -2.758 1.762 1.00 . A A . 6 TRP N 1 1 9 2391 1 1 6 TRP NE1 N 0.671 1.410 -1.772 1.00 . A A . 6 TRP NE1 1 1 9 2392 1 1 6 TRP O O 1.369 -2.770 -0.328 1.00 . A A . 6 TRP O 1 1 9 2393 1 1 7 LEU C C 2.957 -4.446 1.622 1.00 . A A . 7 LEU C 1 1 9 2394 1 1 7 LEU CA C 2.807 -2.987 2.057 1.00 . A A . 7 LEU CA 1 1 9 2395 1 1 7 LEU CB C 3.270 -2.812 3.506 1.00 . A A . 7 LEU CB 1 1 9 2396 1 1 7 LEU CD1 C 3.292 -1.340 5.539 1.00 . A A . 7 LEU CD1 1 1 9 2397 1 1 7 LEU CD2 C 4.420 -0.576 3.438 1.00 . A A . 7 LEU CD2 1 1 9 2398 1 1 7 LEU CG C 3.254 -1.367 4.019 1.00 . A A . 7 LEU CG 1 1 9 2399 1 1 7 LEU H H 0.919 -2.306 2.726 1.00 . A A . 7 LEU H 1 1 9 2400 1 1 7 LEU HA H 3.416 -2.369 1.416 1.00 . A A . 7 LEU HA 1 1 9 2401 1 1 7 LEU HB2 H 2.625 -3.403 4.140 1.00 . A A . 7 LEU HB2 1 1 9 2402 1 1 7 LEU HB3 H 4.275 -3.191 3.593 1.00 . A A . 7 LEU HB3 1 1 9 2403 1 1 7 LEU HD11 H 4.278 -1.619 5.880 1.00 . A A . 7 LEU HD11 1 1 9 2404 1 1 7 LEU HD12 H 2.565 -2.036 5.929 1.00 . A A . 7 LEU HD12 1 1 9 2405 1 1 7 LEU HD13 H 3.060 -0.344 5.886 1.00 . A A . 7 LEU HD13 1 1 9 2406 1 1 7 LEU HD21 H 4.508 0.367 3.957 1.00 . A A . 7 LEU HD21 1 1 9 2407 1 1 7 LEU HD22 H 4.245 -0.393 2.388 1.00 . A A . 7 LEU HD22 1 1 9 2408 1 1 7 LEU HD23 H 5.334 -1.140 3.559 1.00 . A A . 7 LEU HD23 1 1 9 2409 1 1 7 LEU HG H 2.337 -0.892 3.702 1.00 . A A . 7 LEU HG 1 1 9 2410 1 1 7 LEU N N 1.423 -2.549 1.919 1.00 . A A . 7 LEU N 1 1 9 2411 1 1 7 LEU O O 3.961 -4.820 1.012 1.00 . A A . 7 LEU O 1 1 9 2412 1 1 8 ALA C C 1.661 -6.867 0.062 1.00 . A A . 8 ALA C 1 1 9 2413 1 1 8 ALA CA C 1.942 -6.674 1.557 1.00 . A A . 8 ALA CA 1 1 9 2414 1 1 8 ALA CB C 0.919 -7.436 2.389 1.00 . A A . 8 ALA CB 1 1 9 2415 1 1 8 ALA H H 1.166 -4.895 2.404 1.00 . A A . 8 ALA H 1 1 9 2416 1 1 8 ALA HA H 2.920 -7.074 1.782 1.00 . A A . 8 ALA HA 1 1 9 2417 1 1 8 ALA HB1 H -0.058 -6.997 2.249 1.00 . A A . 8 ALA HB1 1 1 9 2418 1 1 8 ALA HB2 H 1.192 -7.381 3.432 1.00 . A A . 8 ALA HB2 1 1 9 2419 1 1 8 ALA HB3 H 0.898 -8.469 2.076 1.00 . A A . 8 ALA HB3 1 1 9 2420 1 1 8 ALA N N 1.941 -5.259 1.926 1.00 . A A . 8 ALA N 1 1 9 2421 1 1 8 ALA O O 1.940 -7.931 -0.493 1.00 . A A . 8 ALA O 1 1 9 2422 1 1 9 ASP C C 1.997 -5.427 -2.873 1.00 . A A . 9 ASP C 1 1 9 2423 1 1 9 ASP CA C 0.807 -5.889 -2.021 1.00 . A A . 9 ASP CA 1 1 9 2424 1 1 9 ASP CB C -0.423 -5.026 -2.337 1.00 . A A . 9 ASP CB 1 1 9 2425 1 1 9 ASP CG C -1.626 -5.857 -2.737 1.00 . A A . 9 ASP CG 1 1 9 2426 1 1 9 ASP H H 0.922 -5.007 -0.096 1.00 . A A . 9 ASP H 1 1 9 2427 1 1 9 ASP HA H 0.584 -6.916 -2.267 1.00 . A A . 9 ASP HA 1 1 9 2428 1 1 9 ASP HB2 H -0.687 -4.445 -1.467 1.00 . A A . 9 ASP HB2 1 1 9 2429 1 1 9 ASP HB3 H -0.187 -4.355 -3.151 1.00 . A A . 9 ASP HB3 1 1 9 2430 1 1 9 ASP N N 1.115 -5.831 -0.589 1.00 . A A . 9 ASP N 1 1 9 2431 1 1 9 ASP O O 1.839 -5.134 -4.060 1.00 . A A . 9 ASP O 1 1 9 2432 1 1 9 ASP OD1 O -2.380 -6.282 -1.836 1.00 . A A . 9 ASP OD1 1 1 9 2433 1 1 9 ASP OD2 O -1.815 -6.082 -3.951 1.00 . A A . 9 ASP OD2 1 1 9 2434 1 1 10 DAL C C 4.771 -3.495 -2.613 1.00 . A A . 10 DAL C 1 1 9 2435 1 1 10 DAL CA C 4.391 -4.936 -2.966 1.00 . A A . 10 DAL CA 1 1 9 2436 1 1 10 DAL CB C 5.538 -5.874 -2.634 1.00 . A A . 10 DAL CB 1 1 9 2437 1 1 10 DAL H H 3.252 -5.606 -1.319 1.00 . A A . 10 DAL H 1 1 9 2438 1 1 10 DAL HA H 4.202 -5.000 -4.028 1.00 . A A . 10 DAL HA 1 1 9 2439 1 1 10 DAL HB1 H 5.790 -5.770 -1.589 1.00 . A A . 10 DAL HB1 1 1 9 2440 1 1 10 DAL HB2 H 6.395 -5.623 -3.239 1.00 . A A . 10 DAL HB2 1 1 9 2441 1 1 10 DAL HB3 H 5.240 -6.892 -2.833 1.00 . A A . 10 DAL HB3 1 1 9 2442 1 1 10 DAL N N 3.184 -5.363 -2.265 1.00 . A A . 10 DAL N 1 1 9 2443 1 1 10 DAL O O 5.802 -2.994 -3.067 1.00 . A A . 10 DAL O 1 1 9 2444 1 1 11 GLY C C 4.110 -0.496 -2.562 1.00 . A A . 11 GLY C 1 1 9 2445 1 1 11 GLY CA C 4.209 -1.464 -1.403 1.00 . A A . 11 GLY CA 1 1 9 2446 1 1 11 GLY H H 3.135 -3.282 -1.470 1.00 . A A . 11 GLY H 1 1 9 2447 1 1 11 GLY HA2 H 3.498 -1.172 -0.645 1.00 . A A . 11 GLY HA2 1 1 9 2448 1 1 11 GLY HA3 H 5.205 -1.411 -0.988 1.00 . A A . 11 GLY HA3 1 1 9 2449 1 1 11 GLY N N 3.939 -2.835 -1.801 1.00 . A A . 11 GLY N 1 1 9 2450 1 1 11 GLY O O 3.017 -0.050 -2.912 1.00 . A A . 11 GLY O 1 1 9 2451 1 1 12 TRP C C 5.332 0.020 -5.629 1.00 . A A . 12 TRP C 1 1 9 2452 1 1 12 TRP CA C 5.294 0.753 -4.285 1.00 . A A . 12 TRP CA 1 1 9 2453 1 1 12 TRP CB C 6.484 1.700 -4.136 1.00 . A A . 12 TRP CB 1 1 9 2454 1 1 12 TRP CD1 C 6.725 3.075 -1.993 1.00 . A A . 12 TRP CD1 1 1 9 2455 1 1 12 TRP CD2 C 5.187 3.855 -3.424 1.00 . A A . 12 TRP CD2 1 1 9 2456 1 1 12 TRP CE2 C 5.205 4.682 -2.288 1.00 . A A . 12 TRP CE2 1 1 9 2457 1 1 12 TRP CE3 C 4.296 4.155 -4.464 1.00 . A A . 12 TRP CE3 1 1 9 2458 1 1 12 TRP CG C 6.167 2.832 -3.214 1.00 . A A . 12 TRP CG 1 1 9 2459 1 1 12 TRP CH2 C 3.507 6.053 -3.186 1.00 . A A . 12 TRP CH2 1 1 9 2460 1 1 12 TRP CZ2 C 4.367 5.781 -2.156 1.00 . A A . 12 TRP CZ2 1 1 9 2461 1 1 12 TRP CZ3 C 3.468 5.251 -4.334 1.00 . A A . 12 TRP CZ3 1 1 9 2462 1 1 12 TRP H H 6.093 -0.563 -2.833 1.00 . A A . 12 TRP H 1 1 9 2463 1 1 12 TRP HA H 4.385 1.339 -4.247 1.00 . A A . 12 TRP HA 1 1 9 2464 1 1 12 TRP HB2 H 7.324 1.157 -3.730 1.00 . A A . 12 TRP HB2 1 1 9 2465 1 1 12 TRP HB3 H 6.750 2.108 -5.100 1.00 . A A . 12 TRP HB3 1 1 9 2466 1 1 12 TRP HD1 H 7.502 2.473 -1.548 1.00 . A A . 12 TRP HD1 1 1 9 2467 1 1 12 TRP HE1 H 6.384 4.567 -0.555 1.00 . A A . 12 TRP HE1 1 1 9 2468 1 1 12 TRP HE3 H 4.249 3.548 -5.356 1.00 . A A . 12 TRP HE3 1 1 9 2469 1 1 12 TRP HH2 H 2.841 6.901 -3.126 1.00 . A A . 12 TRP HH2 1 1 9 2470 1 1 12 TRP HZ2 H 4.378 6.398 -1.274 1.00 . A A . 12 TRP HZ2 1 1 9 2471 1 1 12 TRP HZ3 H 2.779 5.500 -5.129 1.00 . A A . 12 TRP HZ3 1 1 9 2472 1 1 12 TRP N N 5.255 -0.172 -3.158 1.00 . A A . 12 TRP N 1 1 9 2473 1 1 12 TRP NE1 N 6.151 4.187 -1.429 1.00 . A A . 12 TRP NE1 1 1 9 2474 1 1 12 TRP O O 5.549 0.640 -6.673 1.00 . A A . 12 TRP O 1 1 9 2475 1 1 13 ALA C C 3.666 -2.041 -7.450 1.00 . A A . 13 ALA C 1 1 9 2476 1 1 13 ALA CA C 5.056 -2.091 -6.824 1.00 . A A . 13 ALA CA 1 1 9 2477 1 1 13 ALA CB C 5.470 -3.526 -6.540 1.00 . A A . 13 ALA CB 1 1 9 2478 1 1 13 ALA H H 4.892 -1.730 -4.749 1.00 . A A . 13 ALA H 1 1 9 2479 1 1 13 ALA HA H 5.764 -1.665 -7.516 1.00 . A A . 13 ALA HA 1 1 9 2480 1 1 13 ALA HB1 H 5.410 -3.716 -5.479 1.00 . A A . 13 ALA HB1 1 1 9 2481 1 1 13 ALA HB2 H 6.484 -3.678 -6.876 1.00 . A A . 13 ALA HB2 1 1 9 2482 1 1 13 ALA HB3 H 4.811 -4.202 -7.065 1.00 . A A . 13 ALA HB3 1 1 9 2483 1 1 13 ALA N N 5.084 -1.293 -5.604 1.00 . A A . 13 ALA N 1 1 9 2484 1 1 13 ALA O O 3.524 -2.075 -8.674 1.00 . A A . 13 ALA O 1 1 9 2485 1 1 14 SER C C 1.046 -0.590 -7.892 1.00 . A A . 14 SER C 1 1 9 2486 1 1 14 SER CA C 1.259 -1.848 -7.046 1.00 . A A . 14 SER CA 1 1 9 2487 1 1 14 SER CB C 0.304 -1.849 -5.842 1.00 . A A . 14 SER CB 1 1 9 2488 1 1 14 SER H H 2.831 -1.896 -5.633 1.00 . A A . 14 SER H 1 1 9 2489 1 1 14 SER HA H 1.054 -2.712 -7.657 1.00 . A A . 14 SER HA 1 1 9 2490 1 1 14 SER HB2 H -0.592 -1.303 -6.094 1.00 . A A . 14 SER HB2 1 1 9 2491 1 1 14 SER HB3 H 0.044 -2.867 -5.593 1.00 . A A . 14 SER HB3 1 1 9 2492 1 1 14 SER HG H 1.219 -1.922 -4.103 1.00 . A A . 14 SER HG 1 1 9 2493 1 1 14 SER N N 2.645 -1.935 -6.595 1.00 . A A . 14 SER N 1 1 9 2494 1 1 14 SER O O 0.212 -0.578 -8.799 1.00 . A A . 14 SER O 1 1 9 2495 1 1 14 SER OG O 0.901 -1.241 -4.704 1.00 . A A . 14 SER OG 1 1 9 2496 1 1 15 DAL C C 0.908 2.768 -7.552 1.00 . A A . 15 DAL C 1 1 9 2497 1 1 15 DAL CA C 1.719 1.726 -8.324 1.00 . A A . 15 DAL CA 1 1 9 2498 1 1 15 DAL CB C 3.111 2.254 -8.630 1.00 . A A . 15 DAL CB 1 1 9 2499 1 1 15 DAL H H 2.460 0.388 -6.857 1.00 . A A . 15 DAL H 1 1 9 2500 1 1 15 DAL HA H 1.227 1.529 -9.263 1.00 . A A . 15 DAL HA 1 1 9 2501 1 1 15 DAL HB1 H 3.849 1.551 -8.273 1.00 . A A . 15 DAL HB1 1 1 9 2502 1 1 15 DAL HB2 H 3.253 3.205 -8.139 1.00 . A A . 15 DAL HB2 1 1 9 2503 1 1 15 DAL HB3 H 3.219 2.379 -9.696 1.00 . A A . 15 DAL HB3 1 1 9 2504 1 1 15 DAL N N 1.813 0.464 -7.590 1.00 . A A . 15 DAL N 1 1 9 2505 1 1 15 DAL O O 1.079 3.973 -7.749 1.00 . A A . 15 DAL O 1 1 9 2506 1 1 16 ARG C C -0.089 3.609 -4.595 1.00 . A A . 16 ARG C 1 1 9 2507 1 1 16 ARG CA C -0.817 3.183 -5.872 1.00 . A A . 16 ARG CA 1 1 9 2508 1 1 16 ARG CB C -2.141 2.477 -5.519 1.00 . A A . 16 ARG CB 1 1 9 2509 1 1 16 ARG CD C -3.217 0.568 -4.283 1.00 . A A . 16 ARG CD 1 1 9 2510 1 1 16 ARG CG C -2.037 1.531 -4.329 1.00 . A A . 16 ARG CG 1 1 9 2511 1 1 16 ARG CZ C -2.852 -1.342 -2.746 1.00 . A A . 16 ARG CZ 1 1 9 2512 1 1 16 ARG H H -0.067 1.325 -6.564 1.00 . A A . 16 ARG H 1 1 9 2513 1 1 16 ARG HA H -1.026 4.067 -6.460 1.00 . A A . 16 ARG HA 1 1 9 2514 1 1 16 ARG HB2 H -2.883 3.226 -5.290 1.00 . A A . 16 ARG HB2 1 1 9 2515 1 1 16 ARG HB3 H -2.478 1.899 -6.375 1.00 . A A . 16 ARG HB3 1 1 9 2516 1 1 16 ARG HD2 H -4.125 1.126 -4.459 1.00 . A A . 16 ARG HD2 1 1 9 2517 1 1 16 ARG HD3 H -3.096 -0.169 -5.064 1.00 . A A . 16 ARG HD3 1 1 9 2518 1 1 16 ARG HE H -3.789 0.361 -2.272 1.00 . A A . 16 ARG HE 1 1 9 2519 1 1 16 ARG HG2 H -1.119 0.962 -4.410 1.00 . A A . 16 ARG HG2 1 1 9 2520 1 1 16 ARG HG3 H -2.023 2.113 -3.420 1.00 . A A . 16 ARG HG3 1 1 9 2521 1 1 16 ARG HH11 H -2.078 -1.627 -4.598 1.00 . A A . 16 ARG HH11 1 1 9 2522 1 1 16 ARG HH12 H -1.861 -2.942 -3.494 1.00 . A A . 16 ARG HH12 1 1 9 2523 1 1 16 ARG HH21 H -3.495 -1.377 -0.827 1.00 . A A . 16 ARG HH21 1 1 9 2524 1 1 16 ARG HH22 H -2.665 -2.802 -1.357 1.00 . A A . 16 ARG HH22 1 1 9 2525 1 1 16 ARG N N 0.023 2.296 -6.675 1.00 . A A . 16 ARG N 1 1 9 2526 1 1 16 ARG NE N -3.327 -0.116 -2.994 1.00 . A A . 16 ARG NE 1 1 9 2527 1 1 16 ARG NH1 N -2.211 -2.026 -3.691 1.00 . A A . 16 ARG NH1 1 1 9 2528 1 1 16 ARG NH2 N -3.017 -1.885 -1.545 1.00 . A A . 16 ARG NH2 1 1 9 2529 1 1 16 ARG O O 0.787 2.894 -4.110 1.00 . A A . 16 ARG O 1 1 9 2530 1 1 17 PRO C C -0.439 4.704 -1.540 1.00 . A A . 17 PRO C 1 1 9 2531 1 1 17 PRO CA C 0.182 5.293 -2.808 1.00 . A A . 17 PRO CA 1 1 9 2532 1 1 17 PRO CB C -0.066 6.807 -2.870 1.00 . A A . 17 PRO CB 1 1 9 2533 1 1 17 PRO CD C -1.451 5.715 -4.529 1.00 . A A . 17 PRO CD 1 1 9 2534 1 1 17 PRO CG C -0.921 7.051 -4.079 1.00 . A A . 17 PRO CG 1 1 9 2535 1 1 17 PRO HA H 1.243 5.102 -2.797 1.00 . A A . 17 PRO HA 1 1 9 2536 1 1 17 PRO HB2 H -0.569 7.124 -1.968 1.00 . A A . 17 PRO HB2 1 1 9 2537 1 1 17 PRO HB3 H 0.884 7.319 -2.950 1.00 . A A . 17 PRO HB3 1 1 9 2538 1 1 17 PRO HD2 H -2.412 5.516 -4.084 1.00 . A A . 17 PRO HD2 1 1 9 2539 1 1 17 PRO HD3 H -1.516 5.682 -5.604 1.00 . A A . 17 PRO HD3 1 1 9 2540 1 1 17 PRO HG2 H -1.740 7.705 -3.819 1.00 . A A . 17 PRO HG2 1 1 9 2541 1 1 17 PRO HG3 H -0.324 7.497 -4.861 1.00 . A A . 17 PRO HG3 1 1 9 2542 1 1 17 PRO N N -0.438 4.784 -4.030 1.00 . A A . 17 PRO N 1 1 9 2543 1 1 17 PRO O O -1.504 4.085 -1.584 1.00 . A A . 17 PRO O 1 1 9 2544 1 1 18 PRO C C -1.565 4.974 1.352 1.00 . A A . 18 PRO C 1 1 9 2545 1 1 18 PRO CA C -0.229 4.377 0.908 1.00 . A A . 18 PRO CA 1 1 9 2546 1 1 18 PRO CB C 0.866 4.801 1.891 1.00 . A A . 18 PRO CB 1 1 9 2547 1 1 18 PRO CD C 1.517 5.607 -0.270 1.00 . A A . 18 PRO CD 1 1 9 2548 1 1 18 PRO CG C 1.639 5.872 1.202 1.00 . A A . 18 PRO CG 1 1 9 2549 1 1 18 PRO HA H -0.305 3.299 0.896 1.00 . A A . 18 PRO HA 1 1 9 2550 1 1 18 PRO HB2 H 0.408 5.174 2.791 1.00 . A A . 18 PRO HB2 1 1 9 2551 1 1 18 PRO HB3 H 1.487 3.955 2.129 1.00 . A A . 18 PRO HB3 1 1 9 2552 1 1 18 PRO HD2 H 1.491 6.536 -0.818 1.00 . A A . 18 PRO HD2 1 1 9 2553 1 1 18 PRO HD3 H 2.335 4.991 -0.611 1.00 . A A . 18 PRO HD3 1 1 9 2554 1 1 18 PRO HG2 H 1.221 6.838 1.442 1.00 . A A . 18 PRO HG2 1 1 9 2555 1 1 18 PRO HG3 H 2.675 5.827 1.504 1.00 . A A . 18 PRO HG3 1 1 9 2556 1 1 18 PRO N N 0.236 4.890 -0.388 1.00 . A A . 18 PRO N 1 1 9 2557 1 1 18 PRO O O -1.850 6.145 1.094 1.00 . A A . 18 PRO O 1 1 9 2558 1 1 19 PRO C C -3.579 5.403 3.848 1.00 . A A . 19 PRO C 1 1 9 2559 1 1 19 PRO CA C -3.691 4.611 2.545 1.00 . A A . 19 PRO CA 1 1 9 2560 1 1 19 PRO CB C -4.450 3.306 2.771 1.00 . A A . 19 PRO CB 1 1 9 2561 1 1 19 PRO CD C -2.118 2.767 2.397 1.00 . A A . 19 PRO CD 1 1 9 2562 1 1 19 PRO CG C -3.426 2.237 2.931 1.00 . A A . 19 PRO CG 1 1 9 2563 1 1 19 PRO HA H -4.211 5.208 1.810 1.00 . A A . 19 PRO HA 1 1 9 2564 1 1 19 PRO HB2 H -5.067 3.391 3.652 1.00 . A A . 19 PRO HB2 1 1 9 2565 1 1 19 PRO HB3 H -5.065 3.111 1.922 1.00 . A A . 19 PRO HB3 1 1 9 2566 1 1 19 PRO HD2 H -1.348 2.709 3.150 1.00 . A A . 19 PRO HD2 1 1 9 2567 1 1 19 PRO HD3 H -1.831 2.208 1.522 1.00 . A A . 19 PRO HD3 1 1 9 2568 1 1 19 PRO HG2 H -3.334 1.979 3.970 1.00 . A A . 19 PRO HG2 1 1 9 2569 1 1 19 PRO HG3 H -3.727 1.367 2.365 1.00 . A A . 19 PRO HG3 1 1 9 2570 1 1 19 PRO N N -2.395 4.169 2.046 1.00 . A A . 19 PRO N 1 1 9 2571 1 1 19 PRO O O -2.689 5.154 4.663 1.00 . A A . 19 PRO O 1 1 9 2572 1 1 20 SER C C -5.851 7.883 5.420 1.00 . A A . 20 SER C 1 1 9 2573 1 1 20 SER CA C -4.499 7.194 5.239 1.00 . A A . 20 SER CA 1 1 9 2574 1 1 20 SER CB C -3.381 8.242 5.179 1.00 . A A . 20 SER CB 1 1 9 2575 1 1 20 SER H H -5.171 6.510 3.348 1.00 . A A . 20 SER H 1 1 9 2576 1 1 20 SER HA H -4.325 6.548 6.087 1.00 . A A . 20 SER HA 1 1 9 2577 1 1 20 SER HB2 H -3.521 8.960 5.973 1.00 . A A . 20 SER HB2 1 1 9 2578 1 1 20 SER HB3 H -2.426 7.753 5.301 1.00 . A A . 20 SER HB3 1 1 9 2579 1 1 20 SER HG H -2.575 9.432 3.847 1.00 . A A . 20 SER HG 1 1 9 2580 1 1 20 SER N N -4.489 6.360 4.036 1.00 . A A . 20 SER N 1 1 9 2581 1 1 20 SER O O -6.323 8.530 4.459 1.00 . A A . 20 SER O 1 1 9 2582 1 1 20 SER OXT O -6.428 7.769 6.521 1.00 . A A . 20 SER OXT 1 1 9 2583 1 1 20 SER OG O -3.387 8.929 3.939 1.00 . A A . 20 SER OG 1 1 10 2584 1 1 1 ASP C C -6.884 -1.496 5.605 1.00 . A A . 1 ASP C 1 1 10 2585 1 1 1 ASP CA C -7.673 -0.546 6.505 1.00 . A A . 1 ASP CA 1 1 10 2586 1 1 1 ASP CB C -6.830 -0.150 7.721 1.00 . A A . 1 ASP CB 1 1 10 2587 1 1 1 ASP CG C -7.231 1.197 8.292 1.00 . A A . 1 ASP CG 1 1 10 2588 1 1 1 ASP H1 H -9.440 -0.475 7.565 1.00 . A A . 1 ASP H1 1 1 10 2589 1 1 1 ASP H2 H -8.683 -2.016 7.540 1.00 . A A . 1 ASP H2 1 1 10 2590 1 1 1 ASP H3 H -9.497 -1.435 6.145 1.00 . A A . 1 ASP H3 1 1 10 2591 1 1 1 ASP HA H -7.924 0.342 5.943 1.00 . A A . 1 ASP HA 1 1 10 2592 1 1 1 ASP HB2 H -6.948 -0.897 8.492 1.00 . A A . 1 ASP HB2 1 1 10 2593 1 1 1 ASP HB3 H -5.790 -0.102 7.430 1.00 . A A . 1 ASP HB3 1 1 10 2594 1 1 1 ASP N N -8.937 -1.175 6.982 1.00 . A A . 1 ASP N 1 1 10 2595 1 1 1 ASP O O -6.943 -2.716 5.770 1.00 . A A . 1 ASP O 1 1 10 2596 1 1 1 ASP OD1 O -6.720 2.227 7.802 1.00 . A A . 1 ASP OD1 1 1 10 2597 1 1 1 ASP OD2 O -8.057 1.223 9.229 1.00 . A A . 1 ASP OD2 1 1 10 2598 1 1 2 ALA C C -3.869 -1.291 3.753 1.00 . A A . 2 ALA C 1 1 10 2599 1 1 2 ALA CA C -5.341 -1.714 3.722 1.00 . A A . 2 ALA CA 1 1 10 2600 1 1 2 ALA CB C -5.903 -1.588 2.312 1.00 . A A . 2 ALA CB 1 1 10 2601 1 1 2 ALA H H -6.141 0.053 4.574 1.00 . A A . 2 ALA H 1 1 10 2602 1 1 2 ALA HA H -5.410 -2.751 4.017 1.00 . A A . 2 ALA HA 1 1 10 2603 1 1 2 ALA HB1 H -5.207 -2.017 1.606 1.00 . A A . 2 ALA HB1 1 1 10 2604 1 1 2 ALA HB2 H -6.057 -0.545 2.078 1.00 . A A . 2 ALA HB2 1 1 10 2605 1 1 2 ALA HB3 H -6.846 -2.113 2.252 1.00 . A A . 2 ALA HB3 1 1 10 2606 1 1 2 ALA N N -6.146 -0.925 4.653 1.00 . A A . 2 ALA N 1 1 10 2607 1 1 2 ALA O O -3.172 -1.380 2.741 1.00 . A A . 2 ALA O 1 1 10 2608 1 1 3 TYR C C -1.057 -1.595 5.006 1.00 . A A . 3 TYR C 1 1 10 2609 1 1 3 TYR CA C -2.008 -0.401 5.063 1.00 . A A . 3 TYR CA 1 1 10 2610 1 1 3 TYR CB C -1.814 0.382 6.364 1.00 . A A . 3 TYR CB 1 1 10 2611 1 1 3 TYR CD1 C -0.944 2.708 5.869 1.00 . A A . 3 TYR CD1 1 1 10 2612 1 1 3 TYR CD2 C 0.596 1.068 6.670 1.00 . A A . 3 TYR CD2 1 1 10 2613 1 1 3 TYR CE1 C 0.074 3.640 5.819 1.00 . A A . 3 TYR CE1 1 1 10 2614 1 1 3 TYR CE2 C 1.617 1.996 6.618 1.00 . A A . 3 TYR CE2 1 1 10 2615 1 1 3 TYR CG C -0.700 1.404 6.296 1.00 . A A . 3 TYR CG 1 1 10 2616 1 1 3 TYR CZ C 1.352 3.280 6.193 1.00 . A A . 3 TYR CZ 1 1 10 2617 1 1 3 TYR H H -3.999 -0.785 5.691 1.00 . A A . 3 TYR H 1 1 10 2618 1 1 3 TYR HA H -1.782 0.245 4.234 1.00 . A A . 3 TYR HA 1 1 10 2619 1 1 3 TYR HB2 H -2.728 0.906 6.601 1.00 . A A . 3 TYR HB2 1 1 10 2620 1 1 3 TYR HB3 H -1.584 -0.309 7.162 1.00 . A A . 3 TYR HB3 1 1 10 2621 1 1 3 TYR HD1 H -1.945 2.990 5.565 1.00 . A A . 3 TYR HD1 1 1 10 2622 1 1 3 TYR HD2 H 0.802 0.060 7.001 1.00 . A A . 3 TYR HD2 1 1 10 2623 1 1 3 TYR HE1 H -0.134 4.647 5.492 1.00 . A A . 3 TYR HE1 1 1 10 2624 1 1 3 TYR HE2 H 2.618 1.713 6.910 1.00 . A A . 3 TYR HE2 1 1 10 2625 1 1 3 TYR HH H 2.769 4.197 5.271 1.00 . A A . 3 TYR HH 1 1 10 2626 1 1 3 TYR N N -3.399 -0.833 4.917 1.00 . A A . 3 TYR N 1 1 10 2627 1 1 3 TYR O O -0.137 -1.618 4.187 1.00 . A A . 3 TYR O 1 1 10 2628 1 1 3 TYR OH O 2.367 4.208 6.143 1.00 . A A . 3 TYR OH 1 1 10 2629 1 1 4 ALA C C -0.579 -4.530 4.539 1.00 . A A . 4 ALA C 1 1 10 2630 1 1 4 ALA CA C -0.464 -3.795 5.873 1.00 . A A . 4 ALA CA 1 1 10 2631 1 1 4 ALA CB C -0.864 -4.708 7.024 1.00 . A A . 4 ALA CB 1 1 10 2632 1 1 4 ALA H H -2.051 -2.528 6.478 1.00 . A A . 4 ALA H 1 1 10 2633 1 1 4 ALA HA H 0.565 -3.492 6.019 1.00 . A A . 4 ALA HA 1 1 10 2634 1 1 4 ALA HB1 H -0.128 -5.490 7.137 1.00 . A A . 4 ALA HB1 1 1 10 2635 1 1 4 ALA HB2 H -1.828 -5.148 6.817 1.00 . A A . 4 ALA HB2 1 1 10 2636 1 1 4 ALA HB3 H -0.920 -4.132 7.937 1.00 . A A . 4 ALA HB3 1 1 10 2637 1 1 4 ALA N N -1.293 -2.593 5.859 1.00 . A A . 4 ALA N 1 1 10 2638 1 1 4 ALA O O 0.405 -5.075 4.035 1.00 . A A . 4 ALA O 1 1 10 2639 1 1 5 GLN C C -1.272 -4.430 1.566 1.00 . A A . 5 GLN C 1 1 10 2640 1 1 5 GLN CA C -2.035 -5.157 2.673 1.00 . A A . 5 GLN CA 1 1 10 2641 1 1 5 GLN CB C -3.538 -5.172 2.366 1.00 . A A . 5 GLN CB 1 1 10 2642 1 1 5 GLN CD C -3.599 -7.067 0.680 1.00 . A A . 5 GLN CD 1 1 10 2643 1 1 5 GLN CG C -3.873 -5.593 0.943 1.00 . A A . 5 GLN CG 1 1 10 2644 1 1 5 GLN H H -2.523 -4.051 4.409 1.00 . A A . 5 GLN H 1 1 10 2645 1 1 5 GLN HA H -1.678 -6.173 2.732 1.00 . A A . 5 GLN HA 1 1 10 2646 1 1 5 GLN HB2 H -4.024 -5.857 3.045 1.00 . A A . 5 GLN HB2 1 1 10 2647 1 1 5 GLN HB3 H -3.935 -4.180 2.527 1.00 . A A . 5 GLN HB3 1 1 10 2648 1 1 5 GLN HE21 H -5.356 -7.277 -0.239 1.00 . A A . 5 GLN HE21 1 1 10 2649 1 1 5 GLN HE22 H -4.383 -8.700 -0.143 1.00 . A A . 5 GLN HE22 1 1 10 2650 1 1 5 GLN HG2 H -4.919 -5.397 0.763 1.00 . A A . 5 GLN HG2 1 1 10 2651 1 1 5 GLN HG3 H -3.278 -5.004 0.262 1.00 . A A . 5 GLN HG3 1 1 10 2652 1 1 5 GLN N N -1.786 -4.517 3.962 1.00 . A A . 5 GLN N 1 1 10 2653 1 1 5 GLN NE2 N -4.542 -7.749 0.034 1.00 . A A . 5 GLN NE2 1 1 10 2654 1 1 5 GLN O O -0.723 -5.063 0.665 1.00 . A A . 5 GLN O 1 1 10 2655 1 1 5 GLN OE1 O -2.544 -7.588 1.046 1.00 . A A . 5 GLN OE1 1 1 10 2656 1 1 6 TRP C C 0.958 -2.656 0.642 1.00 . A A . 6 TRP C 1 1 10 2657 1 1 6 TRP CA C -0.518 -2.275 0.674 1.00 . A A . 6 TRP CA 1 1 10 2658 1 1 6 TRP CB C -0.660 -0.788 1.019 1.00 . A A . 6 TRP CB 1 1 10 2659 1 1 6 TRP CD1 C -0.303 0.425 -1.198 1.00 . A A . 6 TRP CD1 1 1 10 2660 1 1 6 TRP CD2 C 1.284 0.829 0.323 1.00 . A A . 6 TRP CD2 1 1 10 2661 1 1 6 TRP CE2 C 1.590 1.547 -0.846 1.00 . A A . 6 TRP CE2 1 1 10 2662 1 1 6 TRP CE3 C 2.145 0.932 1.419 1.00 . A A . 6 TRP CE3 1 1 10 2663 1 1 6 TRP CG C 0.066 0.116 0.073 1.00 . A A . 6 TRP CG 1 1 10 2664 1 1 6 TRP CH2 C 3.540 2.443 0.131 1.00 . A A . 6 TRP CH2 1 1 10 2665 1 1 6 TRP CZ2 C 2.716 2.356 -0.955 1.00 . A A . 6 TRP CZ2 1 1 10 2666 1 1 6 TRP CZ3 C 3.265 1.740 1.312 1.00 . A A . 6 TRP CZ3 1 1 10 2667 1 1 6 TRP H H -1.679 -2.653 2.404 1.00 . A A . 6 TRP H 1 1 10 2668 1 1 6 TRP HA H -0.951 -2.459 -0.297 1.00 . A A . 6 TRP HA 1 1 10 2669 1 1 6 TRP HB2 H -1.703 -0.520 0.999 1.00 . A A . 6 TRP HB2 1 1 10 2670 1 1 6 TRP HB3 H -0.269 -0.616 2.008 1.00 . A A . 6 TRP HB3 1 1 10 2671 1 1 6 TRP HD1 H -1.185 0.043 -1.683 1.00 . A A . 6 TRP HD1 1 1 10 2672 1 1 6 TRP HE1 H 0.560 1.641 -2.664 1.00 . A A . 6 TRP HE1 1 1 10 2673 1 1 6 TRP HE3 H 1.949 0.394 2.336 1.00 . A A . 6 TRP HE3 1 1 10 2674 1 1 6 TRP HH2 H 4.421 3.069 0.092 1.00 . A A . 6 TRP HH2 1 1 10 2675 1 1 6 TRP HZ2 H 2.944 2.901 -1.860 1.00 . A A . 6 TRP HZ2 1 1 10 2676 1 1 6 TRP HZ3 H 3.943 1.832 2.149 1.00 . A A . 6 TRP HZ3 1 1 10 2677 1 1 6 TRP N N -1.230 -3.095 1.653 1.00 . A A . 6 TRP N 1 1 10 2678 1 1 6 TRP NE1 N 0.608 1.279 -1.758 1.00 . A A . 6 TRP NE1 1 1 10 2679 1 1 6 TRP O O 1.528 -2.889 -0.425 1.00 . A A . 6 TRP O 1 1 10 2680 1 1 7 LEU C C 3.205 -4.523 1.493 1.00 . A A . 7 LEU C 1 1 10 2681 1 1 7 LEU CA C 2.968 -3.087 1.964 1.00 . A A . 7 LEU CA 1 1 10 2682 1 1 7 LEU CB C 3.410 -2.923 3.421 1.00 . A A . 7 LEU CB 1 1 10 2683 1 1 7 LEU CD1 C 3.302 -1.521 5.499 1.00 . A A . 7 LEU CD1 1 1 10 2684 1 1 7 LEU CD2 C 4.411 -0.615 3.447 1.00 . A A . 7 LEU CD2 1 1 10 2685 1 1 7 LEU CG C 3.291 -1.500 3.978 1.00 . A A . 7 LEU CG 1 1 10 2686 1 1 7 LEU H H 1.039 -2.534 2.637 1.00 . A A . 7 LEU H 1 1 10 2687 1 1 7 LEU HA H 3.544 -2.418 1.344 1.00 . A A . 7 LEU HA 1 1 10 2688 1 1 7 LEU HB2 H 2.805 -3.577 4.032 1.00 . A A . 7 LEU HB2 1 1 10 2689 1 1 7 LEU HB3 H 4.438 -3.234 3.503 1.00 . A A . 7 LEU HB3 1 1 10 2690 1 1 7 LEU HD11 H 2.603 -2.265 5.853 1.00 . A A . 7 LEU HD11 1 1 10 2691 1 1 7 LEU HD12 H 3.014 -0.550 5.874 1.00 . A A . 7 LEU HD12 1 1 10 2692 1 1 7 LEU HD13 H 4.295 -1.763 5.849 1.00 . A A . 7 LEU HD13 1 1 10 2693 1 1 7 LEU HD21 H 5.359 -1.114 3.577 1.00 . A A . 7 LEU HD21 1 1 10 2694 1 1 7 LEU HD22 H 4.418 0.320 3.990 1.00 . A A . 7 LEU HD22 1 1 10 2695 1 1 7 LEU HD23 H 4.249 -0.418 2.396 1.00 . A A . 7 LEU HD23 1 1 10 2696 1 1 7 LEU HG H 2.350 -1.075 3.661 1.00 . A A . 7 LEU HG 1 1 10 2697 1 1 7 LEU N N 1.561 -2.725 1.828 1.00 . A A . 7 LEU N 1 1 10 2698 1 1 7 LEU O O 4.234 -4.823 0.885 1.00 . A A . 7 LEU O 1 1 10 2699 1 1 8 ALA C C 2.049 -6.982 -0.135 1.00 . A A . 8 ALA C 1 1 10 2700 1 1 8 ALA CA C 2.323 -6.805 1.364 1.00 . A A . 8 ALA CA 1 1 10 2701 1 1 8 ALA CB C 1.351 -7.646 2.180 1.00 . A A . 8 ALA CB 1 1 10 2702 1 1 8 ALA H H 1.438 -5.095 2.246 1.00 . A A . 8 ALA H 1 1 10 2703 1 1 8 ALA HA H 3.324 -7.150 1.578 1.00 . A A . 8 ALA HA 1 1 10 2704 1 1 8 ALA HB1 H 0.359 -7.227 2.102 1.00 . A A . 8 ALA HB1 1 1 10 2705 1 1 8 ALA HB2 H 1.660 -7.650 3.215 1.00 . A A . 8 ALA HB2 1 1 10 2706 1 1 8 ALA HB3 H 1.345 -8.658 1.802 1.00 . A A . 8 ALA HB3 1 1 10 2707 1 1 8 ALA N N 2.237 -5.402 1.767 1.00 . A A . 8 ALA N 1 1 10 2708 1 1 8 ALA O O 2.391 -8.015 -0.712 1.00 . A A . 8 ALA O 1 1 10 2709 1 1 9 ASP C C 2.290 -5.466 -3.038 1.00 . A A . 9 ASP C 1 1 10 2710 1 1 9 ASP CA C 1.132 -6.016 -2.195 1.00 . A A . 9 ASP CA 1 1 10 2711 1 1 9 ASP CB C -0.150 -5.226 -2.496 1.00 . A A . 9 ASP CB 1 1 10 2712 1 1 9 ASP CG C -1.292 -6.123 -2.930 1.00 . A A . 9 ASP CG 1 1 10 2713 1 1 9 ASP H H 1.197 -5.168 -0.253 1.00 . A A . 9 ASP H 1 1 10 2714 1 1 9 ASP HA H 0.974 -7.050 -2.462 1.00 . A A . 9 ASP HA 1 1 10 2715 1 1 9 ASP HB2 H -0.456 -4.690 -1.611 1.00 . A A . 9 ASP HB2 1 1 10 2716 1 1 9 ASP HB3 H 0.048 -4.518 -3.288 1.00 . A A . 9 ASP HB3 1 1 10 2717 1 1 9 ASP N N 1.440 -5.967 -0.763 1.00 . A A . 9 ASP N 1 1 10 2718 1 1 9 ASP O O 2.116 -5.168 -4.222 1.00 . A A . 9 ASP O 1 1 10 2719 1 1 9 ASP OD1 O -2.046 -6.590 -2.051 1.00 . A A . 9 ASP OD1 1 1 10 2720 1 1 9 ASP OD2 O -1.432 -6.360 -4.148 1.00 . A A . 9 ASP OD2 1 1 10 2721 1 1 10 DAL C C 4.951 -3.371 -2.722 1.00 . A A . 10 DAL C 1 1 10 2722 1 1 10 DAL CA C 4.648 -4.819 -3.116 1.00 . A A . 10 DAL CA 1 1 10 2723 1 1 10 DAL CB C 5.845 -5.703 -2.813 1.00 . A A . 10 DAL CB 1 1 10 2724 1 1 10 DAL H H 3.551 -5.583 -1.482 1.00 . A A . 10 DAL H 1 1 10 2725 1 1 10 DAL HA H 4.459 -4.863 -4.179 1.00 . A A . 10 DAL HA 1 1 10 2726 1 1 10 DAL HB1 H 6.059 -5.660 -1.756 1.00 . A A . 10 DAL HB1 1 1 10 2727 1 1 10 DAL HB2 H 6.701 -5.353 -3.370 1.00 . A A . 10 DAL HB2 1 1 10 2728 1 1 10 DAL HB3 H 5.622 -6.721 -3.095 1.00 . A A . 10 DAL HB3 1 1 10 2729 1 1 10 DAL N N 3.470 -5.333 -2.425 1.00 . A A . 10 DAL N 1 1 10 2730 1 1 10 DAL O O 5.951 -2.801 -3.164 1.00 . A A . 10 DAL O 1 1 10 2731 1 1 11 GLY C C 4.133 -0.416 -2.585 1.00 . A A . 11 GLY C 1 1 10 2732 1 1 11 GLY CA C 4.284 -1.409 -1.454 1.00 . A A . 11 GLY CA 1 1 10 2733 1 1 11 GLY H H 3.310 -3.280 -1.571 1.00 . A A . 11 GLY H 1 1 10 2734 1 1 11 GLY HA2 H 3.558 -1.176 -0.689 1.00 . A A . 11 GLY HA2 1 1 10 2735 1 1 11 GLY HA3 H 5.276 -1.314 -1.036 1.00 . A A . 11 GLY HA3 1 1 10 2736 1 1 11 GLY N N 4.087 -2.780 -1.890 1.00 . A A . 11 GLY N 1 1 10 2737 1 1 11 GLY O O 3.018 -0.016 -2.923 1.00 . A A . 11 GLY O 1 1 10 2738 1 1 12 TRP C C 5.318 0.244 -5.639 1.00 . A A . 12 TRP C 1 1 10 2739 1 1 12 TRP CA C 5.249 0.937 -4.276 1.00 . A A . 12 TRP CA 1 1 10 2740 1 1 12 TRP CB C 6.391 1.937 -4.103 1.00 . A A . 12 TRP CB 1 1 10 2741 1 1 12 TRP CD1 C 6.562 3.266 -1.924 1.00 . A A . 12 TRP CD1 1 1 10 2742 1 1 12 TRP CD2 C 4.993 4.010 -3.340 1.00 . A A . 12 TRP CD2 1 1 10 2743 1 1 12 TRP CE2 C 4.969 4.806 -2.182 1.00 . A A . 12 TRP CE2 1 1 10 2744 1 1 12 TRP CE3 C 4.093 4.295 -4.375 1.00 . A A . 12 TRP CE3 1 1 10 2745 1 1 12 TRP CG C 6.020 3.028 -3.153 1.00 . A A . 12 TRP CG 1 1 10 2746 1 1 12 TRP CH2 C 3.210 6.119 -3.051 1.00 . A A . 12 TRP CH2 1 1 10 2747 1 1 12 TRP CZ2 C 4.080 5.861 -2.025 1.00 . A A . 12 TRP CZ2 1 1 10 2748 1 1 12 TRP CZ3 C 3.214 5.347 -4.220 1.00 . A A . 12 TRP CZ3 1 1 10 2749 1 1 12 TRP H H 6.116 -0.376 -2.859 1.00 . A A . 12 TRP H 1 1 10 2750 1 1 12 TRP HA H 4.313 1.477 -4.220 1.00 . A A . 12 TRP HA 1 1 10 2751 1 1 12 TRP HB2 H 7.257 1.425 -3.709 1.00 . A A . 12 TRP HB2 1 1 10 2752 1 1 12 TRP HB3 H 6.637 2.380 -5.056 1.00 . A A . 12 TRP HB3 1 1 10 2753 1 1 12 TRP HD1 H 7.366 2.688 -1.492 1.00 . A A . 12 TRP HD1 1 1 10 2754 1 1 12 TRP HE1 H 6.147 4.700 -0.448 1.00 . A A . 12 TRP HE1 1 1 10 2755 1 1 12 TRP HE3 H 4.077 3.710 -5.283 1.00 . A A . 12 TRP HE3 1 1 10 2756 1 1 12 TRP HH2 H 2.505 6.934 -2.972 1.00 . A A . 12 TRP HH2 1 1 10 2757 1 1 12 TRP HZ2 H 4.059 6.454 -1.126 1.00 . A A . 12 TRP HZ2 1 1 10 2758 1 1 12 TRP HZ3 H 2.516 5.584 -5.012 1.00 . A A . 12 TRP HZ3 1 1 10 2759 1 1 12 TRP N N 5.259 -0.019 -3.174 1.00 . A A . 12 TRP N 1 1 10 2760 1 1 12 TRP NE1 N 5.935 4.334 -1.333 1.00 . A A . 12 TRP NE1 1 1 10 2761 1 1 12 TRP O O 5.444 0.907 -6.671 1.00 . A A . 12 TRP O 1 1 10 2762 1 1 13 ALA C C 3.824 -1.864 -7.514 1.00 . A A . 13 ALA C 1 1 10 2763 1 1 13 ALA CA C 5.215 -1.853 -6.885 1.00 . A A . 13 ALA CA 1 1 10 2764 1 1 13 ALA CB C 5.705 -3.271 -6.640 1.00 . A A . 13 ALA CB 1 1 10 2765 1 1 13 ALA H H 5.076 -1.563 -4.798 1.00 . A A . 13 ALA H 1 1 10 2766 1 1 13 ALA HA H 5.899 -1.372 -7.565 1.00 . A A . 13 ALA HA 1 1 10 2767 1 1 13 ALA HB1 H 4.874 -3.957 -6.698 1.00 . A A . 13 ALA HB1 1 1 10 2768 1 1 13 ALA HB2 H 6.155 -3.332 -5.660 1.00 . A A . 13 ALA HB2 1 1 10 2769 1 1 13 ALA HB3 H 6.438 -3.528 -7.389 1.00 . A A . 13 ALA HB3 1 1 10 2770 1 1 13 ALA N N 5.200 -1.088 -5.644 1.00 . A A . 13 ALA N 1 1 10 2771 1 1 13 ALA O O 3.686 -1.885 -8.738 1.00 . A A . 13 ALA O 1 1 10 2772 1 1 14 SER C C 1.123 -0.537 -7.922 1.00 . A A . 14 SER C 1 1 10 2773 1 1 14 SER CA C 1.409 -1.806 -7.114 1.00 . A A . 14 SER CA 1 1 10 2774 1 1 14 SER CB C 0.453 -1.903 -5.915 1.00 . A A . 14 SER CB 1 1 10 2775 1 1 14 SER H H 2.978 -1.796 -5.697 1.00 . A A . 14 SER H 1 1 10 2776 1 1 14 SER HA H 1.258 -2.661 -7.753 1.00 . A A . 14 SER HA 1 1 10 2777 1 1 14 SER HB2 H -0.487 -1.438 -6.167 1.00 . A A . 14 SER HB2 1 1 10 2778 1 1 14 SER HB3 H 0.284 -2.942 -5.676 1.00 . A A . 14 SER HB3 1 1 10 2779 1 1 14 SER HG H 1.368 -1.908 -4.175 1.00 . A A . 14 SER HG 1 1 10 2780 1 1 14 SER N N 2.796 -1.827 -6.660 1.00 . A A . 14 SER N 1 1 10 2781 1 1 14 SER O O 0.274 -0.540 -8.815 1.00 . A A . 14 SER O 1 1 10 2782 1 1 14 SER OG O 0.989 -1.253 -4.770 1.00 . A A . 14 SER OG 1 1 10 2783 1 1 15 DAL C C 0.799 2.789 -7.504 1.00 . A A . 15 DAL C 1 1 10 2784 1 1 15 DAL CA C 1.674 1.820 -8.303 1.00 . A A . 15 DAL CA 1 1 10 2785 1 1 15 DAL CB C 3.031 2.443 -8.587 1.00 . A A . 15 DAL CB 1 1 10 2786 1 1 15 DAL H H 2.507 0.484 -6.885 1.00 . A A . 15 DAL H 1 1 10 2787 1 1 15 DAL HA H 1.197 1.621 -9.249 1.00 . A A . 15 DAL HA 1 1 10 2788 1 1 15 DAL HB1 H 3.017 2.895 -9.567 1.00 . A A . 15 DAL HB1 1 1 10 2789 1 1 15 DAL HB2 H 3.792 1.678 -8.554 1.00 . A A . 15 DAL HB2 1 1 10 2790 1 1 15 DAL HB3 H 3.245 3.197 -7.845 1.00 . A A . 15 DAL HB3 1 1 10 2791 1 1 15 DAL N N 1.844 0.546 -7.605 1.00 . A A . 15 DAL N 1 1 10 2792 1 1 15 DAL O O 0.889 4.008 -7.675 1.00 . A A . 15 DAL O 1 1 10 2793 1 1 16 ARG C C -0.229 3.499 -4.527 1.00 . A A . 16 ARG C 1 1 10 2794 1 1 16 ARG CA C -0.938 3.051 -5.807 1.00 . A A . 16 ARG CA 1 1 10 2795 1 1 16 ARG CB C -2.204 2.244 -5.454 1.00 . A A . 16 ARG CB 1 1 10 2796 1 1 16 ARG CD C -2.964 0.080 -4.422 1.00 . A A . 16 ARG CD 1 1 10 2797 1 1 16 ARG CG C -2.003 1.254 -4.314 1.00 . A A . 16 ARG CG 1 1 10 2798 1 1 16 ARG CZ C -3.445 -0.572 -2.083 1.00 . A A . 16 ARG CZ 1 1 10 2799 1 1 16 ARG H H -0.071 1.265 -6.544 1.00 . A A . 16 ARG H 1 1 10 2800 1 1 16 ARG HA H -1.216 3.930 -6.374 1.00 . A A . 16 ARG HA 1 1 10 2801 1 1 16 ARG HB2 H -2.987 2.931 -5.169 1.00 . A A . 16 ARG HB2 1 1 10 2802 1 1 16 ARG HB3 H -2.528 1.684 -6.327 1.00 . A A . 16 ARG HB3 1 1 10 2803 1 1 16 ARG HD2 H -3.972 0.460 -4.495 1.00 . A A . 16 ARG HD2 1 1 10 2804 1 1 16 ARG HD3 H -2.727 -0.478 -5.315 1.00 . A A . 16 ARG HD3 1 1 10 2805 1 1 16 ARG HE H -2.374 -1.649 -3.384 1.00 . A A . 16 ARG HE 1 1 10 2806 1 1 16 ARG HG2 H -0.989 0.880 -4.349 1.00 . A A . 16 ARG HG2 1 1 10 2807 1 1 16 ARG HG3 H -2.169 1.761 -3.374 1.00 . A A . 16 ARG HG3 1 1 10 2808 1 1 16 ARG HH11 H -4.239 1.215 -2.618 1.00 . A A . 16 ARG HH11 1 1 10 2809 1 1 16 ARG HH12 H -4.556 0.721 -0.989 1.00 . A A . 16 ARG HH12 1 1 10 2810 1 1 16 ARG HH21 H -2.796 -2.293 -1.239 1.00 . A A . 16 ARG HH21 1 1 10 2811 1 1 16 ARG HH22 H -3.736 -1.269 -0.205 1.00 . A A . 16 ARG HH22 1 1 10 2812 1 1 16 ARG N N -0.047 2.241 -6.634 1.00 . A A . 16 ARG N 1 1 10 2813 1 1 16 ARG NE N -2.879 -0.817 -3.269 1.00 . A A . 16 ARG NE 1 1 10 2814 1 1 16 ARG NH1 N -4.137 0.547 -1.880 1.00 . A A . 16 ARG NH1 1 1 10 2815 1 1 16 ARG NH2 N -3.315 -1.450 -1.094 1.00 . A A . 16 ARG NH2 1 1 10 2816 1 1 16 ARG O O 0.692 2.829 -4.059 1.00 . A A . 16 ARG O 1 1 10 2817 1 1 17 PRO C C -0.646 4.521 -1.454 1.00 . A A . 17 PRO C 1 1 10 2818 1 1 17 PRO CA C -0.052 5.162 -2.708 1.00 . A A . 17 PRO CA 1 1 10 2819 1 1 17 PRO CB C -0.383 6.661 -2.746 1.00 . A A . 17 PRO CB 1 1 10 2820 1 1 17 PRO CD C -1.718 5.516 -4.410 1.00 . A A . 17 PRO CD 1 1 10 2821 1 1 17 PRO CG C -1.265 6.873 -3.942 1.00 . A A . 17 PRO CG 1 1 10 2822 1 1 17 PRO HA H 1.017 5.027 -2.697 1.00 . A A . 17 PRO HA 1 1 10 2823 1 1 17 PRO HB2 H -0.892 6.936 -1.835 1.00 . A A . 17 PRO HB2 1 1 10 2824 1 1 17 PRO HB3 H 0.536 7.225 -2.831 1.00 . A A . 17 PRO HB3 1 1 10 2825 1 1 17 PRO HD2 H -2.660 5.251 -3.959 1.00 . A A . 17 PRO HD2 1 1 10 2826 1 1 17 PRO HD3 H -1.792 5.497 -5.485 1.00 . A A . 17 PRO HD3 1 1 10 2827 1 1 17 PRO HG2 H -2.120 7.470 -3.660 1.00 . A A . 17 PRO HG2 1 1 10 2828 1 1 17 PRO HG3 H -0.707 7.370 -4.722 1.00 . A A . 17 PRO HG3 1 1 10 2829 1 1 17 PRO N N -0.645 4.639 -3.938 1.00 . A A . 17 PRO N 1 1 10 2830 1 1 17 PRO O O -1.679 3.850 -1.515 1.00 . A A . 17 PRO O 1 1 10 2831 1 1 18 PRO C C -1.800 4.687 1.433 1.00 . A A . 18 PRO C 1 1 10 2832 1 1 18 PRO CA C -0.437 4.158 0.985 1.00 . A A . 18 PRO CA 1 1 10 2833 1 1 18 PRO CB C 0.633 4.605 1.984 1.00 . A A . 18 PRO CB 1 1 10 2834 1 1 18 PRO CD C 1.256 5.495 -0.154 1.00 . A A . 18 PRO CD 1 1 10 2835 1 1 18 PRO CG C 1.361 5.726 1.324 1.00 . A A . 18 PRO CG 1 1 10 2836 1 1 18 PRO HA H -0.467 3.078 0.948 1.00 . A A . 18 PRO HA 1 1 10 2837 1 1 18 PRO HB2 H 0.154 4.936 2.891 1.00 . A A . 18 PRO HB2 1 1 10 2838 1 1 18 PRO HB3 H 1.289 3.781 2.204 1.00 . A A . 18 PRO HB3 1 1 10 2839 1 1 18 PRO HD2 H 1.184 6.436 -0.678 1.00 . A A . 18 PRO HD2 1 1 10 2840 1 1 18 PRO HD3 H 2.104 4.930 -0.509 1.00 . A A . 18 PRO HD3 1 1 10 2841 1 1 18 PRO HG2 H 0.900 6.666 1.587 1.00 . A A . 18 PRO HG2 1 1 10 2842 1 1 18 PRO HG3 H 2.397 5.719 1.631 1.00 . A A . 18 PRO HG3 1 1 10 2843 1 1 18 PRO N N 0.012 4.719 -0.296 1.00 . A A . 18 PRO N 1 1 10 2844 1 1 18 PRO O O -2.126 5.857 1.218 1.00 . A A . 18 PRO O 1 1 10 2845 1 1 19 PRO C C -3.860 4.926 3.923 1.00 . A A . 19 PRO C 1 1 10 2846 1 1 19 PRO CA C -3.925 4.195 2.582 1.00 . A A . 19 PRO CA 1 1 10 2847 1 1 19 PRO CB C -4.636 2.851 2.734 1.00 . A A . 19 PRO CB 1 1 10 2848 1 1 19 PRO CD C -2.279 2.422 2.381 1.00 . A A . 19 PRO CD 1 1 10 2849 1 1 19 PRO CG C -3.572 1.817 2.867 1.00 . A A . 19 PRO CG 1 1 10 2850 1 1 19 PRO HA H -4.458 4.807 1.869 1.00 . A A . 19 PRO HA 1 1 10 2851 1 1 19 PRO HB2 H -5.271 2.871 3.606 1.00 . A A . 19 PRO HB2 1 1 10 2852 1 1 19 PRO HB3 H -5.227 2.671 1.865 1.00 . A A . 19 PRO HB3 1 1 10 2853 1 1 19 PRO HD2 H -1.521 2.364 3.145 1.00 . A A . 19 PRO HD2 1 1 10 2854 1 1 19 PRO HD3 H -1.954 1.912 1.489 1.00 . A A . 19 PRO HD3 1 1 10 2855 1 1 19 PRO HG2 H -3.486 1.517 3.895 1.00 . A A . 19 PRO HG2 1 1 10 2856 1 1 19 PRO HG3 H -3.828 0.963 2.258 1.00 . A A . 19 PRO HG3 1 1 10 2857 1 1 19 PRO N N -2.607 3.825 2.082 1.00 . A A . 19 PRO N 1 1 10 2858 1 1 19 PRO O O -2.925 4.732 4.701 1.00 . A A . 19 PRO O 1 1 10 2859 1 1 20 SER C C -5.423 5.655 6.582 1.00 . A A . 20 SER C 1 1 10 2860 1 1 20 SER CA C -4.922 6.529 5.432 1.00 . A A . 20 SER CA 1 1 10 2861 1 1 20 SER CB C -5.825 7.758 5.271 1.00 . A A . 20 SER CB 1 1 10 2862 1 1 20 SER H H -5.577 5.880 3.522 1.00 . A A . 20 SER H 1 1 10 2863 1 1 20 SER HA H -3.920 6.862 5.663 1.00 . A A . 20 SER HA 1 1 10 2864 1 1 20 SER HB2 H -5.966 8.227 6.233 1.00 . A A . 20 SER HB2 1 1 10 2865 1 1 20 SER HB3 H -5.357 8.459 4.595 1.00 . A A . 20 SER HB3 1 1 10 2866 1 1 20 SER HG H -7.449 8.131 4.239 1.00 . A A . 20 SER HG 1 1 10 2867 1 1 20 SER N N -4.861 5.769 4.184 1.00 . A A . 20 SER N 1 1 10 2868 1 1 20 SER O O -4.756 5.630 7.637 1.00 . A A . 20 SER O 1 1 10 2869 1 1 20 SER OXT O -6.477 5.002 6.418 1.00 . A A . 20 SER OXT 1 1 10 2870 1 1 20 SER OG O -7.095 7.400 4.750 1.00 . A A . 20 SER OG 1 1 11 2871 1 1 1 ASP C C -6.319 -3.396 4.589 1.00 . A A . 1 ASP C 1 1 11 2872 1 1 1 ASP CA C -6.537 -4.414 5.709 1.00 . A A . 1 ASP CA 1 1 11 2873 1 1 1 ASP CB C -7.734 -4.002 6.573 1.00 . A A . 1 ASP CB 1 1 11 2874 1 1 1 ASP CG C -9.054 -4.486 6.001 1.00 . A A . 1 ASP CG 1 1 11 2875 1 1 1 ASP H1 H -5.436 -5.404 7.141 1.00 . A A . 1 ASP H1 1 1 11 2876 1 1 1 ASP H2 H -5.301 -3.695 7.196 1.00 . A A . 1 ASP H2 1 1 11 2877 1 1 1 ASP H3 H -4.498 -4.583 5.966 1.00 . A A . 1 ASP H3 1 1 11 2878 1 1 1 ASP HA H -6.735 -5.380 5.268 1.00 . A A . 1 ASP HA 1 1 11 2879 1 1 1 ASP HB2 H -7.618 -4.420 7.561 1.00 . A A . 1 ASP HB2 1 1 11 2880 1 1 1 ASP HB3 H -7.766 -2.925 6.644 1.00 . A A . 1 ASP HB3 1 1 11 2881 1 1 1 ASP N N -5.335 -4.534 6.581 1.00 . A A . 1 ASP N 1 1 11 2882 1 1 1 ASP O O -6.641 -3.662 3.430 1.00 . A A . 1 ASP O 1 1 11 2883 1 1 1 ASP OD1 O -9.614 -3.789 5.128 1.00 . A A . 1 ASP OD1 1 1 11 2884 1 1 1 ASP OD2 O -9.526 -5.562 6.425 1.00 . A A . 1 ASP OD2 1 1 11 2885 1 1 2 ALA C C -4.018 -0.837 3.926 1.00 . A A . 2 ALA C 1 1 11 2886 1 1 2 ALA CA C -5.506 -1.174 3.970 1.00 . A A . 2 ALA CA 1 1 11 2887 1 1 2 ALA CB C -6.325 0.064 4.300 1.00 . A A . 2 ALA CB 1 1 11 2888 1 1 2 ALA H H -5.536 -2.080 5.882 1.00 . A A . 2 ALA H 1 1 11 2889 1 1 2 ALA HA H -5.812 -1.531 2.997 1.00 . A A . 2 ALA HA 1 1 11 2890 1 1 2 ALA HB1 H -7.012 -0.162 5.101 1.00 . A A . 2 ALA HB1 1 1 11 2891 1 1 2 ALA HB2 H -6.880 0.372 3.426 1.00 . A A . 2 ALA HB2 1 1 11 2892 1 1 2 ALA HB3 H -5.665 0.861 4.606 1.00 . A A . 2 ALA HB3 1 1 11 2893 1 1 2 ALA N N -5.770 -2.231 4.942 1.00 . A A . 2 ALA N 1 1 11 2894 1 1 2 ALA O O -3.353 -1.069 2.917 1.00 . A A . 2 ALA O 1 1 11 2895 1 1 3 TYR C C -1.211 -1.181 5.100 1.00 . A A . 3 TYR C 1 1 11 2896 1 1 3 TYR CA C -2.087 0.070 5.124 1.00 . A A . 3 TYR CA 1 1 11 2897 1 1 3 TYR CB C -1.821 0.893 6.389 1.00 . A A . 3 TYR CB 1 1 11 2898 1 1 3 TYR CD1 C 0.633 1.433 6.618 1.00 . A A . 3 TYR CD1 1 1 11 2899 1 1 3 TYR CD2 C -0.822 3.153 5.829 1.00 . A A . 3 TYR CD2 1 1 11 2900 1 1 3 TYR CE1 C 1.708 2.296 6.527 1.00 . A A . 3 TYR CE1 1 1 11 2901 1 1 3 TYR CE2 C 0.249 4.020 5.739 1.00 . A A . 3 TYR CE2 1 1 11 2902 1 1 3 TYR CG C -0.648 1.842 6.270 1.00 . A A . 3 TYR CG 1 1 11 2903 1 1 3 TYR CZ C 1.511 3.587 6.087 1.00 . A A . 3 TYR CZ 1 1 11 2904 1 1 3 TYR H H -4.088 -0.137 5.803 1.00 . A A . 3 TYR H 1 1 11 2905 1 1 3 TYR HA H -1.845 0.666 4.261 1.00 . A A . 3 TYR HA 1 1 11 2906 1 1 3 TYR HB2 H -2.697 1.482 6.618 1.00 . A A . 3 TYR HB2 1 1 11 2907 1 1 3 TYR HB3 H -1.622 0.221 7.212 1.00 . A A . 3 TYR HB3 1 1 11 2908 1 1 3 TYR HD1 H 0.786 0.420 6.962 1.00 . A A . 3 TYR HD1 1 1 11 2909 1 1 3 TYR HD2 H -1.812 3.492 5.545 1.00 . A A . 3 TYR HD2 1 1 11 2910 1 1 3 TYR HE1 H 2.697 1.957 6.798 1.00 . A A . 3 TYR HE1 1 1 11 2911 1 1 3 TYR HE2 H 0.094 5.033 5.402 1.00 . A A . 3 TYR HE2 1 1 11 2912 1 1 3 TYR HH H 2.967 4.393 5.122 1.00 . A A . 3 TYR HH 1 1 11 2913 1 1 3 TYR N N -3.502 -0.293 5.031 1.00 . A A . 3 TYR N 1 1 11 2914 1 1 3 TYR O O -0.265 -1.266 4.315 1.00 . A A . 3 TYR O 1 1 11 2915 1 1 3 TYR OH O 2.579 4.450 5.999 1.00 . A A . 3 TYR OH 1 1 11 2916 1 1 4 ALA C C -0.985 -4.188 4.685 1.00 . A A . 4 ALA C 1 1 11 2917 1 1 4 ALA CA C -0.805 -3.416 5.991 1.00 . A A . 4 ALA CA 1 1 11 2918 1 1 4 ALA CB C -1.257 -4.258 7.177 1.00 . A A . 4 ALA CB 1 1 11 2919 1 1 4 ALA H H -2.322 -2.044 6.531 1.00 . A A . 4 ALA H 1 1 11 2920 1 1 4 ALA HA H 0.244 -3.182 6.119 1.00 . A A . 4 ALA HA 1 1 11 2921 1 1 4 ALA HB1 H -1.269 -3.647 8.067 1.00 . A A . 4 ALA HB1 1 1 11 2922 1 1 4 ALA HB2 H -0.573 -5.082 7.315 1.00 . A A . 4 ALA HB2 1 1 11 2923 1 1 4 ALA HB3 H -2.250 -4.640 6.989 1.00 . A A . 4 ALA HB3 1 1 11 2924 1 1 4 ALA N N -1.547 -2.160 5.944 1.00 . A A . 4 ALA N 1 1 11 2925 1 1 4 ALA O O -0.068 -4.874 4.230 1.00 . A A . 4 ALA O 1 1 11 2926 1 1 5 GLN C C -1.651 -4.080 1.680 1.00 . A A . 5 GLN C 1 1 11 2927 1 1 5 GLN CA C -2.464 -4.713 2.809 1.00 . A A . 5 GLN CA 1 1 11 2928 1 1 5 GLN CB C -3.962 -4.622 2.502 1.00 . A A . 5 GLN CB 1 1 11 2929 1 1 5 GLN CD C -4.268 -6.786 1.216 1.00 . A A . 5 GLN CD 1 1 11 2930 1 1 5 GLN CG C -4.358 -5.269 1.184 1.00 . A A . 5 GLN CG 1 1 11 2931 1 1 5 GLN H H -2.855 -3.476 4.477 1.00 . A A . 5 GLN H 1 1 11 2932 1 1 5 GLN HA H -2.184 -5.752 2.903 1.00 . A A . 5 GLN HA 1 1 11 2933 1 1 5 GLN HB2 H -4.510 -5.109 3.295 1.00 . A A . 5 GLN HB2 1 1 11 2934 1 1 5 GLN HB3 H -4.247 -3.581 2.467 1.00 . A A . 5 GLN HB3 1 1 11 2935 1 1 5 GLN HE21 H -4.224 -6.854 -0.773 1.00 . A A . 5 GLN HE21 1 1 11 2936 1 1 5 GLN HE22 H -4.147 -8.380 0.033 1.00 . A A . 5 GLN HE22 1 1 11 2937 1 1 5 GLN HG2 H -5.375 -4.990 0.953 1.00 . A A . 5 GLN HG2 1 1 11 2938 1 1 5 GLN HG3 H -3.701 -4.899 0.412 1.00 . A A . 5 GLN HG3 1 1 11 2939 1 1 5 GLN N N -2.169 -4.051 4.074 1.00 . A A . 5 GLN N 1 1 11 2940 1 1 5 GLN NE2 N -4.207 -7.402 0.040 1.00 . A A . 5 GLN NE2 1 1 11 2941 1 1 5 GLN O O -1.162 -4.778 0.793 1.00 . A A . 5 GLN O 1 1 11 2942 1 1 5 GLN OE1 O -4.254 -7.399 2.285 1.00 . A A . 5 GLN OE1 1 1 11 2943 1 1 6 TRP C C 0.718 -2.486 0.732 1.00 . A A . 6 TRP C 1 1 11 2944 1 1 6 TRP CA C -0.730 -2.011 0.740 1.00 . A A . 6 TRP CA 1 1 11 2945 1 1 6 TRP CB C -0.783 -0.509 1.039 1.00 . A A . 6 TRP CB 1 1 11 2946 1 1 6 TRP CD1 C -0.321 0.621 -1.206 1.00 . A A . 6 TRP CD1 1 1 11 2947 1 1 6 TRP CD2 C 1.267 0.965 0.332 1.00 . A A . 6 TRP CD2 1 1 11 2948 1 1 6 TRP CE2 C 1.633 1.633 -0.850 1.00 . A A . 6 TRP CE2 1 1 11 2949 1 1 6 TRP CE3 C 2.117 1.043 1.439 1.00 . A A . 6 TRP CE3 1 1 11 2950 1 1 6 TRP CG C 0.010 0.322 0.080 1.00 . A A . 6 TRP CG 1 1 11 2951 1 1 6 TRP CH2 C 3.621 2.433 0.136 1.00 . A A . 6 TRP CH2 1 1 11 2952 1 1 6 TRP CZ2 C 2.809 2.369 -0.960 1.00 . A A . 6 TRP CZ2 1 1 11 2953 1 1 6 TRP CZ3 C 3.286 1.778 1.330 1.00 . A A . 6 TRP CZ3 1 1 11 2954 1 1 6 TRP H H -1.906 -2.260 2.481 1.00 . A A . 6 TRP H 1 1 11 2955 1 1 6 TRP HA H -1.167 -2.197 -0.229 1.00 . A A . 6 TRP HA 1 1 11 2956 1 1 6 TRP HB2 H -1.807 -0.178 0.999 1.00 . A A . 6 TRP HB2 1 1 11 2957 1 1 6 TRP HB3 H -0.395 -0.333 2.030 1.00 . A A . 6 TRP HB3 1 1 11 2958 1 1 6 TRP HD1 H -1.218 0.282 -1.698 1.00 . A A . 6 TRP HD1 1 1 11 2959 1 1 6 TRP HE1 H 0.638 1.746 -2.687 1.00 . A A . 6 TRP HE1 1 1 11 2960 1 1 6 TRP HE3 H 1.876 0.541 2.366 1.00 . A A . 6 TRP HE3 1 1 11 2961 1 1 6 TRP HH2 H 4.540 3.003 0.095 1.00 . A A . 6 TRP HH2 1 1 11 2962 1 1 6 TRP HZ2 H 3.083 2.875 -1.874 1.00 . A A . 6 TRP HZ2 1 1 11 2963 1 1 6 TRP HZ3 H 3.958 1.850 2.174 1.00 . A A . 6 TRP HZ3 1 1 11 2964 1 1 6 TRP N N -1.499 -2.752 1.738 1.00 . A A . 6 TRP N 1 1 11 2965 1 1 6 TRP NE1 N 0.650 1.404 -1.772 1.00 . A A . 6 TRP NE1 1 1 11 2966 1 1 6 TRP O O 1.280 -2.783 -0.323 1.00 . A A . 6 TRP O 1 1 11 2967 1 1 7 LEU C C 2.831 -4.470 1.641 1.00 . A A . 7 LEU C 1 1 11 2968 1 1 7 LEU CA C 2.686 -3.013 2.081 1.00 . A A . 7 LEU CA 1 1 11 2969 1 1 7 LEU CB C 3.131 -2.847 3.537 1.00 . A A . 7 LEU CB 1 1 11 2970 1 1 7 LEU CD1 C 3.159 -1.372 5.569 1.00 . A A . 7 LEU CD1 1 1 11 2971 1 1 7 LEU CD2 C 4.344 -0.646 3.487 1.00 . A A . 7 LEU CD2 1 1 11 2972 1 1 7 LEU CG C 3.147 -1.402 4.048 1.00 . A A . 7 LEU CG 1 1 11 2973 1 1 7 LEU H H 0.793 -2.317 2.725 1.00 . A A . 7 LEU H 1 1 11 2974 1 1 7 LEU HA H 3.309 -2.396 1.450 1.00 . A A . 7 LEU HA 1 1 11 2975 1 1 7 LEU HB2 H 2.461 -3.421 4.162 1.00 . A A . 7 LEU HB2 1 1 11 2976 1 1 7 LEU HB3 H 4.124 -3.253 3.639 1.00 . A A . 7 LEU HB3 1 1 11 2977 1 1 7 LEU HD11 H 2.406 -2.047 5.948 1.00 . A A . 7 LEU HD11 1 1 11 2978 1 1 7 LEU HD12 H 2.949 -0.369 5.910 1.00 . A A . 7 LEU HD12 1 1 11 2979 1 1 7 LEU HD13 H 4.131 -1.678 5.927 1.00 . A A . 7 LEU HD13 1 1 11 2980 1 1 7 LEU HD21 H 4.491 0.264 4.050 1.00 . A A . 7 LEU HD21 1 1 11 2981 1 1 7 LEU HD22 H 4.162 -0.400 2.450 1.00 . A A . 7 LEU HD22 1 1 11 2982 1 1 7 LEU HD23 H 5.227 -1.263 3.561 1.00 . A A . 7 LEU HD23 1 1 11 2983 1 1 7 LEU HG H 2.249 -0.902 3.715 1.00 . A A . 7 LEU HG 1 1 11 2984 1 1 7 LEU N N 1.307 -2.562 1.925 1.00 . A A . 7 LEU N 1 1 11 2985 1 1 7 LEU O O 3.847 -4.852 1.057 1.00 . A A . 7 LEU O 1 1 11 2986 1 1 8 ALA C C 1.531 -6.871 0.035 1.00 . A A . 8 ALA C 1 1 11 2987 1 1 8 ALA CA C 1.798 -6.688 1.534 1.00 . A A . 8 ALA CA 1 1 11 2988 1 1 8 ALA CB C 0.766 -7.452 2.352 1.00 . A A . 8 ALA CB 1 1 11 2989 1 1 8 ALA H H 1.015 -4.906 2.371 1.00 . A A . 8 ALA H 1 1 11 2990 1 1 8 ALA HA H 2.773 -7.093 1.765 1.00 . A A . 8 ALA HA 1 1 11 2991 1 1 8 ALA HB1 H -0.227 -7.152 2.051 1.00 . A A . 8 ALA HB1 1 1 11 2992 1 1 8 ALA HB2 H 0.905 -7.235 3.401 1.00 . A A . 8 ALA HB2 1 1 11 2993 1 1 8 ALA HB3 H 0.888 -8.512 2.185 1.00 . A A . 8 ALA HB3 1 1 11 2994 1 1 8 ALA N N 1.800 -5.275 1.913 1.00 . A A . 8 ALA N 1 1 11 2995 1 1 8 ALA O O 1.811 -7.933 -0.523 1.00 . A A . 8 ALA O 1 1 11 2996 1 1 9 ASP C C 1.909 -5.427 -2.885 1.00 . A A . 9 ASP C 1 1 11 2997 1 1 9 ASP CA C 0.703 -5.877 -2.049 1.00 . A A . 9 ASP CA 1 1 11 2998 1 1 9 ASP CB C -0.511 -4.997 -2.376 1.00 . A A . 9 ASP CB 1 1 11 2999 1 1 9 ASP CG C -1.658 -5.791 -2.968 1.00 . A A . 9 ASP CG 1 1 11 3000 1 1 9 ASP H H 0.801 -5.007 -0.119 1.00 . A A . 9 ASP H 1 1 11 3001 1 1 9 ASP HA H 0.470 -6.900 -2.303 1.00 . A A . 9 ASP HA 1 1 11 3002 1 1 9 ASP HB2 H -0.860 -4.519 -1.473 1.00 . A A . 9 ASP HB2 1 1 11 3003 1 1 9 ASP HB3 H -0.218 -4.238 -3.087 1.00 . A A . 9 ASP HB3 1 1 11 3004 1 1 9 ASP N N 0.997 -5.828 -0.614 1.00 . A A . 9 ASP N 1 1 11 3005 1 1 9 ASP O O 1.770 -5.129 -4.073 1.00 . A A . 9 ASP O 1 1 11 3006 1 1 9 ASP OD1 O -1.681 -5.970 -4.204 1.00 . A A . 9 ASP OD1 1 1 11 3007 1 1 9 ASP OD2 O -2.534 -6.234 -2.196 1.00 . A A . 9 ASP OD2 1 1 11 3008 1 1 10 DAL C C 4.711 -3.533 -2.575 1.00 . A A . 10 DAL C 1 1 11 3009 1 1 10 DAL CA C 4.311 -4.966 -2.943 1.00 . A A . 10 DAL CA 1 1 11 3010 1 1 10 DAL CB C 5.439 -5.924 -2.604 1.00 . A A . 10 DAL CB 1 1 11 3011 1 1 10 DAL H H 3.142 -5.625 -1.314 1.00 . A A . 10 DAL H 1 1 11 3012 1 1 10 DAL HA H 4.135 -5.018 -4.007 1.00 . A A . 10 DAL HA 1 1 11 3013 1 1 10 DAL HB1 H 5.723 -5.787 -1.571 1.00 . A A . 10 DAL HB1 1 1 11 3014 1 1 10 DAL HB2 H 6.287 -5.724 -3.241 1.00 . A A . 10 DAL HB2 1 1 11 3015 1 1 10 DAL HB3 H 5.106 -6.940 -2.754 1.00 . A A . 10 DAL HB3 1 1 11 3016 1 1 10 DAL N N 3.090 -5.379 -2.259 1.00 . A A . 10 DAL N 1 1 11 3017 1 1 10 DAL O O 5.754 -3.045 -3.015 1.00 . A A . 10 DAL O 1 1 11 3018 1 1 11 GLY C C 4.095 -0.524 -2.511 1.00 . A A . 11 GLY C 1 1 11 3019 1 1 11 GLY CA C 4.168 -1.502 -1.358 1.00 . A A . 11 GLY CA 1 1 11 3020 1 1 11 GLY H H 3.066 -3.303 -1.449 1.00 . A A . 11 GLY H 1 1 11 3021 1 1 11 GLY HA2 H 3.453 -1.204 -0.605 1.00 . A A . 11 GLY HA2 1 1 11 3022 1 1 11 GLY HA3 H 5.160 -1.467 -0.932 1.00 . A A . 11 GLY HA3 1 1 11 3023 1 1 11 GLY N N 3.880 -2.865 -1.768 1.00 . A A . 11 GLY N 1 1 11 3024 1 1 11 GLY O O 3.010 -0.069 -2.877 1.00 . A A . 11 GLY O 1 1 11 3025 1 1 12 TRP C C 5.358 0.012 -5.556 1.00 . A A . 12 TRP C 1 1 11 3026 1 1 12 TRP CA C 5.312 0.732 -4.206 1.00 . A A . 12 TRP CA 1 1 11 3027 1 1 12 TRP CB C 6.510 1.667 -4.037 1.00 . A A . 12 TRP CB 1 1 11 3028 1 1 12 TRP CD1 C 6.729 3.029 -1.883 1.00 . A A . 12 TRP CD1 1 1 11 3029 1 1 12 TRP CD2 C 5.225 3.833 -3.336 1.00 . A A . 12 TRP CD2 1 1 11 3030 1 1 12 TRP CE2 C 5.231 4.653 -2.195 1.00 . A A . 12 TRP CE2 1 1 11 3031 1 1 12 TRP CE3 C 4.356 4.148 -4.390 1.00 . A A . 12 TRP CE3 1 1 11 3032 1 1 12 TRP CG C 6.190 2.798 -3.115 1.00 . A A . 12 TRP CG 1 1 11 3033 1 1 12 TRP CH2 C 3.564 6.048 -3.116 1.00 . A A . 12 TRP CH2 1 1 11 3034 1 1 12 TRP CZ2 C 4.403 5.761 -2.072 1.00 . A A . 12 TRP CZ2 1 1 11 3035 1 1 12 TRP CZ3 C 3.538 5.253 -4.269 1.00 . A A . 12 TRP CZ3 1 1 11 3036 1 1 12 TRP H H 6.082 -0.599 -2.751 1.00 . A A . 12 TRP H 1 1 11 3037 1 1 12 TRP HA H 4.410 1.327 -4.174 1.00 . A A . 12 TRP HA 1 1 11 3038 1 1 12 TRP HB2 H 7.339 1.114 -3.619 1.00 . A A . 12 TRP HB2 1 1 11 3039 1 1 12 TRP HB3 H 6.794 2.076 -4.995 1.00 . A A . 12 TRP HB3 1 1 11 3040 1 1 12 TRP HD1 H 7.492 2.415 -1.428 1.00 . A A . 12 TRP HD1 1 1 11 3041 1 1 12 TRP HE1 H 6.378 4.514 -0.442 1.00 . A A . 12 TRP HE1 1 1 11 3042 1 1 12 TRP HE3 H 4.319 3.547 -5.286 1.00 . A A . 12 TRP HE3 1 1 11 3043 1 1 12 TRP HH2 H 2.907 6.903 -3.063 1.00 . A A . 12 TRP HH2 1 1 11 3044 1 1 12 TRP HZ2 H 4.405 6.373 -1.186 1.00 . A A . 12 TRP HZ2 1 1 11 3045 1 1 12 TRP HZ3 H 2.866 5.513 -5.075 1.00 . A A . 12 TRP HZ3 1 1 11 3046 1 1 12 TRP N N 5.251 -0.201 -3.087 1.00 . A A . 12 TRP N 1 1 11 3047 1 1 12 TRP NE1 N 6.157 4.143 -1.322 1.00 . A A . 12 TRP NE1 1 1 11 3048 1 1 12 TRP O O 5.539 0.647 -6.597 1.00 . A A . 12 TRP O 1 1 11 3049 1 1 13 ALA C C 3.764 -2.039 -7.412 1.00 . A A . 13 ALA C 1 1 11 3050 1 1 13 ALA CA C 5.145 -2.096 -6.767 1.00 . A A . 13 ALA CA 1 1 11 3051 1 1 13 ALA CB C 5.554 -3.534 -6.493 1.00 . A A . 13 ALA CB 1 1 11 3052 1 1 13 ALA H H 4.995 -1.762 -4.687 1.00 . A A . 13 ALA H 1 1 11 3053 1 1 13 ALA HA H 5.863 -1.663 -7.446 1.00 . A A . 13 ALA HA 1 1 11 3054 1 1 13 ALA HB1 H 6.559 -3.693 -6.853 1.00 . A A . 13 ALA HB1 1 1 11 3055 1 1 13 ALA HB2 H 4.879 -4.205 -7.003 1.00 . A A . 13 ALA HB2 1 1 11 3056 1 1 13 ALA HB3 H 5.517 -3.724 -5.431 1.00 . A A . 13 ALA HB3 1 1 11 3057 1 1 13 ALA N N 5.160 -1.310 -5.540 1.00 . A A . 13 ALA N 1 1 11 3058 1 1 13 ALA O O 3.641 -2.063 -8.638 1.00 . A A . 13 ALA O 1 1 11 3059 1 1 14 SER C C 1.163 -0.584 -7.895 1.00 . A A . 14 SER C 1 1 11 3060 1 1 14 SER CA C 1.352 -1.843 -7.047 1.00 . A A . 14 SER CA 1 1 11 3061 1 1 14 SER CB C 0.375 -1.839 -5.861 1.00 . A A . 14 SER CB 1 1 11 3062 1 1 14 SER H H 2.900 -1.904 -5.607 1.00 . A A . 14 SER H 1 1 11 3063 1 1 14 SER HA H 1.154 -2.705 -7.663 1.00 . A A . 14 SER HA 1 1 11 3064 1 1 14 SER HB2 H -0.526 -1.316 -6.141 1.00 . A A . 14 SER HB2 1 1 11 3065 1 1 14 SER HB3 H 0.130 -2.858 -5.597 1.00 . A A . 14 SER HB3 1 1 11 3066 1 1 14 SER HG H 1.260 -1.860 -4.106 1.00 . A A . 14 SER HG 1 1 11 3067 1 1 14 SER N N 2.730 -1.936 -6.572 1.00 . A A . 14 SER N 1 1 11 3068 1 1 14 SER O O 0.352 -0.568 -8.823 1.00 . A A . 14 SER O 1 1 11 3069 1 1 14 SER OG O 0.939 -1.198 -4.726 1.00 . A A . 14 SER OG 1 1 11 3070 1 1 15 DAL C C 1.031 2.774 -7.545 1.00 . A A . 15 DAL C 1 1 11 3071 1 1 15 DAL CA C 1.853 1.730 -8.303 1.00 . A A . 15 DAL CA 1 1 11 3072 1 1 15 DAL CB C 3.254 2.252 -8.576 1.00 . A A . 15 DAL CB 1 1 11 3073 1 1 15 DAL H H 2.553 0.387 -6.823 1.00 . A A . 15 DAL H 1 1 11 3074 1 1 15 DAL HA H 1.381 1.539 -9.254 1.00 . A A . 15 DAL HA 1 1 11 3075 1 1 15 DAL HB1 H 3.537 2.948 -7.801 1.00 . A A . 15 DAL HB1 1 1 11 3076 1 1 15 DAL HB2 H 3.267 2.752 -9.533 1.00 . A A . 15 DAL HB2 1 1 11 3077 1 1 15 DAL HB3 H 3.949 1.427 -8.591 1.00 . A A . 15 DAL HB3 1 1 11 3078 1 1 15 DAL N N 1.925 0.467 -7.572 1.00 . A A . 15 DAL N 1 1 11 3079 1 1 15 DAL O O 1.215 3.979 -7.733 1.00 . A A . 15 DAL O 1 1 11 3080 1 1 16 ARG C C -0.021 3.612 -4.608 1.00 . A A . 16 ARG C 1 1 11 3081 1 1 16 ARG CA C -0.726 3.195 -5.901 1.00 . A A . 16 ARG CA 1 1 11 3082 1 1 16 ARG CB C -2.063 2.497 -5.578 1.00 . A A . 16 ARG CB 1 1 11 3083 1 1 16 ARG CD C -3.178 0.587 -4.382 1.00 . A A . 16 ARG CD 1 1 11 3084 1 1 16 ARG CG C -1.992 1.542 -4.393 1.00 . A A . 16 ARG CG 1 1 11 3085 1 1 16 ARG CZ C -2.838 -1.336 -2.857 1.00 . A A . 16 ARG CZ 1 1 11 3086 1 1 16 ARG H H 0.026 1.334 -6.583 1.00 . A A . 16 ARG H 1 1 11 3087 1 1 16 ARG HA H -0.916 4.082 -6.491 1.00 . A A . 16 ARG HA 1 1 11 3088 1 1 16 ARG HB2 H -2.803 3.252 -5.358 1.00 . A A . 16 ARG HB2 1 1 11 3089 1 1 16 ARG HB3 H -2.389 1.928 -6.444 1.00 . A A . 16 ARG HB3 1 1 11 3090 1 1 16 ARG HD2 H -4.079 1.153 -4.568 1.00 . A A . 16 ARG HD2 1 1 11 3091 1 1 16 ARG HD3 H -3.046 -0.141 -5.169 1.00 . A A . 16 ARG HD3 1 1 11 3092 1 1 16 ARG HE H -3.802 0.354 -2.389 1.00 . A A . 16 ARG HE 1 1 11 3093 1 1 16 ARG HG2 H -1.076 0.968 -4.456 1.00 . A A . 16 ARG HG2 1 1 11 3094 1 1 16 ARG HG3 H -1.996 2.118 -3.479 1.00 . A A . 16 ARG HG3 1 1 11 3095 1 1 16 ARG HH11 H -2.017 -1.596 -4.691 1.00 . A A . 16 ARG HH11 1 1 11 3096 1 1 16 ARG HH12 H -1.816 -2.919 -3.596 1.00 . A A . 16 ARG HH12 1 1 11 3097 1 1 16 ARG HH21 H -3.528 -1.395 -0.955 1.00 . A A . 16 ARG HH21 1 1 11 3098 1 1 16 ARG HH22 H -2.674 -2.808 -1.478 1.00 . A A . 16 ARG HH22 1 1 11 3099 1 1 16 ARG N N 0.125 2.305 -6.689 1.00 . A A . 16 ARG N 1 1 11 3100 1 1 16 ARG NE N -3.318 -0.112 -3.103 1.00 . A A . 16 ARG NE 1 1 11 3101 1 1 16 ARG NH1 N -2.169 -2.004 -3.792 1.00 . A A . 16 ARG NH1 1 1 11 3102 1 1 16 ARG NH2 N -3.029 -1.892 -1.665 1.00 . A A . 16 ARG NH2 1 1 11 3103 1 1 16 ARG O O 0.837 2.887 -4.105 1.00 . A A . 16 ARG O 1 1 11 3104 1 1 17 PRO C C -0.424 4.709 -1.559 1.00 . A A . 17 PRO C 1 1 11 3105 1 1 17 PRO CA C 0.229 5.292 -2.813 1.00 . A A . 17 PRO CA 1 1 11 3106 1 1 17 PRO CB C -0.006 6.809 -2.877 1.00 . A A . 17 PRO CB 1 1 11 3107 1 1 17 PRO CD C -1.363 5.732 -4.569 1.00 . A A . 17 PRO CD 1 1 11 3108 1 1 17 PRO CG C -0.831 7.062 -4.105 1.00 . A A . 17 PRO CG 1 1 11 3109 1 1 17 PRO HA H 1.287 5.093 -2.780 1.00 . A A . 17 PRO HA 1 1 11 3110 1 1 17 PRO HB2 H -0.528 7.126 -1.987 1.00 . A A . 17 PRO HB2 1 1 11 3111 1 1 17 PRO HB3 H 0.949 7.314 -2.934 1.00 . A A . 17 PRO HB3 1 1 11 3112 1 1 17 PRO HD2 H -2.336 5.541 -4.146 1.00 . A A . 17 PRO HD2 1 1 11 3113 1 1 17 PRO HD3 H -1.403 5.701 -5.645 1.00 . A A . 17 PRO HD3 1 1 11 3114 1 1 17 PRO HG2 H -1.650 7.722 -3.862 1.00 . A A . 17 PRO HG2 1 1 11 3115 1 1 17 PRO HG3 H -0.213 7.505 -4.872 1.00 . A A . 17 PRO HG3 1 1 11 3116 1 1 17 PRO N N -0.370 4.790 -4.049 1.00 . A A . 17 PRO N 1 1 11 3117 1 1 17 PRO O O -1.492 4.097 -1.627 1.00 . A A . 17 PRO O 1 1 11 3118 1 1 18 PRO C C -1.604 5.003 1.313 1.00 . A A . 18 PRO C 1 1 11 3119 1 1 18 PRO CA C -0.272 4.383 0.892 1.00 . A A . 18 PRO CA 1 1 11 3120 1 1 18 PRO CB C 0.811 4.788 1.896 1.00 . A A . 18 PRO CB 1 1 11 3121 1 1 18 PRO CD C 1.509 5.600 -0.247 1.00 . A A . 18 PRO CD 1 1 11 3122 1 1 18 PRO CG C 1.603 5.859 1.228 1.00 . A A . 18 PRO CG 1 1 11 3123 1 1 18 PRO HA H -0.366 3.307 0.877 1.00 . A A . 18 PRO HA 1 1 11 3124 1 1 18 PRO HB2 H 0.342 5.157 2.792 1.00 . A A . 18 PRO HB2 1 1 11 3125 1 1 18 PRO HB3 H 1.421 3.936 2.135 1.00 . A A . 18 PRO HB3 1 1 11 3126 1 1 18 PRO HD2 H 1.499 6.533 -0.792 1.00 . A A . 18 PRO HD2 1 1 11 3127 1 1 18 PRO HD3 H 2.330 4.981 -0.574 1.00 . A A . 18 PRO HD3 1 1 11 3128 1 1 18 PRO HG2 H 1.184 6.825 1.464 1.00 . A A . 18 PRO HG2 1 1 11 3129 1 1 18 PRO HG3 H 2.632 5.808 1.551 1.00 . A A . 18 PRO HG3 1 1 11 3130 1 1 18 PRO N N 0.227 4.892 -0.394 1.00 . A A . 18 PRO N 1 1 11 3131 1 1 18 PRO O O -1.872 6.174 1.036 1.00 . A A . 18 PRO O 1 1 11 3132 1 1 19 PRO C C -3.637 5.487 3.783 1.00 . A A . 19 PRO C 1 1 11 3133 1 1 19 PRO CA C -3.746 4.684 2.488 1.00 . A A . 19 PRO CA 1 1 11 3134 1 1 19 PRO CB C -4.526 3.391 2.718 1.00 . A A . 19 PRO CB 1 1 11 3135 1 1 19 PRO CD C -2.196 2.819 2.382 1.00 . A A . 19 PRO CD 1 1 11 3136 1 1 19 PRO CG C -3.517 2.311 2.905 1.00 . A A . 19 PRO CG 1 1 11 3137 1 1 19 PRO HA H -4.250 5.280 1.741 1.00 . A A . 19 PRO HA 1 1 11 3138 1 1 19 PRO HB2 H -5.153 3.495 3.589 1.00 . A A . 19 PRO HB2 1 1 11 3139 1 1 19 PRO HB3 H -5.131 3.195 1.863 1.00 . A A . 19 PRO HB3 1 1 11 3140 1 1 19 PRO HD2 H -1.437 2.763 3.147 1.00 . A A . 19 PRO HD2 1 1 11 3141 1 1 19 PRO HD3 H -1.903 2.244 1.519 1.00 . A A . 19 PRO HD3 1 1 11 3142 1 1 19 PRO HG2 H -3.442 2.063 3.947 1.00 . A A . 19 PRO HG2 1 1 11 3143 1 1 19 PRO HG3 H -3.821 1.439 2.344 1.00 . A A . 19 PRO HG3 1 1 11 3144 1 1 19 PRO N N -2.451 4.219 2.008 1.00 . A A . 19 PRO N 1 1 11 3145 1 1 19 PRO O O -2.719 5.279 4.578 1.00 . A A . 19 PRO O 1 1 11 3146 1 1 20 SER C C -6.023 7.493 5.667 1.00 . A A . 20 SER C 1 1 11 3147 1 1 20 SER CA C -4.593 7.245 5.184 1.00 . A A . 20 SER CA 1 1 11 3148 1 1 20 SER CB C -3.889 8.579 4.911 1.00 . A A . 20 SER CB 1 1 11 3149 1 1 20 SER H H -5.284 6.525 3.314 1.00 . A A . 20 SER H 1 1 11 3150 1 1 20 SER HA H -4.055 6.719 5.959 1.00 . A A . 20 SER HA 1 1 11 3151 1 1 20 SER HB2 H -4.053 9.247 5.744 1.00 . A A . 20 SER HB2 1 1 11 3152 1 1 20 SER HB3 H -2.829 8.406 4.793 1.00 . A A . 20 SER HB3 1 1 11 3153 1 1 20 SER HG H -3.776 9.034 3.008 1.00 . A A . 20 SER HG 1 1 11 3154 1 1 20 SER N N -4.580 6.406 3.987 1.00 . A A . 20 SER N 1 1 11 3155 1 1 20 SER O O -6.288 7.262 6.866 1.00 . A A . 20 SER O 1 1 11 3156 1 1 20 SER OXT O -6.866 7.914 4.845 1.00 . A A . 20 SER OXT 1 1 11 3157 1 1 20 SER OG O -4.385 9.193 3.732 1.00 . A A . 20 SER OG 1 1 12 3158 1 1 1 ASP C C -5.702 -3.063 5.728 1.00 . A A . 1 ASP C 1 1 12 3159 1 1 1 ASP CA C -6.239 -3.345 7.131 1.00 . A A . 1 ASP CA 1 1 12 3160 1 1 1 ASP CB C -7.767 -3.471 7.099 1.00 . A A . 1 ASP CB 1 1 12 3161 1 1 1 ASP CG C -8.321 -4.138 8.344 1.00 . A A . 1 ASP CG 1 1 12 3162 1 1 1 ASP H1 H -4.844 -2.088 7.982 1.00 . A A . 1 ASP H1 1 1 12 3163 1 1 1 ASP H2 H -6.097 -2.588 9.043 1.00 . A A . 1 ASP H2 1 1 12 3164 1 1 1 ASP H3 H -6.413 -1.413 7.833 1.00 . A A . 1 ASP H3 1 1 12 3165 1 1 1 ASP HA H -5.815 -4.273 7.487 1.00 . A A . 1 ASP HA 1 1 12 3166 1 1 1 ASP HB2 H -8.201 -2.485 7.018 1.00 . A A . 1 ASP HB2 1 1 12 3167 1 1 1 ASP HB3 H -8.055 -4.058 6.239 1.00 . A A . 1 ASP HB3 1 1 12 3168 1 1 1 ASP N N -5.865 -2.261 8.082 1.00 . A A . 1 ASP N 1 1 12 3169 1 1 1 ASP O O -4.947 -3.863 5.173 1.00 . A A . 1 ASP O 1 1 12 3170 1 1 1 ASP OD1 O -8.359 -5.386 8.383 1.00 . A A . 1 ASP OD1 1 1 12 3171 1 1 1 ASP OD2 O -8.718 -3.412 9.280 1.00 . A A . 1 ASP OD2 1 1 12 3172 1 1 2 ALA C C -4.160 -1.185 3.814 1.00 . A A . 2 ALA C 1 1 12 3173 1 1 2 ALA CA C -5.650 -1.524 3.827 1.00 . A A . 2 ALA CA 1 1 12 3174 1 1 2 ALA CB C -6.462 -0.341 3.326 1.00 . A A . 2 ALA CB 1 1 12 3175 1 1 2 ALA H H -6.694 -1.322 5.660 1.00 . A A . 2 ALA H 1 1 12 3176 1 1 2 ALA HA H -5.825 -2.357 3.162 1.00 . A A . 2 ALA HA 1 1 12 3177 1 1 2 ALA HB1 H -7.489 -0.452 3.638 1.00 . A A . 2 ALA HB1 1 1 12 3178 1 1 2 ALA HB2 H -6.414 -0.305 2.248 1.00 . A A . 2 ALA HB2 1 1 12 3179 1 1 2 ALA HB3 H -6.056 0.571 3.736 1.00 . A A . 2 ALA HB3 1 1 12 3180 1 1 2 ALA N N -6.094 -1.918 5.164 1.00 . A A . 2 ALA N 1 1 12 3181 1 1 2 ALA O O -3.461 -1.481 2.845 1.00 . A A . 2 ALA O 1 1 12 3182 1 1 3 TYR C C -1.379 -1.426 4.977 1.00 . A A . 3 TYR C 1 1 12 3183 1 1 3 TYR CA C -2.272 -0.188 5.012 1.00 . A A . 3 TYR CA 1 1 12 3184 1 1 3 TYR CB C -2.033 0.610 6.299 1.00 . A A . 3 TYR CB 1 1 12 3185 1 1 3 TYR CD1 C 0.403 1.209 6.564 1.00 . A A . 3 TYR CD1 1 1 12 3186 1 1 3 TYR CD2 C -1.092 2.906 5.800 1.00 . A A . 3 TYR CD2 1 1 12 3187 1 1 3 TYR CE1 C 1.454 2.102 6.504 1.00 . A A . 3 TYR CE1 1 1 12 3188 1 1 3 TYR CE2 C -0.045 3.805 5.742 1.00 . A A . 3 TYR CE2 1 1 12 3189 1 1 3 TYR CG C -0.886 1.592 6.212 1.00 . A A . 3 TYR CG 1 1 12 3190 1 1 3 TYR CZ C 1.226 3.398 6.093 1.00 . A A . 3 TYR CZ 1 1 12 3191 1 1 3 TYR H H -4.296 -0.359 5.633 1.00 . A A . 3 TYR H 1 1 12 3192 1 1 3 TYR HA H -2.025 0.429 4.165 1.00 . A A . 3 TYR HA 1 1 12 3193 1 1 3 TYR HB2 H -2.924 1.170 6.539 1.00 . A A . 3 TYR HB2 1 1 12 3194 1 1 3 TYR HB3 H -1.821 -0.078 7.105 1.00 . A A . 3 TYR HB3 1 1 12 3195 1 1 3 TYR HD1 H 0.579 0.193 6.884 1.00 . A A . 3 TYR HD1 1 1 12 3196 1 1 3 TYR HD2 H -2.088 3.224 5.513 1.00 . A A . 3 TYR HD2 1 1 12 3197 1 1 3 TYR HE1 H 2.449 1.784 6.778 1.00 . A A . 3 TYR HE1 1 1 12 3198 1 1 3 TYR HE2 H -0.224 4.821 5.427 1.00 . A A . 3 TYR HE2 1 1 12 3199 1 1 3 TYR HH H 2.326 4.775 6.864 1.00 . A A . 3 TYR HH 1 1 12 3200 1 1 3 TYR N N -3.683 -0.565 4.895 1.00 . A A . 3 TYR N 1 1 12 3201 1 1 3 TYR O O -0.388 -1.462 4.246 1.00 . A A . 3 TYR O 1 1 12 3202 1 1 3 TYR OH O 2.270 4.292 6.035 1.00 . A A . 3 TYR OH 1 1 12 3203 1 1 4 ALA C C -1.109 -4.424 4.443 1.00 . A A . 4 ALA C 1 1 12 3204 1 1 4 ALA CA C -0.996 -3.698 5.782 1.00 . A A . 4 ALA CA 1 1 12 3205 1 1 4 ALA CB C -1.487 -4.588 6.915 1.00 . A A . 4 ALA CB 1 1 12 3206 1 1 4 ALA H H -2.560 -2.367 6.296 1.00 . A A . 4 ALA H 1 1 12 3207 1 1 4 ALA HA H 0.044 -3.458 5.964 1.00 . A A . 4 ALA HA 1 1 12 3208 1 1 4 ALA HB1 H -0.985 -5.542 6.867 1.00 . A A . 4 ALA HB1 1 1 12 3209 1 1 4 ALA HB2 H -2.553 -4.736 6.819 1.00 . A A . 4 ALA HB2 1 1 12 3210 1 1 4 ALA HB3 H -1.274 -4.115 7.862 1.00 . A A . 4 ALA HB3 1 1 12 3211 1 1 4 ALA N N -1.751 -2.449 5.750 1.00 . A A . 4 ALA N 1 1 12 3212 1 1 4 ALA O O -0.158 -5.069 3.998 1.00 . A A . 4 ALA O 1 1 12 3213 1 1 5 GLN C C -1.667 -4.238 1.422 1.00 . A A . 5 GLN C 1 1 12 3214 1 1 5 GLN CA C -2.506 -4.924 2.500 1.00 . A A . 5 GLN CA 1 1 12 3215 1 1 5 GLN CB C -3.993 -4.858 2.139 1.00 . A A . 5 GLN CB 1 1 12 3216 1 1 5 GLN CD C -4.322 -7.066 0.953 1.00 . A A . 5 GLN CD 1 1 12 3217 1 1 5 GLN CG C -4.335 -5.553 0.833 1.00 . A A . 5 GLN CG 1 1 12 3218 1 1 5 GLN H H -2.991 -3.759 4.193 1.00 . A A . 5 GLN H 1 1 12 3219 1 1 5 GLN HA H -2.205 -5.958 2.571 1.00 . A A . 5 GLN HA 1 1 12 3220 1 1 5 GLN HB2 H -4.564 -5.323 2.930 1.00 . A A . 5 GLN HB2 1 1 12 3221 1 1 5 GLN HB3 H -4.286 -3.822 2.058 1.00 . A A . 5 GLN HB3 1 1 12 3222 1 1 5 GLN HE21 H -2.479 -7.142 0.204 1.00 . A A . 5 GLN HE21 1 1 12 3223 1 1 5 GLN HE22 H -3.185 -8.663 0.620 1.00 . A A . 5 GLN HE22 1 1 12 3224 1 1 5 GLN HG2 H -5.320 -5.239 0.520 1.00 . A A . 5 GLN HG2 1 1 12 3225 1 1 5 GLN HG3 H -3.611 -5.258 0.091 1.00 . A A . 5 GLN HG3 1 1 12 3226 1 1 5 GLN N N -2.274 -4.298 3.795 1.00 . A A . 5 GLN N 1 1 12 3227 1 1 5 GLN NE2 N -3.217 -7.686 0.552 1.00 . A A . 5 GLN NE2 1 1 12 3228 1 1 5 GLN O O -1.138 -4.896 0.526 1.00 . A A . 5 GLN O 1 1 12 3229 1 1 5 GLN OE1 O -5.296 -7.671 1.402 1.00 . A A . 5 GLN OE1 1 1 12 3230 1 1 6 TRP C C 0.707 -2.576 0.613 1.00 . A A . 6 TRP C 1 1 12 3231 1 1 6 TRP CA C -0.749 -2.127 0.583 1.00 . A A . 6 TRP CA 1 1 12 3232 1 1 6 TRP CB C -0.842 -0.636 0.920 1.00 . A A . 6 TRP CB 1 1 12 3233 1 1 6 TRP CD1 C -0.324 0.548 -1.285 1.00 . A A . 6 TRP CD1 1 1 12 3234 1 1 6 TRP CD2 C 1.197 0.900 0.318 1.00 . A A . 6 TRP CD2 1 1 12 3235 1 1 6 TRP CE2 C 1.591 1.598 -0.837 1.00 . A A . 6 TRP CE2 1 1 12 3236 1 1 6 TRP CE3 C 2.003 0.977 1.458 1.00 . A A . 6 TRP CE3 1 1 12 3237 1 1 6 TRP CG C -0.035 0.234 0.008 1.00 . A A . 6 TRP CG 1 1 12 3238 1 1 6 TRP CH2 C 3.522 2.424 0.238 1.00 . A A . 6 TRP CH2 1 1 12 3239 1 1 6 TRP CZ2 C 2.753 2.362 -0.889 1.00 . A A . 6 TRP CZ2 1 1 12 3240 1 1 6 TRP CZ3 C 3.158 1.740 1.407 1.00 . A A . 6 TRP CZ3 1 1 12 3241 1 1 6 TRP H H -1.977 -2.450 2.276 1.00 . A A . 6 TRP H 1 1 12 3242 1 1 6 TRP HA H -1.148 -2.294 -0.405 1.00 . A A . 6 TRP HA 1 1 12 3243 1 1 6 TRP HB2 H -1.872 -0.324 0.852 1.00 . A A . 6 TRP HB2 1 1 12 3244 1 1 6 TRP HB3 H -0.491 -0.478 1.927 1.00 . A A . 6 TRP HB3 1 1 12 3245 1 1 6 TRP HD1 H -1.193 0.196 -1.816 1.00 . A A . 6 TRP HD1 1 1 12 3246 1 1 6 TRP HE1 H 0.664 1.721 -2.708 1.00 . A A . 6 TRP HE1 1 1 12 3247 1 1 6 TRP HE3 H 1.738 0.453 2.366 1.00 . A A . 6 TRP HE3 1 1 12 3248 1 1 6 TRP HH2 H 4.428 3.015 0.242 1.00 . A A . 6 TRP HH2 1 1 12 3249 1 1 6 TRP HZ2 H 3.049 2.891 -1.783 1.00 . A A . 6 TRP HZ2 1 1 12 3250 1 1 6 TRP HZ3 H 3.795 1.810 2.278 1.00 . A A . 6 TRP HZ3 1 1 12 3251 1 1 6 TRP N N -1.538 -2.911 1.530 1.00 . A A . 6 TRP N 1 1 12 3252 1 1 6 TRP NE1 N 0.649 1.363 -1.799 1.00 . A A . 6 TRP NE1 1 1 12 3253 1 1 6 TRP O O 1.311 -2.835 -0.429 1.00 . A A . 6 TRP O 1 1 12 3254 1 1 7 LEU C C 2.824 -4.549 1.547 1.00 . A A . 7 LEU C 1 1 12 3255 1 1 7 LEU CA C 2.637 -3.104 2.013 1.00 . A A . 7 LEU CA 1 1 12 3256 1 1 7 LEU CB C 3.031 -2.963 3.486 1.00 . A A . 7 LEU CB 1 1 12 3257 1 1 7 LEU CD1 C 3.018 -1.520 5.538 1.00 . A A . 7 LEU CD1 1 1 12 3258 1 1 7 LEU CD2 C 4.227 -0.753 3.485 1.00 . A A . 7 LEU CD2 1 1 12 3259 1 1 7 LEU CG C 3.028 -1.527 4.018 1.00 . A A . 7 LEU CG 1 1 12 3260 1 1 7 LEU H H 0.710 -2.459 2.611 1.00 . A A . 7 LEU H 1 1 12 3261 1 1 7 LEU HA H 3.269 -2.462 1.418 1.00 . A A . 7 LEU HA 1 1 12 3262 1 1 7 LEU HB2 H 2.339 -3.546 4.077 1.00 . A A . 7 LEU HB2 1 1 12 3263 1 1 7 LEU HB3 H 4.020 -3.371 3.616 1.00 . A A . 7 LEU HB3 1 1 12 3264 1 1 7 LEU HD11 H 2.317 -2.260 5.897 1.00 . A A . 7 LEU HD11 1 1 12 3265 1 1 7 LEU HD12 H 2.723 -0.543 5.892 1.00 . A A . 7 LEU HD12 1 1 12 3266 1 1 7 LEU HD13 H 4.006 -1.754 5.906 1.00 . A A . 7 LEU HD13 1 1 12 3267 1 1 7 LEU HD21 H 5.117 -1.357 3.578 1.00 . A A . 7 LEU HD21 1 1 12 3268 1 1 7 LEU HD22 H 4.349 0.158 4.052 1.00 . A A . 7 LEU HD22 1 1 12 3269 1 1 7 LEU HD23 H 4.065 -0.508 2.444 1.00 . A A . 7 LEU HD23 1 1 12 3270 1 1 7 LEU HG H 2.131 -1.028 3.679 1.00 . A A . 7 LEU HG 1 1 12 3271 1 1 7 LEU N N 1.256 -2.674 1.823 1.00 . A A . 7 LEU N 1 1 12 3272 1 1 7 LEU O O 3.863 -4.897 0.984 1.00 . A A . 7 LEU O 1 1 12 3273 1 1 8 ALA C C 1.625 -6.943 -0.144 1.00 . A A . 8 ALA C 1 1 12 3274 1 1 8 ALA CA C 1.839 -6.784 1.366 1.00 . A A . 8 ALA CA 1 1 12 3275 1 1 8 ALA CB C 0.796 -7.584 2.134 1.00 . A A . 8 ALA CB 1 1 12 3276 1 1 8 ALA H H 0.998 -5.036 2.218 1.00 . A A . 8 ALA H 1 1 12 3277 1 1 8 ALA HA H 2.813 -7.176 1.621 1.00 . A A . 8 ALA HA 1 1 12 3278 1 1 8 ALA HB1 H 0.956 -8.639 1.967 1.00 . A A . 8 ALA HB1 1 1 12 3279 1 1 8 ALA HB2 H -0.191 -7.311 1.792 1.00 . A A . 8 ALA HB2 1 1 12 3280 1 1 8 ALA HB3 H 0.883 -7.370 3.189 1.00 . A A . 8 ALA HB3 1 1 12 3281 1 1 8 ALA N N 1.802 -5.380 1.773 1.00 . A A . 8 ALA N 1 1 12 3282 1 1 8 ALA O O 1.939 -7.991 -0.711 1.00 . A A . 8 ALA O 1 1 12 3283 1 1 9 ASP C C 2.071 -5.427 -3.026 1.00 . A A . 9 ASP C 1 1 12 3284 1 1 9 ASP CA C 0.851 -5.925 -2.237 1.00 . A A . 9 ASP CA 1 1 12 3285 1 1 9 ASP CB C -0.378 -5.071 -2.585 1.00 . A A . 9 ASP CB 1 1 12 3286 1 1 9 ASP CG C -1.572 -5.913 -2.987 1.00 . A A . 9 ASP CG 1 1 12 3287 1 1 9 ASP H H 0.872 -5.088 -0.290 1.00 . A A . 9 ASP H 1 1 12 3288 1 1 9 ASP HA H 0.654 -6.949 -2.518 1.00 . A A . 9 ASP HA 1 1 12 3289 1 1 9 ASP HB2 H -0.655 -4.479 -1.727 1.00 . A A . 9 ASP HB2 1 1 12 3290 1 1 9 ASP HB3 H -0.133 -4.411 -3.405 1.00 . A A . 9 ASP HB3 1 1 12 3291 1 1 9 ASP N N 1.097 -5.897 -0.793 1.00 . A A . 9 ASP N 1 1 12 3292 1 1 9 ASP O O 1.962 -5.113 -4.214 1.00 . A A . 9 ASP O 1 1 12 3293 1 1 9 ASP OD1 O -2.341 -6.318 -2.090 1.00 . A A . 9 ASP OD1 1 1 12 3294 1 1 9 ASP OD2 O -1.738 -6.166 -4.199 1.00 . A A . 9 ASP OD2 1 1 12 3295 1 1 10 DAL C C 4.821 -3.469 -2.583 1.00 . A A . 10 DAL C 1 1 12 3296 1 1 10 DAL CA C 4.460 -4.897 -3.002 1.00 . A A . 10 DAL CA 1 1 12 3297 1 1 10 DAL CB C 5.599 -5.841 -2.661 1.00 . A A . 10 DAL CB 1 1 12 3298 1 1 10 DAL H H 3.259 -5.617 -1.420 1.00 . A A . 10 DAL H 1 1 12 3299 1 1 10 DAL HA H 4.312 -4.922 -4.072 1.00 . A A . 10 DAL HA 1 1 12 3300 1 1 10 DAL HB1 H 6.490 -5.535 -3.187 1.00 . A A . 10 DAL HB1 1 1 12 3301 1 1 10 DAL HB2 H 5.333 -6.846 -2.953 1.00 . A A . 10 DAL HB2 1 1 12 3302 1 1 10 DAL HB3 H 5.779 -5.809 -1.597 1.00 . A A . 10 DAL HB3 1 1 12 3303 1 1 10 DAL N N 3.229 -5.356 -2.363 1.00 . A A . 10 DAL N 1 1 12 3304 1 1 10 DAL O O 5.869 -2.951 -2.974 1.00 . A A . 10 DAL O 1 1 12 3305 1 1 11 GLY C C 4.153 -0.473 -2.460 1.00 . A A . 11 GLY C 1 1 12 3306 1 1 11 GLY CA C 4.204 -1.480 -1.331 1.00 . A A . 11 GLY CA 1 1 12 3307 1 1 11 GLY H H 3.136 -3.296 -1.507 1.00 . A A . 11 GLY H 1 1 12 3308 1 1 11 GLY HA2 H 3.460 -1.214 -0.594 1.00 . A A . 11 GLY HA2 1 1 12 3309 1 1 11 GLY HA3 H 5.181 -1.441 -0.872 1.00 . A A . 11 GLY HA3 1 1 12 3310 1 1 11 GLY N N 3.953 -2.837 -1.787 1.00 . A A . 11 GLY N 1 1 12 3311 1 1 11 GLY O O 3.073 -0.026 -2.850 1.00 . A A . 11 GLY O 1 1 12 3312 1 1 12 TRP C C 5.521 0.163 -5.443 1.00 . A A . 12 TRP C 1 1 12 3313 1 1 12 TRP CA C 5.405 0.847 -4.078 1.00 . A A . 12 TRP CA 1 1 12 3314 1 1 12 TRP CB C 6.573 1.803 -3.838 1.00 . A A . 12 TRP CB 1 1 12 3315 1 1 12 TRP CD1 C 6.681 3.138 -1.657 1.00 . A A . 12 TRP CD1 1 1 12 3316 1 1 12 TRP CD2 C 5.198 3.913 -3.146 1.00 . A A . 12 TRP CD2 1 1 12 3317 1 1 12 TRP CE2 C 5.141 4.717 -1.995 1.00 . A A . 12 TRP CE2 1 1 12 3318 1 1 12 TRP CE3 C 4.353 4.214 -4.223 1.00 . A A . 12 TRP CE3 1 1 12 3319 1 1 12 TRP CG C 6.189 2.907 -2.909 1.00 . A A . 12 TRP CG 1 1 12 3320 1 1 12 TRP CH2 C 3.459 6.069 -2.950 1.00 . A A . 12 TRP CH2 1 1 12 3321 1 1 12 TRP CZ2 C 4.273 5.795 -1.884 1.00 . A A . 12 TRP CZ2 1 1 12 3322 1 1 12 TRP CZ3 C 3.495 5.290 -4.114 1.00 . A A . 12 TRP CZ3 1 1 12 3323 1 1 12 TRP H H 6.148 -0.511 -2.633 1.00 . A A . 12 TRP H 1 1 12 3324 1 1 12 TRP HA H 4.489 1.421 -4.066 1.00 . A A . 12 TRP HA 1 1 12 3325 1 1 12 TRP HB2 H 7.396 1.260 -3.396 1.00 . A A . 12 TRP HB2 1 1 12 3326 1 1 12 TRP HB3 H 6.889 2.238 -4.774 1.00 . A A . 12 TRP HB3 1 1 12 3327 1 1 12 TRP HD1 H 7.449 2.543 -1.186 1.00 . A A . 12 TRP HD1 1 1 12 3328 1 1 12 TRP HE1 H 6.236 4.590 -0.208 1.00 . A A . 12 TRP HE1 1 1 12 3329 1 1 12 TRP HE3 H 4.364 3.625 -5.128 1.00 . A A . 12 TRP HE3 1 1 12 3330 1 1 12 TRP HH2 H 2.772 6.901 -2.907 1.00 . A A . 12 TRP HH2 1 1 12 3331 1 1 12 TRP HZ2 H 4.226 6.394 -0.991 1.00 . A A . 12 TRP HZ2 1 1 12 3332 1 1 12 TRP HZ3 H 2.840 5.539 -4.937 1.00 . A A . 12 TRP HZ3 1 1 12 3333 1 1 12 TRP N N 5.322 -0.117 -2.987 1.00 . A A . 12 TRP N 1 1 12 3334 1 1 12 TRP NE1 N 6.056 4.225 -1.100 1.00 . A A . 12 TRP NE1 1 1 12 3335 1 1 12 TRP O O 5.779 0.823 -6.452 1.00 . A A . 12 TRP O 1 1 12 3336 1 1 13 ALA C C 3.982 -1.869 -7.413 1.00 . A A . 13 ALA C 1 1 12 3337 1 1 13 ALA CA C 5.341 -1.908 -6.723 1.00 . A A . 13 ALA CA 1 1 12 3338 1 1 13 ALA CB C 5.777 -3.342 -6.470 1.00 . A A . 13 ALA CB 1 1 12 3339 1 1 13 ALA H H 5.069 -1.624 -4.647 1.00 . A A . 13 ALA H 1 1 12 3340 1 1 13 ALA HA H 6.070 -1.442 -7.366 1.00 . A A . 13 ALA HA 1 1 12 3341 1 1 13 ALA HB1 H 6.802 -3.463 -6.783 1.00 . A A . 13 ALA HB1 1 1 12 3342 1 1 13 ALA HB2 H 5.147 -4.015 -7.033 1.00 . A A . 13 ALA HB2 1 1 12 3343 1 1 13 ALA HB3 H 5.693 -3.566 -5.417 1.00 . A A . 13 ALA HB3 1 1 12 3344 1 1 13 ALA N N 5.295 -1.154 -5.476 1.00 . A A . 13 ALA N 1 1 12 3345 1 1 13 ALA O O 3.900 -1.869 -8.642 1.00 . A A . 13 ALA O 1 1 12 3346 1 1 14 SER C C 1.361 -0.460 -7.946 1.00 . A A . 14 SER C 1 1 12 3347 1 1 14 SER CA C 1.555 -1.739 -7.128 1.00 . A A . 14 SER CA 1 1 12 3348 1 1 14 SER CB C 0.537 -1.798 -5.979 1.00 . A A . 14 SER CB 1 1 12 3349 1 1 14 SER H H 3.054 -1.795 -5.636 1.00 . A A . 14 SER H 1 1 12 3350 1 1 14 SER HA H 1.404 -2.587 -7.775 1.00 . A A . 14 SER HA 1 1 12 3351 1 1 14 SER HB2 H -0.364 -1.282 -6.271 1.00 . A A . 14 SER HB2 1 1 12 3352 1 1 14 SER HB3 H 0.304 -2.831 -5.762 1.00 . A A . 14 SER HB3 1 1 12 3353 1 1 14 SER HG H 1.372 -1.869 -4.200 1.00 . A A . 14 SER HG 1 1 12 3354 1 1 14 SER N N 2.917 -1.809 -6.607 1.00 . A A . 14 SER N 1 1 12 3355 1 1 14 SER O O 0.575 -0.436 -8.895 1.00 . A A . 14 SER O 1 1 12 3356 1 1 14 SER OG O 1.047 -1.190 -4.800 1.00 . A A . 14 SER OG 1 1 12 3357 1 1 15 DAL C C 1.137 2.880 -7.520 1.00 . A A . 15 DAL C 1 1 12 3358 1 1 15 DAL CA C 2.011 1.878 -8.275 1.00 . A A . 15 DAL CA 1 1 12 3359 1 1 15 DAL CB C 3.407 2.441 -8.485 1.00 . A A . 15 DAL CB 1 1 12 3360 1 1 15 DAL H H 2.701 0.511 -6.812 1.00 . A A . 15 DAL H 1 1 12 3361 1 1 15 DAL HA H 1.577 1.700 -9.246 1.00 . A A . 15 DAL HA 1 1 12 3362 1 1 15 DAL HB1 H 4.136 1.657 -8.350 1.00 . A A . 15 DAL HB1 1 1 12 3363 1 1 15 DAL HB2 H 3.590 3.230 -7.770 1.00 . A A . 15 DAL HB2 1 1 12 3364 1 1 15 DAL HB3 H 3.485 2.837 -9.486 1.00 . A A . 15 DAL HB3 1 1 12 3365 1 1 15 DAL N N 2.091 0.597 -7.575 1.00 . A A . 15 DAL N 1 1 12 3366 1 1 15 DAL O O 1.293 4.094 -7.672 1.00 . A A . 15 DAL O 1 1 12 3367 1 1 16 ARG C C -0.030 3.619 -4.602 1.00 . A A . 16 ARG C 1 1 12 3368 1 1 16 ARG CA C -0.683 3.212 -5.925 1.00 . A A . 16 ARG CA 1 1 12 3369 1 1 16 ARG CB C -2.009 2.470 -5.658 1.00 . A A . 16 ARG CB 1 1 12 3370 1 1 16 ARG CD C -3.097 0.490 -4.550 1.00 . A A . 16 ARG CD 1 1 12 3371 1 1 16 ARG CG C -1.942 1.482 -4.499 1.00 . A A . 16 ARG CG 1 1 12 3372 1 1 16 ARG CZ C -2.764 -1.468 -3.067 1.00 . A A . 16 ARG CZ 1 1 12 3373 1 1 16 ARG H H 0.141 1.390 -6.627 1.00 . A A . 16 ARG H 1 1 12 3374 1 1 16 ARG HA H -0.881 4.107 -6.500 1.00 . A A . 16 ARG HA 1 1 12 3375 1 1 16 ARG HB2 H -2.775 3.197 -5.436 1.00 . A A . 16 ARG HB2 1 1 12 3376 1 1 16 ARG HB3 H -2.296 1.918 -6.548 1.00 . A A . 16 ARG HB3 1 1 12 3377 1 1 16 ARG HD2 H -4.009 1.032 -4.752 1.00 . A A . 16 ARG HD2 1 1 12 3378 1 1 16 ARG HD3 H -2.916 -0.213 -5.349 1.00 . A A . 16 ARG HD3 1 1 12 3379 1 1 16 ARG HE H -3.762 0.196 -2.578 1.00 . A A . 16 ARG HE 1 1 12 3380 1 1 16 ARG HG2 H -1.007 0.939 -4.551 1.00 . A A . 16 ARG HG2 1 1 12 3381 1 1 16 ARG HG3 H -1.991 2.031 -3.569 1.00 . A A . 16 ARG HG3 1 1 12 3382 1 1 16 ARG HH11 H -1.900 -1.671 -4.889 1.00 . A A . 16 ARG HH11 1 1 12 3383 1 1 16 ARG HH12 H -1.704 -3.018 -3.823 1.00 . A A . 16 ARG HH12 1 1 12 3384 1 1 16 ARG HH21 H -3.496 -1.587 -1.184 1.00 . A A . 16 ARG HH21 1 1 12 3385 1 1 16 ARG HH22 H -2.608 -2.973 -1.723 1.00 . A A . 16 ARG HH22 1 1 12 3386 1 1 16 ARG N N 0.217 2.365 -6.706 1.00 . A A . 16 ARG N 1 1 12 3387 1 1 16 ARG NE N -3.255 -0.244 -3.293 1.00 . A A . 16 ARG NE 1 1 12 3388 1 1 16 ARG NH1 N -2.065 -2.104 -4.004 1.00 . A A . 16 ARG NH1 1 1 12 3389 1 1 16 ARG NH2 N -2.973 -2.058 -1.895 1.00 . A A . 16 ARG NH2 1 1 12 3390 1 1 16 ARG O O 0.832 2.906 -4.089 1.00 . A A . 16 ARG O 1 1 12 3391 1 1 17 PRO C C -0.548 4.635 -1.544 1.00 . A A . 17 PRO C 1 1 12 3392 1 1 17 PRO CA C 0.123 5.264 -2.765 1.00 . A A . 17 PRO CA 1 1 12 3393 1 1 17 PRO CB C -0.154 6.775 -2.801 1.00 . A A . 17 PRO CB 1 1 12 3394 1 1 17 PRO CD C -1.426 5.703 -4.559 1.00 . A A . 17 PRO CD 1 1 12 3395 1 1 17 PRO CG C -0.944 7.035 -4.050 1.00 . A A . 17 PRO CG 1 1 12 3396 1 1 17 PRO HA H 1.185 5.095 -2.705 1.00 . A A . 17 PRO HA 1 1 12 3397 1 1 17 PRO HB2 H -0.715 7.056 -1.922 1.00 . A A . 17 PRO HB2 1 1 12 3398 1 1 17 PRO HB3 H 0.788 7.307 -2.813 1.00 . A A . 17 PRO HB3 1 1 12 3399 1 1 17 PRO HD2 H -2.407 5.478 -4.171 1.00 . A A . 17 PRO HD2 1 1 12 3400 1 1 17 PRO HD3 H -1.433 5.695 -5.637 1.00 . A A . 17 PRO HD3 1 1 12 3401 1 1 17 PRO HG2 H -1.786 7.671 -3.822 1.00 . A A . 17 PRO HG2 1 1 12 3402 1 1 17 PRO HG3 H -0.311 7.508 -4.787 1.00 . A A . 17 PRO HG3 1 1 12 3403 1 1 17 PRO N N -0.426 4.775 -4.029 1.00 . A A . 17 PRO N 1 1 12 3404 1 1 17 PRO O O -1.600 4.001 -1.654 1.00 . A A . 17 PRO O 1 1 12 3405 1 1 18 PRO C C -1.819 4.819 1.287 1.00 . A A . 18 PRO C 1 1 12 3406 1 1 18 PRO CA C -0.452 4.253 0.902 1.00 . A A . 18 PRO CA 1 1 12 3407 1 1 18 PRO CB C 0.582 4.677 1.949 1.00 . A A . 18 PRO CB 1 1 12 3408 1 1 18 PRO CD C 1.330 5.537 -0.158 1.00 . A A . 18 PRO CD 1 1 12 3409 1 1 18 PRO CG C 1.363 5.781 1.322 1.00 . A A . 18 PRO CG 1 1 12 3410 1 1 18 PRO HA H -0.507 3.174 0.865 1.00 . A A . 18 PRO HA 1 1 12 3411 1 1 18 PRO HB2 H 0.071 5.020 2.832 1.00 . A A . 18 PRO HB2 1 1 12 3412 1 1 18 PRO HB3 H 1.210 3.841 2.198 1.00 . A A . 18 PRO HB3 1 1 12 3413 1 1 18 PRO HD2 H 1.319 6.474 -0.693 1.00 . A A . 18 PRO HD2 1 1 12 3414 1 1 18 PRO HD3 H 2.175 4.938 -0.460 1.00 . A A . 18 PRO HD3 1 1 12 3415 1 1 18 PRO HG2 H 0.904 6.731 1.553 1.00 . A A . 18 PRO HG2 1 1 12 3416 1 1 18 PRO HG3 H 2.381 5.759 1.681 1.00 . A A . 18 PRO HG3 1 1 12 3417 1 1 18 PRO N N 0.068 4.803 -0.357 1.00 . A A . 18 PRO N 1 1 12 3418 1 1 18 PRO O O -2.122 5.981 1.008 1.00 . A A . 18 PRO O 1 1 12 3419 1 1 19 PRO C C -3.949 5.208 3.696 1.00 . A A . 19 PRO C 1 1 12 3420 1 1 19 PRO CA C -3.984 4.414 2.390 1.00 . A A . 19 PRO CA 1 1 12 3421 1 1 19 PRO CB C -4.724 3.092 2.582 1.00 . A A . 19 PRO CB 1 1 12 3422 1 1 19 PRO CD C -2.365 2.606 2.324 1.00 . A A . 19 PRO CD 1 1 12 3423 1 1 19 PRO CG C -3.684 2.047 2.797 1.00 . A A . 19 PRO CG 1 1 12 3424 1 1 19 PRO HA H -4.484 4.999 1.632 1.00 . A A . 19 PRO HA 1 1 12 3425 1 1 19 PRO HB2 H -5.386 3.166 3.431 1.00 . A A . 19 PRO HB2 1 1 12 3426 1 1 19 PRO HB3 H -5.290 2.882 1.705 1.00 . A A . 19 PRO HB3 1 1 12 3427 1 1 19 PRO HD2 H -1.632 2.570 3.114 1.00 . A A . 19 PRO HD2 1 1 12 3428 1 1 19 PRO HD3 H -2.023 2.050 1.467 1.00 . A A . 19 PRO HD3 1 1 12 3429 1 1 19 PRO HG2 H -3.637 1.795 3.840 1.00 . A A . 19 PRO HG2 1 1 12 3430 1 1 19 PRO HG3 H -3.938 1.169 2.221 1.00 . A A . 19 PRO HG3 1 1 12 3431 1 1 19 PRO N N -2.658 4.000 1.951 1.00 . A A . 19 PRO N 1 1 12 3432 1 1 19 PRO O O -3.337 4.782 4.676 1.00 . A A . 19 PRO O 1 1 12 3433 1 1 20 SER C C -5.841 6.848 5.781 1.00 . A A . 20 SER C 1 1 12 3434 1 1 20 SER CA C -4.661 7.221 4.883 1.00 . A A . 20 SER CA 1 1 12 3435 1 1 20 SER CB C -4.754 8.696 4.477 1.00 . A A . 20 SER CB 1 1 12 3436 1 1 20 SER H H -5.082 6.648 2.886 1.00 . A A . 20 SER H 1 1 12 3437 1 1 20 SER HA H -3.746 7.069 5.436 1.00 . A A . 20 SER HA 1 1 12 3438 1 1 20 SER HB2 H -4.936 9.298 5.354 1.00 . A A . 20 SER HB2 1 1 12 3439 1 1 20 SER HB3 H -3.823 9.000 4.020 1.00 . A A . 20 SER HB3 1 1 12 3440 1 1 20 SER HG H -5.844 9.841 3.319 1.00 . A A . 20 SER HG 1 1 12 3441 1 1 20 SER N N -4.612 6.364 3.699 1.00 . A A . 20 SER N 1 1 12 3442 1 1 20 SER O O -5.614 6.628 6.989 1.00 . A A . 20 SER O 1 1 12 3443 1 1 20 SER OXT O -6.980 6.777 5.269 1.00 . A A . 20 SER OXT 1 1 12 3444 1 1 20 SER OG O -5.807 8.910 3.551 1.00 . A A . 20 SER OG 1 1 13 3445 1 1 1 ASP C C -6.277 -3.339 4.759 1.00 . A A . 1 ASP C 1 1 13 3446 1 1 1 ASP CA C -6.502 -4.285 5.938 1.00 . A A . 1 ASP CA 1 1 13 3447 1 1 1 ASP CB C -5.424 -5.374 5.953 1.00 . A A . 1 ASP CB 1 1 13 3448 1 1 1 ASP CG C -4.895 -5.646 7.348 1.00 . A A . 1 ASP CG 1 1 13 3449 1 1 1 ASP H1 H -8.558 -4.185 5.882 1.00 . A A . 1 ASP H1 1 1 13 3450 1 1 1 ASP H2 H -7.932 -5.560 6.695 1.00 . A A . 1 ASP H2 1 1 13 3451 1 1 1 ASP H3 H -7.884 -5.478 4.981 1.00 . A A . 1 ASP H3 1 1 13 3452 1 1 1 ASP HA H -6.446 -3.719 6.857 1.00 . A A . 1 ASP HA 1 1 13 3453 1 1 1 ASP HB2 H -5.841 -6.290 5.561 1.00 . A A . 1 ASP HB2 1 1 13 3454 1 1 1 ASP HB3 H -4.599 -5.064 5.328 1.00 . A A . 1 ASP HB3 1 1 13 3455 1 1 1 ASP N N -7.839 -4.936 5.867 1.00 . A A . 1 ASP N 1 1 13 3456 1 1 1 ASP O O -6.657 -3.643 3.627 1.00 . A A . 1 ASP O 1 1 13 3457 1 1 1 ASP OD1 O -4.168 -4.784 7.886 1.00 . A A . 1 ASP OD1 1 1 13 3458 1 1 1 ASP OD2 O -5.208 -6.720 7.903 1.00 . A A . 1 ASP OD2 1 1 13 3459 1 1 2 ALA C C -3.889 -0.855 3.963 1.00 . A A . 2 ALA C 1 1 13 3460 1 1 2 ALA CA C -5.375 -1.196 4.007 1.00 . A A . 2 ALA CA 1 1 13 3461 1 1 2 ALA CB C -6.200 0.057 4.249 1.00 . A A . 2 ALA CB 1 1 13 3462 1 1 2 ALA H H -5.378 -2.012 5.960 1.00 . A A . 2 ALA H 1 1 13 3463 1 1 2 ALA HA H -5.667 -1.611 3.052 1.00 . A A . 2 ALA HA 1 1 13 3464 1 1 2 ALA HB1 H -6.431 0.523 3.303 1.00 . A A . 2 ALA HB1 1 1 13 3465 1 1 2 ALA HB2 H -5.635 0.745 4.861 1.00 . A A . 2 ALA HB2 1 1 13 3466 1 1 2 ALA HB3 H -7.116 -0.207 4.755 1.00 . A A . 2 ALA HB3 1 1 13 3467 1 1 2 ALA N N -5.656 -2.193 5.037 1.00 . A A . 2 ALA N 1 1 13 3468 1 1 2 ALA O O -3.223 -1.088 2.955 1.00 . A A . 2 ALA O 1 1 13 3469 1 1 3 TYR C C -1.080 -1.181 5.123 1.00 . A A . 3 TYR C 1 1 13 3470 1 1 3 TYR CA C -1.962 0.065 5.154 1.00 . A A . 3 TYR CA 1 1 13 3471 1 1 3 TYR CB C -1.694 0.884 6.419 1.00 . A A . 3 TYR CB 1 1 13 3472 1 1 3 TYR CD1 C -0.708 3.141 5.829 1.00 . A A . 3 TYR CD1 1 1 13 3473 1 1 3 TYR CD2 C 0.756 1.445 6.655 1.00 . A A . 3 TYR CD2 1 1 13 3474 1 1 3 TYR CE1 C 0.358 4.014 5.730 1.00 . A A . 3 TYR CE1 1 1 13 3475 1 1 3 TYR CE2 C 1.825 2.314 6.555 1.00 . A A . 3 TYR CE2 1 1 13 3476 1 1 3 TYR CG C -0.527 1.840 6.293 1.00 . A A . 3 TYR CG 1 1 13 3477 1 1 3 TYR CZ C 1.621 3.596 6.093 1.00 . A A . 3 TYR CZ 1 1 13 3478 1 1 3 TYR H H -3.961 -0.145 5.836 1.00 . A A . 3 TYR H 1 1 13 3479 1 1 3 TYR HA H -1.726 0.666 4.293 1.00 . A A . 3 TYR HA 1 1 13 3480 1 1 3 TYR HB2 H -2.571 1.468 6.656 1.00 . A A . 3 TYR HB2 1 1 13 3481 1 1 3 TYR HB3 H -1.485 0.211 7.238 1.00 . A A . 3 TYR HB3 1 1 13 3482 1 1 3 TYR HD1 H -1.699 3.468 5.534 1.00 . A A . 3 TYR HD1 1 1 13 3483 1 1 3 TYR HD2 H 0.914 0.439 7.016 1.00 . A A . 3 TYR HD2 1 1 13 3484 1 1 3 TYR HE1 H 0.198 5.020 5.375 1.00 . A A . 3 TYR HE1 1 1 13 3485 1 1 3 TYR HE2 H 2.814 1.986 6.838 1.00 . A A . 3 TYR HE2 1 1 13 3486 1 1 3 TYR HH H 2.796 4.930 6.827 1.00 . A A . 3 TYR HH 1 1 13 3487 1 1 3 TYR N N -3.375 -0.304 5.065 1.00 . A A . 3 TYR N 1 1 13 3488 1 1 3 TYR O O -0.146 -1.265 4.323 1.00 . A A . 3 TYR O 1 1 13 3489 1 1 3 TYR OH O 2.684 4.465 5.994 1.00 . A A . 3 TYR OH 1 1 13 3490 1 1 4 ALA C C -0.838 -4.178 4.709 1.00 . A A . 4 ALA C 1 1 13 3491 1 1 4 ALA CA C -0.648 -3.409 6.015 1.00 . A A . 4 ALA CA 1 1 13 3492 1 1 4 ALA CB C -1.081 -4.258 7.202 1.00 . A A . 4 ALA CB 1 1 13 3493 1 1 4 ALA H H -2.166 -2.042 6.573 1.00 . A A . 4 ALA H 1 1 13 3494 1 1 4 ALA HA H 0.400 -3.169 6.131 1.00 . A A . 4 ALA HA 1 1 13 3495 1 1 4 ALA HB1 H -0.247 -4.855 7.540 1.00 . A A . 4 ALA HB1 1 1 13 3496 1 1 4 ALA HB2 H -1.891 -4.908 6.903 1.00 . A A . 4 ALA HB2 1 1 13 3497 1 1 4 ALA HB3 H -1.412 -3.615 8.003 1.00 . A A . 4 ALA HB3 1 1 13 3498 1 1 4 ALA N N -1.398 -2.158 5.975 1.00 . A A . 4 ALA N 1 1 13 3499 1 1 4 ALA O O 0.079 -4.855 4.241 1.00 . A A . 4 ALA O 1 1 13 3500 1 1 5 GLN C C -1.529 -4.067 1.715 1.00 . A A . 5 GLN C 1 1 13 3501 1 1 5 GLN CA C -2.332 -4.707 2.848 1.00 . A A . 5 GLN CA 1 1 13 3502 1 1 5 GLN CB C -3.833 -4.623 2.550 1.00 . A A . 5 GLN CB 1 1 13 3503 1 1 5 GLN CD C -4.053 -6.723 1.158 1.00 . A A . 5 GLN CD 1 1 13 3504 1 1 5 GLN CG C -4.226 -5.215 1.207 1.00 . A A . 5 GLN CG 1 1 13 3505 1 1 5 GLN H H -2.715 -3.478 4.524 1.00 . A A . 5 GLN H 1 1 13 3506 1 1 5 GLN HA H -2.046 -5.745 2.937 1.00 . A A . 5 GLN HA 1 1 13 3507 1 1 5 GLN HB2 H -4.371 -5.152 3.322 1.00 . A A . 5 GLN HB2 1 1 13 3508 1 1 5 GLN HB3 H -4.133 -3.585 2.563 1.00 . A A . 5 GLN HB3 1 1 13 3509 1 1 5 GLN HE21 H -2.215 -6.521 0.420 1.00 . A A . 5 GLN HE21 1 1 13 3510 1 1 5 GLN HE22 H -2.755 -8.145 0.658 1.00 . A A . 5 GLN HE22 1 1 13 3511 1 1 5 GLN HG2 H -5.262 -4.980 1.013 1.00 . A A . 5 GLN HG2 1 1 13 3512 1 1 5 GLN HG3 H -3.608 -4.771 0.442 1.00 . A A . 5 GLN HG3 1 1 13 3513 1 1 5 GLN N N -2.029 -4.047 4.112 1.00 . A A . 5 GLN N 1 1 13 3514 1 1 5 GLN NE2 N -2.890 -7.175 0.699 1.00 . A A . 5 GLN NE2 1 1 13 3515 1 1 5 GLN O O -1.032 -4.762 0.829 1.00 . A A . 5 GLN O 1 1 13 3516 1 1 5 GLN OE1 O -4.956 -7.473 1.529 1.00 . A A . 5 GLN OE1 1 1 13 3517 1 1 6 TRP C C 0.814 -2.461 0.741 1.00 . A A . 6 TRP C 1 1 13 3518 1 1 6 TRP CA C -0.636 -1.992 0.765 1.00 . A A . 6 TRP CA 1 1 13 3519 1 1 6 TRP CB C -0.689 -0.491 1.071 1.00 . A A . 6 TRP CB 1 1 13 3520 1 1 6 TRP CD1 C -0.264 0.637 -1.181 1.00 . A A . 6 TRP CD1 1 1 13 3521 1 1 6 TRP CD2 C 1.343 0.994 0.332 1.00 . A A . 6 TRP CD2 1 1 13 3522 1 1 6 TRP CE2 C 1.690 1.659 -0.857 1.00 . A A . 6 TRP CE2 1 1 13 3523 1 1 6 TRP CE3 C 2.208 1.081 1.427 1.00 . A A . 6 TRP CE3 1 1 13 3524 1 1 6 TRP CG C 0.087 0.344 0.100 1.00 . A A . 6 TRP CG 1 1 13 3525 1 1 6 TRP CH2 C 3.687 2.472 0.097 1.00 . A A . 6 TRP CH2 1 1 13 3526 1 1 6 TRP CZ2 C 2.860 2.400 -0.987 1.00 . A A . 6 TRP CZ2 1 1 13 3527 1 1 6 TRP CZ3 C 3.372 1.821 1.299 1.00 . A A . 6 TRP CZ3 1 1 13 3528 1 1 6 TRP H H -1.806 -2.248 2.510 1.00 . A A . 6 TRP H 1 1 13 3529 1 1 6 TRP HA H -1.083 -2.175 -0.200 1.00 . A A . 6 TRP HA 1 1 13 3530 1 1 6 TRP HB2 H -1.714 -0.162 1.047 1.00 . A A . 6 TRP HB2 1 1 13 3531 1 1 6 TRP HB3 H -0.284 -0.316 2.055 1.00 . A A . 6 TRP HB3 1 1 13 3532 1 1 6 TRP HD1 H -1.165 0.291 -1.657 1.00 . A A . 6 TRP HD1 1 1 13 3533 1 1 6 TRP HE1 H 0.669 1.759 -2.680 1.00 . A A . 6 TRP HE1 1 1 13 3534 1 1 6 TRP HE3 H 1.982 0.582 2.360 1.00 . A A . 6 TRP HE3 1 1 13 3535 1 1 6 TRP HH2 H 4.602 3.047 0.041 1.00 . A A . 6 TRP HH2 1 1 13 3536 1 1 6 TRP HZ2 H 3.119 2.902 -1.908 1.00 . A A . 6 TRP HZ2 1 1 13 3537 1 1 6 TRP HZ3 H 4.055 1.900 2.133 1.00 . A A . 6 TRP HZ3 1 1 13 3538 1 1 6 TRP N N -1.394 -2.738 1.768 1.00 . A A . 6 TRP N 1 1 13 3539 1 1 6 TRP NE1 N 0.695 1.421 -1.764 1.00 . A A . 6 TRP NE1 1 1 13 3540 1 1 6 TRP O O 1.366 -2.755 -0.321 1.00 . A A . 6 TRP O 1 1 13 3541 1 1 7 LEU C C 2.947 -4.436 1.633 1.00 . A A . 7 LEU C 1 1 13 3542 1 1 7 LEU CA C 2.799 -2.977 2.068 1.00 . A A . 7 LEU CA 1 1 13 3543 1 1 7 LEU CB C 3.256 -2.804 3.520 1.00 . A A . 7 LEU CB 1 1 13 3544 1 1 7 LEU CD1 C 3.270 -1.335 5.556 1.00 . A A . 7 LEU CD1 1 1 13 3545 1 1 7 LEU CD2 C 4.421 -0.576 3.465 1.00 . A A . 7 LEU CD2 1 1 13 3546 1 1 7 LEU CG C 3.245 -1.361 4.035 1.00 . A A . 7 LEU CG 1 1 13 3547 1 1 7 LEU H H 0.910 -2.292 2.732 1.00 . A A . 7 LEU H 1 1 13 3548 1 1 7 LEU HA H 3.412 -2.360 1.429 1.00 . A A . 7 LEU HA 1 1 13 3549 1 1 7 LEU HB2 H 2.606 -3.394 4.150 1.00 . A A . 7 LEU HB2 1 1 13 3550 1 1 7 LEU HB3 H 4.259 -3.188 3.609 1.00 . A A . 7 LEU HB3 1 1 13 3551 1 1 7 LEU HD11 H 4.243 -1.647 5.906 1.00 . A A . 7 LEU HD11 1 1 13 3552 1 1 7 LEU HD12 H 2.516 -2.006 5.940 1.00 . A A . 7 LEU HD12 1 1 13 3553 1 1 7 LEU HD13 H 3.069 -0.332 5.901 1.00 . A A . 7 LEU HD13 1 1 13 3554 1 1 7 LEU HD21 H 4.536 0.347 4.014 1.00 . A A . 7 LEU HD21 1 1 13 3555 1 1 7 LEU HD22 H 4.236 -0.354 2.424 1.00 . A A . 7 LEU HD22 1 1 13 3556 1 1 7 LEU HD23 H 5.323 -1.163 3.554 1.00 . A A . 7 LEU HD23 1 1 13 3557 1 1 7 LEU HG H 2.334 -0.879 3.711 1.00 . A A . 7 LEU HG 1 1 13 3558 1 1 7 LEU N N 1.416 -2.535 1.927 1.00 . A A . 7 LEU N 1 1 13 3559 1 1 7 LEU O O 3.955 -4.814 1.035 1.00 . A A . 7 LEU O 1 1 13 3560 1 1 8 ALA C C 1.647 -6.859 0.066 1.00 . A A . 8 ALA C 1 1 13 3561 1 1 8 ALA CA C 1.926 -6.661 1.561 1.00 . A A . 8 ALA CA 1 1 13 3562 1 1 8 ALA CB C 0.903 -7.421 2.394 1.00 . A A . 8 ALA CB 1 1 13 3563 1 1 8 ALA H H 1.148 -4.879 2.399 1.00 . A A . 8 ALA H 1 1 13 3564 1 1 8 ALA HA H 2.904 -7.061 1.787 1.00 . A A . 8 ALA HA 1 1 13 3565 1 1 8 ALA HB1 H -0.093 -7.168 2.061 1.00 . A A . 8 ALA HB1 1 1 13 3566 1 1 8 ALA HB2 H 1.014 -7.153 3.434 1.00 . A A . 8 ALA HB2 1 1 13 3567 1 1 8 ALA HB3 H 1.061 -8.483 2.278 1.00 . A A . 8 ALA HB3 1 1 13 3568 1 1 8 ALA N N 1.926 -5.246 1.928 1.00 . A A . 8 ALA N 1 1 13 3569 1 1 8 ALA O O 1.942 -7.920 -0.488 1.00 . A A . 8 ALA O 1 1 13 3570 1 1 9 ASP C C 1.966 -5.445 -2.873 1.00 . A A . 9 ASP C 1 1 13 3571 1 1 9 ASP CA C 0.776 -5.901 -2.017 1.00 . A A . 9 ASP CA 1 1 13 3572 1 1 9 ASP CB C -0.455 -5.042 -2.339 1.00 . A A . 9 ASP CB 1 1 13 3573 1 1 9 ASP CG C -1.572 -5.848 -2.971 1.00 . A A . 9 ASP CG 1 1 13 3574 1 1 9 ASP H H 0.876 -5.012 -0.094 1.00 . A A . 9 ASP H 1 1 13 3575 1 1 9 ASP HA H 0.555 -6.930 -2.256 1.00 . A A . 9 ASP HA 1 1 13 3576 1 1 9 ASP HB2 H -0.829 -4.600 -1.429 1.00 . A A . 9 ASP HB2 1 1 13 3577 1 1 9 ASP HB3 H -0.171 -4.256 -3.024 1.00 . A A . 9 ASP HB3 1 1 13 3578 1 1 9 ASP N N 1.084 -5.833 -0.586 1.00 . A A . 9 ASP N 1 1 13 3579 1 1 9 ASP O O 1.809 -5.170 -4.065 1.00 . A A . 9 ASP O 1 1 13 3580 1 1 9 ASP OD1 O -1.547 -6.031 -4.206 1.00 . A A . 9 ASP OD1 1 1 13 3581 1 1 9 ASP OD2 O -2.472 -6.297 -2.230 1.00 . A A . 9 ASP OD2 1 1 13 3582 1 1 10 DAL C C 4.756 -3.510 -2.613 1.00 . A A . 10 DAL C 1 1 13 3583 1 1 10 DAL CA C 4.360 -4.946 -2.971 1.00 . A A . 10 DAL CA 1 1 13 3584 1 1 10 DAL CB C 5.501 -5.895 -2.650 1.00 . A A . 10 DAL CB 1 1 13 3585 1 1 10 DAL H H 3.221 -5.597 -1.315 1.00 . A A . 10 DAL H 1 1 13 3586 1 1 10 DAL HA H 4.164 -5.003 -4.031 1.00 . A A . 10 DAL HA 1 1 13 3587 1 1 10 DAL HB1 H 5.771 -5.787 -1.610 1.00 . A A . 10 DAL HB1 1 1 13 3588 1 1 10 DAL HB2 H 6.351 -5.659 -3.271 1.00 . A A . 10 DAL HB2 1 1 13 3589 1 1 10 DAL HB3 H 5.187 -6.911 -2.837 1.00 . A A . 10 DAL HB3 1 1 13 3590 1 1 10 DAL N N 3.153 -5.367 -2.264 1.00 . A A . 10 DAL N 1 1 13 3591 1 1 10 DAL O O 5.790 -3.018 -3.070 1.00 . A A . 10 DAL O 1 1 13 3592 1 1 11 GLY C C 4.128 -0.505 -2.553 1.00 . A A . 11 GLY C 1 1 13 3593 1 1 11 GLY CA C 4.222 -1.477 -1.397 1.00 . A A . 11 GLY CA 1 1 13 3594 1 1 11 GLY H H 3.127 -3.283 -1.464 1.00 . A A . 11 GLY H 1 1 13 3595 1 1 11 GLY HA2 H 3.518 -1.178 -0.634 1.00 . A A . 11 GLY HA2 1 1 13 3596 1 1 11 GLY HA3 H 5.220 -1.436 -0.986 1.00 . A A . 11 GLY HA3 1 1 13 3597 1 1 11 GLY N N 3.934 -2.843 -1.797 1.00 . A A . 11 GLY N 1 1 13 3598 1 1 11 GLY O O 3.038 -0.052 -2.902 1.00 . A A . 11 GLY O 1 1 13 3599 1 1 12 TRP C C 5.350 0.010 -5.622 1.00 . A A . 12 TRP C 1 1 13 3600 1 1 12 TRP CA C 5.316 0.740 -4.277 1.00 . A A . 12 TRP CA 1 1 13 3601 1 1 12 TRP CB C 6.509 1.684 -4.127 1.00 . A A . 12 TRP CB 1 1 13 3602 1 1 12 TRP CD1 C 6.744 3.079 -1.997 1.00 . A A . 12 TRP CD1 1 1 13 3603 1 1 12 TRP CD2 C 5.200 3.833 -3.433 1.00 . A A . 12 TRP CD2 1 1 13 3604 1 1 12 TRP CE2 C 5.211 4.670 -2.305 1.00 . A A . 12 TRP CE2 1 1 13 3605 1 1 12 TRP CE3 C 4.307 4.115 -4.476 1.00 . A A . 12 TRP CE3 1 1 13 3606 1 1 12 TRP CG C 6.187 2.820 -3.215 1.00 . A A . 12 TRP CG 1 1 13 3607 1 1 12 TRP CH2 C 3.500 6.018 -3.217 1.00 . A A . 12 TRP CH2 1 1 13 3608 1 1 12 TRP CZ2 C 4.363 5.764 -2.184 1.00 . A A . 12 TRP CZ2 1 1 13 3609 1 1 12 TRP CZ3 C 3.469 5.205 -4.357 1.00 . A A . 12 TRP CZ3 1 1 13 3610 1 1 12 TRP H H 6.111 -0.584 -2.828 1.00 . A A . 12 TRP H 1 1 13 3611 1 1 12 TRP HA H 4.410 1.330 -4.236 1.00 . A A . 12 TRP HA 1 1 13 3612 1 1 12 TRP HB2 H 7.346 1.141 -3.712 1.00 . A A . 12 TRP HB2 1 1 13 3613 1 1 12 TRP HB3 H 6.782 2.085 -5.092 1.00 . A A . 12 TRP HB3 1 1 13 3614 1 1 12 TRP HD1 H 7.527 2.487 -1.547 1.00 . A A . 12 TRP HD1 1 1 13 3615 1 1 12 TRP HE1 H 6.391 4.580 -0.572 1.00 . A A . 12 TRP HE1 1 1 13 3616 1 1 12 TRP HE3 H 4.265 3.500 -5.362 1.00 . A A . 12 TRP HE3 1 1 13 3617 1 1 12 TRP HH2 H 2.827 6.861 -3.165 1.00 . A A . 12 TRP HH2 1 1 13 3618 1 1 12 TRP HZ2 H 4.368 6.389 -1.307 1.00 . A A . 12 TRP HZ2 1 1 13 3619 1 1 12 TRP HZ3 H 2.778 5.440 -5.154 1.00 . A A . 12 TRP HZ3 1 1 13 3620 1 1 12 TRP N N 5.275 -0.187 -3.151 1.00 . A A . 12 TRP N 1 1 13 3621 1 1 12 TRP NE1 N 6.162 4.191 -1.442 1.00 . A A . 12 TRP NE1 1 1 13 3622 1 1 12 TRP O O 5.574 0.630 -6.664 1.00 . A A . 12 TRP O 1 1 13 3623 1 1 13 ALA C C 3.664 -2.051 -7.438 1.00 . A A . 13 ALA C 1 1 13 3624 1 1 13 ALA CA C 5.057 -2.098 -6.819 1.00 . A A . 13 ALA CA 1 1 13 3625 1 1 13 ALA CB C 5.473 -3.533 -6.537 1.00 . A A . 13 ALA CB 1 1 13 3626 1 1 13 ALA H H 4.893 -1.736 -4.745 1.00 . A A . 13 ALA H 1 1 13 3627 1 1 13 ALA HA H 5.761 -1.671 -7.515 1.00 . A A . 13 ALA HA 1 1 13 3628 1 1 13 ALA HB1 H 4.675 -4.203 -6.822 1.00 . A A . 13 ALA HB1 1 1 13 3629 1 1 13 ALA HB2 H 5.682 -3.648 -5.484 1.00 . A A . 13 ALA HB2 1 1 13 3630 1 1 13 ALA HB3 H 6.359 -3.765 -7.108 1.00 . A A . 13 ALA HB3 1 1 13 3631 1 1 13 ALA N N 5.091 -1.301 -5.599 1.00 . A A . 13 ALA N 1 1 13 3632 1 1 13 ALA O O 3.516 -2.090 -8.661 1.00 . A A . 13 ALA O 1 1 13 3633 1 1 14 SER C C 1.038 -0.605 -7.873 1.00 . A A . 14 SER C 1 1 13 3634 1 1 14 SER CA C 1.259 -1.861 -7.027 1.00 . A A . 14 SER CA 1 1 13 3635 1 1 14 SER CB C 0.306 -1.867 -5.821 1.00 . A A . 14 SER CB 1 1 13 3636 1 1 14 SER H H 2.836 -1.901 -5.619 1.00 . A A . 14 SER H 1 1 13 3637 1 1 14 SER HA H 1.058 -2.726 -7.638 1.00 . A A . 14 SER HA 1 1 13 3638 1 1 14 SER HB2 H -0.604 -1.347 -6.080 1.00 . A A . 14 SER HB2 1 1 13 3639 1 1 14 SER HB3 H 0.071 -2.888 -5.556 1.00 . A A . 14 SER HB3 1 1 13 3640 1 1 14 SER HG H 1.236 -1.892 -4.089 1.00 . A A . 14 SER HG 1 1 13 3641 1 1 14 SER N N 2.646 -1.943 -6.579 1.00 . A A . 14 SER N 1 1 13 3642 1 1 14 SER O O 0.194 -0.594 -8.770 1.00 . A A . 14 SER O 1 1 13 3643 1 1 14 SER OG O 0.888 -1.228 -4.694 1.00 . A A . 14 SER OG 1 1 13 3644 1 1 15 DAL C C 0.889 2.747 -7.545 1.00 . A A . 15 DAL C 1 1 13 3645 1 1 15 DAL CA C 1.707 1.710 -8.318 1.00 . A A . 15 DAL CA 1 1 13 3646 1 1 15 DAL CB C 3.096 2.248 -8.624 1.00 . A A . 15 DAL CB 1 1 13 3647 1 1 15 DAL H H 2.465 0.376 -6.858 1.00 . A A . 15 DAL H 1 1 13 3648 1 1 15 DAL HA H 1.216 1.509 -9.257 1.00 . A A . 15 DAL HA 1 1 13 3649 1 1 15 DAL HB1 H 3.111 2.647 -9.626 1.00 . A A . 15 DAL HB1 1 1 13 3650 1 1 15 DAL HB2 H 3.817 1.449 -8.543 1.00 . A A . 15 DAL HB2 1 1 13 3651 1 1 15 DAL HB3 H 3.343 3.029 -7.921 1.00 . A A . 15 DAL HB3 1 1 13 3652 1 1 15 DAL N N 1.810 0.449 -7.584 1.00 . A A . 15 DAL N 1 1 13 3653 1 1 15 DAL O O 1.055 3.953 -7.739 1.00 . A A . 15 DAL O 1 1 13 3654 1 1 16 ARG C C -0.096 3.591 -4.597 1.00 . A A . 16 ARG C 1 1 13 3655 1 1 16 ARG CA C -0.835 3.147 -5.861 1.00 . A A . 16 ARG CA 1 1 13 3656 1 1 16 ARG CB C -2.143 2.422 -5.481 1.00 . A A . 16 ARG CB 1 1 13 3657 1 1 16 ARG CD C -3.139 0.471 -4.242 1.00 . A A . 16 ARG CD 1 1 13 3658 1 1 16 ARG CG C -2.000 1.479 -4.292 1.00 . A A . 16 ARG CG 1 1 13 3659 1 1 16 ARG CZ C -3.506 0.055 -1.827 1.00 . A A . 16 ARG CZ 1 1 13 3660 1 1 16 ARG H H -0.075 1.297 -6.558 1.00 . A A . 16 ARG H 1 1 13 3661 1 1 16 ARG HA H -1.067 4.024 -6.452 1.00 . A A . 16 ARG HA 1 1 13 3662 1 1 16 ARG HB2 H -2.891 3.161 -5.236 1.00 . A A . 16 ARG HB2 1 1 13 3663 1 1 16 ARG HB3 H -2.490 1.838 -6.328 1.00 . A A . 16 ARG HB3 1 1 13 3664 1 1 16 ARG HD2 H -4.077 1.005 -4.271 1.00 . A A . 16 ARG HD2 1 1 13 3665 1 1 16 ARG HD3 H -3.067 -0.172 -5.107 1.00 . A A . 16 ARG HD3 1 1 13 3666 1 1 16 ARG HE H -2.760 -1.270 -3.128 1.00 . A A . 16 ARG HE 1 1 13 3667 1 1 16 ARG HG2 H -1.063 0.946 -4.379 1.00 . A A . 16 ARG HG2 1 1 13 3668 1 1 16 ARG HG3 H -2.004 2.061 -3.381 1.00 . A A . 16 ARG HG3 1 1 13 3669 1 1 16 ARG HH11 H -4.015 1.925 -2.422 1.00 . A A . 16 ARG HH11 1 1 13 3670 1 1 16 ARG HH12 H -4.268 1.587 -0.744 1.00 . A A . 16 ARG HH12 1 1 13 3671 1 1 16 ARG HH21 H -3.096 -1.705 -0.915 1.00 . A A . 16 ARG HH21 1 1 13 3672 1 1 16 ARG HH22 H -3.747 -0.472 0.113 1.00 . A A . 16 ARG HH22 1 1 13 3673 1 1 16 ARG N N 0.008 2.268 -6.668 1.00 . A A . 16 ARG N 1 1 13 3674 1 1 16 ARG NE N -3.101 -0.355 -3.034 1.00 . A A . 16 ARG NE 1 1 13 3675 1 1 16 ARG NH1 N -3.968 1.291 -1.651 1.00 . A A . 16 ARG NH1 1 1 13 3676 1 1 16 ARG NH2 N -3.445 -0.776 -0.791 1.00 . A A . 16 ARG NH2 1 1 13 3677 1 1 16 ARG O O 0.792 2.888 -4.117 1.00 . A A . 16 ARG O 1 1 13 3678 1 1 17 PRO C C -0.433 4.717 -1.550 1.00 . A A . 17 PRO C 1 1 13 3679 1 1 17 PRO CA C 0.180 5.291 -2.828 1.00 . A A . 17 PRO CA 1 1 13 3680 1 1 17 PRO CB C -0.073 6.804 -2.909 1.00 . A A . 17 PRO CB 1 1 13 3681 1 1 17 PRO CD C -1.477 5.684 -4.531 1.00 . A A . 17 PRO CD 1 1 13 3682 1 1 17 PRO CG C -0.946 7.028 -4.110 1.00 . A A . 17 PRO CG 1 1 13 3683 1 1 17 PRO HA H 1.241 5.103 -2.822 1.00 . A A . 17 PRO HA 1 1 13 3684 1 1 17 PRO HB2 H -0.565 7.133 -2.005 1.00 . A A . 17 PRO HB2 1 1 13 3685 1 1 17 PRO HB3 H 0.874 7.317 -3.010 1.00 . A A . 17 PRO HB3 1 1 13 3686 1 1 17 PRO HD2 H -2.428 5.485 -4.066 1.00 . A A . 17 PRO HD2 1 1 13 3687 1 1 17 PRO HD3 H -1.561 5.634 -5.604 1.00 . A A . 17 PRO HD3 1 1 13 3688 1 1 17 PRO HG2 H -1.763 7.683 -3.850 1.00 . A A . 17 PRO HG2 1 1 13 3689 1 1 17 PRO HG3 H -0.361 7.463 -4.907 1.00 . A A . 17 PRO HG3 1 1 13 3690 1 1 17 PRO N N -0.449 4.766 -4.039 1.00 . A A . 17 PRO N 1 1 13 3691 1 1 17 PRO O O -1.503 4.106 -1.579 1.00 . A A . 17 PRO O 1 1 13 3692 1 1 18 PRO C C -1.537 5.009 1.338 1.00 . A A . 18 PRO C 1 1 13 3693 1 1 18 PRO CA C -0.205 4.404 0.895 1.00 . A A . 18 PRO CA 1 1 13 3694 1 1 18 PRO CB C 0.895 4.834 1.871 1.00 . A A . 18 PRO CB 1 1 13 3695 1 1 18 PRO CD C 1.543 5.611 -0.302 1.00 . A A . 18 PRO CD 1 1 13 3696 1 1 18 PRO CG C 1.673 5.892 1.166 1.00 . A A . 18 PRO CG 1 1 13 3697 1 1 18 PRO HA H -0.284 3.326 0.893 1.00 . A A . 18 PRO HA 1 1 13 3698 1 1 18 PRO HB2 H 0.441 5.221 2.767 1.00 . A A . 18 PRO HB2 1 1 13 3699 1 1 18 PRO HB3 H 1.511 3.988 2.117 1.00 . A A . 18 PRO HB3 1 1 13 3700 1 1 18 PRO HD2 H 1.522 6.535 -0.861 1.00 . A A . 18 PRO HD2 1 1 13 3701 1 1 18 PRO HD3 H 2.353 4.984 -0.639 1.00 . A A . 18 PRO HD3 1 1 13 3702 1 1 18 PRO HG2 H 1.262 6.863 1.397 1.00 . A A . 18 PRO HG2 1 1 13 3703 1 1 18 PRO HG3 H 2.710 5.844 1.465 1.00 . A A . 18 PRO HG3 1 1 13 3704 1 1 18 PRO N N 0.255 4.905 -0.407 1.00 . A A . 18 PRO N 1 1 13 3705 1 1 18 PRO O O -1.813 6.183 1.082 1.00 . A A . 18 PRO O 1 1 13 3706 1 1 19 PRO C C -3.555 5.445 3.827 1.00 . A A . 19 PRO C 1 1 13 3707 1 1 19 PRO CA C -3.670 4.660 2.521 1.00 . A A . 19 PRO CA 1 1 13 3708 1 1 19 PRO CB C -4.440 3.360 2.736 1.00 . A A . 19 PRO CB 1 1 13 3709 1 1 19 PRO CD C -2.111 2.804 2.373 1.00 . A A . 19 PRO CD 1 1 13 3710 1 1 19 PRO CG C -3.424 2.284 2.904 1.00 . A A . 19 PRO CG 1 1 13 3711 1 1 19 PRO HA H -4.182 5.265 1.786 1.00 . A A . 19 PRO HA 1 1 13 3712 1 1 19 PRO HB2 H -5.064 3.448 3.612 1.00 . A A . 19 PRO HB2 1 1 13 3713 1 1 19 PRO HB3 H -5.049 3.171 1.881 1.00 . A A . 19 PRO HB3 1 1 13 3714 1 1 19 PRO HD2 H -1.343 2.738 3.128 1.00 . A A . 19 PRO HD2 1 1 13 3715 1 1 19 PRO HD3 H -1.826 2.245 1.497 1.00 . A A . 19 PRO HD3 1 1 13 3716 1 1 19 PRO HG2 H -3.338 2.027 3.943 1.00 . A A . 19 PRO HG2 1 1 13 3717 1 1 19 PRO HG3 H -3.729 1.415 2.338 1.00 . A A . 19 PRO HG3 1 1 13 3718 1 1 19 PRO N N -2.375 4.209 2.025 1.00 . A A . 19 PRO N 1 1 13 3719 1 1 19 PRO O O -2.632 5.229 4.614 1.00 . A A . 19 PRO O 1 1 13 3720 1 1 20 SER C C -5.902 7.751 5.530 1.00 . A A . 20 SER C 1 1 13 3721 1 1 20 SER CA C -4.509 7.181 5.259 1.00 . A A . 20 SER CA 1 1 13 3722 1 1 20 SER CB C -3.488 8.319 5.142 1.00 . A A . 20 SER CB 1 1 13 3723 1 1 20 SER H H -5.208 6.485 3.382 1.00 . A A . 20 SER H 1 1 13 3724 1 1 20 SER HA H -4.230 6.547 6.088 1.00 . A A . 20 SER HA 1 1 13 3725 1 1 20 SER HB2 H -3.628 9.010 5.960 1.00 . A A . 20 SER HB2 1 1 13 3726 1 1 20 SER HB3 H -2.490 7.909 5.186 1.00 . A A . 20 SER HB3 1 1 13 3727 1 1 20 SER HG H -2.946 9.682 3.842 1.00 . A A . 20 SER HG 1 1 13 3728 1 1 20 SER N N -4.500 6.359 4.049 1.00 . A A . 20 SER N 1 1 13 3729 1 1 20 SER O O -6.488 8.355 4.605 1.00 . A A . 20 SER O 1 1 13 3730 1 1 20 SER OXT O -6.394 7.589 6.666 1.00 . A A . 20 SER OXT 1 1 13 3731 1 1 20 SER OG O -3.640 9.024 3.921 1.00 . A A . 20 SER OG 1 1 14 3732 1 1 1 ASP C C -6.379 -3.296 4.405 1.00 . A A . 1 ASP C 1 1 14 3733 1 1 1 ASP CA C -6.604 -4.385 5.452 1.00 . A A . 1 ASP CA 1 1 14 3734 1 1 1 ASP CB C -7.557 -3.882 6.542 1.00 . A A . 1 ASP CB 1 1 14 3735 1 1 1 ASP CG C -8.317 -5.011 7.214 1.00 . A A . 1 ASP CG 1 1 14 3736 1 1 1 ASP H1 H -4.648 -5.026 5.331 1.00 . A A . 1 ASP H1 1 1 14 3737 1 1 1 ASP H2 H -5.517 -5.637 6.677 1.00 . A A . 1 ASP H2 1 1 14 3738 1 1 1 ASP H3 H -4.981 -4.007 6.669 1.00 . A A . 1 ASP H3 1 1 14 3739 1 1 1 ASP HA H -7.040 -5.248 4.971 1.00 . A A . 1 ASP HA 1 1 14 3740 1 1 1 ASP HB2 H -6.988 -3.359 7.296 1.00 . A A . 1 ASP HB2 1 1 14 3741 1 1 1 ASP HB3 H -8.272 -3.203 6.101 1.00 . A A . 1 ASP HB3 1 1 14 3742 1 1 1 ASP N N -5.322 -4.801 6.090 1.00 . A A . 1 ASP N 1 1 14 3743 1 1 1 ASP O O -6.758 -3.456 3.243 1.00 . A A . 1 ASP O 1 1 14 3744 1 1 1 ASP OD1 O -9.415 -5.357 6.730 1.00 . A A . 1 ASP OD1 1 1 14 3745 1 1 1 ASP OD2 O -7.813 -5.547 8.223 1.00 . A A . 1 ASP OD2 1 1 14 3746 1 1 2 ALA C C -3.989 -0.756 3.898 1.00 . A A . 2 ALA C 1 1 14 3747 1 1 2 ALA CA C -5.481 -1.073 3.926 1.00 . A A . 2 ALA CA 1 1 14 3748 1 1 2 ALA CB C -6.280 0.153 4.343 1.00 . A A . 2 ALA CB 1 1 14 3749 1 1 2 ALA H H -5.484 -2.125 5.763 1.00 . A A . 2 ALA H 1 1 14 3750 1 1 2 ALA HA H -5.797 -1.357 2.932 1.00 . A A . 2 ALA HA 1 1 14 3751 1 1 2 ALA HB1 H -5.756 0.671 5.132 1.00 . A A . 2 ALA HB1 1 1 14 3752 1 1 2 ALA HB2 H -7.252 -0.155 4.699 1.00 . A A . 2 ALA HB2 1 1 14 3753 1 1 2 ALA HB3 H -6.397 0.811 3.496 1.00 . A A . 2 ALA HB3 1 1 14 3754 1 1 2 ALA N N -5.760 -2.190 4.824 1.00 . A A . 2 ALA N 1 1 14 3755 1 1 2 ALA O O -3.325 -0.962 2.881 1.00 . A A . 2 ALA O 1 1 14 3756 1 1 3 TYR C C -1.189 -1.181 5.096 1.00 . A A . 3 TYR C 1 1 14 3757 1 1 3 TYR CA C -2.047 0.081 5.127 1.00 . A A . 3 TYR CA 1 1 14 3758 1 1 3 TYR CB C -1.777 0.887 6.401 1.00 . A A . 3 TYR CB 1 1 14 3759 1 1 3 TYR CD1 C -0.772 3.137 5.819 1.00 . A A . 3 TYR CD1 1 1 14 3760 1 1 3 TYR CD2 C 0.673 1.434 6.662 1.00 . A A . 3 TYR CD2 1 1 14 3761 1 1 3 TYR CE1 C 0.300 4.005 5.731 1.00 . A A . 3 TYR CE1 1 1 14 3762 1 1 3 TYR CE2 C 1.749 2.296 6.572 1.00 . A A . 3 TYR CE2 1 1 14 3763 1 1 3 TYR CG C -0.603 1.836 6.286 1.00 . A A . 3 TYR CG 1 1 14 3764 1 1 3 TYR CZ C 1.557 3.580 6.107 1.00 . A A . 3 TYR CZ 1 1 14 3765 1 1 3 TYR H H -4.051 -0.120 5.798 1.00 . A A . 3 TYR H 1 1 14 3766 1 1 3 TYR HA H -1.792 0.684 4.273 1.00 . A A . 3 TYR HA 1 1 14 3767 1 1 3 TYR HB2 H -2.650 1.474 6.641 1.00 . A A . 3 TYR HB2 1 1 14 3768 1 1 3 TYR HB3 H -1.575 0.205 7.214 1.00 . A A . 3 TYR HB3 1 1 14 3769 1 1 3 TYR HD1 H -1.757 3.469 5.514 1.00 . A A . 3 TYR HD1 1 1 14 3770 1 1 3 TYR HD2 H 0.822 0.427 7.024 1.00 . A A . 3 TYR HD2 1 1 14 3771 1 1 3 TYR HE1 H 0.150 5.011 5.373 1.00 . A A . 3 TYR HE1 1 1 14 3772 1 1 3 TYR HE2 H 2.733 1.963 6.865 1.00 . A A . 3 TYR HE2 1 1 14 3773 1 1 3 TYR HH H 2.677 4.971 6.821 1.00 . A A . 3 TYR HH 1 1 14 3774 1 1 3 TYR N N -3.467 -0.258 5.022 1.00 . A A . 3 TYR N 1 1 14 3775 1 1 3 TYR O O -0.257 -1.283 4.297 1.00 . A A . 3 TYR O 1 1 14 3776 1 1 3 TYR OH O 2.625 4.443 6.020 1.00 . A A . 3 TYR OH 1 1 14 3777 1 1 4 ALA C C -0.984 -4.176 4.677 1.00 . A A . 4 ALA C 1 1 14 3778 1 1 4 ALA CA C -0.800 -3.418 5.991 1.00 . A A . 4 ALA CA 1 1 14 3779 1 1 4 ALA CB C -1.268 -4.262 7.168 1.00 . A A . 4 ALA CB 1 1 14 3780 1 1 4 ALA H H -2.289 -2.022 6.549 1.00 . A A . 4 ALA H 1 1 14 3781 1 1 4 ALA HA H 0.252 -3.199 6.125 1.00 . A A . 4 ALA HA 1 1 14 3782 1 1 4 ALA HB1 H -2.265 -4.631 6.973 1.00 . A A . 4 ALA HB1 1 1 14 3783 1 1 4 ALA HB2 H -1.278 -3.658 8.063 1.00 . A A . 4 ALA HB2 1 1 14 3784 1 1 4 ALA HB3 H -0.596 -5.096 7.304 1.00 . A A . 4 ALA HB3 1 1 14 3785 1 1 4 ALA N N -1.525 -2.153 5.950 1.00 . A A . 4 ALA N 1 1 14 3786 1 1 4 ALA O O -0.071 -4.863 4.215 1.00 . A A . 4 ALA O 1 1 14 3787 1 1 5 GLN C C -1.642 -4.038 1.677 1.00 . A A . 5 GLN C 1 1 14 3788 1 1 5 GLN CA C -2.470 -4.670 2.796 1.00 . A A . 5 GLN CA 1 1 14 3789 1 1 5 GLN CB C -3.965 -4.550 2.484 1.00 . A A . 5 GLN CB 1 1 14 3790 1 1 5 GLN CD C -4.246 -6.631 1.072 1.00 . A A . 5 GLN CD 1 1 14 3791 1 1 5 GLN CG C -4.360 -5.118 1.130 1.00 . A A . 5 GLN CG 1 1 14 3792 1 1 5 GLN H H -2.848 -3.448 4.479 1.00 . A A . 5 GLN H 1 1 14 3793 1 1 5 GLN HA H -2.208 -5.714 2.880 1.00 . A A . 5 GLN HA 1 1 14 3794 1 1 5 GLN HB2 H -4.523 -5.075 3.245 1.00 . A A . 5 GLN HB2 1 1 14 3795 1 1 5 GLN HB3 H -4.242 -3.506 2.505 1.00 . A A . 5 GLN HB3 1 1 14 3796 1 1 5 GLN HE21 H -2.879 -6.506 -0.371 1.00 . A A . 5 GLN HE21 1 1 14 3797 1 1 5 GLN HE22 H -3.296 -8.105 0.133 1.00 . A A . 5 GLN HE22 1 1 14 3798 1 1 5 GLN HG2 H -5.383 -4.841 0.922 1.00 . A A . 5 GLN HG2 1 1 14 3799 1 1 5 GLN HG3 H -3.713 -4.692 0.378 1.00 . A A . 5 GLN HG3 1 1 14 3800 1 1 5 GLN N N -2.168 -4.025 4.069 1.00 . A A . 5 GLN N 1 1 14 3801 1 1 5 GLN NE2 N -3.387 -7.131 0.189 1.00 . A A . 5 GLN NE2 1 1 14 3802 1 1 5 GLN O O -1.154 -4.734 0.787 1.00 . A A . 5 GLN O 1 1 14 3803 1 1 5 GLN OE1 O -4.923 -7.344 1.814 1.00 . A A . 5 GLN OE1 1 1 14 3804 1 1 6 TRP C C 0.747 -2.452 0.750 1.00 . A A . 6 TRP C 1 1 14 3805 1 1 6 TRP CA C -0.699 -1.972 0.756 1.00 . A A . 6 TRP CA 1 1 14 3806 1 1 6 TRP CB C -0.743 -0.472 1.063 1.00 . A A . 6 TRP CB 1 1 14 3807 1 1 6 TRP CD1 C -0.295 0.653 -1.184 1.00 . A A . 6 TRP CD1 1 1 14 3808 1 1 6 TRP CD2 C 1.303 0.999 0.341 1.00 . A A . 6 TRP CD2 1 1 14 3809 1 1 6 TRP CE2 C 1.663 1.661 -0.846 1.00 . A A . 6 TRP CE2 1 1 14 3810 1 1 6 TRP CE3 C 2.161 1.080 1.442 1.00 . A A . 6 TRP CE3 1 1 14 3811 1 1 6 TRP CG C 0.044 0.357 0.100 1.00 . A A . 6 TRP CG 1 1 14 3812 1 1 6 TRP CH2 C 3.658 2.461 0.122 1.00 . A A . 6 TRP CH2 1 1 14 3813 1 1 6 TRP CZ2 C 2.838 2.394 -0.968 1.00 . A A . 6 TRP CZ2 1 1 14 3814 1 1 6 TRP CZ3 C 3.331 1.813 1.321 1.00 . A A . 6 TRP CZ3 1 1 14 3815 1 1 6 TRP H H -1.888 -2.222 2.488 1.00 . A A . 6 TRP H 1 1 14 3816 1 1 6 TRP HA H -1.133 -2.149 -0.217 1.00 . A A . 6 TRP HA 1 1 14 3817 1 1 6 TRP HB2 H -1.767 -0.136 1.034 1.00 . A A . 6 TRP HB2 1 1 14 3818 1 1 6 TRP HB3 H -0.344 -0.302 2.050 1.00 . A A . 6 TRP HB3 1 1 14 3819 1 1 6 TRP HD1 H -1.196 0.313 -1.667 1.00 . A A . 6 TRP HD1 1 1 14 3820 1 1 6 TRP HE1 H 0.656 1.767 -2.676 1.00 . A A . 6 TRP HE1 1 1 14 3821 1 1 6 TRP HE3 H 1.925 0.583 2.373 1.00 . A A . 6 TRP HE3 1 1 14 3822 1 1 6 TRP HH2 H 4.576 3.030 0.072 1.00 . A A . 6 TRP HH2 1 1 14 3823 1 1 6 TRP HZ2 H 3.108 2.893 -1.887 1.00 . A A . 6 TRP HZ2 1 1 14 3824 1 1 6 TRP HZ3 H 4.008 1.887 2.160 1.00 . A A . 6 TRP HZ3 1 1 14 3825 1 1 6 TRP N N -1.479 -2.713 1.744 1.00 . A A . 6 TRP N 1 1 14 3826 1 1 6 TRP NE1 N 0.673 1.429 -1.759 1.00 . A A . 6 TRP NE1 1 1 14 3827 1 1 6 TRP O O 1.312 -2.745 -0.306 1.00 . A A . 6 TRP O 1 1 14 3828 1 1 7 LEU C C 2.854 -4.448 1.670 1.00 . A A . 7 LEU C 1 1 14 3829 1 1 7 LEU CA C 2.710 -2.988 2.101 1.00 . A A . 7 LEU CA 1 1 14 3830 1 1 7 LEU CB C 3.152 -2.813 3.557 1.00 . A A . 7 LEU CB 1 1 14 3831 1 1 7 LEU CD1 C 3.184 -1.332 5.582 1.00 . A A . 7 LEU CD1 1 1 14 3832 1 1 7 LEU CD2 C 4.332 -0.593 3.485 1.00 . A A . 7 LEU CD2 1 1 14 3833 1 1 7 LEU CG C 3.153 -1.366 4.062 1.00 . A A . 7 LEU CG 1 1 14 3834 1 1 7 LEU H H 0.818 -2.293 2.742 1.00 . A A . 7 LEU H 1 1 14 3835 1 1 7 LEU HA H 3.334 -2.376 1.468 1.00 . A A . 7 LEU HA 1 1 14 3836 1 1 7 LEU HB2 H 2.485 -3.389 4.183 1.00 . A A . 7 LEU HB2 1 1 14 3837 1 1 7 LEU HB3 H 4.148 -3.210 3.662 1.00 . A A . 7 LEU HB3 1 1 14 3838 1 1 7 LEU HD11 H 2.992 -0.325 5.923 1.00 . A A . 7 LEU HD11 1 1 14 3839 1 1 7 LEU HD12 H 4.155 -1.652 5.930 1.00 . A A . 7 LEU HD12 1 1 14 3840 1 1 7 LEU HD13 H 2.425 -1.995 5.972 1.00 . A A . 7 LEU HD13 1 1 14 3841 1 1 7 LEU HD21 H 5.237 -1.170 3.606 1.00 . A A . 7 LEU HD21 1 1 14 3842 1 1 7 LEU HD22 H 4.434 0.349 4.004 1.00 . A A . 7 LEU HD22 1 1 14 3843 1 1 7 LEU HD23 H 4.162 -0.406 2.434 1.00 . A A . 7 LEU HD23 1 1 14 3844 1 1 7 LEU HG H 2.244 -0.880 3.739 1.00 . A A . 7 LEU HG 1 1 14 3845 1 1 7 LEU N N 1.332 -2.536 1.943 1.00 . A A . 7 LEU N 1 1 14 3846 1 1 7 LEU O O 3.870 -4.836 1.092 1.00 . A A . 7 LEU O 1 1 14 3847 1 1 8 ALA C C 1.580 -6.856 0.072 1.00 . A A . 8 ALA C 1 1 14 3848 1 1 8 ALA CA C 1.815 -6.664 1.575 1.00 . A A . 8 ALA CA 1 1 14 3849 1 1 8 ALA CB C 0.759 -7.415 2.375 1.00 . A A . 8 ALA CB 1 1 14 3850 1 1 8 ALA H H 1.035 -4.875 2.399 1.00 . A A . 8 ALA H 1 1 14 3851 1 1 8 ALA HA H 2.781 -7.075 1.830 1.00 . A A . 8 ALA HA 1 1 14 3852 1 1 8 ALA HB1 H 0.670 -8.423 1.997 1.00 . A A . 8 ALA HB1 1 1 14 3853 1 1 8 ALA HB2 H -0.191 -6.910 2.281 1.00 . A A . 8 ALA HB2 1 1 14 3854 1 1 8 ALA HB3 H 1.050 -7.445 3.415 1.00 . A A . 8 ALA HB3 1 1 14 3855 1 1 8 ALA N N 1.819 -5.249 1.944 1.00 . A A . 8 ALA N 1 1 14 3856 1 1 8 ALA O O 1.912 -7.906 -0.481 1.00 . A A . 8 ALA O 1 1 14 3857 1 1 9 ASP C C 1.959 -5.443 -2.849 1.00 . A A . 9 ASP C 1 1 14 3858 1 1 9 ASP CA C 0.746 -5.898 -2.025 1.00 . A A . 9 ASP CA 1 1 14 3859 1 1 9 ASP CB C -0.473 -5.036 -2.374 1.00 . A A . 9 ASP CB 1 1 14 3860 1 1 9 ASP CG C -1.465 -5.768 -3.256 1.00 . A A . 9 ASP CG 1 1 14 3861 1 1 9 ASP H H 0.776 -5.023 -0.095 1.00 . A A . 9 ASP H 1 1 14 3862 1 1 9 ASP HA H 0.527 -6.926 -2.273 1.00 . A A . 9 ASP HA 1 1 14 3863 1 1 9 ASP HB2 H -0.976 -4.747 -1.463 1.00 . A A . 9 ASP HB2 1 1 14 3864 1 1 9 ASP HB3 H -0.143 -4.148 -2.894 1.00 . A A . 9 ASP HB3 1 1 14 3865 1 1 9 ASP N N 1.015 -5.836 -0.586 1.00 . A A . 9 ASP N 1 1 14 3866 1 1 9 ASP O O 1.831 -5.155 -4.041 1.00 . A A . 9 ASP O 1 1 14 3867 1 1 9 ASP OD1 O -1.326 -5.692 -4.495 1.00 . A A . 9 ASP OD1 1 1 14 3868 1 1 9 ASP OD2 O -2.379 -6.418 -2.707 1.00 . A A . 9 ASP OD2 1 1 14 3869 1 1 10 DAL C C 4.747 -3.526 -2.531 1.00 . A A . 10 DAL C 1 1 14 3870 1 1 10 DAL CA C 4.358 -4.963 -2.890 1.00 . A A . 10 DAL CA 1 1 14 3871 1 1 10 DAL CB C 5.490 -5.911 -2.534 1.00 . A A . 10 DAL CB 1 1 14 3872 1 1 10 DAL H H 3.179 -5.622 -1.266 1.00 . A A . 10 DAL H 1 1 14 3873 1 1 10 DAL HA H 4.191 -5.026 -3.955 1.00 . A A . 10 DAL HA 1 1 14 3874 1 1 10 DAL HB1 H 5.749 -5.781 -1.494 1.00 . A A . 10 DAL HB1 1 1 14 3875 1 1 10 DAL HB2 H 6.349 -5.694 -3.150 1.00 . A A . 10 DAL HB2 1 1 14 3876 1 1 10 DAL HB3 H 5.173 -6.929 -2.702 1.00 . A A . 10 DAL HB3 1 1 14 3877 1 1 10 DAL N N 3.133 -5.381 -2.213 1.00 . A A . 10 DAL N 1 1 14 3878 1 1 10 DAL O O 5.789 -3.035 -2.971 1.00 . A A . 10 DAL O 1 1 14 3879 1 1 11 GLY C C 4.116 -0.522 -2.498 1.00 . A A . 11 GLY C 1 1 14 3880 1 1 11 GLY CA C 4.192 -1.487 -1.335 1.00 . A A . 11 GLY CA 1 1 14 3881 1 1 11 GLY H H 3.097 -3.294 -1.412 1.00 . A A . 11 GLY H 1 1 14 3882 1 1 11 GLY HA2 H 3.476 -1.184 -0.585 1.00 . A A . 11 GLY HA2 1 1 14 3883 1 1 11 GLY HA3 H 5.184 -1.444 -0.910 1.00 . A A . 11 GLY HA3 1 1 14 3884 1 1 11 GLY N N 3.911 -2.856 -1.733 1.00 . A A . 11 GLY N 1 1 14 3885 1 1 11 GLY O O 3.032 -0.065 -2.862 1.00 . A A . 11 GLY O 1 1 14 3886 1 1 12 TRP C C 5.381 -0.032 -5.555 1.00 . A A . 12 TRP C 1 1 14 3887 1 1 12 TRP CA C 5.329 0.707 -4.215 1.00 . A A . 12 TRP CA 1 1 14 3888 1 1 12 TRP CB C 6.521 1.652 -4.055 1.00 . A A . 12 TRP CB 1 1 14 3889 1 1 12 TRP CD1 C 6.733 3.059 -1.929 1.00 . A A . 12 TRP CD1 1 1 14 3890 1 1 12 TRP CD2 C 5.204 3.806 -3.386 1.00 . A A . 12 TRP CD2 1 1 14 3891 1 1 12 TRP CE2 C 5.203 4.649 -2.262 1.00 . A A . 12 TRP CE2 1 1 14 3892 1 1 12 TRP CE3 C 4.321 4.082 -4.439 1.00 . A A . 12 TRP CE3 1 1 14 3893 1 1 12 TRP CG C 6.189 2.793 -3.152 1.00 . A A . 12 TRP CG 1 1 14 3894 1 1 12 TRP CH2 C 3.504 5.993 -3.198 1.00 . A A . 12 TRP CH2 1 1 14 3895 1 1 12 TRP CZ2 C 4.355 5.743 -2.156 1.00 . A A . 12 TRP CZ2 1 1 14 3896 1 1 12 TRP CZ3 C 3.484 5.174 -4.335 1.00 . A A . 12 TRP CZ3 1 1 14 3897 1 1 12 TRP H H 6.102 -0.612 -2.750 1.00 . A A . 12 TRP H 1 1 14 3898 1 1 12 TRP HA H 4.422 1.297 -4.191 1.00 . A A . 12 TRP HA 1 1 14 3899 1 1 12 TRP HB2 H 7.352 1.110 -3.626 1.00 . A A . 12 TRP HB2 1 1 14 3900 1 1 12 TRP HB3 H 6.806 2.048 -5.018 1.00 . A A . 12 TRP HB3 1 1 14 3901 1 1 12 TRP HD1 H 7.511 2.469 -1.468 1.00 . A A . 12 TRP HD1 1 1 14 3902 1 1 12 TRP HE1 H 6.366 4.568 -0.516 1.00 . A A . 12 TRP HE1 1 1 14 3903 1 1 12 TRP HE3 H 4.289 3.462 -5.323 1.00 . A A . 12 TRP HE3 1 1 14 3904 1 1 12 TRP HH2 H 2.830 6.836 -3.158 1.00 . A A . 12 TRP HH2 1 1 14 3905 1 1 12 TRP HZ2 H 4.352 6.373 -1.283 1.00 . A A . 12 TRP HZ2 1 1 14 3906 1 1 12 TRP HZ3 H 2.800 5.405 -5.140 1.00 . A A . 12 TRP HZ3 1 1 14 3907 1 1 12 TRP N N 5.271 -0.213 -3.085 1.00 . A A . 12 TRP N 1 1 14 3908 1 1 12 TRP NE1 N 6.145 4.175 -1.387 1.00 . A A . 12 TRP NE1 1 1 14 3909 1 1 12 TRP O O 5.649 0.575 -6.595 1.00 . A A . 12 TRP O 1 1 14 3910 1 1 13 ALA C C 3.674 -2.092 -7.379 1.00 . A A . 13 ALA C 1 1 14 3911 1 1 13 ALA CA C 5.062 -2.139 -6.747 1.00 . A A . 13 ALA CA 1 1 14 3912 1 1 13 ALA CB C 5.473 -3.573 -6.453 1.00 . A A . 13 ALA CB 1 1 14 3913 1 1 13 ALA H H 4.853 -1.759 -4.681 1.00 . A A . 13 ALA H 1 1 14 3914 1 1 13 ALA HA H 5.774 -1.718 -7.439 1.00 . A A . 13 ALA HA 1 1 14 3915 1 1 13 ALA HB1 H 4.728 -4.250 -6.844 1.00 . A A . 13 ALA HB1 1 1 14 3916 1 1 13 ALA HB2 H 5.562 -3.712 -5.386 1.00 . A A . 13 ALA HB2 1 1 14 3917 1 1 13 ALA HB3 H 6.423 -3.774 -6.923 1.00 . A A . 13 ALA HB3 1 1 14 3918 1 1 13 ALA N N 5.086 -1.335 -5.532 1.00 . A A . 13 ALA N 1 1 14 3919 1 1 13 ALA O O 3.535 -2.147 -8.602 1.00 . A A . 13 ALA O 1 1 14 3920 1 1 14 SER C C 1.056 -0.623 -7.839 1.00 . A A . 14 SER C 1 1 14 3921 1 1 14 SER CA C 1.265 -1.877 -6.985 1.00 . A A . 14 SER CA 1 1 14 3922 1 1 14 SER CB C 0.307 -1.869 -5.783 1.00 . A A . 14 SER CB 1 1 14 3923 1 1 14 SER H H 2.834 -1.909 -5.567 1.00 . A A . 14 SER H 1 1 14 3924 1 1 14 SER HA H 1.062 -2.745 -7.591 1.00 . A A . 14 SER HA 1 1 14 3925 1 1 14 SER HB2 H -0.597 -1.343 -6.049 1.00 . A A . 14 SER HB2 1 1 14 3926 1 1 14 SER HB3 H 0.062 -2.887 -5.514 1.00 . A A . 14 SER HB3 1 1 14 3927 1 1 14 SER HG H 1.223 -1.891 -4.044 1.00 . A A . 14 SER HG 1 1 14 3928 1 1 14 SER N N 2.650 -1.963 -6.528 1.00 . A A . 14 SER N 1 1 14 3929 1 1 14 SER O O 0.211 -0.610 -8.737 1.00 . A A . 14 SER O 1 1 14 3930 1 1 14 SER OG O 0.890 -1.228 -4.657 1.00 . A A . 14 SER OG 1 1 14 3931 1 1 15 DAL C C 0.922 2.730 -7.535 1.00 . A A . 15 DAL C 1 1 14 3932 1 1 15 DAL CA C 1.743 1.686 -8.296 1.00 . A A . 15 DAL CA 1 1 14 3933 1 1 15 DAL CB C 3.137 2.216 -8.596 1.00 . A A . 15 DAL CB 1 1 14 3934 1 1 15 DAL H H 2.490 0.352 -6.828 1.00 . A A . 15 DAL H 1 1 14 3935 1 1 15 DAL HA H 1.258 1.482 -9.238 1.00 . A A . 15 DAL HA 1 1 14 3936 1 1 15 DAL HB1 H 3.342 2.105 -9.649 1.00 . A A . 15 DAL HB1 1 1 14 3937 1 1 15 DAL HB2 H 3.864 1.658 -8.026 1.00 . A A . 15 DAL HB2 1 1 14 3938 1 1 15 DAL HB3 H 3.192 3.260 -8.326 1.00 . A A . 15 DAL HB3 1 1 14 3939 1 1 15 DAL N N 1.835 0.427 -7.555 1.00 . A A . 15 DAL N 1 1 14 3940 1 1 15 DAL O O 1.084 3.935 -7.743 1.00 . A A . 15 DAL O 1 1 14 3941 1 1 16 ARG C C -0.075 3.599 -4.592 1.00 . A A . 16 ARG C 1 1 14 3942 1 1 16 ARG CA C -0.806 3.146 -5.858 1.00 . A A . 16 ARG CA 1 1 14 3943 1 1 16 ARG CB C -2.115 2.423 -5.481 1.00 . A A . 16 ARG CB 1 1 14 3944 1 1 16 ARG CD C -2.998 0.349 -4.365 1.00 . A A . 16 ARG CD 1 1 14 3945 1 1 16 ARG CG C -1.970 1.469 -4.301 1.00 . A A . 16 ARG CG 1 1 14 3946 1 1 16 ARG CZ C -3.481 -0.243 -2.010 1.00 . A A . 16 ARG CZ 1 1 14 3947 1 1 16 ARG H H -0.041 1.291 -6.533 1.00 . A A . 16 ARG H 1 1 14 3948 1 1 16 ARG HA H -1.034 4.020 -6.456 1.00 . A A . 16 ARG HA 1 1 14 3949 1 1 16 ARG HB2 H -2.860 3.162 -5.229 1.00 . A A . 16 ARG HB2 1 1 14 3950 1 1 16 ARG HB3 H -2.464 1.846 -6.333 1.00 . A A . 16 ARG HB3 1 1 14 3951 1 1 16 ARG HD2 H -3.983 0.786 -4.423 1.00 . A A . 16 ARG HD2 1 1 14 3952 1 1 16 ARG HD3 H -2.812 -0.237 -5.252 1.00 . A A . 16 ARG HD3 1 1 14 3953 1 1 16 ARG HE H -2.473 -1.387 -3.304 1.00 . A A . 16 ARG HE 1 1 14 3954 1 1 16 ARG HG2 H -0.980 1.037 -4.319 1.00 . A A . 16 ARG HG2 1 1 14 3955 1 1 16 ARG HG3 H -2.109 2.023 -3.383 1.00 . A A . 16 ARG HG3 1 1 14 3956 1 1 16 ARG HH11 H -4.177 1.581 -2.557 1.00 . A A . 16 ARG HH11 1 1 14 3957 1 1 16 ARG HH12 H -4.514 1.119 -0.923 1.00 . A A . 16 ARG HH12 1 1 14 3958 1 1 16 ARG HH21 H -2.918 -1.988 -1.152 1.00 . A A . 16 ARG HH21 1 1 14 3959 1 1 16 ARG HH22 H -3.798 -0.907 -0.123 1.00 . A A . 16 ARG HH22 1 1 14 3960 1 1 16 ARG N N 0.042 2.260 -6.653 1.00 . A A . 16 ARG N 1 1 14 3961 1 1 16 ARG NE N -2.937 -0.530 -3.197 1.00 . A A . 16 ARG NE 1 1 14 3962 1 1 16 ARG NH1 N -4.109 0.914 -1.814 1.00 . A A . 16 ARG NH1 1 1 14 3963 1 1 16 ARG NH2 N -3.392 -1.118 -1.013 1.00 . A A . 16 ARG NH2 1 1 14 3964 1 1 16 ARG O O 0.811 2.901 -4.102 1.00 . A A . 16 ARG O 1 1 14 3965 1 1 17 PRO C C -0.440 4.743 -1.553 1.00 . A A . 17 PRO C 1 1 14 3966 1 1 17 PRO CA C 0.184 5.309 -2.829 1.00 . A A . 17 PRO CA 1 1 14 3967 1 1 17 PRO CB C -0.067 6.821 -2.920 1.00 . A A . 17 PRO CB 1 1 14 3968 1 1 17 PRO CD C -1.461 5.690 -4.544 1.00 . A A . 17 PRO CD 1 1 14 3969 1 1 17 PRO CG C -0.937 7.037 -4.125 1.00 . A A . 17 PRO CG 1 1 14 3970 1 1 17 PRO HA H 1.245 5.120 -2.812 1.00 . A A . 17 PRO HA 1 1 14 3971 1 1 17 PRO HB2 H -0.561 7.156 -2.020 1.00 . A A . 17 PRO HB2 1 1 14 3972 1 1 17 PRO HB3 H 0.881 7.333 -3.023 1.00 . A A . 17 PRO HB3 1 1 14 3973 1 1 17 PRO HD2 H -2.415 5.490 -4.084 1.00 . A A . 17 PRO HD2 1 1 14 3974 1 1 17 PRO HD3 H -1.538 5.636 -5.618 1.00 . A A . 17 PRO HD3 1 1 14 3975 1 1 17 PRO HG2 H -1.758 7.689 -3.868 1.00 . A A . 17 PRO HG2 1 1 14 3976 1 1 17 PRO HG3 H -0.352 7.474 -4.921 1.00 . A A . 17 PRO HG3 1 1 14 3977 1 1 17 PRO N N -0.434 4.777 -4.041 1.00 . A A . 17 PRO N 1 1 14 3978 1 1 17 PRO O O -1.516 4.143 -1.587 1.00 . A A . 17 PRO O 1 1 14 3979 1 1 18 PRO C C -1.552 5.042 1.333 1.00 . A A . 18 PRO C 1 1 14 3980 1 1 18 PRO CA C -0.223 4.427 0.893 1.00 . A A . 18 PRO CA 1 1 14 3981 1 1 18 PRO CB C 0.878 4.845 1.873 1.00 . A A . 18 PRO CB 1 1 14 3982 1 1 18 PRO CD C 1.541 5.614 -0.300 1.00 . A A . 18 PRO CD 1 1 14 3983 1 1 18 PRO CG C 1.676 5.889 1.169 1.00 . A A . 18 PRO CG 1 1 14 3984 1 1 18 PRO HA H -0.312 3.349 0.890 1.00 . A A . 18 PRO HA 1 1 14 3985 1 1 18 PRO HB2 H 0.424 5.243 2.765 1.00 . A A . 18 PRO HB2 1 1 14 3986 1 1 18 PRO HB3 H 1.480 3.991 2.127 1.00 . A A . 18 PRO HB3 1 1 14 3987 1 1 18 PRO HD2 H 1.530 6.540 -0.856 1.00 . A A . 18 PRO HD2 1 1 14 3988 1 1 18 PRO HD3 H 2.345 4.980 -0.640 1.00 . A A . 18 PRO HD3 1 1 14 3989 1 1 18 PRO HG2 H 1.283 6.868 1.402 1.00 . A A . 18 PRO HG2 1 1 14 3990 1 1 18 PRO HG3 H 2.711 5.821 1.468 1.00 . A A . 18 PRO HG3 1 1 14 3991 1 1 18 PRO N N 0.246 4.923 -0.407 1.00 . A A . 18 PRO N 1 1 14 3992 1 1 18 PRO O O -1.814 6.221 1.086 1.00 . A A . 18 PRO O 1 1 14 3993 1 1 19 PRO C C -3.581 5.473 3.817 1.00 . A A . 19 PRO C 1 1 14 3994 1 1 19 PRO CA C -3.695 4.702 2.502 1.00 . A A . 19 PRO CA 1 1 14 3995 1 1 19 PRO CB C -4.479 3.408 2.703 1.00 . A A . 19 PRO CB 1 1 14 3996 1 1 19 PRO CD C -2.153 2.833 2.346 1.00 . A A . 19 PRO CD 1 1 14 3997 1 1 19 PRO CG C -3.474 2.320 2.863 1.00 . A A . 19 PRO CG 1 1 14 3998 1 1 19 PRO HA H -4.197 5.319 1.771 1.00 . A A . 19 PRO HA 1 1 14 3999 1 1 19 PRO HB2 H -5.104 3.494 3.578 1.00 . A A . 19 PRO HB2 1 1 14 4000 1 1 19 PRO HB3 H -5.087 3.234 1.845 1.00 . A A . 19 PRO HB3 1 1 14 4001 1 1 19 PRO HD2 H -1.391 2.753 3.105 1.00 . A A . 19 PRO HD2 1 1 14 4002 1 1 19 PRO HD3 H -1.868 2.280 1.467 1.00 . A A . 19 PRO HD3 1 1 14 4003 1 1 19 PRO HG2 H -3.396 2.050 3.900 1.00 . A A . 19 PRO HG2 1 1 14 4004 1 1 19 PRO HG3 H -3.784 1.462 2.286 1.00 . A A . 19 PRO HG3 1 1 14 4005 1 1 19 PRO N N -2.402 4.244 2.009 1.00 . A A . 19 PRO N 1 1 14 4006 1 1 19 PRO O O -2.667 5.238 4.608 1.00 . A A . 19 PRO O 1 1 14 4007 1 1 20 SER C C -5.950 7.403 5.774 1.00 . A A . 20 SER C 1 1 14 4008 1 1 20 SER CA C -4.526 7.204 5.258 1.00 . A A . 20 SER CA 1 1 14 4009 1 1 20 SER CB C -3.864 8.561 4.999 1.00 . A A . 20 SER CB 1 1 14 4010 1 1 20 SER H H -5.219 6.536 3.370 1.00 . A A . 20 SER H 1 1 14 4011 1 1 20 SER HA H -3.957 6.675 6.008 1.00 . A A . 20 SER HA 1 1 14 4012 1 1 20 SER HB2 H -2.974 8.417 4.406 1.00 . A A . 20 SER HB2 1 1 14 4013 1 1 20 SER HB3 H -4.553 9.199 4.466 1.00 . A A . 20 SER HB3 1 1 14 4014 1 1 20 SER HG H -2.612 8.932 6.461 1.00 . A A . 20 SER HG 1 1 14 4015 1 1 20 SER N N -4.517 6.395 4.040 1.00 . A A . 20 SER N 1 1 14 4016 1 1 20 SER O O -6.810 7.858 4.988 1.00 . A A . 20 SER O 1 1 14 4017 1 1 20 SER OXT O -6.194 7.102 6.961 1.00 . A A . 20 SER OXT 1 1 14 4018 1 1 20 SER OG O -3.503 9.192 6.215 1.00 . A A . 20 SER OG 1 1 15 4019 1 1 1 ASP C C -6.738 -3.147 4.835 1.00 . A A . 1 ASP C 1 1 15 4020 1 1 1 ASP CA C -6.871 -4.268 5.868 1.00 . A A . 1 ASP CA 1 1 15 4021 1 1 1 ASP CB C -7.684 -5.434 5.295 1.00 . A A . 1 ASP CB 1 1 15 4022 1 1 1 ASP CG C -6.811 -6.466 4.607 1.00 . A A . 1 ASP CG 1 1 15 4023 1 1 1 ASP H1 H -7.582 -4.576 7.776 1.00 . A A . 1 ASP H1 1 1 15 4024 1 1 1 ASP H2 H -8.495 -3.460 6.845 1.00 . A A . 1 ASP H2 1 1 15 4025 1 1 1 ASP H3 H -6.972 -3.001 7.488 1.00 . A A . 1 ASP H3 1 1 15 4026 1 1 1 ASP HA H -5.884 -4.620 6.130 1.00 . A A . 1 ASP HA 1 1 15 4027 1 1 1 ASP HB2 H -8.219 -5.920 6.097 1.00 . A A . 1 ASP HB2 1 1 15 4028 1 1 1 ASP HB3 H -8.394 -5.052 4.576 1.00 . A A . 1 ASP HB3 1 1 15 4029 1 1 1 ASP N N -7.540 -3.783 7.106 1.00 . A A . 1 ASP N 1 1 15 4030 1 1 1 ASP O O -7.605 -2.972 3.976 1.00 . A A . 1 ASP O 1 1 15 4031 1 1 1 ASP OD1 O -6.278 -7.354 5.305 1.00 . A A . 1 ASP OD1 1 1 15 4032 1 1 1 ASP OD2 O -6.659 -6.385 3.370 1.00 . A A . 1 ASP OD2 1 1 15 4033 1 1 2 ALA C C -3.909 -0.933 3.962 1.00 . A A . 2 ALA C 1 1 15 4034 1 1 2 ALA CA C -5.394 -1.281 4.013 1.00 . A A . 2 ALA CA 1 1 15 4035 1 1 2 ALA CB C -6.212 -0.064 4.420 1.00 . A A . 2 ALA CB 1 1 15 4036 1 1 2 ALA H H -4.995 -2.577 5.641 1.00 . A A . 2 ALA H 1 1 15 4037 1 1 2 ALA HA H -5.715 -1.586 3.027 1.00 . A A . 2 ALA HA 1 1 15 4038 1 1 2 ALA HB1 H -6.030 0.158 5.460 1.00 . A A . 2 ALA HB1 1 1 15 4039 1 1 2 ALA HB2 H -7.261 -0.272 4.274 1.00 . A A . 2 ALA HB2 1 1 15 4040 1 1 2 ALA HB3 H -5.924 0.782 3.815 1.00 . A A . 2 ALA HB3 1 1 15 4041 1 1 2 ALA N N -5.646 -2.388 4.932 1.00 . A A . 2 ALA N 1 1 15 4042 1 1 2 ALA O O -3.252 -1.145 2.943 1.00 . A A . 2 ALA O 1 1 15 4043 1 1 3 TYR C C -1.085 -1.273 5.105 1.00 . A A . 3 TYR C 1 1 15 4044 1 1 3 TYR CA C -1.971 -0.031 5.151 1.00 . A A . 3 TYR CA 1 1 15 4045 1 1 3 TYR CB C -1.696 0.780 6.420 1.00 . A A . 3 TYR CB 1 1 15 4046 1 1 3 TYR CD1 C -0.733 3.054 5.855 1.00 . A A . 3 TYR CD1 1 1 15 4047 1 1 3 TYR CD2 C 0.754 1.351 6.623 1.00 . A A . 3 TYR CD2 1 1 15 4048 1 1 3 TYR CE1 C 0.325 3.935 5.755 1.00 . A A . 3 TYR CE1 1 1 15 4049 1 1 3 TYR CE2 C 1.816 2.229 6.521 1.00 . A A . 3 TYR CE2 1 1 15 4050 1 1 3 TYR CG C -0.537 1.745 6.292 1.00 . A A . 3 TYR CG 1 1 15 4051 1 1 3 TYR CZ C 1.597 3.519 6.087 1.00 . A A . 3 TYR CZ 1 1 15 4052 1 1 3 TYR H H -3.963 -0.261 5.850 1.00 . A A . 3 TYR H 1 1 15 4053 1 1 3 TYR HA H -1.744 0.576 4.292 1.00 . A A . 3 TYR HA 1 1 15 4054 1 1 3 TYR HB2 H -2.575 1.356 6.669 1.00 . A A . 3 TYR HB2 1 1 15 4055 1 1 3 TYR HB3 H -1.476 0.102 7.232 1.00 . A A . 3 TYR HB3 1 1 15 4056 1 1 3 TYR HD1 H -1.730 3.380 5.584 1.00 . A A . 3 TYR HD1 1 1 15 4057 1 1 3 TYR HD2 H 0.925 0.340 6.962 1.00 . A A . 3 TYR HD2 1 1 15 4058 1 1 3 TYR HE1 H 0.153 4.946 5.422 1.00 . A A . 3 TYR HE1 1 1 15 4059 1 1 3 TYR HE2 H 2.813 1.903 6.781 1.00 . A A . 3 TYR HE2 1 1 15 4060 1 1 3 TYR HH H 2.782 4.841 6.828 1.00 . A A . 3 TYR HH 1 1 15 4061 1 1 3 TYR N N -3.385 -0.402 5.070 1.00 . A A . 3 TYR N 1 1 15 4062 1 1 3 TYR O O -0.156 -1.347 4.298 1.00 . A A . 3 TYR O 1 1 15 4063 1 1 3 TYR OH O 2.653 4.396 5.987 1.00 . A A . 3 TYR OH 1 1 15 4064 1 1 4 ALA C C -0.829 -4.269 4.672 1.00 . A A . 4 ALA C 1 1 15 4065 1 1 4 ALA CA C -0.634 -3.505 5.981 1.00 . A A . 4 ALA CA 1 1 15 4066 1 1 4 ALA CB C -1.055 -4.359 7.168 1.00 . A A . 4 ALA CB 1 1 15 4067 1 1 4 ALA H H -2.153 -2.149 6.560 1.00 . A A . 4 ALA H 1 1 15 4068 1 1 4 ALA HA H 0.415 -3.260 6.091 1.00 . A A . 4 ALA HA 1 1 15 4069 1 1 4 ALA HB1 H -0.565 -5.321 7.112 1.00 . A A . 4 ALA HB1 1 1 15 4070 1 1 4 ALA HB2 H -2.126 -4.500 7.149 1.00 . A A . 4 ALA HB2 1 1 15 4071 1 1 4 ALA HB3 H -0.773 -3.864 8.085 1.00 . A A . 4 ALA HB3 1 1 15 4072 1 1 4 ALA N N -1.391 -2.257 5.954 1.00 . A A . 4 ALA N 1 1 15 4073 1 1 4 ALA O O 0.090 -4.935 4.191 1.00 . A A . 4 ALA O 1 1 15 4074 1 1 5 GLN C C -1.560 -4.153 1.684 1.00 . A A . 5 GLN C 1 1 15 4075 1 1 5 GLN CA C -2.343 -4.803 2.827 1.00 . A A . 5 GLN CA 1 1 15 4076 1 1 5 GLN CB C -3.849 -4.727 2.555 1.00 . A A . 5 GLN CB 1 1 15 4077 1 1 5 GLN CD C -3.998 -6.877 1.227 1.00 . A A . 5 GLN CD 1 1 15 4078 1 1 5 GLN CG C -4.267 -5.382 1.250 1.00 . A A . 5 GLN CG 1 1 15 4079 1 1 5 GLN H H -2.714 -3.588 4.514 1.00 . A A . 5 GLN H 1 1 15 4080 1 1 5 GLN HA H -2.049 -5.839 2.907 1.00 . A A . 5 GLN HA 1 1 15 4081 1 1 5 GLN HB2 H -4.373 -5.217 3.361 1.00 . A A . 5 GLN HB2 1 1 15 4082 1 1 5 GLN HB3 H -4.146 -3.689 2.523 1.00 . A A . 5 GLN HB3 1 1 15 4083 1 1 5 GLN HE21 H -3.482 -6.785 -0.693 1.00 . A A . 5 GLN HE21 1 1 15 4084 1 1 5 GLN HE22 H -3.411 -8.352 0.030 1.00 . A A . 5 GLN HE22 1 1 15 4085 1 1 5 GLN HG2 H -5.325 -5.220 1.102 1.00 . A A . 5 GLN HG2 1 1 15 4086 1 1 5 GLN HG3 H -3.717 -4.919 0.445 1.00 . A A . 5 GLN HG3 1 1 15 4087 1 1 5 GLN N N -2.028 -4.147 4.090 1.00 . A A . 5 GLN N 1 1 15 4088 1 1 5 GLN NE2 N -3.588 -7.389 0.071 1.00 . A A . 5 GLN NE2 1 1 15 4089 1 1 5 GLN O O -1.092 -4.839 0.776 1.00 . A A . 5 GLN O 1 1 15 4090 1 1 5 GLN OE1 O -4.156 -7.564 2.237 1.00 . A A . 5 GLN OE1 1 1 15 4091 1 1 6 TRP C C 0.783 -2.526 0.703 1.00 . A A . 6 TRP C 1 1 15 4092 1 1 6 TRP CA C -0.670 -2.071 0.743 1.00 . A A . 6 TRP CA 1 1 15 4093 1 1 6 TRP CB C -0.735 -0.571 1.051 1.00 . A A . 6 TRP CB 1 1 15 4094 1 1 6 TRP CD1 C -0.326 0.575 -1.196 1.00 . A A . 6 TRP CD1 1 1 15 4095 1 1 6 TRP CD2 C 1.283 0.938 0.316 1.00 . A A . 6 TRP CD2 1 1 15 4096 1 1 6 TRP CE2 C 1.618 1.615 -0.870 1.00 . A A . 6 TRP CE2 1 1 15 4097 1 1 6 TRP CE3 C 2.151 1.025 1.409 1.00 . A A . 6 TRP CE3 1 1 15 4098 1 1 6 TRP CG C 0.031 0.276 0.083 1.00 . A A . 6 TRP CG 1 1 15 4099 1 1 6 TRP CH2 C 3.610 2.443 0.084 1.00 . A A . 6 TRP CH2 1 1 15 4100 1 1 6 TRP CZ2 C 2.780 2.370 -0.997 1.00 . A A . 6 TRP CZ2 1 1 15 4101 1 1 6 TRP CZ3 C 3.307 1.779 1.282 1.00 . A A . 6 TRP CZ3 1 1 15 4102 1 1 6 TRP H H -1.801 -2.343 2.512 1.00 . A A . 6 TRP H 1 1 15 4103 1 1 6 TRP HA H -1.125 -2.257 -0.217 1.00 . A A . 6 TRP HA 1 1 15 4104 1 1 6 TRP HB2 H -1.763 -0.252 1.031 1.00 . A A . 6 TRP HB2 1 1 15 4105 1 1 6 TRP HB3 H -0.331 -0.395 2.035 1.00 . A A . 6 TRP HB3 1 1 15 4106 1 1 6 TRP HD1 H -1.226 0.223 -1.673 1.00 . A A . 6 TRP HD1 1 1 15 4107 1 1 6 TRP HE1 H 0.590 1.719 -2.689 1.00 . A A . 6 TRP HE1 1 1 15 4108 1 1 6 TRP HE3 H 1.934 0.516 2.338 1.00 . A A . 6 TRP HE3 1 1 15 4109 1 1 6 TRP HH2 H 4.518 3.027 0.029 1.00 . A A . 6 TRP HH2 1 1 15 4110 1 1 6 TRP HZ2 H 3.030 2.883 -1.914 1.00 . A A . 6 TRP HZ2 1 1 15 4111 1 1 6 TRP HZ3 H 3.992 1.858 2.114 1.00 . A A . 6 TRP HZ3 1 1 15 4112 1 1 6 TRP N N -1.411 -2.826 1.753 1.00 . A A . 6 TRP N 1 1 15 4113 1 1 6 TRP NE1 N 0.623 1.374 -1.774 1.00 . A A . 6 TRP NE1 1 1 15 4114 1 1 6 TRP O O 1.327 -2.813 -0.365 1.00 . A A . 6 TRP O 1 1 15 4115 1 1 7 LEU C C 2.944 -4.477 1.559 1.00 . A A . 7 LEU C 1 1 15 4116 1 1 7 LEU CA C 2.786 -3.025 2.010 1.00 . A A . 7 LEU CA 1 1 15 4117 1 1 7 LEU CB C 3.254 -2.862 3.459 1.00 . A A . 7 LEU CB 1 1 15 4118 1 1 7 LEU CD1 C 3.251 -1.403 5.501 1.00 . A A . 7 LEU CD1 1 1 15 4119 1 1 7 LEU CD2 C 4.458 -0.653 3.440 1.00 . A A . 7 LEU CD2 1 1 15 4120 1 1 7 LEU CG C 3.257 -1.420 3.980 1.00 . A A . 7 LEU CG 1 1 15 4121 1 1 7 LEU H H 0.898 -2.358 2.694 1.00 . A A . 7 LEU H 1 1 15 4122 1 1 7 LEU HA H 3.387 -2.396 1.373 1.00 . A A . 7 LEU HA 1 1 15 4123 1 1 7 LEU HB2 H 2.603 -3.449 4.092 1.00 . A A . 7 LEU HB2 1 1 15 4124 1 1 7 LEU HB3 H 4.254 -3.254 3.542 1.00 . A A . 7 LEU HB3 1 1 15 4125 1 1 7 LEU HD11 H 3.369 -0.388 5.850 1.00 . A A . 7 LEU HD11 1 1 15 4126 1 1 7 LEU HD12 H 4.065 -2.009 5.871 1.00 . A A . 7 LEU HD12 1 1 15 4127 1 1 7 LEU HD13 H 2.313 -1.801 5.861 1.00 . A A . 7 LEU HD13 1 1 15 4128 1 1 7 LEU HD21 H 4.662 0.193 4.079 1.00 . A A . 7 LEU HD21 1 1 15 4129 1 1 7 LEU HD22 H 4.243 -0.304 2.439 1.00 . A A . 7 LEU HD22 1 1 15 4130 1 1 7 LEU HD23 H 5.320 -1.303 3.416 1.00 . A A . 7 LEU HD23 1 1 15 4131 1 1 7 LEU HG H 2.361 -0.921 3.640 1.00 . A A . 7 LEU HG 1 1 15 4132 1 1 7 LEU N N 1.398 -2.596 1.883 1.00 . A A . 7 LEU N 1 1 15 4133 1 1 7 LEU O O 3.954 -4.840 0.952 1.00 . A A . 7 LEU O 1 1 15 4134 1 1 8 ALA C C 1.681 -6.886 -0.039 1.00 . A A . 8 ALA C 1 1 15 4135 1 1 8 ALA CA C 1.942 -6.709 1.461 1.00 . A A . 8 ALA CA 1 1 15 4136 1 1 8 ALA CB C 0.913 -7.485 2.271 1.00 . A A . 8 ALA CB 1 1 15 4137 1 1 8 ALA H H 1.151 -4.944 2.324 1.00 . A A . 8 ALA H 1 1 15 4138 1 1 8 ALA HA H 2.919 -7.107 1.693 1.00 . A A . 8 ALA HA 1 1 15 4139 1 1 8 ALA HB1 H 1.006 -7.224 3.315 1.00 . A A . 8 ALA HB1 1 1 15 4140 1 1 8 ALA HB2 H 1.084 -8.545 2.149 1.00 . A A . 8 ALA HB2 1 1 15 4141 1 1 8 ALA HB3 H -0.080 -7.238 1.925 1.00 . A A . 8 ALA HB3 1 1 15 4142 1 1 8 ALA N N 1.931 -5.299 1.847 1.00 . A A . 8 ALA N 1 1 15 4143 1 1 8 ALA O O 1.988 -7.936 -0.605 1.00 . A A . 8 ALA O 1 1 15 4144 1 1 9 ASP C C 2.030 -5.414 -2.948 1.00 . A A . 9 ASP C 1 1 15 4145 1 1 9 ASP CA C 0.834 -5.898 -2.117 1.00 . A A . 9 ASP CA 1 1 15 4146 1 1 9 ASP CB C -0.402 -5.049 -2.441 1.00 . A A . 9 ASP CB 1 1 15 4147 1 1 9 ASP CG C -1.464 -5.833 -3.186 1.00 . A A . 9 ASP CG 1 1 15 4148 1 1 9 ASP H H 0.905 -5.038 -0.182 1.00 . A A . 9 ASP H 1 1 15 4149 1 1 9 ASP HA H 0.627 -6.926 -2.377 1.00 . A A . 9 ASP HA 1 1 15 4150 1 1 9 ASP HB2 H -0.833 -4.682 -1.521 1.00 . A A . 9 ASP HB2 1 1 15 4151 1 1 9 ASP HB3 H -0.105 -4.209 -3.053 1.00 . A A . 9 ASP HB3 1 1 15 4152 1 1 9 ASP N N 1.122 -5.852 -0.682 1.00 . A A . 9 ASP N 1 1 15 4153 1 1 9 ASP O O 1.881 -5.092 -4.129 1.00 . A A . 9 ASP O 1 1 15 4154 1 1 9 ASP OD1 O -1.325 -5.997 -4.417 1.00 . A A . 9 ASP OD1 1 1 15 4155 1 1 9 ASP OD2 O -2.433 -6.283 -2.540 1.00 . A A . 9 ASP OD2 1 1 15 4156 1 1 10 DAL C C 4.801 -3.487 -2.633 1.00 . A A . 10 DAL C 1 1 15 4157 1 1 10 DAL CA C 4.426 -4.924 -3.009 1.00 . A A . 10 DAL CA 1 1 15 4158 1 1 10 DAL CB C 5.571 -5.865 -2.676 1.00 . A A . 10 DAL CB 1 1 15 4159 1 1 10 DAL H H 3.273 -5.633 -1.389 1.00 . A A . 10 DAL H 1 1 15 4160 1 1 10 DAL HA H 4.251 -4.974 -4.074 1.00 . A A . 10 DAL HA 1 1 15 4161 1 1 10 DAL HB1 H 6.437 -5.601 -3.262 1.00 . A A . 10 DAL HB1 1 1 15 4162 1 1 10 DAL HB2 H 5.278 -6.880 -2.899 1.00 . A A . 10 DAL HB2 1 1 15 4163 1 1 10 DAL HB3 H 5.806 -5.780 -1.626 1.00 . A A . 10 DAL HB3 1 1 15 4164 1 1 10 DAL N N 3.213 -5.366 -2.328 1.00 . A A . 10 DAL N 1 1 15 4165 1 1 10 DAL O O 5.837 -2.980 -3.069 1.00 . A A . 10 DAL O 1 1 15 4166 1 1 11 GLY C C 4.134 -0.487 -2.551 1.00 . A A . 11 GLY C 1 1 15 4167 1 1 11 GLY CA C 4.227 -1.471 -1.405 1.00 . A A . 11 GLY CA 1 1 15 4168 1 1 11 GLY H H 3.153 -3.289 -1.506 1.00 . A A . 11 GLY H 1 1 15 4169 1 1 11 GLY HA2 H 3.510 -1.189 -0.647 1.00 . A A . 11 GLY HA2 1 1 15 4170 1 1 11 GLY HA3 H 5.220 -1.422 -0.983 1.00 . A A . 11 GLY HA3 1 1 15 4171 1 1 11 GLY N N 3.960 -2.837 -1.823 1.00 . A A . 11 GLY N 1 1 15 4172 1 1 11 GLY O O 3.041 -0.046 -2.909 1.00 . A A . 11 GLY O 1 1 15 4173 1 1 12 TRP C C 5.390 0.088 -5.593 1.00 . A A . 12 TRP C 1 1 15 4174 1 1 12 TRP CA C 5.325 0.800 -4.240 1.00 . A A . 12 TRP CA 1 1 15 4175 1 1 12 TRP CB C 6.501 1.761 -4.063 1.00 . A A . 12 TRP CB 1 1 15 4176 1 1 12 TRP CD1 C 6.685 3.135 -1.914 1.00 . A A . 12 TRP CD1 1 1 15 4177 1 1 12 TRP CD2 C 5.153 3.886 -3.363 1.00 . A A . 12 TRP CD2 1 1 15 4178 1 1 12 TRP CE2 C 5.137 4.711 -2.225 1.00 . A A . 12 TRP CE2 1 1 15 4179 1 1 12 TRP CE3 C 4.272 4.170 -4.415 1.00 . A A . 12 TRP CE3 1 1 15 4180 1 1 12 TRP CG C 6.150 2.883 -3.142 1.00 . A A . 12 TRP CG 1 1 15 4181 1 1 12 TRP CH2 C 3.424 6.049 -3.145 1.00 . A A . 12 TRP CH2 1 1 15 4182 1 1 12 TRP CZ2 C 4.275 5.792 -2.104 1.00 . A A . 12 TRP CZ2 1 1 15 4183 1 1 12 TRP CZ3 C 3.419 5.249 -4.295 1.00 . A A . 12 TRP CZ3 1 1 15 4184 1 1 12 TRP H H 6.122 -0.530 -2.797 1.00 . A A . 12 TRP H 1 1 15 4185 1 1 12 TRP HA H 4.410 1.374 -4.206 1.00 . A A . 12 TRP HA 1 1 15 4186 1 1 12 TRP HB2 H 7.339 1.226 -3.640 1.00 . A A . 12 TRP HB2 1 1 15 4187 1 1 12 TRP HB3 H 6.782 2.176 -5.019 1.00 . A A . 12 TRP HB3 1 1 15 4188 1 1 12 TRP HD1 H 7.469 2.547 -1.459 1.00 . A A . 12 TRP HD1 1 1 15 4189 1 1 12 TRP HE1 H 6.294 4.613 -0.476 1.00 . A A . 12 TRP HE1 1 1 15 4190 1 1 12 TRP HE3 H 4.251 3.565 -5.309 1.00 . A A . 12 TRP HE3 1 1 15 4191 1 1 12 TRP HH2 H 2.740 6.883 -3.093 1.00 . A A . 12 TRP HH2 1 1 15 4192 1 1 12 TRP HZ2 H 4.259 6.407 -1.220 1.00 . A A . 12 TRP HZ2 1 1 15 4193 1 1 12 TRP HZ3 H 2.737 5.485 -5.100 1.00 . A A . 12 TRP HZ3 1 1 15 4194 1 1 12 TRP N N 5.283 -0.142 -3.127 1.00 . A A . 12 TRP N 1 1 15 4195 1 1 12 TRP NE1 N 6.081 4.233 -1.354 1.00 . A A . 12 TRP NE1 1 1 15 4196 1 1 12 TRP O O 5.609 0.726 -6.625 1.00 . A A . 12 TRP O 1 1 15 4197 1 1 13 ALA C C 3.776 -1.982 -7.460 1.00 . A A . 13 ALA C 1 1 15 4198 1 1 13 ALA CA C 5.162 -2.009 -6.821 1.00 . A A . 13 ALA CA 1 1 15 4199 1 1 13 ALA CB C 5.605 -3.438 -6.555 1.00 . A A . 13 ALA CB 1 1 15 4200 1 1 13 ALA H H 4.968 -1.681 -4.744 1.00 . A A . 13 ALA H 1 1 15 4201 1 1 13 ALA HA H 5.867 -1.557 -7.502 1.00 . A A . 13 ALA HA 1 1 15 4202 1 1 13 ALA HB1 H 5.941 -3.527 -5.533 1.00 . A A . 13 ALA HB1 1 1 15 4203 1 1 13 ALA HB2 H 6.414 -3.689 -7.223 1.00 . A A . 13 ALA HB2 1 1 15 4204 1 1 13 ALA HB3 H 4.777 -4.110 -6.723 1.00 . A A . 13 ALA HB3 1 1 15 4205 1 1 13 ALA N N 5.163 -1.229 -5.590 1.00 . A A . 13 ALA N 1 1 15 4206 1 1 13 ALA O O 3.647 -2.026 -8.685 1.00 . A A . 13 ALA O 1 1 15 4207 1 1 14 SER C C 1.127 -0.557 -7.913 1.00 . A A . 14 SER C 1 1 15 4208 1 1 14 SER CA C 1.361 -1.826 -7.088 1.00 . A A . 14 SER CA 1 1 15 4209 1 1 14 SER CB C 0.386 -1.875 -5.900 1.00 . A A . 14 SER CB 1 1 15 4210 1 1 14 SER H H 2.915 -1.842 -5.653 1.00 . A A . 14 SER H 1 1 15 4211 1 1 14 SER HA H 1.188 -2.683 -7.719 1.00 . A A . 14 SER HA 1 1 15 4212 1 1 14 SER HB2 H -0.532 -1.375 -6.170 1.00 . A A . 14 SER HB2 1 1 15 4213 1 1 14 SER HB3 H 0.173 -2.905 -5.654 1.00 . A A . 14 SER HB3 1 1 15 4214 1 1 14 SER HG H 1.301 -1.896 -4.160 1.00 . A A . 14 SER HG 1 1 15 4215 1 1 14 SER N N 2.742 -1.887 -6.617 1.00 . A A . 14 SER N 1 1 15 4216 1 1 14 SER O O 0.279 -0.539 -8.806 1.00 . A A . 14 SER O 1 1 15 4217 1 1 14 SER OG O 0.931 -1.235 -4.754 1.00 . A A . 14 SER OG 1 1 15 4218 1 1 15 DAL C C 0.923 2.780 -7.545 1.00 . A A . 15 DAL C 1 1 15 4219 1 1 15 DAL CA C 1.772 1.770 -8.323 1.00 . A A . 15 DAL CA 1 1 15 4220 1 1 15 DAL CB C 3.155 2.340 -8.603 1.00 . A A . 15 DAL CB 1 1 15 4221 1 1 15 DAL H H 2.549 0.421 -6.887 1.00 . A A . 15 DAL H 1 1 15 4222 1 1 15 DAL HA H 1.297 1.575 -9.272 1.00 . A A . 15 DAL HA 1 1 15 4223 1 1 15 DAL HB1 H 3.239 2.573 -9.653 1.00 . A A . 15 DAL HB1 1 1 15 4224 1 1 15 DAL HB2 H 3.905 1.611 -8.335 1.00 . A A . 15 DAL HB2 1 1 15 4225 1 1 15 DAL HB3 H 3.300 3.238 -8.021 1.00 . A A . 15 DAL HB3 1 1 15 4226 1 1 15 DAL N N 1.890 0.499 -7.609 1.00 . A A . 15 DAL N 1 1 15 4227 1 1 15 DAL O O 1.049 3.991 -7.738 1.00 . A A . 15 DAL O 1 1 15 4228 1 1 16 ARG C C -0.097 3.574 -4.583 1.00 . A A . 16 ARG C 1 1 15 4229 1 1 16 ARG CA C -0.814 3.122 -5.858 1.00 . A A . 16 ARG CA 1 1 15 4230 1 1 16 ARG CB C -2.104 2.359 -5.492 1.00 . A A . 16 ARG CB 1 1 15 4231 1 1 16 ARG CD C -2.857 0.173 -4.493 1.00 . A A . 16 ARG CD 1 1 15 4232 1 1 16 ARG CG C -1.926 1.368 -4.347 1.00 . A A . 16 ARG CG 1 1 15 4233 1 1 16 ARG CZ C -3.450 -0.473 -2.176 1.00 . A A . 16 ARG CZ 1 1 15 4234 1 1 16 ARG H H 0.004 1.298 -6.560 1.00 . A A . 16 ARG H 1 1 15 4235 1 1 16 ARG HA H -1.065 3.998 -6.443 1.00 . A A . 16 ARG HA 1 1 15 4236 1 1 16 ARG HB2 H -2.861 3.073 -5.205 1.00 . A A . 16 ARG HB2 1 1 15 4237 1 1 16 ARG HB3 H -2.453 1.806 -6.359 1.00 . A A . 16 ARG HB3 1 1 15 4238 1 1 16 ARG HD2 H -3.867 0.533 -4.621 1.00 . A A . 16 ARG HD2 1 1 15 4239 1 1 16 ARG HD3 H -2.563 -0.387 -5.367 1.00 . A A . 16 ARG HD3 1 1 15 4240 1 1 16 ARG HE H -2.282 -1.533 -3.408 1.00 . A A . 16 ARG HE 1 1 15 4241 1 1 16 ARG HG2 H -0.904 1.015 -4.343 1.00 . A A . 16 ARG HG2 1 1 15 4242 1 1 16 ARG HG3 H -2.139 1.869 -3.414 1.00 . A A . 16 ARG HG3 1 1 15 4243 1 1 16 ARG HH11 H -4.254 1.293 -2.765 1.00 . A A . 16 ARG HH11 1 1 15 4244 1 1 16 ARG HH12 H -4.649 0.799 -1.154 1.00 . A A . 16 ARG HH12 1 1 15 4245 1 1 16 ARG HH21 H -2.814 -2.175 -1.285 1.00 . A A . 16 ARG HH21 1 1 15 4246 1 1 16 ARG HH22 H -3.832 -1.166 -0.313 1.00 . A A . 16 ARG HH22 1 1 15 4247 1 1 16 ARG N N 0.058 2.272 -6.668 1.00 . A A . 16 ARG N 1 1 15 4248 1 1 16 ARG NE N -2.813 -0.712 -3.328 1.00 . A A . 16 ARG NE 1 1 15 4249 1 1 16 ARG NH1 N -4.177 0.631 -2.020 1.00 . A A . 16 ARG NH1 1 1 15 4250 1 1 16 ARG NH2 N -3.358 -1.343 -1.176 1.00 . A A . 16 ARG NH2 1 1 15 4251 1 1 16 ARG O O 0.802 2.888 -4.098 1.00 . A A . 16 ARG O 1 1 15 4252 1 1 17 PRO C C -0.495 4.668 -1.529 1.00 . A A . 17 PRO C 1 1 15 4253 1 1 17 PRO CA C 0.119 5.267 -2.796 1.00 . A A . 17 PRO CA 1 1 15 4254 1 1 17 PRO CB C -0.170 6.773 -2.864 1.00 . A A . 17 PRO CB 1 1 15 4255 1 1 17 PRO CD C -1.528 5.635 -4.515 1.00 . A A . 17 PRO CD 1 1 15 4256 1 1 17 PRO CG C -1.037 6.988 -4.072 1.00 . A A . 17 PRO CG 1 1 15 4257 1 1 17 PRO HA H 1.184 5.104 -2.779 1.00 . A A . 17 PRO HA 1 1 15 4258 1 1 17 PRO HB2 H -0.679 7.080 -1.962 1.00 . A A . 17 PRO HB2 1 1 15 4259 1 1 17 PRO HB3 H 0.766 7.310 -2.950 1.00 . A A . 17 PRO HB3 1 1 15 4260 1 1 17 PRO HD2 H -2.481 5.406 -4.066 1.00 . A A . 17 PRO HD2 1 1 15 4261 1 1 17 PRO HD3 H -1.596 5.595 -5.590 1.00 . A A . 17 PRO HD3 1 1 15 4262 1 1 17 PRO HG2 H -1.873 7.618 -3.812 1.00 . A A . 17 PRO HG2 1 1 15 4263 1 1 17 PRO HG3 H -0.456 7.448 -4.858 1.00 . A A . 17 PRO HG3 1 1 15 4264 1 1 17 PRO N N -0.484 4.737 -4.019 1.00 . A A . 17 PRO N 1 1 15 4265 1 1 17 PRO O O -1.554 4.040 -1.576 1.00 . A A . 17 PRO O 1 1 15 4266 1 1 18 PRO C C -1.623 4.930 1.365 1.00 . A A . 18 PRO C 1 1 15 4267 1 1 18 PRO CA C -0.289 4.335 0.917 1.00 . A A . 18 PRO CA 1 1 15 4268 1 1 18 PRO CB C 0.806 4.754 1.902 1.00 . A A . 18 PRO CB 1 1 15 4269 1 1 18 PRO CD C 1.450 5.586 -0.249 1.00 . A A . 18 PRO CD 1 1 15 4270 1 1 18 PRO CG C 1.562 5.844 1.225 1.00 . A A . 18 PRO CG 1 1 15 4271 1 1 18 PRO HA H -0.365 3.257 0.899 1.00 . A A . 18 PRO HA 1 1 15 4272 1 1 18 PRO HB2 H 0.348 5.108 2.810 1.00 . A A . 18 PRO HB2 1 1 15 4273 1 1 18 PRO HB3 H 1.437 3.912 2.123 1.00 . A A . 18 PRO HB3 1 1 15 4274 1 1 18 PRO HD2 H 1.416 6.518 -0.793 1.00 . A A . 18 PRO HD2 1 1 15 4275 1 1 18 PRO HD3 H 2.275 4.980 -0.589 1.00 . A A . 18 PRO HD3 1 1 15 4276 1 1 18 PRO HG2 H 1.124 6.800 1.470 1.00 . A A . 18 PRO HG2 1 1 15 4277 1 1 18 PRO HG3 H 2.597 5.817 1.532 1.00 . A A . 18 PRO HG3 1 1 15 4278 1 1 18 PRO N N 0.176 4.857 -0.376 1.00 . A A . 18 PRO N 1 1 15 4279 1 1 18 PRO O O -1.915 6.098 1.100 1.00 . A A . 18 PRO O 1 1 15 4280 1 1 19 PRO C C -3.628 5.369 3.865 1.00 . A A . 19 PRO C 1 1 15 4281 1 1 19 PRO CA C -3.741 4.567 2.569 1.00 . A A . 19 PRO CA 1 1 15 4282 1 1 19 PRO CB C -4.493 3.261 2.811 1.00 . A A . 19 PRO CB 1 1 15 4283 1 1 19 PRO CD C -2.161 2.729 2.425 1.00 . A A . 19 PRO CD 1 1 15 4284 1 1 19 PRO CG C -3.465 2.195 2.963 1.00 . A A . 19 PRO CG 1 1 15 4285 1 1 19 PRO HA H -4.269 5.155 1.832 1.00 . A A . 19 PRO HA 1 1 15 4286 1 1 19 PRO HB2 H -5.098 3.349 3.700 1.00 . A A . 19 PRO HB2 1 1 15 4287 1 1 19 PRO HB3 H -5.118 3.061 1.971 1.00 . A A . 19 PRO HB3 1 1 15 4288 1 1 19 PRO HD2 H -1.390 2.679 3.176 1.00 . A A . 19 PRO HD2 1 1 15 4289 1 1 19 PRO HD3 H -1.874 2.168 1.551 1.00 . A A . 19 PRO HD3 1 1 15 4290 1 1 19 PRO HG2 H -3.367 1.933 4.000 1.00 . A A . 19 PRO HG2 1 1 15 4291 1 1 19 PRO HG3 H -3.766 1.326 2.396 1.00 . A A . 19 PRO HG3 1 1 15 4292 1 1 19 PRO N N -2.446 4.127 2.067 1.00 . A A . 19 PRO N 1 1 15 4293 1 1 19 PRO O O -2.767 5.097 4.703 1.00 . A A . 19 PRO O 1 1 15 4294 1 1 20 SER C C -5.868 7.882 5.404 1.00 . A A . 20 SER C 1 1 15 4295 1 1 20 SER CA C -4.509 7.209 5.212 1.00 . A A . 20 SER CA 1 1 15 4296 1 1 20 SER CB C -3.406 8.269 5.117 1.00 . A A . 20 SER CB 1 1 15 4297 1 1 20 SER H H -5.166 6.529 3.315 1.00 . A A . 20 SER H 1 1 15 4298 1 1 20 SER HA H -4.313 6.577 6.066 1.00 . A A . 20 SER HA 1 1 15 4299 1 1 20 SER HB2 H -2.837 8.113 4.212 1.00 . A A . 20 SER HB2 1 1 15 4300 1 1 20 SER HB3 H -3.853 9.252 5.094 1.00 . A A . 20 SER HB3 1 1 15 4301 1 1 20 SER HG H -2.863 8.737 6.941 1.00 . A A . 20 SER HG 1 1 15 4302 1 1 20 SER N N -4.505 6.362 4.020 1.00 . A A . 20 SER N 1 1 15 4303 1 1 20 SER O O -6.352 8.528 4.449 1.00 . A A . 20 SER O 1 1 15 4304 1 1 20 SER OXT O -6.437 7.756 6.508 1.00 . A A . 20 SER OXT 1 1 15 4305 1 1 20 SER OG O -2.526 8.192 6.226 1.00 . A A . 20 SER OG 1 1 16 4306 1 1 1 ASP C C -5.634 -2.995 5.714 1.00 . A A . 1 ASP C 1 1 16 4307 1 1 1 ASP CA C -6.129 -3.345 7.115 1.00 . A A . 1 ASP CA 1 1 16 4308 1 1 1 ASP CB C -4.947 -3.722 8.014 1.00 . A A . 1 ASP CB 1 1 16 4309 1 1 1 ASP CG C -5.265 -3.563 9.489 1.00 . A A . 1 ASP CG 1 1 16 4310 1 1 1 ASP H1 H -7.429 -4.643 8.046 1.00 . A A . 1 ASP H1 1 1 16 4311 1 1 1 ASP H2 H -6.575 -5.317 6.719 1.00 . A A . 1 ASP H2 1 1 16 4312 1 1 1 ASP H3 H -7.868 -4.221 6.444 1.00 . A A . 1 ASP H3 1 1 16 4313 1 1 1 ASP HA H -6.634 -2.487 7.534 1.00 . A A . 1 ASP HA 1 1 16 4314 1 1 1 ASP HB2 H -4.678 -4.752 7.832 1.00 . A A . 1 ASP HB2 1 1 16 4315 1 1 1 ASP HB3 H -4.105 -3.089 7.776 1.00 . A A . 1 ASP HB3 1 1 16 4316 1 1 1 ASP N N -7.086 -4.484 7.078 1.00 . A A . 1 ASP N 1 1 16 4317 1 1 1 ASP O O -4.971 -3.804 5.061 1.00 . A A . 1 ASP O 1 1 16 4318 1 1 1 ASP OD1 O -5.082 -2.447 10.019 1.00 . A A . 1 ASP OD1 1 1 16 4319 1 1 1 ASP OD2 O -5.697 -4.555 10.113 1.00 . A A . 1 ASP OD2 1 1 16 4320 1 1 2 ALA C C -4.054 -1.015 3.894 1.00 . A A . 2 ALA C 1 1 16 4321 1 1 2 ALA CA C -5.548 -1.325 3.934 1.00 . A A . 2 ALA CA 1 1 16 4322 1 1 2 ALA CB C -6.350 -0.101 3.525 1.00 . A A . 2 ALA CB 1 1 16 4323 1 1 2 ALA H H -6.489 -1.188 5.828 1.00 . A A . 2 ALA H 1 1 16 4324 1 1 2 ALA HA H -5.760 -2.114 3.228 1.00 . A A . 2 ALA HA 1 1 16 4325 1 1 2 ALA HB1 H -5.991 0.761 4.068 1.00 . A A . 2 ALA HB1 1 1 16 4326 1 1 2 ALA HB2 H -7.393 -0.262 3.753 1.00 . A A . 2 ALA HB2 1 1 16 4327 1 1 2 ALA HB3 H -6.234 0.067 2.465 1.00 . A A . 2 ALA HB3 1 1 16 4328 1 1 2 ALA N N -5.960 -1.785 5.259 1.00 . A A . 2 ALA N 1 1 16 4329 1 1 2 ALA O O -3.375 -1.337 2.919 1.00 . A A . 2 ALA O 1 1 16 4330 1 1 3 TYR C C -1.264 -1.300 5.020 1.00 . A A . 3 TYR C 1 1 16 4331 1 1 3 TYR CA C -2.130 -0.044 5.053 1.00 . A A . 3 TYR CA 1 1 16 4332 1 1 3 TYR CB C -1.856 0.764 6.327 1.00 . A A . 3 TYR CB 1 1 16 4333 1 1 3 TYR CD1 C -0.880 3.033 5.774 1.00 . A A . 3 TYR CD1 1 1 16 4334 1 1 3 TYR CD2 C 0.594 1.323 6.552 1.00 . A A . 3 TYR CD2 1 1 16 4335 1 1 3 TYR CE1 C 0.183 3.911 5.687 1.00 . A A . 3 TYR CE1 1 1 16 4336 1 1 3 TYR CE2 C 1.660 2.196 6.462 1.00 . A A . 3 TYR CE2 1 1 16 4337 1 1 3 TYR CG C -0.692 1.723 6.209 1.00 . A A . 3 TYR CG 1 1 16 4338 1 1 3 TYR CZ C 1.450 3.489 6.030 1.00 . A A . 3 TYR CZ 1 1 16 4339 1 1 3 TYR H H -4.147 -0.167 5.706 1.00 . A A . 3 TYR H 1 1 16 4340 1 1 3 TYR HA H -1.883 0.559 4.196 1.00 . A A . 3 TYR HA 1 1 16 4341 1 1 3 TYR HB2 H -2.731 1.344 6.574 1.00 . A A . 3 TYR HB2 1 1 16 4342 1 1 3 TYR HB3 H -1.643 0.082 7.137 1.00 . A A . 3 TYR HB3 1 1 16 4343 1 1 3 TYR HD1 H -1.873 3.363 5.494 1.00 . A A . 3 TYR HD1 1 1 16 4344 1 1 3 TYR HD2 H 0.756 0.310 6.888 1.00 . A A . 3 TYR HD2 1 1 16 4345 1 1 3 TYR HE1 H 0.018 4.924 5.356 1.00 . A A . 3 TYR HE1 1 1 16 4346 1 1 3 TYR HE2 H 2.653 1.865 6.731 1.00 . A A . 3 TYR HE2 1 1 16 4347 1 1 3 TYR HH H 2.584 4.858 6.764 1.00 . A A . 3 TYR HH 1 1 16 4348 1 1 3 TYR N N -3.549 -0.392 4.961 1.00 . A A . 3 TYR N 1 1 16 4349 1 1 3 TYR O O -0.284 -1.365 4.276 1.00 . A A . 3 TYR O 1 1 16 4350 1 1 3 TYR OH O 2.509 4.363 5.944 1.00 . A A . 3 TYR OH 1 1 16 4351 1 1 4 ALA C C -1.060 -4.308 4.518 1.00 . A A . 4 ALA C 1 1 16 4352 1 1 4 ALA CA C -0.917 -3.569 5.848 1.00 . A A . 4 ALA CA 1 1 16 4353 1 1 4 ALA CB C -1.411 -4.436 6.997 1.00 . A A . 4 ALA CB 1 1 16 4354 1 1 4 ALA H H -2.445 -2.200 6.368 1.00 . A A . 4 ALA H 1 1 16 4355 1 1 4 ALA HA H 0.130 -3.348 6.013 1.00 . A A . 4 ALA HA 1 1 16 4356 1 1 4 ALA HB1 H -1.407 -3.858 7.910 1.00 . A A . 4 ALA HB1 1 1 16 4357 1 1 4 ALA HB2 H -0.761 -5.291 7.109 1.00 . A A . 4 ALA HB2 1 1 16 4358 1 1 4 ALA HB3 H -2.416 -4.772 6.788 1.00 . A A . 4 ALA HB3 1 1 16 4359 1 1 4 ALA N N -1.646 -2.306 5.811 1.00 . A A . 4 ALA N 1 1 16 4360 1 1 4 ALA O O -0.129 -4.980 4.072 1.00 . A A . 4 ALA O 1 1 16 4361 1 1 5 GLN C C -1.633 -4.138 1.503 1.00 . A A . 5 GLN C 1 1 16 4362 1 1 5 GLN CA C -2.481 -4.797 2.590 1.00 . A A . 5 GLN CA 1 1 16 4363 1 1 5 GLN CB C -3.968 -4.704 2.233 1.00 . A A . 5 GLN CB 1 1 16 4364 1 1 5 GLN CD C -4.405 -6.853 0.977 1.00 . A A . 5 GLN CD 1 1 16 4365 1 1 5 GLN CG C -4.314 -5.341 0.898 1.00 . A A . 5 GLN CG 1 1 16 4366 1 1 5 GLN H H -2.928 -3.600 4.273 1.00 . A A . 5 GLN H 1 1 16 4367 1 1 5 GLN HA H -2.200 -5.837 2.671 1.00 . A A . 5 GLN HA 1 1 16 4368 1 1 5 GLN HB2 H -4.543 -5.197 3.003 1.00 . A A . 5 GLN HB2 1 1 16 4369 1 1 5 GLN HB3 H -4.252 -3.663 2.195 1.00 . A A . 5 GLN HB3 1 1 16 4370 1 1 5 GLN HE21 H -2.476 -7.023 0.515 1.00 . A A . 5 GLN HE21 1 1 16 4371 1 1 5 GLN HE22 H -3.319 -8.508 0.777 1.00 . A A . 5 GLN HE22 1 1 16 4372 1 1 5 GLN HG2 H -5.265 -4.955 0.565 1.00 . A A . 5 GLN HG2 1 1 16 4373 1 1 5 GLN HG3 H -3.550 -5.077 0.185 1.00 . A A . 5 GLN HG3 1 1 16 4374 1 1 5 GLN N N -2.227 -4.162 3.878 1.00 . A A . 5 GLN N 1 1 16 4375 1 1 5 GLN NE2 N -3.287 -7.529 0.731 1.00 . A A . 5 GLN NE2 1 1 16 4376 1 1 5 GLN O O -1.104 -4.815 0.623 1.00 . A A . 5 GLN O 1 1 16 4377 1 1 5 GLN OE1 O -5.468 -7.409 1.255 1.00 . A A . 5 GLN OE1 1 1 16 4378 1 1 6 TRP C C 0.744 -2.514 0.644 1.00 . A A . 6 TRP C 1 1 16 4379 1 1 6 TRP CA C -0.706 -2.045 0.628 1.00 . A A . 6 TRP CA 1 1 16 4380 1 1 6 TRP CB C -0.771 -0.550 0.959 1.00 . A A . 6 TRP CB 1 1 16 4381 1 1 6 TRP CD1 C -0.296 0.612 -1.265 1.00 . A A . 6 TRP CD1 1 1 16 4382 1 1 6 TRP CD2 C 1.272 0.954 0.294 1.00 . A A . 6 TRP CD2 1 1 16 4383 1 1 6 TRP CE2 C 1.645 1.637 -0.877 1.00 . A A . 6 TRP CE2 1 1 16 4384 1 1 6 TRP CE3 C 2.110 1.029 1.411 1.00 . A A . 6 TRP CE3 1 1 16 4385 1 1 6 TRP CG C 0.024 0.302 0.021 1.00 . A A . 6 TRP CG 1 1 16 4386 1 1 6 TRP CH2 C 3.615 2.445 0.138 1.00 . A A . 6 TRP CH2 1 1 16 4387 1 1 6 TRP CZ2 C 2.815 2.384 -0.968 1.00 . A A . 6 TRP CZ2 1 1 16 4388 1 1 6 TRP CZ3 C 3.273 1.775 1.322 1.00 . A A . 6 TRP CZ3 1 1 16 4389 1 1 6 TRP H H -1.942 -2.334 2.321 1.00 . A A . 6 TRP H 1 1 16 4390 1 1 6 TRP HA H -1.118 -2.209 -0.356 1.00 . A A . 6 TRP HA 1 1 16 4391 1 1 6 TRP HB2 H -1.797 -0.224 0.917 1.00 . A A . 6 TRP HB2 1 1 16 4392 1 1 6 TRP HB3 H -0.391 -0.391 1.956 1.00 . A A . 6 TRP HB3 1 1 16 4393 1 1 6 TRP HD1 H -1.185 0.269 -1.769 1.00 . A A . 6 TRP HD1 1 1 16 4394 1 1 6 TRP HE1 H 0.670 1.758 -2.724 1.00 . A A . 6 TRP HE1 1 1 16 4395 1 1 6 TRP HE3 H 1.862 0.517 2.330 1.00 . A A . 6 TRP HE3 1 1 16 4396 1 1 6 TRP HH2 H 4.528 3.022 0.113 1.00 . A A . 6 TRP HH2 1 1 16 4397 1 1 6 TRP HZ2 H 3.096 2.900 -1.875 1.00 . A A . 6 TRP HZ2 1 1 16 4398 1 1 6 TRP HZ3 H 3.934 1.844 2.174 1.00 . A A . 6 TRP HZ3 1 1 16 4399 1 1 6 TRP N N -1.500 -2.810 1.586 1.00 . A A . 6 TRP N 1 1 16 4400 1 1 6 TRP NE1 N 0.674 1.407 -1.812 1.00 . A A . 6 TRP NE1 1 1 16 4401 1 1 6 TRP O O 1.331 -2.787 -0.404 1.00 . A A . 6 TRP O 1 1 16 4402 1 1 7 LEU C C 2.849 -4.508 1.574 1.00 . A A . 7 LEU C 1 1 16 4403 1 1 7 LEU CA C 2.686 -3.055 2.023 1.00 . A A . 7 LEU CA 1 1 16 4404 1 1 7 LEU CB C 3.101 -2.898 3.489 1.00 . A A . 7 LEU CB 1 1 16 4405 1 1 7 LEU CD1 C 3.130 -1.423 5.518 1.00 . A A . 7 LEU CD1 1 1 16 4406 1 1 7 LEU CD2 C 4.341 -0.710 3.446 1.00 . A A . 7 LEU CD2 1 1 16 4407 1 1 7 LEU CG C 3.130 -1.453 3.998 1.00 . A A . 7 LEU CG 1 1 16 4408 1 1 7 LEU H H 0.776 -2.383 2.641 1.00 . A A . 7 LEU H 1 1 16 4409 1 1 7 LEU HA H 3.315 -2.429 1.410 1.00 . A A . 7 LEU HA 1 1 16 4410 1 1 7 LEU HB2 H 2.407 -3.459 4.098 1.00 . A A . 7 LEU HB2 1 1 16 4411 1 1 7 LEU HB3 H 4.085 -3.321 3.613 1.00 . A A . 7 LEU HB3 1 1 16 4412 1 1 7 LEU HD11 H 4.100 -1.724 5.885 1.00 . A A . 7 LEU HD11 1 1 16 4413 1 1 7 LEU HD12 H 2.377 -2.102 5.890 1.00 . A A . 7 LEU HD12 1 1 16 4414 1 1 7 LEU HD13 H 2.911 -0.421 5.858 1.00 . A A . 7 LEU HD13 1 1 16 4415 1 1 7 LEU HD21 H 4.561 0.139 4.076 1.00 . A A . 7 LEU HD21 1 1 16 4416 1 1 7 LEU HD22 H 4.129 -0.367 2.443 1.00 . A A . 7 LEU HD22 1 1 16 4417 1 1 7 LEU HD23 H 5.194 -1.373 3.426 1.00 . A A . 7 LEU HD23 1 1 16 4418 1 1 7 LEU HG H 2.242 -0.942 3.656 1.00 . A A . 7 LEU HG 1 1 16 4419 1 1 7 LEU N N 1.307 -2.611 1.847 1.00 . A A . 7 LEU N 1 1 16 4420 1 1 7 LEU O O 3.875 -4.875 0.999 1.00 . A A . 7 LEU O 1 1 16 4421 1 1 8 ALA C C 1.622 -6.907 -0.072 1.00 . A A . 8 ALA C 1 1 16 4422 1 1 8 ALA CA C 1.839 -6.735 1.437 1.00 . A A . 8 ALA CA 1 1 16 4423 1 1 8 ALA CB C 0.782 -7.510 2.213 1.00 . A A . 8 ALA CB 1 1 16 4424 1 1 8 ALA H H 1.029 -4.967 2.279 1.00 . A A . 8 ALA H 1 1 16 4425 1 1 8 ALA HA H 2.807 -7.139 1.697 1.00 . A A . 8 ALA HA 1 1 16 4426 1 1 8 ALA HB1 H 0.753 -7.157 3.233 1.00 . A A . 8 ALA HB1 1 1 16 4427 1 1 8 ALA HB2 H 1.027 -8.562 2.203 1.00 . A A . 8 ALA HB2 1 1 16 4428 1 1 8 ALA HB3 H -0.184 -7.361 1.753 1.00 . A A . 8 ALA HB3 1 1 16 4429 1 1 8 ALA N N 1.822 -5.325 1.827 1.00 . A A . 8 ALA N 1 1 16 4430 1 1 8 ALA O O 1.938 -7.960 -0.630 1.00 . A A . 8 ALA O 1 1 16 4431 1 1 9 ASP C C 2.056 -5.426 -2.971 1.00 . A A . 9 ASP C 1 1 16 4432 1 1 9 ASP CA C 0.838 -5.910 -2.171 1.00 . A A . 9 ASP CA 1 1 16 4433 1 1 9 ASP CB C -0.387 -5.055 -2.524 1.00 . A A . 9 ASP CB 1 1 16 4434 1 1 9 ASP CG C -1.466 -5.854 -3.227 1.00 . A A . 9 ASP CG 1 1 16 4435 1 1 9 ASP H H 0.861 -5.056 -0.232 1.00 . A A . 9 ASP H 1 1 16 4436 1 1 9 ASP HA H 0.635 -6.936 -2.440 1.00 . A A . 9 ASP HA 1 1 16 4437 1 1 9 ASP HB2 H -0.806 -4.642 -1.619 1.00 . A A . 9 ASP HB2 1 1 16 4438 1 1 9 ASP HB3 H -0.081 -4.247 -3.174 1.00 . A A . 9 ASP HB3 1 1 16 4439 1 1 9 ASP N N 1.088 -5.869 -0.728 1.00 . A A . 9 ASP N 1 1 16 4440 1 1 9 ASP O O 1.939 -5.114 -4.159 1.00 . A A . 9 ASP O 1 1 16 4441 1 1 9 ASP OD1 O -1.427 -5.936 -4.473 1.00 . A A . 9 ASP OD1 1 1 16 4442 1 1 9 ASP OD2 O -2.351 -6.397 -2.532 1.00 . A A . 9 ASP OD2 1 1 16 4443 1 1 10 DAL C C 4.811 -3.484 -2.585 1.00 . A A . 10 DAL C 1 1 16 4444 1 1 10 DAL CA C 4.449 -4.922 -2.971 1.00 . A A . 10 DAL CA 1 1 16 4445 1 1 10 DAL CB C 5.589 -5.858 -2.612 1.00 . A A . 10 DAL CB 1 1 16 4446 1 1 10 DAL H H 3.256 -5.626 -1.377 1.00 . A A . 10 DAL H 1 1 16 4447 1 1 10 DAL HA H 4.299 -4.971 -4.040 1.00 . A A . 10 DAL HA 1 1 16 4448 1 1 10 DAL HB1 H 5.811 -5.761 -1.559 1.00 . A A . 10 DAL HB1 1 1 16 4449 1 1 10 DAL HB2 H 6.463 -5.600 -3.190 1.00 . A A . 10 DAL HB2 1 1 16 4450 1 1 10 DAL HB3 H 5.300 -6.876 -2.827 1.00 . A A . 10 DAL HB3 1 1 16 4451 1 1 10 DAL N N 3.220 -5.366 -2.319 1.00 . A A . 10 DAL N 1 1 16 4452 1 1 10 DAL O O 5.855 -2.973 -2.997 1.00 . A A . 10 DAL O 1 1 16 4453 1 1 11 GLY C C 4.143 -0.488 -2.520 1.00 . A A . 11 GLY C 1 1 16 4454 1 1 11 GLY CA C 4.203 -1.470 -1.371 1.00 . A A . 11 GLY CA 1 1 16 4455 1 1 11 GLY H H 3.136 -3.290 -1.498 1.00 . A A . 11 GLY H 1 1 16 4456 1 1 11 GLY HA2 H 3.464 -1.188 -0.635 1.00 . A A . 11 GLY HA2 1 1 16 4457 1 1 11 GLY HA3 H 5.183 -1.420 -0.920 1.00 . A A . 11 GLY HA3 1 1 16 4458 1 1 11 GLY N N 3.949 -2.836 -1.795 1.00 . A A . 11 GLY N 1 1 16 4459 1 1 11 GLY O O 3.062 -0.038 -2.904 1.00 . A A . 11 GLY O 1 1 16 4460 1 1 12 TRP C C 5.468 0.066 -5.538 1.00 . A A . 12 TRP C 1 1 16 4461 1 1 12 TRP CA C 5.384 0.782 -4.187 1.00 . A A . 12 TRP CA 1 1 16 4462 1 1 12 TRP CB C 6.565 1.731 -3.988 1.00 . A A . 12 TRP CB 1 1 16 4463 1 1 12 TRP CD1 C 6.725 3.102 -1.835 1.00 . A A . 12 TRP CD1 1 1 16 4464 1 1 12 TRP CD2 C 5.223 3.868 -3.310 1.00 . A A . 12 TRP CD2 1 1 16 4465 1 1 12 TRP CE2 C 5.195 4.692 -2.172 1.00 . A A . 12 TRP CE2 1 1 16 4466 1 1 12 TRP CE3 C 4.363 4.159 -4.376 1.00 . A A . 12 TRP CE3 1 1 16 4467 1 1 12 TRP CG C 6.208 2.856 -3.072 1.00 . A A . 12 TRP CG 1 1 16 4468 1 1 12 TRP CH2 C 3.509 6.044 -3.121 1.00 . A A . 12 TRP CH2 1 1 16 4469 1 1 12 TRP CZ2 C 4.339 5.780 -2.065 1.00 . A A . 12 TRP CZ2 1 1 16 4470 1 1 12 TRP CZ3 C 3.517 5.244 -4.271 1.00 . A A . 12 TRP CZ3 1 1 16 4471 1 1 12 TRP H H 6.135 -0.550 -2.724 1.00 . A A . 12 TRP H 1 1 16 4472 1 1 12 TRP HA H 4.473 1.367 -4.173 1.00 . A A . 12 TRP HA 1 1 16 4473 1 1 12 TRP HB2 H 7.391 1.188 -3.551 1.00 . A A . 12 TRP HB2 1 1 16 4474 1 1 12 TRP HB3 H 6.867 2.145 -4.938 1.00 . A A . 12 TRP HB3 1 1 16 4475 1 1 12 TRP HD1 H 7.496 2.508 -1.367 1.00 . A A . 12 TRP HD1 1 1 16 4476 1 1 12 TRP HE1 H 6.320 4.584 -0.403 1.00 . A A . 12 TRP HE1 1 1 16 4477 1 1 12 TRP HE3 H 4.352 3.554 -5.271 1.00 . A A . 12 TRP HE3 1 1 16 4478 1 1 12 TRP HH2 H 2.831 6.884 -3.080 1.00 . A A . 12 TRP HH2 1 1 16 4479 1 1 12 TRP HZ2 H 4.314 6.394 -1.181 1.00 . A A . 12 TRP HZ2 1 1 16 4480 1 1 12 TRP HZ3 H 2.851 5.486 -5.087 1.00 . A A . 12 TRP HZ3 1 1 16 4481 1 1 12 TRP N N 5.308 -0.155 -3.073 1.00 . A A . 12 TRP N 1 1 16 4482 1 1 12 TRP NE1 N 6.120 4.205 -1.285 1.00 . A A . 12 TRP NE1 1 1 16 4483 1 1 12 TRP O O 5.723 0.697 -6.566 1.00 . A A . 12 TRP O 1 1 16 4484 1 1 13 ALA C C 3.861 -1.985 -7.432 1.00 . A A . 13 ALA C 1 1 16 4485 1 1 13 ALA CA C 5.232 -2.032 -6.765 1.00 . A A . 13 ALA CA 1 1 16 4486 1 1 13 ALA CB C 5.645 -3.467 -6.483 1.00 . A A . 13 ALA CB 1 1 16 4487 1 1 13 ALA H H 4.995 -1.692 -4.694 1.00 . A A . 13 ALA H 1 1 16 4488 1 1 13 ALA HA H 5.958 -1.595 -7.432 1.00 . A A . 13 ALA HA 1 1 16 4489 1 1 13 ALA HB1 H 6.069 -3.532 -5.492 1.00 . A A . 13 ALA HB1 1 1 16 4490 1 1 13 ALA HB2 H 6.380 -3.775 -7.210 1.00 . A A . 13 ALA HB2 1 1 16 4491 1 1 13 ALA HB3 H 4.781 -4.112 -6.548 1.00 . A A . 13 ALA HB3 1 1 16 4492 1 1 13 ALA N N 5.218 -1.247 -5.536 1.00 . A A . 13 ALA N 1 1 16 4493 1 1 13 ALA O O 3.755 -2.026 -8.659 1.00 . A A . 13 ALA O 1 1 16 4494 1 1 14 SER C C 1.238 -0.527 -7.932 1.00 . A A . 14 SER C 1 1 16 4495 1 1 14 SER CA C 1.441 -1.797 -7.101 1.00 . A A . 14 SER CA 1 1 16 4496 1 1 14 SER CB C 0.449 -1.829 -5.927 1.00 . A A . 14 SER CB 1 1 16 4497 1 1 14 SER H H 2.971 -1.835 -5.642 1.00 . A A . 14 SER H 1 1 16 4498 1 1 14 SER HA H 1.266 -2.653 -7.733 1.00 . A A . 14 SER HA 1 1 16 4499 1 1 14 SER HB2 H -0.455 -1.312 -6.209 1.00 . A A . 14 SER HB2 1 1 16 4500 1 1 14 SER HB3 H 0.214 -2.856 -5.686 1.00 . A A . 14 SER HB3 1 1 16 4501 1 1 14 SER HG H 1.316 -1.873 -4.163 1.00 . A A . 14 SER HG 1 1 16 4502 1 1 14 SER N N 2.814 -1.877 -6.608 1.00 . A A . 14 SER N 1 1 16 4503 1 1 14 SER O O 0.407 -0.500 -8.842 1.00 . A A . 14 SER O 1 1 16 4504 1 1 14 SER OG O 0.990 -1.202 -4.772 1.00 . A A . 14 SER OG 1 1 16 4505 1 1 15 DAL C C 1.065 2.814 -7.571 1.00 . A A . 15 DAL C 1 1 16 4506 1 1 15 DAL CA C 1.914 1.794 -8.333 1.00 . A A . 15 DAL CA 1 1 16 4507 1 1 15 DAL CB C 3.308 2.346 -8.593 1.00 . A A . 15 DAL CB 1 1 16 4508 1 1 15 DAL H H 2.649 0.438 -6.880 1.00 . A A . 15 DAL H 1 1 16 4509 1 1 15 DAL HA H 1.452 1.602 -9.289 1.00 . A A . 15 DAL HA 1 1 16 4510 1 1 15 DAL HB1 H 4.046 1.644 -8.236 1.00 . A A . 15 DAL HB1 1 1 16 4511 1 1 15 DAL HB2 H 3.425 3.287 -8.075 1.00 . A A . 15 DAL HB2 1 1 16 4512 1 1 15 DAL HB3 H 3.439 2.499 -9.653 1.00 . A A . 15 DAL HB3 1 1 16 4513 1 1 15 DAL N N 2.005 0.523 -7.615 1.00 . A A . 15 DAL N 1 1 16 4514 1 1 15 DAL O O 1.212 4.024 -7.758 1.00 . A A . 15 DAL O 1 1 16 4515 1 1 16 ARG C C -0.005 3.617 -4.630 1.00 . A A . 16 ARG C 1 1 16 4516 1 1 16 ARG CA C -0.701 3.177 -5.919 1.00 . A A . 16 ARG CA 1 1 16 4517 1 1 16 ARG CB C -2.005 2.427 -5.580 1.00 . A A . 16 ARG CB 1 1 16 4518 1 1 16 ARG CD C -2.748 0.217 -4.630 1.00 . A A . 16 ARG CD 1 1 16 4519 1 1 16 ARG CG C -1.858 1.434 -4.432 1.00 . A A . 16 ARG CG 1 1 16 4520 1 1 16 ARG CZ C -3.396 -0.519 -2.355 1.00 . A A . 16 ARG CZ 1 1 16 4521 1 1 16 ARG H H 0.105 1.345 -6.608 1.00 . A A . 16 ARG H 1 1 16 4522 1 1 16 ARG HA H -0.932 4.057 -6.506 1.00 . A A . 16 ARG HA 1 1 16 4523 1 1 16 ARG HB2 H -2.761 3.148 -5.307 1.00 . A A . 16 ARG HB2 1 1 16 4524 1 1 16 ARG HB3 H -2.342 1.877 -6.454 1.00 . A A . 16 ARG HB3 1 1 16 4525 1 1 16 ARG HD2 H -3.765 0.549 -4.775 1.00 . A A . 16 ARG HD2 1 1 16 4526 1 1 16 ARG HD3 H -2.416 -0.313 -5.509 1.00 . A A . 16 ARG HD3 1 1 16 4527 1 1 16 ARG HE H -2.137 -1.491 -3.568 1.00 . A A . 16 ARG HE 1 1 16 4528 1 1 16 ARG HG2 H -0.828 1.109 -4.382 1.00 . A A . 16 ARG HG2 1 1 16 4529 1 1 16 ARG HG3 H -2.129 1.924 -3.508 1.00 . A A . 16 ARG HG3 1 1 16 4530 1 1 16 ARG HH11 H -4.241 1.235 -2.920 1.00 . A A . 16 ARG HH11 1 1 16 4531 1 1 16 ARG HH12 H -4.681 0.675 -1.343 1.00 . A A . 16 ARG HH12 1 1 16 4532 1 1 16 ARG HH21 H -2.729 -2.223 -1.491 1.00 . A A . 16 ARG HH21 1 1 16 4533 1 1 16 ARG HH22 H -3.822 -1.285 -0.530 1.00 . A A . 16 ARG HH22 1 1 16 4534 1 1 16 ARG N N 0.175 2.317 -6.712 1.00 . A A . 16 ARG N 1 1 16 4535 1 1 16 ARG NE N -2.705 -0.696 -3.486 1.00 . A A . 16 ARG NE 1 1 16 4536 1 1 16 ARG NH1 N -4.169 0.552 -2.193 1.00 . A A . 16 ARG NH1 1 1 16 4537 1 1 16 ARG NH2 N -3.308 -1.416 -1.379 1.00 . A A . 16 ARG NH2 1 1 16 4538 1 1 16 ARG O O 0.880 2.920 -4.132 1.00 . A A . 16 ARG O 1 1 16 4539 1 1 17 PRO C C -0.451 4.694 -1.579 1.00 . A A . 17 PRO C 1 1 16 4540 1 1 17 PRO CA C 0.193 5.296 -2.829 1.00 . A A . 17 PRO CA 1 1 16 4541 1 1 17 PRO CB C -0.081 6.805 -2.893 1.00 . A A . 17 PRO CB 1 1 16 4542 1 1 17 PRO CD C -1.419 5.689 -4.575 1.00 . A A . 17 PRO CD 1 1 16 4543 1 1 17 PRO CG C -0.927 7.035 -4.111 1.00 . A A . 17 PRO CG 1 1 16 4544 1 1 17 PRO HA H 1.256 5.123 -2.793 1.00 . A A . 17 PRO HA 1 1 16 4545 1 1 17 PRO HB2 H -0.601 7.111 -1.997 1.00 . A A . 17 PRO HB2 1 1 16 4546 1 1 17 PRO HB3 H 0.860 7.334 -2.961 1.00 . A A . 17 PRO HB3 1 1 16 4547 1 1 17 PRO HD2 H -2.382 5.465 -4.144 1.00 . A A . 17 PRO HD2 1 1 16 4548 1 1 17 PRO HD3 H -1.468 5.659 -5.651 1.00 . A A . 17 PRO HD3 1 1 16 4549 1 1 17 PRO HG2 H -1.765 7.667 -3.858 1.00 . A A . 17 PRO HG2 1 1 16 4550 1 1 17 PRO HG3 H -0.332 7.500 -4.884 1.00 . A A . 17 PRO HG3 1 1 16 4551 1 1 17 PRO N N -0.392 4.780 -4.065 1.00 . A A . 17 PRO N 1 1 16 4552 1 1 17 PRO O O -1.514 4.075 -1.650 1.00 . A A . 17 PRO O 1 1 16 4553 1 1 18 PRO C C -1.639 4.932 1.281 1.00 . A A . 18 PRO C 1 1 16 4554 1 1 18 PRO CA C -0.290 4.344 0.867 1.00 . A A . 18 PRO CA 1 1 16 4555 1 1 18 PRO CB C 0.777 4.770 1.880 1.00 . A A . 18 PRO CB 1 1 16 4556 1 1 18 PRO CD C 1.479 5.586 -0.261 1.00 . A A . 18 PRO CD 1 1 16 4557 1 1 18 PRO CG C 1.567 5.843 1.214 1.00 . A A . 18 PRO CG 1 1 16 4558 1 1 18 PRO HA H -0.360 3.266 0.848 1.00 . A A . 18 PRO HA 1 1 16 4559 1 1 18 PRO HB2 H 0.292 5.142 2.767 1.00 . A A . 18 PRO HB2 1 1 16 4560 1 1 18 PRO HB3 H 1.392 3.925 2.135 1.00 . A A . 18 PRO HB3 1 1 16 4561 1 1 18 PRO HD2 H 1.465 6.518 -0.806 1.00 . A A . 18 PRO HD2 1 1 16 4562 1 1 18 PRO HD3 H 2.305 4.972 -0.586 1.00 . A A . 18 PRO HD3 1 1 16 4563 1 1 18 PRO HG2 H 1.143 6.808 1.449 1.00 . A A . 18 PRO HG2 1 1 16 4564 1 1 18 PRO HG3 H 2.595 5.797 1.541 1.00 . A A . 18 PRO HG3 1 1 16 4565 1 1 18 PRO N N 0.202 4.869 -0.413 1.00 . A A . 18 PRO N 1 1 16 4566 1 1 18 PRO O O -1.926 6.101 1.014 1.00 . A A . 18 PRO O 1 1 16 4567 1 1 19 PRO C C -3.715 5.336 3.740 1.00 . A A . 19 PRO C 1 1 16 4568 1 1 19 PRO CA C -3.789 4.560 2.425 1.00 . A A . 19 PRO CA 1 1 16 4569 1 1 19 PRO CB C -4.551 3.250 2.613 1.00 . A A . 19 PRO CB 1 1 16 4570 1 1 19 PRO CD C -2.205 2.723 2.319 1.00 . A A . 19 PRO CD 1 1 16 4571 1 1 19 PRO CG C -3.527 2.187 2.812 1.00 . A A . 19 PRO CG 1 1 16 4572 1 1 19 PRO HA H -4.289 5.165 1.683 1.00 . A A . 19 PRO HA 1 1 16 4573 1 1 19 PRO HB2 H -5.204 3.328 3.467 1.00 . A A . 19 PRO HB2 1 1 16 4574 1 1 19 PRO HB3 H -5.128 3.056 1.738 1.00 . A A . 19 PRO HB3 1 1 16 4575 1 1 19 PRO HD2 H -1.459 2.670 3.096 1.00 . A A . 19 PRO HD2 1 1 16 4576 1 1 19 PRO HD3 H -1.887 2.165 1.453 1.00 . A A . 19 PRO HD3 1 1 16 4577 1 1 19 PRO HG2 H -3.468 1.934 3.854 1.00 . A A . 19 PRO HG2 1 1 16 4578 1 1 19 PRO HG3 H -3.804 1.314 2.239 1.00 . A A . 19 PRO HG3 1 1 16 4579 1 1 19 PRO N N -2.479 4.124 1.957 1.00 . A A . 19 PRO N 1 1 16 4580 1 1 19 PRO O O -2.806 5.128 4.545 1.00 . A A . 19 PRO O 1 1 16 4581 1 1 20 SER C C -6.174 7.355 5.557 1.00 . A A . 20 SER C 1 1 16 4582 1 1 20 SER CA C -4.730 7.045 5.164 1.00 . A A . 20 SER CA 1 1 16 4583 1 1 20 SER CB C -3.947 8.347 4.969 1.00 . A A . 20 SER CB 1 1 16 4584 1 1 20 SER H H -5.375 6.354 3.268 1.00 . A A . 20 SER H 1 1 16 4585 1 1 20 SER HA H -4.270 6.477 5.960 1.00 . A A . 20 SER HA 1 1 16 4586 1 1 20 SER HB2 H -2.966 8.120 4.579 1.00 . A A . 20 SER HB2 1 1 16 4587 1 1 20 SER HB3 H -4.474 8.981 4.271 1.00 . A A . 20 SER HB3 1 1 16 4588 1 1 20 SER HG H -3.060 8.675 6.687 1.00 . A A . 20 SER HG 1 1 16 4589 1 1 20 SER N N -4.680 6.234 3.949 1.00 . A A . 20 SER N 1 1 16 4590 1 1 20 SER O O -6.921 7.886 4.706 1.00 . A A . 20 SER O 1 1 16 4591 1 1 20 SER OXT O -6.546 7.062 6.712 1.00 . A A . 20 SER OXT 1 1 16 4592 1 1 20 SER OG O -3.798 9.044 6.195 1.00 . A A . 20 SER OG 1 1 17 4593 1 1 1 ASP C C -6.338 -2.340 5.882 1.00 . A A . 1 ASP C 1 1 17 4594 1 1 1 ASP CA C -6.997 -1.994 7.219 1.00 . A A . 1 ASP CA 1 1 17 4595 1 1 1 ASP CB C -5.929 -1.672 8.273 1.00 . A A . 1 ASP CB 1 1 17 4596 1 1 1 ASP CG C -4.809 -2.698 8.314 1.00 . A A . 1 ASP CG 1 1 17 4597 1 1 1 ASP H1 H -8.598 -3.276 7.022 1.00 . A A . 1 ASP H1 1 1 17 4598 1 1 1 ASP H2 H -8.232 -2.834 8.639 1.00 . A A . 1 ASP H2 1 1 17 4599 1 1 1 ASP H3 H -7.234 -3.956 7.808 1.00 . A A . 1 ASP H3 1 1 17 4600 1 1 1 ASP HA H -7.629 -1.129 7.082 1.00 . A A . 1 ASP HA 1 1 17 4601 1 1 1 ASP HB2 H -5.497 -0.707 8.053 1.00 . A A . 1 ASP HB2 1 1 17 4602 1 1 1 ASP HB3 H -6.395 -1.637 9.247 1.00 . A A . 1 ASP HB3 1 1 17 4603 1 1 1 ASP N N -7.841 -3.116 7.717 1.00 . A A . 1 ASP N 1 1 17 4604 1 1 1 ASP O O -6.043 -3.505 5.607 1.00 . A A . 1 ASP O 1 1 17 4605 1 1 1 ASP OD1 O -5.004 -3.767 8.930 1.00 . A A . 1 ASP OD1 1 1 17 4606 1 1 1 ASP OD2 O -3.739 -2.431 7.728 1.00 . A A . 1 ASP OD2 1 1 17 4607 1 1 2 ALA C C -3.991 -1.150 3.769 1.00 . A A . 2 ALA C 1 1 17 4608 1 1 2 ALA CA C -5.483 -1.504 3.751 1.00 . A A . 2 ALA CA 1 1 17 4609 1 1 2 ALA CB C -6.206 -0.674 2.699 1.00 . A A . 2 ALA CB 1 1 17 4610 1 1 2 ALA H H -6.366 -0.413 5.339 1.00 . A A . 2 ALA H 1 1 17 4611 1 1 2 ALA HA H -5.588 -2.545 3.481 1.00 . A A . 2 ALA HA 1 1 17 4612 1 1 2 ALA HB1 H -5.483 -0.134 2.106 1.00 . A A . 2 ALA HB1 1 1 17 4613 1 1 2 ALA HB2 H -6.868 0.027 3.185 1.00 . A A . 2 ALA HB2 1 1 17 4614 1 1 2 ALA HB3 H -6.780 -1.327 2.059 1.00 . A A . 2 ALA HB3 1 1 17 4615 1 1 2 ALA N N -6.109 -1.317 5.059 1.00 . A A . 2 ALA N 1 1 17 4616 1 1 2 ALA O O -3.294 -1.352 2.774 1.00 . A A . 2 ALA O 1 1 17 4617 1 1 3 TYR C C -1.189 -1.476 4.977 1.00 . A A . 3 TYR C 1 1 17 4618 1 1 3 TYR CA C -2.092 -0.245 5.023 1.00 . A A . 3 TYR CA 1 1 17 4619 1 1 3 TYR CB C -1.858 0.546 6.315 1.00 . A A . 3 TYR CB 1 1 17 4620 1 1 3 TYR CD1 C -0.920 2.844 5.812 1.00 . A A . 3 TYR CD1 1 1 17 4621 1 1 3 TYR CD2 C 0.576 1.153 6.588 1.00 . A A . 3 TYR CD2 1 1 17 4622 1 1 3 TYR CE1 C 0.126 3.744 5.753 1.00 . A A . 3 TYR CE1 1 1 17 4623 1 1 3 TYR CE2 C 1.626 2.049 6.527 1.00 . A A . 3 TYR CE2 1 1 17 4624 1 1 3 TYR CG C -0.712 1.531 6.230 1.00 . A A . 3 TYR CG 1 1 17 4625 1 1 3 TYR CZ C 1.396 3.342 6.110 1.00 . A A . 3 TYR CZ 1 1 17 4626 1 1 3 TYR H H -4.102 -0.481 5.659 1.00 . A A . 3 TYR H 1 1 17 4627 1 1 3 TYR HA H -1.847 0.381 4.183 1.00 . A A . 3 TYR HA 1 1 17 4628 1 1 3 TYR HB2 H -2.751 1.103 6.556 1.00 . A A . 3 TYR HB2 1 1 17 4629 1 1 3 TYR HB3 H -1.644 -0.145 7.117 1.00 . A A . 3 TYR HB3 1 1 17 4630 1 1 3 TYR HD1 H -1.915 3.159 5.521 1.00 . A A . 3 TYR HD1 1 1 17 4631 1 1 3 TYR HD2 H 0.754 0.138 6.913 1.00 . A A . 3 TYR HD2 1 1 17 4632 1 1 3 TYR HE1 H -0.054 4.758 5.434 1.00 . A A . 3 TYR HE1 1 1 17 4633 1 1 3 TYR HE2 H 2.620 1.734 6.806 1.00 . A A . 3 TYR HE2 1 1 17 4634 1 1 3 TYR HH H 2.787 4.267 5.158 1.00 . A A . 3 TYR HH 1 1 17 4635 1 1 3 TYR N N -3.503 -0.622 4.898 1.00 . A A . 3 TYR N 1 1 17 4636 1 1 3 TYR O O -0.231 -1.517 4.203 1.00 . A A . 3 TYR O 1 1 17 4637 1 1 3 TYR OH O 2.438 4.238 6.052 1.00 . A A . 3 TYR OH 1 1 17 4638 1 1 4 ALA C C -0.843 -4.450 4.481 1.00 . A A . 4 ALA C 1 1 17 4639 1 1 4 ALA CA C -0.730 -3.719 5.819 1.00 . A A . 4 ALA CA 1 1 17 4640 1 1 4 ALA CB C -1.193 -4.616 6.959 1.00 . A A . 4 ALA CB 1 1 17 4641 1 1 4 ALA H H -2.290 -2.399 6.376 1.00 . A A . 4 ALA H 1 1 17 4642 1 1 4 ALA HA H 0.307 -3.460 5.989 1.00 . A A . 4 ALA HA 1 1 17 4643 1 1 4 ALA HB1 H -0.486 -5.421 7.094 1.00 . A A . 4 ALA HB1 1 1 17 4644 1 1 4 ALA HB2 H -2.165 -5.025 6.724 1.00 . A A . 4 ALA HB2 1 1 17 4645 1 1 4 ALA HB3 H -1.258 -4.036 7.868 1.00 . A A . 4 ALA HB3 1 1 17 4646 1 1 4 ALA N N -1.508 -2.483 5.792 1.00 . A A . 4 ALA N 1 1 17 4647 1 1 4 ALA O O 0.125 -5.052 4.013 1.00 . A A . 4 ALA O 1 1 17 4648 1 1 5 GLN C C -1.452 -4.300 1.480 1.00 . A A . 5 GLN C 1 1 17 4649 1 1 5 GLN CA C -2.261 -5.005 2.569 1.00 . A A . 5 GLN CA 1 1 17 4650 1 1 5 GLN CB C -3.754 -4.977 2.225 1.00 . A A . 5 GLN CB 1 1 17 4651 1 1 5 GLN CD C -3.749 -7.041 0.764 1.00 . A A . 5 GLN CD 1 1 17 4652 1 1 5 GLN CG C -4.078 -5.562 0.861 1.00 . A A . 5 GLN CG 1 1 17 4653 1 1 5 GLN H H -2.754 -3.865 4.277 1.00 . A A . 5 GLN H 1 1 17 4654 1 1 5 GLN HA H -1.933 -6.032 2.637 1.00 . A A . 5 GLN HA 1 1 17 4655 1 1 5 GLN HB2 H -4.294 -5.541 2.972 1.00 . A A . 5 GLN HB2 1 1 17 4656 1 1 5 GLN HB3 H -4.095 -3.953 2.243 1.00 . A A . 5 GLN HB3 1 1 17 4657 1 1 5 GLN HE21 H -5.565 -7.521 1.425 1.00 . A A . 5 GLN HE21 1 1 17 4658 1 1 5 GLN HE22 H -4.520 -8.849 1.067 1.00 . A A . 5 GLN HE22 1 1 17 4659 1 1 5 GLN HG2 H -5.131 -5.429 0.666 1.00 . A A . 5 GLN HG2 1 1 17 4660 1 1 5 GLN HG3 H -3.505 -5.031 0.116 1.00 . A A . 5 GLN HG3 1 1 17 4661 1 1 5 GLN N N -2.026 -4.373 3.861 1.00 . A A . 5 GLN N 1 1 17 4662 1 1 5 GLN NE2 N -4.709 -7.889 1.122 1.00 . A A . 5 GLN NE2 1 1 17 4663 1 1 5 GLN O O -0.907 -4.948 0.588 1.00 . A A . 5 GLN O 1 1 17 4664 1 1 5 GLN OE1 O -2.644 -7.418 0.374 1.00 . A A . 5 GLN OE1 1 1 17 4665 1 1 6 TRP C C 0.855 -2.594 0.617 1.00 . A A . 6 TRP C 1 1 17 4666 1 1 6 TRP CA C -0.609 -2.170 0.615 1.00 . A A . 6 TRP CA 1 1 17 4667 1 1 6 TRP CB C -0.718 -0.681 0.957 1.00 . A A . 6 TRP CB 1 1 17 4668 1 1 6 TRP CD1 C -0.296 0.526 -1.255 1.00 . A A . 6 TRP CD1 1 1 17 4669 1 1 6 TRP CD2 C 1.285 0.874 0.289 1.00 . A A . 6 TRP CD2 1 1 17 4670 1 1 6 TRP CE2 C 1.630 1.583 -0.875 1.00 . A A . 6 TRP CE2 1 1 17 4671 1 1 6 TRP CE3 C 2.135 0.947 1.397 1.00 . A A . 6 TRP CE3 1 1 17 4672 1 1 6 TRP CG C 0.047 0.202 0.022 1.00 . A A . 6 TRP CG 1 1 17 4673 1 1 6 TRP CH2 C 3.597 2.412 0.131 1.00 . A A . 6 TRP CH2 1 1 17 4674 1 1 6 TRP CZ2 C 2.785 2.355 -0.967 1.00 . A A . 6 TRP CZ2 1 1 17 4675 1 1 6 TRP CZ3 C 3.282 1.717 1.307 1.00 . A A . 6 TRP CZ3 1 1 17 4676 1 1 6 TRP H H -1.816 -2.515 2.320 1.00 . A A . 6 TRP H 1 1 17 4677 1 1 6 TRP HA H -1.024 -2.341 -0.366 1.00 . A A . 6 TRP HA 1 1 17 4678 1 1 6 TRP HB2 H -1.753 -0.385 0.922 1.00 . A A . 6 TRP HB2 1 1 17 4679 1 1 6 TRP HB3 H -0.337 -0.518 1.952 1.00 . A A . 6 TRP HB3 1 1 17 4680 1 1 6 TRP HD1 H -1.184 0.174 -1.753 1.00 . A A . 6 TRP HD1 1 1 17 4681 1 1 6 TRP HE1 H 0.628 1.716 -2.707 1.00 . A A . 6 TRP HE1 1 1 17 4682 1 1 6 TRP HE3 H 1.908 0.414 2.311 1.00 . A A . 6 TRP HE3 1 1 17 4683 1 1 6 TRP HH2 H 4.498 3.008 0.105 1.00 . A A . 6 TRP HH2 1 1 17 4684 1 1 6 TRP HZ2 H 3.045 2.891 -1.868 1.00 . A A . 6 TRP HZ2 1 1 17 4685 1 1 6 TRP HZ3 H 3.952 1.786 2.153 1.00 . A A . 6 TRP HZ3 1 1 17 4686 1 1 6 TRP N N -1.367 -2.969 1.576 1.00 . A A . 6 TRP N 1 1 17 4687 1 1 6 TRP NE1 N 0.651 1.350 -1.801 1.00 . A A . 6 TRP NE1 1 1 17 4688 1 1 6 TRP O O 1.445 -2.834 -0.437 1.00 . A A . 6 TRP O 1 1 17 4689 1 1 7 LEU C C 3.016 -4.543 1.518 1.00 . A A . 7 LEU C 1 1 17 4690 1 1 7 LEU CA C 2.815 -3.099 1.983 1.00 . A A . 7 LEU CA 1 1 17 4691 1 1 7 LEU CB C 3.232 -2.945 3.448 1.00 . A A . 7 LEU CB 1 1 17 4692 1 1 7 LEU CD1 C 3.216 -1.504 5.503 1.00 . A A . 7 LEU CD1 1 1 17 4693 1 1 7 LEU CD2 C 4.352 -0.694 3.423 1.00 . A A . 7 LEU CD2 1 1 17 4694 1 1 7 LEU CG C 3.193 -1.509 3.982 1.00 . A A . 7 LEU CG 1 1 17 4695 1 1 7 LEU H H 0.889 -2.492 2.615 1.00 . A A . 7 LEU H 1 1 17 4696 1 1 7 LEU HA H 3.425 -2.450 1.374 1.00 . A A . 7 LEU HA 1 1 17 4697 1 1 7 LEU HB2 H 2.570 -3.550 4.052 1.00 . A A . 7 LEU HB2 1 1 17 4698 1 1 7 LEU HB3 H 4.236 -3.321 3.560 1.00 . A A . 7 LEU HB3 1 1 17 4699 1 1 7 LEU HD11 H 2.526 -2.247 5.875 1.00 . A A . 7 LEU HD11 1 1 17 4700 1 1 7 LEU HD12 H 2.925 -0.529 5.863 1.00 . A A . 7 LEU HD12 1 1 17 4701 1 1 7 LEU HD13 H 4.213 -1.734 5.849 1.00 . A A . 7 LEU HD13 1 1 17 4702 1 1 7 LEU HD21 H 4.199 -0.525 2.367 1.00 . A A . 7 LEU HD21 1 1 17 4703 1 1 7 LEU HD22 H 5.276 -1.234 3.570 1.00 . A A . 7 LEU HD22 1 1 17 4704 1 1 7 LEU HD23 H 4.405 0.256 3.935 1.00 . A A . 7 LEU HD23 1 1 17 4705 1 1 7 LEU HG H 2.272 -1.042 3.664 1.00 . A A . 7 LEU HG 1 1 17 4706 1 1 7 LEU N N 1.424 -2.692 1.817 1.00 . A A . 7 LEU N 1 1 17 4707 1 1 7 LEU O O 4.051 -4.877 0.937 1.00 . A A . 7 LEU O 1 1 17 4708 1 1 8 ALA C C 1.824 -6.958 -0.146 1.00 . A A . 8 ALA C 1 1 17 4709 1 1 8 ALA CA C 2.062 -6.794 1.360 1.00 . A A . 8 ALA CA 1 1 17 4710 1 1 8 ALA CB C 1.041 -7.604 2.147 1.00 . A A . 8 ALA CB 1 1 17 4711 1 1 8 ALA H H 1.210 -5.055 2.222 1.00 . A A . 8 ALA H 1 1 17 4712 1 1 8 ALA HA H 3.045 -7.172 1.600 1.00 . A A . 8 ALA HA 1 1 17 4713 1 1 8 ALA HB1 H 0.047 -7.247 1.922 1.00 . A A . 8 ALA HB1 1 1 17 4714 1 1 8 ALA HB2 H 1.232 -7.496 3.204 1.00 . A A . 8 ALA HB2 1 1 17 4715 1 1 8 ALA HB3 H 1.119 -8.646 1.872 1.00 . A A . 8 ALA HB3 1 1 17 4716 1 1 8 ALA N N 2.011 -5.389 1.764 1.00 . A A . 8 ALA N 1 1 17 4717 1 1 8 ALA O O 2.149 -8.000 -0.718 1.00 . A A . 8 ALA O 1 1 17 4718 1 1 9 ASP C C 2.187 -5.445 -3.036 1.00 . A A . 9 ASP C 1 1 17 4719 1 1 9 ASP CA C 0.990 -5.956 -2.225 1.00 . A A . 9 ASP CA 1 1 17 4720 1 1 9 ASP CB C -0.254 -5.118 -2.552 1.00 . A A . 9 ASP CB 1 1 17 4721 1 1 9 ASP CG C -1.372 -5.950 -3.149 1.00 . A A . 9 ASP CG 1 1 17 4722 1 1 9 ASP H H 1.030 -5.119 -0.278 1.00 . A A . 9 ASP H 1 1 17 4723 1 1 9 ASP HA H 0.800 -6.983 -2.500 1.00 . A A . 9 ASP HA 1 1 17 4724 1 1 9 ASP HB2 H -0.621 -4.655 -1.649 1.00 . A A . 9 ASP HB2 1 1 17 4725 1 1 9 ASP HB3 H 0.014 -4.347 -3.261 1.00 . A A . 9 ASP HB3 1 1 17 4726 1 1 9 ASP N N 1.262 -5.924 -0.785 1.00 . A A . 9 ASP N 1 1 17 4727 1 1 9 ASP O O 2.051 -5.131 -4.221 1.00 . A A . 9 ASP O 1 1 17 4728 1 1 9 ASP OD1 O -1.347 -6.184 -4.376 1.00 . A A . 9 ASP OD1 1 1 17 4729 1 1 9 ASP OD2 O -2.272 -6.367 -2.390 1.00 . A A . 9 ASP OD2 1 1 17 4730 1 1 10 DAL C C 4.905 -3.446 -2.659 1.00 . A A . 10 DAL C 1 1 17 4731 1 1 10 DAL CA C 4.569 -4.886 -3.057 1.00 . A A . 10 DAL CA 1 1 17 4732 1 1 10 DAL CB C 5.731 -5.804 -2.721 1.00 . A A . 10 DAL CB 1 1 17 4733 1 1 10 DAL H H 3.407 -5.621 -1.454 1.00 . A A . 10 DAL H 1 1 17 4734 1 1 10 DAL HA H 4.406 -4.927 -4.124 1.00 . A A . 10 DAL HA 1 1 17 4735 1 1 10 DAL HB1 H 6.597 -5.513 -3.296 1.00 . A A . 10 DAL HB1 1 1 17 4736 1 1 10 DAL HB2 H 5.465 -6.823 -2.959 1.00 . A A . 10 DAL HB2 1 1 17 4737 1 1 10 DAL HB3 H 5.953 -5.725 -1.668 1.00 . A A . 10 DAL HB3 1 1 17 4738 1 1 10 DAL N N 3.357 -5.361 -2.395 1.00 . A A . 10 DAL N 1 1 17 4739 1 1 10 DAL O O 5.934 -2.910 -3.074 1.00 . A A . 10 DAL O 1 1 17 4740 1 1 11 GLY C C 4.168 -0.466 -2.554 1.00 . A A . 11 GLY C 1 1 17 4741 1 1 11 GLY CA C 4.264 -1.460 -1.416 1.00 . A A . 11 GLY CA 1 1 17 4742 1 1 11 GLY H H 3.236 -3.301 -1.554 1.00 . A A . 11 GLY H 1 1 17 4743 1 1 11 GLY HA2 H 3.527 -1.203 -0.668 1.00 . A A . 11 GLY HA2 1 1 17 4744 1 1 11 GLY HA3 H 5.248 -1.392 -0.975 1.00 . A A . 11 GLY HA3 1 1 17 4745 1 1 11 GLY N N 4.037 -2.826 -1.853 1.00 . A A . 11 GLY N 1 1 17 4746 1 1 11 GLY O O 3.073 -0.036 -2.917 1.00 . A A . 11 GLY O 1 1 17 4747 1 1 12 TRP C C 5.433 0.145 -5.583 1.00 . A A . 12 TRP C 1 1 17 4748 1 1 12 TRP CA C 5.357 0.846 -4.225 1.00 . A A . 12 TRP CA 1 1 17 4749 1 1 12 TRP CB C 6.523 1.816 -4.034 1.00 . A A . 12 TRP CB 1 1 17 4750 1 1 12 TRP CD1 C 6.690 3.143 -1.854 1.00 . A A . 12 TRP CD1 1 1 17 4751 1 1 12 TRP CD2 C 5.165 3.923 -3.298 1.00 . A A . 12 TRP CD2 1 1 17 4752 1 1 12 TRP CE2 C 5.140 4.722 -2.141 1.00 . A A . 12 TRP CE2 1 1 17 4753 1 1 12 TRP CE3 C 4.290 4.229 -4.349 1.00 . A A . 12 TRP CE3 1 1 17 4754 1 1 12 TRP CG C 6.163 2.917 -3.092 1.00 . A A . 12 TRP CG 1 1 17 4755 1 1 12 TRP CH2 C 3.430 6.076 -3.043 1.00 . A A . 12 TRP CH2 1 1 17 4756 1 1 12 TRP CZ2 C 4.274 5.798 -2.002 1.00 . A A . 12 TRP CZ2 1 1 17 4757 1 1 12 TRP CZ3 C 3.435 5.303 -4.211 1.00 . A A . 12 TRP CZ3 1 1 17 4758 1 1 12 TRP H H 6.157 -0.485 -2.785 1.00 . A A . 12 TRP H 1 1 17 4759 1 1 12 TRP HA H 4.436 1.413 -4.190 1.00 . A A . 12 TRP HA 1 1 17 4760 1 1 12 TRP HB2 H 7.368 1.281 -3.623 1.00 . A A . 12 TRP HB2 1 1 17 4761 1 1 12 TRP HB3 H 6.798 2.251 -4.982 1.00 . A A . 12 TRP HB3 1 1 17 4762 1 1 12 TRP HD1 H 7.472 2.546 -1.408 1.00 . A A . 12 TRP HD1 1 1 17 4763 1 1 12 TRP HE1 H 6.284 4.588 -0.387 1.00 . A A . 12 TRP HE1 1 1 17 4764 1 1 12 TRP HE3 H 4.275 3.644 -5.257 1.00 . A A . 12 TRP HE3 1 1 17 4765 1 1 12 TRP HH2 H 2.744 6.907 -2.976 1.00 . A A . 12 TRP HH2 1 1 17 4766 1 1 12 TRP HZ2 H 4.252 6.393 -1.105 1.00 . A A . 12 TRP HZ2 1 1 17 4767 1 1 12 TRP HZ3 H 2.757 5.556 -5.014 1.00 . A A . 12 TRP HZ3 1 1 17 4768 1 1 12 TRP N N 5.317 -0.104 -3.119 1.00 . A A . 12 TRP N 1 1 17 4769 1 1 12 TRP NE1 N 6.079 4.226 -1.275 1.00 . A A . 12 TRP NE1 1 1 17 4770 1 1 12 TRP O O 5.653 0.792 -6.609 1.00 . A A . 12 TRP O 1 1 17 4771 1 1 13 ALA C C 3.842 -1.909 -7.476 1.00 . A A . 13 ALA C 1 1 17 4772 1 1 13 ALA CA C 5.222 -1.945 -6.827 1.00 . A A . 13 ALA CA 1 1 17 4773 1 1 13 ALA CB C 5.658 -3.378 -6.565 1.00 . A A . 13 ALA CB 1 1 17 4774 1 1 13 ALA H H 5.017 -1.632 -4.748 1.00 . A A . 13 ALA H 1 1 17 4775 1 1 13 ALA HA H 5.934 -1.491 -7.498 1.00 . A A . 13 ALA HA 1 1 17 4776 1 1 13 ALA HB1 H 4.870 -4.055 -6.859 1.00 . A A . 13 ALA HB1 1 1 17 4777 1 1 13 ALA HB2 H 5.870 -3.505 -5.514 1.00 . A A . 13 ALA HB2 1 1 17 4778 1 1 13 ALA HB3 H 6.547 -3.590 -7.140 1.00 . A A . 13 ALA HB3 1 1 17 4779 1 1 13 ALA N N 5.214 -1.173 -5.590 1.00 . A A . 13 ALA N 1 1 17 4780 1 1 13 ALA O O 3.722 -1.920 -8.703 1.00 . A A . 13 ALA O 1 1 17 4781 1 1 14 SER C C 1.201 -0.503 -7.936 1.00 . A A . 14 SER C 1 1 17 4782 1 1 14 SER CA C 1.424 -1.774 -7.113 1.00 . A A . 14 SER CA 1 1 17 4783 1 1 14 SER CB C 0.446 -1.822 -5.928 1.00 . A A . 14 SER CB 1 1 17 4784 1 1 14 SER H H 2.971 -1.821 -5.672 1.00 . A A . 14 SER H 1 1 17 4785 1 1 14 SER HA H 1.250 -2.628 -7.747 1.00 . A A . 14 SER HA 1 1 17 4786 1 1 14 SER HB2 H -0.459 -1.296 -6.188 1.00 . A A . 14 SER HB2 1 1 17 4787 1 1 14 SER HB3 H 0.208 -2.851 -5.703 1.00 . A A . 14 SER HB3 1 1 17 4788 1 1 14 SER HG H 1.337 -1.903 -4.177 1.00 . A A . 14 SER HG 1 1 17 4789 1 1 14 SER N N 2.803 -1.842 -6.637 1.00 . A A . 14 SER N 1 1 17 4790 1 1 14 SER O O 0.379 -0.486 -8.854 1.00 . A A . 14 SER O 1 1 17 4791 1 1 14 SER OG O 1.004 -1.220 -4.768 1.00 . A A . 14 SER OG 1 1 17 4792 1 1 15 DAL C C 0.996 2.842 -7.540 1.00 . A A . 15 DAL C 1 1 17 4793 1 1 15 DAL CA C 1.844 1.831 -8.315 1.00 . A A . 15 DAL CA 1 1 17 4794 1 1 15 DAL CB C 3.232 2.392 -8.582 1.00 . A A . 15 DAL CB 1 1 17 4795 1 1 15 DAL H H 2.587 0.477 -6.865 1.00 . A A . 15 DAL H 1 1 17 4796 1 1 15 DAL HA H 1.375 1.643 -9.268 1.00 . A A . 15 DAL HA 1 1 17 4797 1 1 15 DAL HB1 H 3.377 3.289 -7.999 1.00 . A A . 15 DAL HB1 1 1 17 4798 1 1 15 DAL HB2 H 3.326 2.624 -9.631 1.00 . A A . 15 DAL HB2 1 1 17 4799 1 1 15 DAL HB3 H 3.975 1.659 -8.307 1.00 . A A . 15 DAL HB3 1 1 17 4800 1 1 15 DAL N N 1.948 0.557 -7.605 1.00 . A A . 15 DAL N 1 1 17 4801 1 1 15 DAL O O 1.144 4.054 -7.712 1.00 . A A . 15 DAL O 1 1 17 4802 1 1 16 ARG C C -0.076 3.606 -4.586 1.00 . A A . 16 ARG C 1 1 17 4803 1 1 16 ARG CA C -0.769 3.189 -5.885 1.00 . A A . 16 ARG CA 1 1 17 4804 1 1 16 ARG CB C -2.083 2.447 -5.569 1.00 . A A . 16 ARG CB 1 1 17 4805 1 1 16 ARG CD C -3.108 0.456 -4.415 1.00 . A A . 16 ARG CD 1 1 17 4806 1 1 16 ARG CG C -1.975 1.476 -4.398 1.00 . A A . 16 ARG CG 1 1 17 4807 1 1 16 ARG CZ C -2.899 -1.264 -2.641 1.00 . A A . 16 ARG CZ 1 1 17 4808 1 1 16 ARG H H 0.035 1.361 -6.596 1.00 . A A . 16 ARG H 1 1 17 4809 1 1 16 ARG HA H -0.987 4.079 -6.461 1.00 . A A . 16 ARG HA 1 1 17 4810 1 1 16 ARG HB2 H -2.844 3.176 -5.332 1.00 . A A . 16 ARG HB2 1 1 17 4811 1 1 16 ARG HB3 H -2.396 1.882 -6.442 1.00 . A A . 16 ARG HB3 1 1 17 4812 1 1 16 ARG HD2 H -4.003 0.941 -4.775 1.00 . A A . 16 ARG HD2 1 1 17 4813 1 1 16 ARG HD3 H -2.846 -0.350 -5.085 1.00 . A A . 16 ARG HD3 1 1 17 4814 1 1 16 ARG HE H -3.952 0.429 -2.491 1.00 . A A . 16 ARG HE 1 1 17 4815 1 1 16 ARG HG2 H -1.027 0.956 -4.460 1.00 . A A . 16 ARG HG2 1 1 17 4816 1 1 16 ARG HG3 H -2.019 2.036 -3.475 1.00 . A A . 16 ARG HG3 1 1 17 4817 1 1 16 ARG HH11 H -1.845 -1.696 -4.318 1.00 . A A . 16 ARG HH11 1 1 17 4818 1 1 16 ARG HH12 H -1.749 -2.878 -3.058 1.00 . A A . 16 ARG HH12 1 1 17 4819 1 1 16 ARG HH21 H -3.816 -1.135 -0.841 1.00 . A A . 16 ARG HH21 1 1 17 4820 1 1 16 ARG HH22 H -2.869 -2.563 -1.089 1.00 . A A . 16 ARG HH22 1 1 17 4821 1 1 16 ARG N N 0.106 2.335 -6.688 1.00 . A A . 16 ARG N 1 1 17 4822 1 1 16 ARG NE N -3.376 -0.096 -3.085 1.00 . A A . 16 ARG NE 1 1 17 4823 1 1 16 ARG NH1 N -2.099 -2.006 -3.403 1.00 . A A . 16 ARG NH1 1 1 17 4824 1 1 16 ARG NH2 N -3.221 -1.689 -1.423 1.00 . A A . 16 ARG NH2 1 1 17 4825 1 1 16 ARG O O 0.806 2.902 -4.097 1.00 . A A . 16 ARG O 1 1 17 4826 1 1 17 PRO C C -0.514 4.626 -1.520 1.00 . A A . 17 PRO C 1 1 17 4827 1 1 17 PRO CA C 0.117 5.259 -2.760 1.00 . A A . 17 PRO CA 1 1 17 4828 1 1 17 PRO CB C -0.173 6.767 -2.793 1.00 . A A . 17 PRO CB 1 1 17 4829 1 1 17 PRO CD C -1.491 5.677 -4.506 1.00 . A A . 17 PRO CD 1 1 17 4830 1 1 17 PRO CG C -1.005 7.016 -4.017 1.00 . A A . 17 PRO CG 1 1 17 4831 1 1 17 PRO HA H 1.182 5.098 -2.730 1.00 . A A . 17 PRO HA 1 1 17 4832 1 1 17 PRO HB2 H -0.707 7.048 -1.897 1.00 . A A . 17 PRO HB2 1 1 17 4833 1 1 17 PRO HB3 H 0.764 7.308 -2.837 1.00 . A A . 17 PRO HB3 1 1 17 4834 1 1 17 PRO HD2 H -2.456 5.444 -4.086 1.00 . A A . 17 PRO HD2 1 1 17 4835 1 1 17 PRO HD3 H -1.532 5.665 -5.583 1.00 . A A . 17 PRO HD3 1 1 17 4836 1 1 17 PRO HG2 H -1.846 7.644 -3.763 1.00 . A A . 17 PRO HG2 1 1 17 4837 1 1 17 PRO HG3 H -0.402 7.493 -4.775 1.00 . A A . 17 PRO HG3 1 1 17 4838 1 1 17 PRO N N -0.465 4.761 -4.006 1.00 . A A . 17 PRO N 1 1 17 4839 1 1 17 PRO O O -1.566 3.988 -1.601 1.00 . A A . 17 PRO O 1 1 17 4840 1 1 18 PRO C C -1.701 4.806 1.349 1.00 . A A . 18 PRO C 1 1 17 4841 1 1 18 PRO CA C -0.349 4.239 0.919 1.00 . A A . 18 PRO CA 1 1 17 4842 1 1 18 PRO CB C 0.719 4.649 1.937 1.00 . A A . 18 PRO CB 1 1 17 4843 1 1 18 PRO CD C 1.399 5.533 -0.186 1.00 . A A . 18 PRO CD 1 1 17 4844 1 1 18 PRO CG C 1.490 5.752 1.296 1.00 . A A . 18 PRO CG 1 1 17 4845 1 1 18 PRO HA H -0.409 3.160 0.876 1.00 . A A . 18 PRO HA 1 1 17 4846 1 1 18 PRO HB2 H 0.236 4.990 2.838 1.00 . A A . 18 PRO HB2 1 1 17 4847 1 1 18 PRO HB3 H 1.347 3.807 2.164 1.00 . A A . 18 PRO HB3 1 1 17 4848 1 1 18 PRO HD2 H 1.362 6.479 -0.704 1.00 . A A . 18 PRO HD2 1 1 17 4849 1 1 18 PRO HD3 H 2.235 4.945 -0.532 1.00 . A A . 18 PRO HD3 1 1 17 4850 1 1 18 PRO HG2 H 1.053 6.704 1.559 1.00 . A A . 18 PRO HG2 1 1 17 4851 1 1 18 PRO HG3 H 2.520 5.712 1.617 1.00 . A A . 18 PRO HG3 1 1 17 4852 1 1 18 PRO N N 0.135 4.794 -0.351 1.00 . A A . 18 PRO N 1 1 17 4853 1 1 18 PRO O O -2.000 5.977 1.110 1.00 . A A . 18 PRO O 1 1 17 4854 1 1 19 PRO C C -3.772 5.150 3.811 1.00 . A A . 19 PRO C 1 1 17 4855 1 1 19 PRO CA C -3.845 4.387 2.488 1.00 . A A . 19 PRO CA 1 1 17 4856 1 1 19 PRO CB C -4.590 3.066 2.665 1.00 . A A . 19 PRO CB 1 1 17 4857 1 1 19 PRO CD C -2.242 2.570 2.335 1.00 . A A . 19 PRO CD 1 1 17 4858 1 1 19 PRO CG C -3.553 2.008 2.824 1.00 . A A . 19 PRO CG 1 1 17 4859 1 1 19 PRO HA H -4.357 4.995 1.756 1.00 . A A . 19 PRO HA 1 1 17 4860 1 1 19 PRO HB2 H -5.227 3.122 3.533 1.00 . A A . 19 PRO HB2 1 1 17 4861 1 1 19 PRO HB3 H -5.182 2.884 1.798 1.00 . A A . 19 PRO HB3 1 1 17 4862 1 1 19 PRO HD2 H -1.490 2.508 3.106 1.00 . A A . 19 PRO HD2 1 1 17 4863 1 1 19 PRO HD3 H -1.924 2.036 1.455 1.00 . A A . 19 PRO HD3 1 1 17 4864 1 1 19 PRO HG2 H -3.482 1.724 3.857 1.00 . A A . 19 PRO HG2 1 1 17 4865 1 1 19 PRO HG3 H -3.828 1.149 2.228 1.00 . A A . 19 PRO HG3 1 1 17 4866 1 1 19 PRO N N -2.532 3.975 2.008 1.00 . A A . 19 PRO N 1 1 17 4867 1 1 19 PRO O O -2.856 4.944 4.608 1.00 . A A . 19 PRO O 1 1 17 4868 1 1 20 SER C C -6.222 6.899 5.810 1.00 . A A . 20 SER C 1 1 17 4869 1 1 20 SER CA C -4.798 6.833 5.257 1.00 . A A . 20 SER CA 1 1 17 4870 1 1 20 SER CB C -4.268 8.247 4.996 1.00 . A A . 20 SER CB 1 1 17 4871 1 1 20 SER H H -5.446 6.153 3.358 1.00 . A A . 20 SER H 1 1 17 4872 1 1 20 SER HA H -4.166 6.354 5.991 1.00 . A A . 20 SER HA 1 1 17 4873 1 1 20 SER HB2 H -4.442 8.861 5.867 1.00 . A A . 20 SER HB2 1 1 17 4874 1 1 20 SER HB3 H -3.208 8.200 4.795 1.00 . A A . 20 SER HB3 1 1 17 4875 1 1 20 SER HG H -4.398 8.692 3.091 1.00 . A A . 20 SER HG 1 1 17 4876 1 1 20 SER N N -4.745 6.034 4.034 1.00 . A A . 20 SER N 1 1 17 4877 1 1 20 SER O O -6.399 6.626 7.016 1.00 . A A . 20 SER O 1 1 17 4878 1 1 20 SER OXT O -7.147 7.225 5.034 1.00 . A A . 20 SER OXT 1 1 17 4879 1 1 20 SER OG O -4.917 8.844 3.884 1.00 . A A . 20 SER OG 1 1 18 4880 1 1 1 ASP C C -6.745 -3.054 4.804 1.00 . A A . 1 ASP C 1 1 18 4881 1 1 1 ASP CA C -6.891 -4.136 5.874 1.00 . A A . 1 ASP CA 1 1 18 4882 1 1 1 ASP CB C -7.010 -3.498 7.264 1.00 . A A . 1 ASP CB 1 1 18 4883 1 1 1 ASP CG C -8.415 -3.008 7.559 1.00 . A A . 1 ASP CG 1 1 18 4884 1 1 1 ASP H1 H -4.872 -4.503 6.076 1.00 . A A . 1 ASP H1 1 1 18 4885 1 1 1 ASP H2 H -5.671 -5.501 4.931 1.00 . A A . 1 ASP H2 1 1 18 4886 1 1 1 ASP H3 H -5.887 -5.777 6.610 1.00 . A A . 1 ASP H3 1 1 18 4887 1 1 1 ASP HA H -7.783 -4.710 5.672 1.00 . A A . 1 ASP HA 1 1 18 4888 1 1 1 ASP HB2 H -6.738 -4.227 8.012 1.00 . A A . 1 ASP HB2 1 1 18 4889 1 1 1 ASP HB3 H -6.335 -2.657 7.326 1.00 . A A . 1 ASP HB3 1 1 18 4890 1 1 1 ASP N N -5.725 -5.062 5.873 1.00 . A A . 1 ASP N 1 1 18 4891 1 1 1 ASP O O -7.554 -2.974 3.879 1.00 . A A . 1 ASP O 1 1 18 4892 1 1 1 ASP OD1 O -8.759 -1.889 7.123 1.00 . A A . 1 ASP OD1 1 1 18 4893 1 1 1 ASP OD2 O -9.172 -3.744 8.227 1.00 . A A . 1 ASP OD2 1 1 18 4894 1 1 2 ALA C C -3.965 -0.806 3.938 1.00 . A A . 2 ALA C 1 1 18 4895 1 1 2 ALA CA C -5.452 -1.148 3.986 1.00 . A A . 2 ALA CA 1 1 18 4896 1 1 2 ALA CB C -6.269 0.083 4.347 1.00 . A A . 2 ALA CB 1 1 18 4897 1 1 2 ALA H H -5.099 -2.342 5.698 1.00 . A A . 2 ALA H 1 1 18 4898 1 1 2 ALA HA H -5.764 -1.485 3.008 1.00 . A A . 2 ALA HA 1 1 18 4899 1 1 2 ALA HB1 H -5.947 0.458 5.307 1.00 . A A . 2 ALA HB1 1 1 18 4900 1 1 2 ALA HB2 H -7.315 -0.182 4.397 1.00 . A A . 2 ALA HB2 1 1 18 4901 1 1 2 ALA HB3 H -6.125 0.844 3.596 1.00 . A A . 2 ALA HB3 1 1 18 4902 1 1 2 ALA N N -5.708 -2.225 4.938 1.00 . A A . 2 ALA N 1 1 18 4903 1 1 2 ALA O O -3.305 -1.027 2.923 1.00 . A A . 2 ALA O 1 1 18 4904 1 1 3 TYR C C -1.153 -1.155 5.107 1.00 . A A . 3 TYR C 1 1 18 4905 1 1 3 TYR CA C -2.031 0.094 5.134 1.00 . A A . 3 TYR CA 1 1 18 4906 1 1 3 TYR CB C -1.762 0.916 6.397 1.00 . A A . 3 TYR CB 1 1 18 4907 1 1 3 TYR CD1 C -0.756 3.168 5.819 1.00 . A A . 3 TYR CD1 1 1 18 4908 1 1 3 TYR CD2 C 0.691 1.454 6.636 1.00 . A A . 3 TYR CD2 1 1 18 4909 1 1 3 TYR CE1 C 0.318 4.032 5.727 1.00 . A A . 3 TYR CE1 1 1 18 4910 1 1 3 TYR CE2 C 1.768 2.313 6.542 1.00 . A A . 3 TYR CE2 1 1 18 4911 1 1 3 TYR CG C -0.587 1.862 6.275 1.00 . A A . 3 TYR CG 1 1 18 4912 1 1 3 TYR CZ C 1.576 3.600 6.088 1.00 . A A . 3 TYR CZ 1 1 18 4913 1 1 3 TYR H H -4.027 -0.124 5.821 1.00 . A A . 3 TYR H 1 1 18 4914 1 1 3 TYR HA H -1.794 0.692 4.271 1.00 . A A . 3 TYR HA 1 1 18 4915 1 1 3 TYR HB2 H -2.636 1.507 6.627 1.00 . A A . 3 TYR HB2 1 1 18 4916 1 1 3 TYR HB3 H -1.563 0.244 7.220 1.00 . A A . 3 TYR HB3 1 1 18 4917 1 1 3 TYR HD1 H -1.743 3.506 5.524 1.00 . A A . 3 TYR HD1 1 1 18 4918 1 1 3 TYR HD2 H 0.839 0.444 6.991 1.00 . A A . 3 TYR HD2 1 1 18 4919 1 1 3 TYR HE1 H 0.168 5.041 5.378 1.00 . A A . 3 TYR HE1 1 1 18 4920 1 1 3 TYR HE2 H 2.754 1.974 6.824 1.00 . A A . 3 TYR HE2 1 1 18 4921 1 1 3 TYR HH H 2.769 4.909 6.838 1.00 . A A . 3 TYR HH 1 1 18 4922 1 1 3 TYR N N -3.445 -0.271 5.045 1.00 . A A . 3 TYR N 1 1 18 4923 1 1 3 TYR O O -0.217 -1.242 4.310 1.00 . A A . 3 TYR O 1 1 18 4924 1 1 3 TYR OH O 2.647 4.460 5.998 1.00 . A A . 3 TYR OH 1 1 18 4925 1 1 4 ALA C C -0.922 -4.156 4.696 1.00 . A A . 4 ALA C 1 1 18 4926 1 1 4 ALA CA C -0.731 -3.386 6.002 1.00 . A A . 4 ALA CA 1 1 18 4927 1 1 4 ALA CB C -1.174 -4.228 7.190 1.00 . A A . 4 ALA CB 1 1 18 4928 1 1 4 ALA H H -2.244 -2.014 6.555 1.00 . A A . 4 ALA H 1 1 18 4929 1 1 4 ALA HA H 0.319 -3.150 6.122 1.00 . A A . 4 ALA HA 1 1 18 4930 1 1 4 ALA HB1 H -0.473 -5.036 7.341 1.00 . A A . 4 ALA HB1 1 1 18 4931 1 1 4 ALA HB2 H -2.156 -4.635 6.997 1.00 . A A . 4 ALA HB2 1 1 18 4932 1 1 4 ALA HB3 H -1.208 -3.611 8.076 1.00 . A A . 4 ALA HB3 1 1 18 4933 1 1 4 ALA N N -1.476 -2.131 5.959 1.00 . A A . 4 ALA N 1 1 18 4934 1 1 4 ALA O O -0.004 -4.828 4.223 1.00 . A A . 4 ALA O 1 1 18 4935 1 1 5 GLN C C -1.627 -4.057 1.707 1.00 . A A . 5 GLN C 1 1 18 4936 1 1 5 GLN CA C -2.429 -4.691 2.844 1.00 . A A . 5 GLN CA 1 1 18 4937 1 1 5 GLN CB C -3.931 -4.595 2.555 1.00 . A A . 5 GLN CB 1 1 18 4938 1 1 5 GLN CD C -4.159 -6.710 1.184 1.00 . A A . 5 GLN CD 1 1 18 4939 1 1 5 GLN CG C -4.342 -5.203 1.224 1.00 . A A . 5 GLN CG 1 1 18 4940 1 1 5 GLN H H -2.804 -3.466 4.524 1.00 . A A . 5 GLN H 1 1 18 4941 1 1 5 GLN HA H -2.150 -5.730 2.933 1.00 . A A . 5 GLN HA 1 1 18 4942 1 1 5 GLN HB2 H -4.469 -5.106 3.339 1.00 . A A . 5 GLN HB2 1 1 18 4943 1 1 5 GLN HB3 H -4.219 -3.555 2.554 1.00 . A A . 5 GLN HB3 1 1 18 4944 1 1 5 GLN HE21 H -2.935 -6.553 -0.379 1.00 . A A . 5 GLN HE21 1 1 18 4945 1 1 5 GLN HE22 H -3.226 -8.158 0.189 1.00 . A A . 5 GLN HE22 1 1 18 4946 1 1 5 GLN HG2 H -5.383 -4.978 1.046 1.00 . A A . 5 GLN HG2 1 1 18 4947 1 1 5 GLN HG3 H -3.741 -4.760 0.445 1.00 . A A . 5 GLN HG3 1 1 18 4948 1 1 5 GLN N N -2.119 -4.031 4.106 1.00 . A A . 5 GLN N 1 1 18 4949 1 1 5 GLN NE2 N -3.359 -7.188 0.236 1.00 . A A . 5 GLN NE2 1 1 18 4950 1 1 5 GLN O O -1.143 -4.755 0.815 1.00 . A A . 5 GLN O 1 1 18 4951 1 1 5 GLN OE1 O -4.729 -7.438 1.998 1.00 . A A . 5 GLN OE1 1 1 18 4952 1 1 6 TRP C C 0.732 -2.461 0.734 1.00 . A A . 6 TRP C 1 1 18 4953 1 1 6 TRP CA C -0.718 -1.989 0.756 1.00 . A A . 6 TRP CA 1 1 18 4954 1 1 6 TRP CB C -0.768 -0.487 1.054 1.00 . A A . 6 TRP CB 1 1 18 4955 1 1 6 TRP CD1 C -0.345 0.638 -1.199 1.00 . A A . 6 TRP CD1 1 1 18 4956 1 1 6 TRP CD2 C 1.270 0.984 0.309 1.00 . A A . 6 TRP CD2 1 1 18 4957 1 1 6 TRP CE2 C 1.615 1.649 -0.880 1.00 . A A . 6 TRP CE2 1 1 18 4958 1 1 6 TRP CE3 C 2.140 1.064 1.401 1.00 . A A . 6 TRP CE3 1 1 18 4959 1 1 6 TRP CG C 0.008 0.342 0.081 1.00 . A A . 6 TRP CG 1 1 18 4960 1 1 6 TRP CH2 C 3.622 2.449 0.069 1.00 . A A . 6 TRP CH2 1 1 18 4961 1 1 6 TRP CZ2 C 2.790 2.383 -1.013 1.00 . A A . 6 TRP CZ2 1 1 18 4962 1 1 6 TRP CZ3 C 3.308 1.797 1.269 1.00 . A A . 6 TRP CZ3 1 1 18 4963 1 1 6 TRP H H -1.878 -2.236 2.508 1.00 . A A . 6 TRP H 1 1 18 4964 1 1 6 TRP HA H -1.165 -2.176 -0.209 1.00 . A A . 6 TRP HA 1 1 18 4965 1 1 6 TRP HB2 H -1.793 -0.157 1.028 1.00 . A A . 6 TRP HB2 1 1 18 4966 1 1 6 TRP HB3 H -0.365 -0.309 2.037 1.00 . A A . 6 TRP HB3 1 1 18 4967 1 1 6 TRP HD1 H -1.252 0.297 -1.673 1.00 . A A . 6 TRP HD1 1 1 18 4968 1 1 6 TRP HE1 H 0.588 1.757 -2.700 1.00 . A A . 6 TRP HE1 1 1 18 4969 1 1 6 TRP HE3 H 1.915 0.564 2.333 1.00 . A A . 6 TRP HE3 1 1 18 4970 1 1 6 TRP HH2 H 4.540 3.018 0.010 1.00 . A A . 6 TRP HH2 1 1 18 4971 1 1 6 TRP HZ2 H 3.049 2.887 -1.932 1.00 . A A . 6 TRP HZ2 1 1 18 4972 1 1 6 TRP HZ3 H 3.994 1.870 2.101 1.00 . A A . 6 TRP HZ3 1 1 18 4973 1 1 6 TRP N N -1.477 -2.729 1.761 1.00 . A A . 6 TRP N 1 1 18 4974 1 1 6 TRP NE1 N 0.616 1.417 -1.784 1.00 . A A . 6 TRP NE1 1 1 18 4975 1 1 6 TRP O O 1.284 -2.757 -0.326 1.00 . A A . 6 TRP O 1 1 18 4976 1 1 7 LEU C C 2.863 -4.441 1.632 1.00 . A A . 7 LEU C 1 1 18 4977 1 1 7 LEU CA C 2.715 -2.981 2.064 1.00 . A A . 7 LEU CA 1 1 18 4978 1 1 7 LEU CB C 3.173 -2.805 3.515 1.00 . A A . 7 LEU CB 1 1 18 4979 1 1 7 LEU CD1 C 3.211 -1.323 5.542 1.00 . A A . 7 LEU CD1 1 1 18 4980 1 1 7 LEU CD2 C 4.338 -0.578 3.434 1.00 . A A . 7 LEU CD2 1 1 18 4981 1 1 7 LEU CG C 3.169 -1.358 4.022 1.00 . A A . 7 LEU CG 1 1 18 4982 1 1 7 LEU H H 0.826 -2.290 2.725 1.00 . A A . 7 LEU H 1 1 18 4983 1 1 7 LEU HA H 3.328 -2.366 1.425 1.00 . A A . 7 LEU HA 1 1 18 4984 1 1 7 LEU HB2 H 2.521 -3.389 4.148 1.00 . A A . 7 LEU HB2 1 1 18 4985 1 1 7 LEU HB3 H 4.175 -3.193 3.605 1.00 . A A . 7 LEU HB3 1 1 18 4986 1 1 7 LEU HD11 H 2.524 -2.056 5.939 1.00 . A A . 7 LEU HD11 1 1 18 4987 1 1 7 LEU HD12 H 2.927 -0.340 5.887 1.00 . A A . 7 LEU HD12 1 1 18 4988 1 1 7 LEU HD13 H 4.212 -1.547 5.881 1.00 . A A . 7 LEU HD13 1 1 18 4989 1 1 7 LEU HD21 H 5.250 -1.139 3.568 1.00 . A A . 7 LEU HD21 1 1 18 4990 1 1 7 LEU HD22 H 4.423 0.374 3.937 1.00 . A A . 7 LEU HD22 1 1 18 4991 1 1 7 LEU HD23 H 4.168 -0.413 2.380 1.00 . A A . 7 LEU HD23 1 1 18 4992 1 1 7 LEU HG H 2.254 -0.878 3.706 1.00 . A A . 7 LEU HG 1 1 18 4993 1 1 7 LEU N N 1.332 -2.536 1.921 1.00 . A A . 7 LEU N 1 1 18 4994 1 1 7 LEU O O 3.873 -4.820 1.037 1.00 . A A . 7 LEU O 1 1 18 4995 1 1 8 ALA C C 1.606 -6.858 0.051 1.00 . A A . 8 ALA C 1 1 18 4996 1 1 8 ALA CA C 1.842 -6.665 1.554 1.00 . A A . 8 ALA CA 1 1 18 4997 1 1 8 ALA CB C 0.791 -7.421 2.354 1.00 . A A . 8 ALA CB 1 1 18 4998 1 1 8 ALA H H 1.060 -4.883 2.390 1.00 . A A . 8 ALA H 1 1 18 4999 1 1 8 ALA HA H 2.811 -7.071 1.808 1.00 . A A . 8 ALA HA 1 1 18 5000 1 1 8 ALA HB1 H 0.982 -8.482 2.288 1.00 . A A . 8 ALA HB1 1 1 18 5001 1 1 8 ALA HB2 H -0.189 -7.206 1.954 1.00 . A A . 8 ALA HB2 1 1 18 5002 1 1 8 ALA HB3 H 0.834 -7.111 3.388 1.00 . A A . 8 ALA HB3 1 1 18 5003 1 1 8 ALA N N 1.840 -5.250 1.923 1.00 . A A . 8 ALA N 1 1 18 5004 1 1 8 ALA O O 1.934 -7.909 -0.501 1.00 . A A . 8 ALA O 1 1 18 5005 1 1 9 ASP C C 1.978 -5.432 -2.870 1.00 . A A . 9 ASP C 1 1 18 5006 1 1 9 ASP CA C 0.770 -5.898 -2.046 1.00 . A A . 9 ASP CA 1 1 18 5007 1 1 9 ASP CB C -0.456 -5.043 -2.393 1.00 . A A . 9 ASP CB 1 1 18 5008 1 1 9 ASP CG C -1.469 -5.798 -3.230 1.00 . A A . 9 ASP CG 1 1 18 5009 1 1 9 ASP H H 0.806 -5.023 -0.116 1.00 . A A . 9 ASP H 1 1 18 5010 1 1 9 ASP HA H 0.559 -6.927 -2.297 1.00 . A A . 9 ASP HA 1 1 18 5011 1 1 9 ASP HB2 H -0.938 -4.726 -1.480 1.00 . A A . 9 ASP HB2 1 1 18 5012 1 1 9 ASP HB3 H -0.137 -4.172 -2.947 1.00 . A A . 9 ASP HB3 1 1 18 5013 1 1 9 ASP N N 1.041 -5.837 -0.608 1.00 . A A . 9 ASP N 1 1 18 5014 1 1 9 ASP O O 1.845 -5.128 -4.058 1.00 . A A . 9 ASP O 1 1 18 5015 1 1 9 ASP OD1 O -1.335 -5.793 -4.472 1.00 . A A . 9 ASP OD1 1 1 18 5016 1 1 9 ASP OD2 O -2.398 -6.394 -2.645 1.00 . A A . 9 ASP OD2 1 1 18 5017 1 1 10 DAL C C 4.746 -3.505 -2.559 1.00 . A A . 10 DAL C 1 1 18 5018 1 1 10 DAL CA C 4.376 -4.949 -2.913 1.00 . A A . 10 DAL CA 1 1 18 5019 1 1 10 DAL CB C 5.518 -5.882 -2.550 1.00 . A A . 10 DAL CB 1 1 18 5020 1 1 10 DAL H H 3.204 -5.629 -1.293 1.00 . A A . 10 DAL H 1 1 18 5021 1 1 10 DAL HA H 4.213 -5.019 -3.978 1.00 . A A . 10 DAL HA 1 1 18 5022 1 1 10 DAL HB1 H 5.233 -6.901 -2.763 1.00 . A A . 10 DAL HB1 1 1 18 5023 1 1 10 DAL HB2 H 5.738 -5.782 -1.497 1.00 . A A . 10 DAL HB2 1 1 18 5024 1 1 10 DAL HB3 H 6.393 -5.622 -3.127 1.00 . A A . 10 DAL HB3 1 1 18 5025 1 1 10 DAL N N 3.155 -5.377 -2.238 1.00 . A A . 10 DAL N 1 1 18 5026 1 1 10 DAL O O 5.783 -3.003 -3.000 1.00 . A A . 10 DAL O 1 1 18 5027 1 1 11 GLY C C 4.075 -0.507 -2.535 1.00 . A A . 11 GLY C 1 1 18 5028 1 1 11 GLY CA C 4.161 -1.469 -1.370 1.00 . A A . 11 GLY CA 1 1 18 5029 1 1 11 GLY H H 3.091 -3.291 -1.444 1.00 . A A . 11 GLY H 1 1 18 5030 1 1 11 GLY HA2 H 3.439 -1.176 -0.622 1.00 . A A . 11 GLY HA2 1 1 18 5031 1 1 11 GLY HA3 H 5.151 -1.410 -0.943 1.00 . A A . 11 GLY HA3 1 1 18 5032 1 1 11 GLY N N 3.899 -2.843 -1.765 1.00 . A A . 11 GLY N 1 1 18 5033 1 1 11 GLY O O 2.986 -0.064 -2.901 1.00 . A A . 11 GLY O 1 1 18 5034 1 1 12 TRP C C 5.325 -0.006 -5.591 1.00 . A A . 12 TRP C 1 1 18 5035 1 1 12 TRP CA C 5.278 0.733 -4.251 1.00 . A A . 12 TRP CA 1 1 18 5036 1 1 12 TRP CB C 6.469 1.678 -4.098 1.00 . A A . 12 TRP CB 1 1 18 5037 1 1 12 TRP CD1 C 6.690 3.056 -1.956 1.00 . A A . 12 TRP CD1 1 1 18 5038 1 1 12 TRP CD2 C 5.181 3.846 -3.412 1.00 . A A . 12 TRP CD2 1 1 18 5039 1 1 12 TRP CE2 C 5.189 4.675 -2.277 1.00 . A A . 12 TRP CE2 1 1 18 5040 1 1 12 TRP CE3 C 4.309 4.152 -4.465 1.00 . A A . 12 TRP CE3 1 1 18 5041 1 1 12 TRP CG C 6.149 2.814 -3.185 1.00 . A A . 12 TRP CG 1 1 18 5042 1 1 12 TRP CH2 C 3.518 6.059 -3.202 1.00 . A A . 12 TRP CH2 1 1 18 5043 1 1 12 TRP CZ2 C 4.360 5.781 -2.160 1.00 . A A . 12 TRP CZ2 1 1 18 5044 1 1 12 TRP CZ3 C 3.489 5.257 -4.349 1.00 . A A . 12 TRP CZ3 1 1 18 5045 1 1 12 TRP H H 6.060 -0.574 -2.782 1.00 . A A . 12 TRP H 1 1 18 5046 1 1 12 TRP HA H 4.372 1.322 -4.224 1.00 . A A . 12 TRP HA 1 1 18 5047 1 1 12 TRP HB2 H 7.305 1.134 -3.682 1.00 . A A . 12 TRP HB2 1 1 18 5048 1 1 12 TRP HB3 H 6.745 2.079 -5.062 1.00 . A A . 12 TRP HB3 1 1 18 5049 1 1 12 TRP HD1 H 7.455 2.448 -1.497 1.00 . A A . 12 TRP HD1 1 1 18 5050 1 1 12 TRP HE1 H 6.339 4.553 -0.526 1.00 . A A . 12 TRP HE1 1 1 18 5051 1 1 12 TRP HE3 H 4.269 3.546 -5.358 1.00 . A A . 12 TRP HE3 1 1 18 5052 1 1 12 TRP HH2 H 2.860 6.914 -3.153 1.00 . A A . 12 TRP HH2 1 1 18 5053 1 1 12 TRP HZ2 H 4.363 6.398 -1.278 1.00 . A A . 12 TRP HZ2 1 1 18 5054 1 1 12 TRP HZ3 H 2.814 5.511 -5.154 1.00 . A A . 12 TRP HZ3 1 1 18 5055 1 1 12 TRP N N 5.226 -0.185 -3.119 1.00 . A A . 12 TRP N 1 1 18 5056 1 1 12 TRP NE1 N 6.117 4.174 -1.403 1.00 . A A . 12 TRP NE1 1 1 18 5057 1 1 12 TRP O O 5.504 0.615 -6.640 1.00 . A A . 12 TRP O 1 1 18 5058 1 1 13 ALA C C 3.724 -2.087 -7.410 1.00 . A A . 13 ALA C 1 1 18 5059 1 1 13 ALA CA C 5.109 -2.132 -6.772 1.00 . A A . 13 ALA CA 1 1 18 5060 1 1 13 ALA CB C 5.520 -3.566 -6.478 1.00 . A A . 13 ALA CB 1 1 18 5061 1 1 13 ALA H H 4.960 -1.767 -4.697 1.00 . A A . 13 ALA H 1 1 18 5062 1 1 13 ALA HA H 5.823 -1.710 -7.461 1.00 . A A . 13 ALA HA 1 1 18 5063 1 1 13 ALA HB1 H 6.339 -3.842 -7.124 1.00 . A A . 13 ALA HB1 1 1 18 5064 1 1 13 ALA HB2 H 4.683 -4.225 -6.655 1.00 . A A . 13 ALA HB2 1 1 18 5065 1 1 13 ALA HB3 H 5.830 -3.648 -5.447 1.00 . A A . 13 ALA HB3 1 1 18 5066 1 1 13 ALA N N 5.125 -1.328 -5.556 1.00 . A A . 13 ALA N 1 1 18 5067 1 1 13 ALA O O 3.589 -2.150 -8.634 1.00 . A A . 13 ALA O 1 1 18 5068 1 1 14 SER C C 1.106 -0.617 -7.879 1.00 . A A . 14 SER C 1 1 18 5069 1 1 14 SER CA C 1.316 -1.872 -7.027 1.00 . A A . 14 SER CA 1 1 18 5070 1 1 14 SER CB C 0.351 -1.872 -5.830 1.00 . A A . 14 SER CB 1 1 18 5071 1 1 14 SER H H 2.878 -1.895 -5.603 1.00 . A A . 14 SER H 1 1 18 5072 1 1 14 SER HA H 1.119 -2.738 -7.637 1.00 . A A . 14 SER HA 1 1 18 5073 1 1 14 SER HB2 H -0.563 -1.370 -6.107 1.00 . A A . 14 SER HB2 1 1 18 5074 1 1 14 SER HB3 H 0.129 -2.892 -5.550 1.00 . A A . 14 SER HB3 1 1 18 5075 1 1 14 SER HG H 1.251 -1.853 -4.082 1.00 . A A . 14 SER HG 1 1 18 5076 1 1 14 SER N N 2.698 -1.954 -6.565 1.00 . A A . 14 SER N 1 1 18 5077 1 1 14 SER O O 0.263 -0.603 -8.776 1.00 . A A . 14 SER O 1 1 18 5078 1 1 14 SER OG O 0.914 -1.205 -4.709 1.00 . A A . 14 SER OG 1 1 18 5079 1 1 15 DAL C C 0.968 2.735 -7.575 1.00 . A A . 15 DAL C 1 1 18 5080 1 1 15 DAL CA C 1.791 1.691 -8.335 1.00 . A A . 15 DAL CA 1 1 18 5081 1 1 15 DAL CB C 3.182 2.226 -8.634 1.00 . A A . 15 DAL CB 1 1 18 5082 1 1 15 DAL H H 2.541 0.360 -6.868 1.00 . A A . 15 DAL H 1 1 18 5083 1 1 15 DAL HA H 1.306 1.486 -9.277 1.00 . A A . 15 DAL HA 1 1 18 5084 1 1 15 DAL HB1 H 3.258 2.453 -9.686 1.00 . A A . 15 DAL HB1 1 1 18 5085 1 1 15 DAL HB2 H 3.918 1.480 -8.373 1.00 . A A . 15 DAL HB2 1 1 18 5086 1 1 15 DAL HB3 H 3.356 3.122 -8.058 1.00 . A A . 15 DAL HB3 1 1 18 5087 1 1 15 DAL N N 1.885 0.434 -7.594 1.00 . A A . 15 DAL N 1 1 18 5088 1 1 15 DAL O O 1.125 3.939 -7.787 1.00 . A A . 15 DAL O 1 1 18 5089 1 1 16 ARG C C -0.040 3.592 -4.622 1.00 . A A . 16 ARG C 1 1 18 5090 1 1 16 ARG CA C -0.761 3.146 -5.896 1.00 . A A . 16 ARG CA 1 1 18 5091 1 1 16 ARG CB C -2.071 2.420 -5.531 1.00 . A A . 16 ARG CB 1 1 18 5092 1 1 16 ARG CD C -2.847 0.241 -4.536 1.00 . A A . 16 ARG CD 1 1 18 5093 1 1 16 ARG CG C -1.923 1.439 -4.374 1.00 . A A . 16 ARG CG 1 1 18 5094 1 1 16 ARG CZ C -3.518 -0.349 -2.227 1.00 . A A . 16 ARG CZ 1 1 18 5095 1 1 16 ARG H H 0.012 1.293 -6.569 1.00 . A A . 16 ARG H 1 1 18 5096 1 1 16 ARG HA H -0.985 4.022 -6.492 1.00 . A A . 16 ARG HA 1 1 18 5097 1 1 16 ARG HB2 H -2.812 3.156 -5.256 1.00 . A A . 16 ARG HB2 1 1 18 5098 1 1 16 ARG HB3 H -2.429 1.866 -6.394 1.00 . A A . 16 ARG HB3 1 1 18 5099 1 1 16 ARG HD2 H -3.851 0.597 -4.713 1.00 . A A . 16 ARG HD2 1 1 18 5100 1 1 16 ARG HD3 H -2.517 -0.336 -5.386 1.00 . A A . 16 ARG HD3 1 1 18 5101 1 1 16 ARG HE H -2.331 -1.450 -3.401 1.00 . A A . 16 ARG HE 1 1 18 5102 1 1 16 ARG HG2 H -0.901 1.090 -4.340 1.00 . A A . 16 ARG HG2 1 1 18 5103 1 1 16 ARG HG3 H -2.163 1.947 -3.451 1.00 . A A . 16 ARG HG3 1 1 18 5104 1 1 16 ARG HH11 H -4.282 1.412 -2.880 1.00 . A A . 16 ARG HH11 1 1 18 5105 1 1 16 ARG HH12 H -4.731 0.961 -1.270 1.00 . A A . 16 ARG HH12 1 1 18 5106 1 1 16 ARG HH21 H -2.930 -2.038 -1.279 1.00 . A A . 16 ARG HH21 1 1 18 5107 1 1 16 ARG HH22 H -3.964 -0.995 -0.361 1.00 . A A . 16 ARG HH22 1 1 18 5108 1 1 16 ARG N N 0.090 2.263 -6.691 1.00 . A A . 16 ARG N 1 1 18 5109 1 1 16 ARG NE N -2.851 -0.621 -3.353 1.00 . A A . 16 ARG NE 1 1 18 5110 1 1 16 ARG NH1 N -4.236 0.767 -2.118 1.00 . A A . 16 ARG NH1 1 1 18 5111 1 1 16 ARG NH2 N -3.467 -1.198 -1.205 1.00 . A A . 16 ARG NH2 1 1 18 5112 1 1 16 ARG O O 0.842 2.889 -4.127 1.00 . A A . 16 ARG O 1 1 18 5113 1 1 17 PRO C C -0.421 4.712 -1.576 1.00 . A A . 17 PRO C 1 1 18 5114 1 1 17 PRO CA C 0.207 5.292 -2.845 1.00 . A A . 17 PRO CA 1 1 18 5115 1 1 17 PRO CB C -0.056 6.803 -2.922 1.00 . A A . 17 PRO CB 1 1 18 5116 1 1 17 PRO CD C -1.425 5.683 -4.574 1.00 . A A . 17 PRO CD 1 1 18 5117 1 1 17 PRO CG C -0.908 7.028 -4.136 1.00 . A A . 17 PRO CG 1 1 18 5118 1 1 17 PRO HA H 1.269 5.111 -2.825 1.00 . A A . 17 PRO HA 1 1 18 5119 1 1 17 PRO HB2 H -0.566 7.122 -2.024 1.00 . A A . 17 PRO HB2 1 1 18 5120 1 1 17 PRO HB3 H 0.889 7.323 -3.003 1.00 . A A . 17 PRO HB3 1 1 18 5121 1 1 17 PRO HD2 H -2.385 5.478 -4.127 1.00 . A A . 17 PRO HD2 1 1 18 5122 1 1 17 PRO HD3 H -1.489 5.639 -5.649 1.00 . A A . 17 PRO HD3 1 1 18 5123 1 1 17 PRO HG2 H -1.733 7.678 -3.886 1.00 . A A . 17 PRO HG2 1 1 18 5124 1 1 17 PRO HG3 H -0.312 7.471 -4.921 1.00 . A A . 17 PRO HG3 1 1 18 5125 1 1 17 PRO N N -0.403 4.767 -4.067 1.00 . A A . 17 PRO N 1 1 18 5126 1 1 17 PRO O O -1.484 4.090 -1.623 1.00 . A A . 17 PRO O 1 1 18 5127 1 1 18 PRO C C -1.564 5.024 1.307 1.00 . A A . 18 PRO C 1 1 18 5128 1 1 18 PRO CA C -0.235 4.405 0.874 1.00 . A A . 18 PRO CA 1 1 18 5129 1 1 18 PRO CB C 0.859 4.819 1.862 1.00 . A A . 18 PRO CB 1 1 18 5130 1 1 18 PRO CD C 1.523 5.630 -0.294 1.00 . A A . 18 PRO CD 1 1 18 5131 1 1 18 PRO CG C 1.635 5.893 1.179 1.00 . A A . 18 PRO CG 1 1 18 5132 1 1 18 PRO HA H -0.325 3.328 0.865 1.00 . A A . 18 PRO HA 1 1 18 5133 1 1 18 PRO HB2 H 0.400 5.188 2.764 1.00 . A A . 18 PRO HB2 1 1 18 5134 1 1 18 PRO HB3 H 1.477 3.971 2.095 1.00 . A A . 18 PRO HB3 1 1 18 5135 1 1 18 PRO HD2 H 1.496 6.561 -0.840 1.00 . A A . 18 PRO HD2 1 1 18 5136 1 1 18 PRO HD3 H 2.345 5.018 -0.631 1.00 . A A . 18 PRO HD3 1 1 18 5137 1 1 18 PRO HG2 H 1.213 6.857 1.419 1.00 . A A . 18 PRO HG2 1 1 18 5138 1 1 18 PRO HG3 H 2.669 5.849 1.489 1.00 . A A . 18 PRO HG3 1 1 18 5139 1 1 18 PRO N N 0.244 4.909 -0.421 1.00 . A A . 18 PRO N 1 1 18 5140 1 1 18 PRO O O -1.831 6.197 1.040 1.00 . A A . 18 PRO O 1 1 18 5141 1 1 19 PRO C C -3.584 5.500 3.787 1.00 . A A . 19 PRO C 1 1 18 5142 1 1 19 PRO CA C -3.702 4.703 2.489 1.00 . A A . 19 PRO CA 1 1 18 5143 1 1 19 PRO CB C -4.483 3.411 2.718 1.00 . A A . 19 PRO CB 1 1 18 5144 1 1 19 PRO CD C -2.157 2.834 2.363 1.00 . A A . 19 PRO CD 1 1 18 5145 1 1 19 PRO CG C -3.475 2.328 2.893 1.00 . A A . 19 PRO CG 1 1 18 5146 1 1 19 PRO HA H -4.208 5.303 1.748 1.00 . A A . 19 PRO HA 1 1 18 5147 1 1 19 PRO HB2 H -5.104 3.512 3.594 1.00 . A A . 19 PRO HB2 1 1 18 5148 1 1 19 PRO HB3 H -5.094 3.220 1.866 1.00 . A A . 19 PRO HB3 1 1 18 5149 1 1 19 PRO HD2 H -1.392 2.770 3.121 1.00 . A A . 19 PRO HD2 1 1 18 5150 1 1 19 PRO HD3 H -1.873 2.264 1.493 1.00 . A A . 19 PRO HD3 1 1 18 5151 1 1 19 PRO HG2 H -3.393 2.075 3.934 1.00 . A A . 19 PRO HG2 1 1 18 5152 1 1 19 PRO HG3 H -3.787 1.459 2.331 1.00 . A A . 19 PRO HG3 1 1 18 5153 1 1 19 PRO N N -2.410 4.237 2.000 1.00 . A A . 19 PRO N 1 1 18 5154 1 1 19 PRO O O -2.659 5.291 4.574 1.00 . A A . 19 PRO O 1 1 18 5155 1 1 20 SER C C -5.853 7.106 5.963 1.00 . A A . 20 SER C 1 1 18 5156 1 1 20 SER CA C -4.536 7.251 5.202 1.00 . A A . 20 SER CA 1 1 18 5157 1 1 20 SER CB C -4.303 8.718 4.833 1.00 . A A . 20 SER CB 1 1 18 5158 1 1 20 SER H H -5.238 6.537 3.336 1.00 . A A . 20 SER H 1 1 18 5159 1 1 20 SER HA H -3.729 6.919 5.840 1.00 . A A . 20 SER HA 1 1 18 5160 1 1 20 SER HB2 H -3.530 8.780 4.082 1.00 . A A . 20 SER HB2 1 1 18 5161 1 1 20 SER HB3 H -5.218 9.138 4.442 1.00 . A A . 20 SER HB3 1 1 18 5162 1 1 20 SER HG H -3.045 9.871 5.797 1.00 . A A . 20 SER HG 1 1 18 5163 1 1 20 SER N N -4.528 6.417 4.002 1.00 . A A . 20 SER N 1 1 18 5164 1 1 20 SER O O -6.922 7.298 5.343 1.00 . A A . 20 SER O 1 1 18 5165 1 1 20 SER OXT O -5.804 6.803 7.173 1.00 . A A . 20 SER OXT 1 1 18 5166 1 1 20 SER OG O -3.901 9.472 5.964 1.00 . A A . 20 SER OG 1 1 19 5167 1 1 1 ASP C C -6.345 -3.396 4.529 1.00 . A A . 1 ASP C 1 1 19 5168 1 1 1 ASP CA C -6.505 -4.505 5.570 1.00 . A A . 1 ASP CA 1 1 19 5169 1 1 1 ASP CB C -6.353 -5.882 4.913 1.00 . A A . 1 ASP CB 1 1 19 5170 1 1 1 ASP CG C -5.311 -6.742 5.604 1.00 . A A . 1 ASP CG 1 1 19 5171 1 1 1 ASP H1 H -7.925 -3.495 6.667 1.00 . A A . 1 ASP H1 1 1 19 5172 1 1 1 ASP H2 H -7.873 -5.187 6.950 1.00 . A A . 1 ASP H2 1 1 19 5173 1 1 1 ASP H3 H -8.563 -4.578 5.501 1.00 . A A . 1 ASP H3 1 1 19 5174 1 1 1 ASP HA H -5.743 -4.387 6.326 1.00 . A A . 1 ASP HA 1 1 19 5175 1 1 1 ASP HB2 H -7.300 -6.399 4.950 1.00 . A A . 1 ASP HB2 1 1 19 5176 1 1 1 ASP HB3 H -6.060 -5.753 3.881 1.00 . A A . 1 ASP HB3 1 1 19 5177 1 1 1 ASP N N -7.836 -4.435 6.231 1.00 . A A . 1 ASP N 1 1 19 5178 1 1 1 ASP O O -6.874 -3.490 3.419 1.00 . A A . 1 ASP O 1 1 19 5179 1 1 1 ASP OD1 O -4.106 -6.551 5.333 1.00 . A A . 1 ASP OD1 1 1 19 5180 1 1 1 ASP OD2 O -5.699 -7.606 6.418 1.00 . A A . 1 ASP OD2 1 1 19 5181 1 1 2 ALA C C -3.894 -0.853 3.961 1.00 . A A . 2 ALA C 1 1 19 5182 1 1 2 ALA CA C -5.377 -1.213 4.007 1.00 . A A . 2 ALA CA 1 1 19 5183 1 1 2 ALA CB C -6.204 -0.015 4.447 1.00 . A A . 2 ALA CB 1 1 19 5184 1 1 2 ALA H H -5.219 -2.332 5.798 1.00 . A A . 2 ALA H 1 1 19 5185 1 1 2 ALA HA H -5.697 -1.498 3.015 1.00 . A A . 2 ALA HA 1 1 19 5186 1 1 2 ALA HB1 H -7.249 -0.212 4.263 1.00 . A A . 2 ALA HB1 1 1 19 5187 1 1 2 ALA HB2 H -5.898 0.858 3.889 1.00 . A A . 2 ALA HB2 1 1 19 5188 1 1 2 ALA HB3 H -6.050 0.160 5.501 1.00 . A A . 2 ALA HB3 1 1 19 5189 1 1 2 ALA N N -5.612 -2.346 4.900 1.00 . A A . 2 ALA N 1 1 19 5190 1 1 2 ALA O O -3.235 -1.050 2.941 1.00 . A A . 2 ALA O 1 1 19 5191 1 1 3 TYR C C -1.071 -1.188 5.128 1.00 . A A . 3 TYR C 1 1 19 5192 1 1 3 TYR CA C -1.964 0.050 5.160 1.00 . A A . 3 TYR CA 1 1 19 5193 1 1 3 TYR CB C -1.702 0.874 6.424 1.00 . A A . 3 TYR CB 1 1 19 5194 1 1 3 TYR CD1 C -0.727 3.141 5.847 1.00 . A A . 3 TYR CD1 1 1 19 5195 1 1 3 TYR CD2 C 0.747 1.444 6.650 1.00 . A A . 3 TYR CD2 1 1 19 5196 1 1 3 TYR CE1 C 0.335 4.019 5.749 1.00 . A A . 3 TYR CE1 1 1 19 5197 1 1 3 TYR CE2 C 1.812 2.317 6.551 1.00 . A A . 3 TYR CE2 1 1 19 5198 1 1 3 TYR CG C -0.539 1.836 6.299 1.00 . A A . 3 TYR CG 1 1 19 5199 1 1 3 TYR CZ C 1.601 3.603 6.101 1.00 . A A . 3 TYR CZ 1 1 19 5200 1 1 3 TYR H H -3.955 -0.201 5.856 1.00 . A A . 3 TYR H 1 1 19 5201 1 1 3 TYR HA H -1.736 0.652 4.298 1.00 . A A . 3 TYR HA 1 1 19 5202 1 1 3 TYR HB2 H -2.583 1.453 6.658 1.00 . A A . 3 TYR HB2 1 1 19 5203 1 1 3 TYR HB3 H -1.491 0.204 7.245 1.00 . A A . 3 TYR HB3 1 1 19 5204 1 1 3 TYR HD1 H -1.720 3.467 5.560 1.00 . A A . 3 TYR HD1 1 1 19 5205 1 1 3 TYR HD2 H 0.910 0.436 7.002 1.00 . A A . 3 TYR HD2 1 1 19 5206 1 1 3 TYR HE1 H 0.169 5.027 5.404 1.00 . A A . 3 TYR HE1 1 1 19 5207 1 1 3 TYR HE2 H 2.805 1.992 6.826 1.00 . A A . 3 TYR HE2 1 1 19 5208 1 1 3 TYR HH H 2.747 4.968 6.824 1.00 . A A . 3 TYR HH 1 1 19 5209 1 1 3 TYR N N -3.375 -0.330 5.075 1.00 . A A . 3 TYR N 1 1 19 5210 1 1 3 TYR O O -0.149 -1.271 4.314 1.00 . A A . 3 TYR O 1 1 19 5211 1 1 3 TYR OH O 2.660 4.476 6.004 1.00 . A A . 3 TYR OH 1 1 19 5212 1 1 4 ALA C C -0.796 -4.178 4.726 1.00 . A A . 4 ALA C 1 1 19 5213 1 1 4 ALA CA C -0.605 -3.407 6.031 1.00 . A A . 4 ALA CA 1 1 19 5214 1 1 4 ALA CB C -1.030 -4.256 7.220 1.00 . A A . 4 ALA CB 1 1 19 5215 1 1 4 ALA H H -2.125 -2.050 6.602 1.00 . A A . 4 ALA H 1 1 19 5216 1 1 4 ALA HA H 0.442 -3.158 6.143 1.00 . A A . 4 ALA HA 1 1 19 5217 1 1 4 ALA HB1 H -0.816 -3.725 8.136 1.00 . A A . 4 ALA HB1 1 1 19 5218 1 1 4 ALA HB2 H -0.486 -5.189 7.209 1.00 . A A . 4 ALA HB2 1 1 19 5219 1 1 4 ALA HB3 H -2.089 -4.456 7.159 1.00 . A A . 4 ALA HB3 1 1 19 5220 1 1 4 ALA N N -1.367 -2.162 5.993 1.00 . A A . 4 ALA N 1 1 19 5221 1 1 4 ALA O O 0.127 -4.838 4.245 1.00 . A A . 4 ALA O 1 1 19 5222 1 1 5 GLN C C -1.520 -4.087 1.743 1.00 . A A . 5 GLN C 1 1 19 5223 1 1 5 GLN CA C -2.310 -4.727 2.884 1.00 . A A . 5 GLN CA 1 1 19 5224 1 1 5 GLN CB C -3.813 -4.641 2.603 1.00 . A A . 5 GLN CB 1 1 19 5225 1 1 5 GLN CD C -4.292 -6.836 1.428 1.00 . A A . 5 GLN CD 1 1 19 5226 1 1 5 GLN CG C -4.233 -5.322 1.311 1.00 . A A . 5 GLN CG 1 1 19 5227 1 1 5 GLN H H -2.685 -3.510 4.568 1.00 . A A . 5 GLN H 1 1 19 5228 1 1 5 GLN HA H -2.024 -5.765 2.970 1.00 . A A . 5 GLN HA 1 1 19 5229 1 1 5 GLN HB2 H -4.347 -5.105 3.418 1.00 . A A . 5 GLN HB2 1 1 19 5230 1 1 5 GLN HB3 H -4.098 -3.601 2.545 1.00 . A A . 5 GLN HB3 1 1 19 5231 1 1 5 GLN HE21 H -5.232 -6.960 -0.322 1.00 . A A . 5 GLN HE21 1 1 19 5232 1 1 5 GLN HE22 H -4.928 -8.461 0.476 1.00 . A A . 5 GLN HE22 1 1 19 5233 1 1 5 GLN HG2 H -5.211 -4.961 1.032 1.00 . A A . 5 GLN HG2 1 1 19 5234 1 1 5 GLN HG3 H -3.523 -5.062 0.542 1.00 . A A . 5 GLN HG3 1 1 19 5235 1 1 5 GLN N N -1.997 -4.066 4.145 1.00 . A A . 5 GLN N 1 1 19 5236 1 1 5 GLN NE2 N -4.876 -7.484 0.426 1.00 . A A . 5 GLN NE2 1 1 19 5237 1 1 5 GLN O O -1.037 -4.780 0.848 1.00 . A A . 5 GLN O 1 1 19 5238 1 1 5 GLN OE1 O -3.817 -7.418 2.405 1.00 . A A . 5 GLN OE1 1 1 19 5239 1 1 6 TRP C C 0.816 -2.471 0.751 1.00 . A A . 6 TRP C 1 1 19 5240 1 1 6 TRP CA C -0.637 -2.012 0.783 1.00 . A A . 6 TRP CA 1 1 19 5241 1 1 6 TRP CB C -0.700 -0.511 1.080 1.00 . A A . 6 TRP CB 1 1 19 5242 1 1 6 TRP CD1 C -0.301 0.621 -1.176 1.00 . A A . 6 TRP CD1 1 1 19 5243 1 1 6 TRP CD2 C 1.324 0.973 0.321 1.00 . A A . 6 TRP CD2 1 1 19 5244 1 1 6 TRP CE2 C 1.658 1.641 -0.870 1.00 . A A . 6 TRP CE2 1 1 19 5245 1 1 6 TRP CE3 C 2.200 1.055 1.406 1.00 . A A . 6 TRP CE3 1 1 19 5246 1 1 6 TRP CG C 0.064 0.325 0.102 1.00 . A A . 6 TRP CG 1 1 19 5247 1 1 6 TRP CH2 C 3.667 2.448 0.065 1.00 . A A . 6 TRP CH2 1 1 19 5248 1 1 6 TRP CZ2 C 2.828 2.380 -1.010 1.00 . A A . 6 TRP CZ2 1 1 19 5249 1 1 6 TRP CZ3 C 3.363 1.794 1.268 1.00 . A A . 6 TRP CZ3 1 1 19 5250 1 1 6 TRP H H -1.785 -2.267 2.543 1.00 . A A . 6 TRP H 1 1 19 5251 1 1 6 TRP HA H -1.089 -2.204 -0.177 1.00 . A A . 6 TRP HA 1 1 19 5252 1 1 6 TRP HB2 H -1.728 -0.191 1.060 1.00 . A A . 6 TRP HB2 1 1 19 5253 1 1 6 TRP HB3 H -0.292 -0.328 2.061 1.00 . A A . 6 TRP HB3 1 1 19 5254 1 1 6 TRP HD1 H -1.209 0.278 -1.644 1.00 . A A . 6 TRP HD1 1 1 19 5255 1 1 6 TRP HE1 H 0.617 1.747 -2.682 1.00 . A A . 6 TRP HE1 1 1 19 5256 1 1 6 TRP HE3 H 1.983 0.554 2.340 1.00 . A A . 6 TRP HE3 1 1 19 5257 1 1 6 TRP HH2 H 4.582 3.021 0.001 1.00 . A A . 6 TRP HH2 1 1 19 5258 1 1 6 TRP HZ2 H 3.078 2.885 -1.932 1.00 . A A . 6 TRP HZ2 1 1 19 5259 1 1 6 TRP HZ3 H 4.054 1.870 2.095 1.00 . A A . 6 TRP HZ3 1 1 19 5260 1 1 6 TRP N N -1.383 -2.758 1.795 1.00 . A A . 6 TRP N 1 1 19 5261 1 1 6 TRP NE1 N 0.653 1.406 -1.767 1.00 . A A . 6 TRP NE1 1 1 19 5262 1 1 6 TRP O O 1.364 -2.761 -0.314 1.00 . A A . 6 TRP O 1 1 19 5263 1 1 7 LEU C C 2.967 -4.433 1.633 1.00 . A A . 7 LEU C 1 1 19 5264 1 1 7 LEU CA C 2.811 -2.975 2.067 1.00 . A A . 7 LEU CA 1 1 19 5265 1 1 7 LEU CB C 3.277 -2.796 3.515 1.00 . A A . 7 LEU CB 1 1 19 5266 1 1 7 LEU CD1 C 3.296 -1.323 5.549 1.00 . A A . 7 LEU CD1 1 1 19 5267 1 1 7 LEU CD2 C 4.416 -0.556 3.446 1.00 . A A . 7 LEU CD2 1 1 19 5268 1 1 7 LEU CG C 3.256 -1.352 4.029 1.00 . A A . 7 LEU CG 1 1 19 5269 1 1 7 LEU H H 0.921 -2.301 2.742 1.00 . A A . 7 LEU H 1 1 19 5270 1 1 7 LEU HA H 3.416 -2.355 1.423 1.00 . A A . 7 LEU HA 1 1 19 5271 1 1 7 LEU HB2 H 2.637 -3.392 4.151 1.00 . A A . 7 LEU HB2 1 1 19 5272 1 1 7 LEU HB3 H 4.284 -3.170 3.598 1.00 . A A . 7 LEU HB3 1 1 19 5273 1 1 7 LEU HD11 H 2.978 -0.352 5.899 1.00 . A A . 7 LEU HD11 1 1 19 5274 1 1 7 LEU HD12 H 4.304 -1.516 5.887 1.00 . A A . 7 LEU HD12 1 1 19 5275 1 1 7 LEU HD13 H 2.634 -2.081 5.942 1.00 . A A . 7 LEU HD13 1 1 19 5276 1 1 7 LEU HD21 H 5.338 -1.098 3.598 1.00 . A A . 7 LEU HD21 1 1 19 5277 1 1 7 LEU HD22 H 4.477 0.404 3.938 1.00 . A A . 7 LEU HD22 1 1 19 5278 1 1 7 LEU HD23 H 4.256 -0.407 2.387 1.00 . A A . 7 LEU HD23 1 1 19 5279 1 1 7 LEU HG H 2.336 -0.880 3.714 1.00 . A A . 7 LEU HG 1 1 19 5280 1 1 7 LEU N N 1.424 -2.541 1.933 1.00 . A A . 7 LEU N 1 1 19 5281 1 1 7 LEU O O 3.977 -4.805 1.032 1.00 . A A . 7 LEU O 1 1 19 5282 1 1 8 ALA C C 1.655 -6.866 0.075 1.00 . A A . 8 ALA C 1 1 19 5283 1 1 8 ALA CA C 1.962 -6.665 1.564 1.00 . A A . 8 ALA CA 1 1 19 5284 1 1 8 ALA CB C 0.968 -7.439 2.419 1.00 . A A . 8 ALA CB 1 1 19 5285 1 1 8 ALA H H 1.173 -4.888 2.403 1.00 . A A . 8 ALA H 1 1 19 5286 1 1 8 ALA HA H 2.950 -7.052 1.769 1.00 . A A . 8 ALA HA 1 1 19 5287 1 1 8 ALA HB1 H 1.424 -7.684 3.367 1.00 . A A . 8 ALA HB1 1 1 19 5288 1 1 8 ALA HB2 H 0.686 -8.348 1.909 1.00 . A A . 8 ALA HB2 1 1 19 5289 1 1 8 ALA HB3 H 0.090 -6.833 2.587 1.00 . A A . 8 ALA HB3 1 1 19 5290 1 1 8 ALA N N 1.952 -5.250 1.931 1.00 . A A . 8 ALA N 1 1 19 5291 1 1 8 ALA O O 1.931 -7.931 -0.480 1.00 . A A . 8 ALA O 1 1 19 5292 1 1 9 ASP C C 1.942 -5.443 -2.867 1.00 . A A . 9 ASP C 1 1 19 5293 1 1 9 ASP CA C 0.765 -5.905 -1.998 1.00 . A A . 9 ASP CA 1 1 19 5294 1 1 9 ASP CB C -0.478 -5.056 -2.303 1.00 . A A . 9 ASP CB 1 1 19 5295 1 1 9 ASP CG C -1.691 -5.905 -2.633 1.00 . A A . 9 ASP CG 1 1 19 5296 1 1 9 ASP H H 0.904 -5.011 -0.081 1.00 . A A . 9 ASP H 1 1 19 5297 1 1 9 ASP HA H 0.548 -6.937 -2.234 1.00 . A A . 9 ASP HA 1 1 19 5298 1 1 9 ASP HB2 H -0.714 -4.447 -1.445 1.00 . A A . 9 ASP HB2 1 1 19 5299 1 1 9 ASP HB3 H -0.272 -4.413 -3.147 1.00 . A A . 9 ASP HB3 1 1 19 5300 1 1 9 ASP N N 1.094 -5.836 -0.571 1.00 . A A . 9 ASP N 1 1 19 5301 1 1 9 ASP O O 1.770 -5.159 -4.054 1.00 . A A . 9 ASP O 1 1 19 5302 1 1 9 ASP OD1 O -1.888 -6.223 -3.825 1.00 . A A . 9 ASP OD1 1 1 19 5303 1 1 9 ASP OD2 O -2.443 -6.254 -1.698 1.00 . A A . 9 ASP OD2 1 1 19 5304 1 1 10 DAL C C 4.734 -3.511 -2.630 1.00 . A A . 10 DAL C 1 1 19 5305 1 1 10 DAL CA C 4.336 -4.947 -2.985 1.00 . A A . 10 DAL CA 1 1 19 5306 1 1 10 DAL CB C 5.480 -5.895 -2.671 1.00 . A A . 10 DAL CB 1 1 19 5307 1 1 10 DAL H H 3.214 -5.608 -1.323 1.00 . A A . 10 DAL H 1 1 19 5308 1 1 10 DAL HA H 4.134 -5.004 -4.044 1.00 . A A . 10 DAL HA 1 1 19 5309 1 1 10 DAL HB1 H 5.766 -5.777 -1.637 1.00 . A A . 10 DAL HB1 1 1 19 5310 1 1 10 DAL HB2 H 6.322 -5.667 -3.307 1.00 . A A . 10 DAL HB2 1 1 19 5311 1 1 10 DAL HB3 H 5.162 -6.912 -2.844 1.00 . A A . 10 DAL HB3 1 1 19 5312 1 1 10 DAL N N 3.136 -5.371 -2.270 1.00 . A A . 10 DAL N 1 1 19 5313 1 1 10 DAL O O 5.763 -3.017 -3.096 1.00 . A A . 10 DAL O 1 1 19 5314 1 1 11 GLY C C 4.108 -0.508 -2.561 1.00 . A A . 11 GLY C 1 1 19 5315 1 1 11 GLY CA C 4.210 -1.480 -1.406 1.00 . A A . 11 GLY CA 1 1 19 5316 1 1 11 GLY H H 3.117 -3.288 -1.464 1.00 . A A . 11 GLY H 1 1 19 5317 1 1 11 GLY HA2 H 3.509 -1.182 -0.639 1.00 . A A . 11 GLY HA2 1 1 19 5318 1 1 11 GLY HA3 H 5.210 -1.438 -1.001 1.00 . A A . 11 GLY HA3 1 1 19 5319 1 1 11 GLY N N 3.920 -2.846 -1.804 1.00 . A A . 11 GLY N 1 1 19 5320 1 1 11 GLY O O 3.014 -0.058 -2.905 1.00 . A A . 11 GLY O 1 1 19 5321 1 1 12 TRP C C 5.310 0.011 -5.635 1.00 . A A . 12 TRP C 1 1 19 5322 1 1 12 TRP CA C 5.284 0.741 -4.290 1.00 . A A . 12 TRP CA 1 1 19 5323 1 1 12 TRP CB C 6.477 1.685 -4.148 1.00 . A A . 12 TRP CB 1 1 19 5324 1 1 12 TRP CD1 C 6.725 3.058 -2.004 1.00 . A A . 12 TRP CD1 1 1 19 5325 1 1 12 TRP CD2 C 5.189 3.844 -3.433 1.00 . A A . 12 TRP CD2 1 1 19 5326 1 1 12 TRP CE2 C 5.211 4.669 -2.296 1.00 . A A . 12 TRP CE2 1 1 19 5327 1 1 12 TRP CE3 C 4.298 4.148 -4.471 1.00 . A A . 12 TRP CE3 1 1 19 5328 1 1 12 TRP CG C 6.166 2.817 -3.225 1.00 . A A . 12 TRP CG 1 1 19 5329 1 1 12 TRP CH2 C 3.517 6.047 -3.191 1.00 . A A . 12 TRP CH2 1 1 19 5330 1 1 12 TRP CZ2 C 4.377 5.771 -2.162 1.00 . A A . 12 TRP CZ2 1 1 19 5331 1 1 12 TRP CZ3 C 3.475 5.247 -4.339 1.00 . A A . 12 TRP CZ3 1 1 19 5332 1 1 12 TRP H H 6.089 -0.581 -2.845 1.00 . A A . 12 TRP H 1 1 19 5333 1 1 12 TRP HA H 4.378 1.329 -4.245 1.00 . A A . 12 TRP HA 1 1 19 5334 1 1 12 TRP HB2 H 7.318 1.140 -3.744 1.00 . A A . 12 TRP HB2 1 1 19 5335 1 1 12 TRP HB3 H 6.740 2.091 -5.113 1.00 . A A . 12 TRP HB3 1 1 19 5336 1 1 12 TRP HD1 H 7.501 2.452 -1.560 1.00 . A A . 12 TRP HD1 1 1 19 5337 1 1 12 TRP HE1 H 6.390 4.548 -0.564 1.00 . A A . 12 TRP HE1 1 1 19 5338 1 1 12 TRP HE3 H 4.249 3.543 -5.365 1.00 . A A . 12 TRP HE3 1 1 19 5339 1 1 12 TRP HH2 H 2.854 6.897 -3.129 1.00 . A A . 12 TRP HH2 1 1 19 5340 1 1 12 TRP HZ2 H 4.391 6.387 -1.279 1.00 . A A . 12 TRP HZ2 1 1 19 5341 1 1 12 TRP HZ3 H 2.786 5.499 -5.133 1.00 . A A . 12 TRP HZ3 1 1 19 5342 1 1 12 TRP N N 5.250 -0.186 -3.164 1.00 . A A . 12 TRP N 1 1 19 5343 1 1 12 TRP NE1 N 6.156 4.170 -1.438 1.00 . A A . 12 TRP NE1 1 1 19 5344 1 1 12 TRP O O 5.501 0.635 -6.681 1.00 . A A . 12 TRP O 1 1 19 5345 1 1 13 ALA C C 3.648 -2.052 -7.442 1.00 . A A . 13 ALA C 1 1 19 5346 1 1 13 ALA CA C 5.043 -2.102 -6.828 1.00 . A A . 13 ALA CA 1 1 19 5347 1 1 13 ALA CB C 5.457 -3.538 -6.549 1.00 . A A . 13 ALA CB 1 1 19 5348 1 1 13 ALA H H 4.908 -1.746 -4.750 1.00 . A A . 13 ALA H 1 1 19 5349 1 1 13 ALA HA H 5.745 -1.676 -7.525 1.00 . A A . 13 ALA HA 1 1 19 5350 1 1 13 ALA HB1 H 5.962 -3.589 -5.597 1.00 . A A . 13 ALA HB1 1 1 19 5351 1 1 13 ALA HB2 H 6.123 -3.873 -7.329 1.00 . A A . 13 ALA HB2 1 1 19 5352 1 1 13 ALA HB3 H 4.580 -4.168 -6.528 1.00 . A A . 13 ALA HB3 1 1 19 5353 1 1 13 ALA N N 5.081 -1.306 -5.607 1.00 . A A . 13 ALA N 1 1 19 5354 1 1 13 ALA O O 3.497 -2.085 -8.665 1.00 . A A . 13 ALA O 1 1 19 5355 1 1 14 SER C C 1.031 -0.603 -7.870 1.00 . A A . 14 SER C 1 1 19 5356 1 1 14 SER CA C 1.245 -1.859 -7.022 1.00 . A A . 14 SER CA 1 1 19 5357 1 1 14 SER CB C 0.297 -1.857 -5.813 1.00 . A A . 14 SER CB 1 1 19 5358 1 1 14 SER H H 2.826 -1.906 -5.619 1.00 . A A . 14 SER H 1 1 19 5359 1 1 14 SER HA H 1.038 -2.724 -7.631 1.00 . A A . 14 SER HA 1 1 19 5360 1 1 14 SER HB2 H -0.613 -1.339 -6.072 1.00 . A A . 14 SER HB2 1 1 19 5361 1 1 14 SER HB3 H 0.062 -2.877 -5.543 1.00 . A A . 14 SER HB3 1 1 19 5362 1 1 14 SER HG H 1.221 -1.874 -4.078 1.00 . A A . 14 SER HG 1 1 19 5363 1 1 14 SER N N 2.633 -1.946 -6.579 1.00 . A A . 14 SER N 1 1 19 5364 1 1 14 SER O O 0.195 -0.593 -8.775 1.00 . A A . 14 SER O 1 1 19 5365 1 1 14 SER OG O 0.884 -1.213 -4.691 1.00 . A A . 14 SER OG 1 1 19 5366 1 1 15 DAL C C 0.903 2.756 -7.544 1.00 . A A . 15 DAL C 1 1 19 5367 1 1 15 DAL CA C 1.709 1.708 -8.313 1.00 . A A . 15 DAL CA 1 1 19 5368 1 1 15 DAL CB C 3.101 2.231 -8.627 1.00 . A A . 15 DAL CB 1 1 19 5369 1 1 15 DAL H H 2.453 0.375 -6.845 1.00 . A A . 15 DAL H 1 1 19 5370 1 1 15 DAL HA H 1.214 1.508 -9.250 1.00 . A A . 15 DAL HA 1 1 19 5371 1 1 15 DAL HB1 H 3.096 2.698 -9.599 1.00 . A A . 15 DAL HB1 1 1 19 5372 1 1 15 DAL HB2 H 3.803 1.411 -8.625 1.00 . A A . 15 DAL HB2 1 1 19 5373 1 1 15 DAL HB3 H 3.391 2.955 -7.880 1.00 . A A . 15 DAL HB3 1 1 19 5374 1 1 15 DAL N N 1.802 0.449 -7.575 1.00 . A A . 15 DAL N 1 1 19 5375 1 1 15 DAL O O 1.076 3.959 -7.749 1.00 . A A . 15 DAL O 1 1 19 5376 1 1 16 ARG C C -0.083 3.614 -4.586 1.00 . A A . 16 ARG C 1 1 19 5377 1 1 16 ARG CA C -0.814 3.184 -5.860 1.00 . A A . 16 ARG CA 1 1 19 5378 1 1 16 ARG CB C -2.139 2.483 -5.498 1.00 . A A . 16 ARG CB 1 1 19 5379 1 1 16 ARG CD C -3.197 0.559 -4.265 1.00 . A A . 16 ARG CD 1 1 19 5380 1 1 16 ARG CG C -2.030 1.537 -4.308 1.00 . A A . 16 ARG CG 1 1 19 5381 1 1 16 ARG CZ C -2.915 -1.238 -2.580 1.00 . A A . 16 ARG CZ 1 1 19 5382 1 1 16 ARG H H -0.070 1.320 -6.544 1.00 . A A . 16 ARG H 1 1 19 5383 1 1 16 ARG HA H -1.023 4.066 -6.452 1.00 . A A . 16 ARG HA 1 1 19 5384 1 1 16 ARG HB2 H -2.876 3.236 -5.262 1.00 . A A . 16 ARG HB2 1 1 19 5385 1 1 16 ARG HB3 H -2.486 1.907 -6.351 1.00 . A A . 16 ARG HB3 1 1 19 5386 1 1 16 ARG HD2 H -4.100 1.088 -4.532 1.00 . A A . 16 ARG HD2 1 1 19 5387 1 1 16 ARG HD3 H -3.021 -0.229 -4.983 1.00 . A A . 16 ARG HD3 1 1 19 5388 1 1 16 ARG HE H -3.871 0.493 -2.276 1.00 . A A . 16 ARG HE 1 1 19 5389 1 1 16 ARG HG2 H -1.104 0.981 -4.384 1.00 . A A . 16 ARG HG2 1 1 19 5390 1 1 16 ARG HG3 H -2.027 2.120 -3.398 1.00 . A A . 16 ARG HG3 1 1 19 5391 1 1 16 ARG HH11 H -2.038 -1.650 -4.360 1.00 . A A . 16 ARG HH11 1 1 19 5392 1 1 16 ARG HH12 H -1.885 -2.883 -3.156 1.00 . A A . 16 ARG HH12 1 1 19 5393 1 1 16 ARG HH21 H -3.659 -1.137 -0.700 1.00 . A A . 16 ARG HH21 1 1 19 5394 1 1 16 ARG HH22 H -2.806 -2.595 -1.082 1.00 . A A . 16 ARG HH22 1 1 19 5395 1 1 16 ARG N N 0.021 2.290 -6.661 1.00 . A A . 16 ARG N 1 1 19 5396 1 1 16 ARG NE N -3.374 -0.033 -2.938 1.00 . A A . 16 ARG NE 1 1 19 5397 1 1 16 ARG NH1 N -2.222 -1.984 -3.437 1.00 . A A . 16 ARG NH1 1 1 19 5398 1 1 16 ARG NH2 N -3.145 -1.694 -1.353 1.00 . A A . 16 ARG NH2 1 1 19 5399 1 1 16 ARG O O 0.793 2.898 -4.099 1.00 . A A . 16 ARG O 1 1 19 5400 1 1 17 PRO C C -0.428 4.717 -1.536 1.00 . A A . 17 PRO C 1 1 19 5401 1 1 17 PRO CA C 0.193 5.303 -2.805 1.00 . A A . 17 PRO CA 1 1 19 5402 1 1 17 PRO CB C -0.059 6.817 -2.869 1.00 . A A . 17 PRO CB 1 1 19 5403 1 1 17 PRO CD C -1.443 5.721 -4.525 1.00 . A A . 17 PRO CD 1 1 19 5404 1 1 17 PRO CG C -0.913 7.058 -4.079 1.00 . A A . 17 PRO CG 1 1 19 5405 1 1 17 PRO HA H 1.254 5.115 -2.794 1.00 . A A . 17 PRO HA 1 1 19 5406 1 1 17 PRO HB2 H -0.564 7.133 -1.968 1.00 . A A . 17 PRO HB2 1 1 19 5407 1 1 17 PRO HB3 H 0.890 7.332 -2.948 1.00 . A A . 17 PRO HB3 1 1 19 5408 1 1 17 PRO HD2 H -2.404 5.522 -4.079 1.00 . A A . 17 PRO HD2 1 1 19 5409 1 1 17 PRO HD3 H -1.508 5.685 -5.600 1.00 . A A . 17 PRO HD3 1 1 19 5410 1 1 17 PRO HG2 H -1.733 7.712 -3.821 1.00 . A A . 17 PRO HG2 1 1 19 5411 1 1 17 PRO HG3 H -0.316 7.502 -4.862 1.00 . A A . 17 PRO HG3 1 1 19 5412 1 1 17 PRO N N -0.429 4.791 -4.025 1.00 . A A . 17 PRO N 1 1 19 5413 1 1 17 PRO O O -1.496 4.103 -1.579 1.00 . A A . 17 PRO O 1 1 19 5414 1 1 18 PRO C C -1.551 4.997 1.353 1.00 . A A . 18 PRO C 1 1 19 5415 1 1 18 PRO CA C -0.221 4.388 0.910 1.00 . A A . 18 PRO CA 1 1 19 5416 1 1 18 PRO CB C 0.876 4.801 1.895 1.00 . A A . 18 PRO CB 1 1 19 5417 1 1 18 PRO CD C 1.532 5.611 -0.263 1.00 . A A . 18 PRO CD 1 1 19 5418 1 1 18 PRO CG C 1.652 5.873 1.210 1.00 . A A . 18 PRO CG 1 1 19 5419 1 1 18 PRO HA H -0.307 3.310 0.897 1.00 . A A . 18 PRO HA 1 1 19 5420 1 1 18 PRO HB2 H 0.420 5.172 2.797 1.00 . A A . 18 PRO HB2 1 1 19 5421 1 1 18 PRO HB3 H 1.493 3.952 2.128 1.00 . A A . 18 PRO HB3 1 1 19 5422 1 1 18 PRO HD2 H 1.510 6.542 -0.809 1.00 . A A . 18 PRO HD2 1 1 19 5423 1 1 18 PRO HD3 H 2.348 4.993 -0.604 1.00 . A A . 18 PRO HD3 1 1 19 5424 1 1 18 PRO HG2 H 1.234 6.838 1.452 1.00 . A A . 18 PRO HG2 1 1 19 5425 1 1 18 PRO HG3 H 2.688 5.826 1.514 1.00 . A A . 18 PRO HG3 1 1 19 5426 1 1 18 PRO N N 0.249 4.899 -0.384 1.00 . A A . 18 PRO N 1 1 19 5427 1 1 18 PRO O O -1.826 6.170 1.093 1.00 . A A . 18 PRO O 1 1 19 5428 1 1 19 PRO C C -3.563 5.457 3.842 1.00 . A A . 19 PRO C 1 1 19 5429 1 1 19 PRO CA C -3.681 4.658 2.544 1.00 . A A . 19 PRO CA 1 1 19 5430 1 1 19 PRO CB C -4.453 3.360 2.775 1.00 . A A . 19 PRO CB 1 1 19 5431 1 1 19 PRO CD C -2.126 2.798 2.401 1.00 . A A . 19 PRO CD 1 1 19 5432 1 1 19 PRO CG C -3.439 2.280 2.933 1.00 . A A . 19 PRO CG 1 1 19 5433 1 1 19 PRO HA H -4.195 5.256 1.805 1.00 . A A . 19 PRO HA 1 1 19 5434 1 1 19 PRO HB2 H -5.065 3.454 3.658 1.00 . A A . 19 PRO HB2 1 1 19 5435 1 1 19 PRO HB3 H -5.073 3.171 1.928 1.00 . A A . 19 PRO HB3 1 1 19 5436 1 1 19 PRO HD2 H -1.358 2.735 3.156 1.00 . A A . 19 PRO HD2 1 1 19 5437 1 1 19 PRO HD3 H -1.842 2.236 1.527 1.00 . A A . 19 PRO HD3 1 1 19 5438 1 1 19 PRO HG2 H -3.350 2.018 3.971 1.00 . A A . 19 PRO HG2 1 1 19 5439 1 1 19 PRO HG3 H -3.748 1.416 2.365 1.00 . A A . 19 PRO HG3 1 1 19 5440 1 1 19 PRO N N -2.389 4.202 2.047 1.00 . A A . 19 PRO N 1 1 19 5441 1 1 19 PRO O O -2.649 5.236 4.637 1.00 . A A . 19 PRO O 1 1 19 5442 1 1 20 SER C C -5.911 7.729 5.556 1.00 . A A . 20 SER C 1 1 19 5443 1 1 20 SER CA C -4.502 7.226 5.245 1.00 . A A . 20 SER CA 1 1 19 5444 1 1 20 SER CB C -3.548 8.412 5.073 1.00 . A A . 20 SER CB 1 1 19 5445 1 1 20 SER H H -5.196 6.516 3.372 1.00 . A A . 20 SER H 1 1 19 5446 1 1 20 SER HA H -4.161 6.620 6.071 1.00 . A A . 20 SER HA 1 1 19 5447 1 1 20 SER HB2 H -2.684 8.099 4.507 1.00 . A A . 20 SER HB2 1 1 19 5448 1 1 20 SER HB3 H -4.056 9.206 4.545 1.00 . A A . 20 SER HB3 1 1 19 5449 1 1 20 SER HG H -3.421 9.807 6.444 1.00 . A A . 20 SER HG 1 1 19 5450 1 1 20 SER N N -4.495 6.388 4.045 1.00 . A A . 20 SER N 1 1 19 5451 1 1 20 SER O O -6.549 8.310 4.650 1.00 . A A . 20 SER O 1 1 19 5452 1 1 20 SER OXT O -6.366 7.536 6.703 1.00 . A A . 20 SER OXT 1 1 19 5453 1 1 20 SER OG O -3.115 8.904 6.330 1.00 . A A . 20 SER OG 1 1 20 5454 1 1 1 ASP C C -6.327 -3.112 5.446 1.00 . A A . 1 ASP C 1 1 20 5455 1 1 1 ASP CA C -6.761 -3.439 6.875 1.00 . A A . 1 ASP CA 1 1 20 5456 1 1 1 ASP CB C -7.973 -2.589 7.275 1.00 . A A . 1 ASP CB 1 1 20 5457 1 1 1 ASP CG C -9.273 -3.126 6.708 1.00 . A A . 1 ASP CG 1 1 20 5458 1 1 1 ASP H1 H -5.468 -2.163 7.850 1.00 . A A . 1 ASP H1 1 1 20 5459 1 1 1 ASP H2 H -4.828 -3.724 7.528 1.00 . A A . 1 ASP H2 1 1 20 5460 1 1 1 ASP H3 H -5.981 -3.509 8.780 1.00 . A A . 1 ASP H3 1 1 20 5461 1 1 1 ASP HA H -7.029 -4.484 6.929 1.00 . A A . 1 ASP HA 1 1 20 5462 1 1 1 ASP HB2 H -8.053 -2.572 8.352 1.00 . A A . 1 ASP HB2 1 1 20 5463 1 1 1 ASP HB3 H -7.833 -1.580 6.914 1.00 . A A . 1 ASP HB3 1 1 20 5464 1 1 1 ASP N N -5.661 -3.186 7.846 1.00 . A A . 1 ASP N 1 1 20 5465 1 1 1 ASP O O -6.289 -3.993 4.585 1.00 . A A . 1 ASP O 1 1 20 5466 1 1 1 ASP OD1 O -9.614 -2.767 5.561 1.00 . A A . 1 ASP OD1 1 1 20 5467 1 1 1 ASP OD2 O -9.950 -3.905 7.411 1.00 . A A . 1 ASP OD2 1 1 20 5468 1 1 2 ALA C C -4.070 -1.087 3.864 1.00 . A A . 2 ALA C 1 1 20 5469 1 1 2 ALA CA C -5.566 -1.393 3.883 1.00 . A A . 2 ALA CA 1 1 20 5470 1 1 2 ALA CB C -6.357 -0.170 3.453 1.00 . A A . 2 ALA CB 1 1 20 5471 1 1 2 ALA H H -6.050 -1.189 5.934 1.00 . A A . 2 ALA H 1 1 20 5472 1 1 2 ALA HA H -5.768 -2.187 3.179 1.00 . A A . 2 ALA HA 1 1 20 5473 1 1 2 ALA HB1 H -6.098 0.665 4.087 1.00 . A A . 2 ALA HB1 1 1 20 5474 1 1 2 ALA HB2 H -7.413 -0.375 3.540 1.00 . A A . 2 ALA HB2 1 1 20 5475 1 1 2 ALA HB3 H -6.119 0.069 2.428 1.00 . A A . 2 ALA HB3 1 1 20 5476 1 1 2 ALA N N -6.000 -1.842 5.204 1.00 . A A . 2 ALA N 1 1 20 5477 1 1 2 ALA O O -3.379 -1.410 2.898 1.00 . A A . 2 ALA O 1 1 20 5478 1 1 3 TYR C C -1.289 -1.368 5.006 1.00 . A A . 3 TYR C 1 1 20 5479 1 1 3 TYR CA C -2.158 -0.114 5.042 1.00 . A A . 3 TYR CA 1 1 20 5480 1 1 3 TYR CB C -1.893 0.684 6.324 1.00 . A A . 3 TYR CB 1 1 20 5481 1 1 3 TYR CD1 C 0.561 1.220 6.568 1.00 . A A . 3 TYR CD1 1 1 20 5482 1 1 3 TYR CD2 C -0.895 2.953 5.806 1.00 . A A . 3 TYR CD2 1 1 20 5483 1 1 3 TYR CE1 C 1.635 2.085 6.494 1.00 . A A . 3 TYR CE1 1 1 20 5484 1 1 3 TYR CE2 C 0.177 3.822 5.733 1.00 . A A . 3 TYR CE2 1 1 20 5485 1 1 3 TYR CG C -0.720 1.635 6.224 1.00 . A A . 3 TYR CG 1 1 20 5486 1 1 3 TYR CZ C 1.438 3.384 6.077 1.00 . A A . 3 TYR CZ 1 1 20 5487 1 1 3 TYR H H -4.182 -0.232 5.672 1.00 . A A . 3 TYR H 1 1 20 5488 1 1 3 TYR HA H -1.905 0.497 4.192 1.00 . A A . 3 TYR HA 1 1 20 5489 1 1 3 TYR HB2 H -2.768 1.268 6.566 1.00 . A A . 3 TYR HB2 1 1 20 5490 1 1 3 TYR HB3 H -1.694 -0.005 7.132 1.00 . A A . 3 TYR HB3 1 1 20 5491 1 1 3 TYR HD1 H 0.713 0.201 6.893 1.00 . A A . 3 TYR HD1 1 1 20 5492 1 1 3 TYR HD2 H -1.884 3.297 5.526 1.00 . A A . 3 TYR HD2 1 1 20 5493 1 1 3 TYR HE1 H 2.623 1.741 6.764 1.00 . A A . 3 TYR HE1 1 1 20 5494 1 1 3 TYR HE2 H 0.023 4.841 5.414 1.00 . A A . 3 TYR HE2 1 1 20 5495 1 1 3 TYR HH H 2.617 4.694 6.848 1.00 . A A . 3 TYR HH 1 1 20 5496 1 1 3 TYR N N -3.577 -0.462 4.936 1.00 . A A . 3 TYR N 1 1 20 5497 1 1 3 TYR O O -0.296 -1.421 4.278 1.00 . A A . 3 TYR O 1 1 20 5498 1 1 3 TYR OH O 2.507 4.248 6.005 1.00 . A A . 3 TYR OH 1 1 20 5499 1 1 4 ALA C C -1.088 -4.381 4.477 1.00 . A A . 4 ALA C 1 1 20 5500 1 1 4 ALA CA C -0.948 -3.646 5.810 1.00 . A A . 4 ALA CA 1 1 20 5501 1 1 4 ALA CB C -1.443 -4.517 6.956 1.00 . A A . 4 ALA CB 1 1 20 5502 1 1 4 ALA H H -2.489 -2.286 6.323 1.00 . A A . 4 ALA H 1 1 20 5503 1 1 4 ALA HA H 0.098 -3.424 5.979 1.00 . A A . 4 ALA HA 1 1 20 5504 1 1 4 ALA HB1 H -0.737 -5.314 7.134 1.00 . A A . 4 ALA HB1 1 1 20 5505 1 1 4 ALA HB2 H -2.404 -4.938 6.700 1.00 . A A . 4 ALA HB2 1 1 20 5506 1 1 4 ALA HB3 H -1.541 -3.916 7.848 1.00 . A A . 4 ALA HB3 1 1 20 5507 1 1 4 ALA N N -1.680 -2.384 5.777 1.00 . A A . 4 ALA N 1 1 20 5508 1 1 4 ALA O O -0.154 -5.051 4.031 1.00 . A A . 4 ALA O 1 1 20 5509 1 1 5 GLN C C -1.662 -4.194 1.456 1.00 . A A . 5 GLN C 1 1 20 5510 1 1 5 GLN CA C -2.504 -4.863 2.542 1.00 . A A . 5 GLN CA 1 1 20 5511 1 1 5 GLN CB C -3.993 -4.775 2.191 1.00 . A A . 5 GLN CB 1 1 20 5512 1 1 5 GLN CD C -4.327 -6.973 0.969 1.00 . A A . 5 GLN CD 1 1 20 5513 1 1 5 GLN CG C -4.353 -5.455 0.880 1.00 . A A . 5 GLN CG 1 1 20 5514 1 1 5 GLN H H -2.954 -3.673 4.228 1.00 . A A . 5 GLN H 1 1 20 5515 1 1 5 GLN HA H -2.219 -5.902 2.616 1.00 . A A . 5 GLN HA 1 1 20 5516 1 1 5 GLN HB2 H -4.566 -5.238 2.981 1.00 . A A . 5 GLN HB2 1 1 20 5517 1 1 5 GLN HB3 H -4.272 -3.734 2.119 1.00 . A A . 5 GLN HB3 1 1 20 5518 1 1 5 GLN HE21 H -4.452 -7.118 -1.013 1.00 . A A . 5 GLN HE21 1 1 20 5519 1 1 5 GLN HE22 H -4.376 -8.615 -0.153 1.00 . A A . 5 GLN HE22 1 1 20 5520 1 1 5 GLN HG2 H -5.346 -5.146 0.590 1.00 . A A . 5 GLN HG2 1 1 20 5521 1 1 5 GLN HG3 H -3.647 -5.140 0.129 1.00 . A A . 5 GLN HG3 1 1 20 5522 1 1 5 GLN N N -2.253 -4.233 3.833 1.00 . A A . 5 GLN N 1 1 20 5523 1 1 5 GLN NE2 N -4.391 -7.635 -0.182 1.00 . A A . 5 GLN NE2 1 1 20 5524 1 1 5 GLN O O -1.153 -4.861 0.556 1.00 . A A . 5 GLN O 1 1 20 5525 1 1 5 GLN OE1 O -4.249 -7.545 2.057 1.00 . A A . 5 GLN OE1 1 1 20 5526 1 1 6 TRP C C 0.733 -2.556 0.630 1.00 . A A . 6 TRP C 1 1 20 5527 1 1 6 TRP CA C -0.720 -2.097 0.609 1.00 . A A . 6 TRP CA 1 1 20 5528 1 1 6 TRP CB C -0.800 -0.605 0.944 1.00 . A A . 6 TRP CB 1 1 20 5529 1 1 6 TRP CD1 C -0.330 0.576 -1.272 1.00 . A A . 6 TRP CD1 1 1 20 5530 1 1 6 TRP CD2 C 1.234 0.914 0.292 1.00 . A A . 6 TRP CD2 1 1 20 5531 1 1 6 TRP CE2 C 1.604 1.610 -0.872 1.00 . A A . 6 TRP CE2 1 1 20 5532 1 1 6 TRP CE3 C 2.070 0.982 1.410 1.00 . A A . 6 TRP CE3 1 1 20 5533 1 1 6 TRP CG C -0.010 0.258 0.013 1.00 . A A . 6 TRP CG 1 1 20 5534 1 1 6 TRP CH2 C 3.568 2.419 0.153 1.00 . A A . 6 TRP CH2 1 1 20 5535 1 1 6 TRP CZ2 C 2.770 2.365 -0.954 1.00 . A A . 6 TRP CZ2 1 1 20 5536 1 1 6 TRP CZ3 C 3.229 1.736 1.330 1.00 . A A . 6 TRP CZ3 1 1 20 5537 1 1 6 TRP H H -1.938 -2.402 2.311 1.00 . A A . 6 TRP H 1 1 20 5538 1 1 6 TRP HA H -1.127 -2.262 -0.376 1.00 . A A . 6 TRP HA 1 1 20 5539 1 1 6 TRP HB2 H -1.829 -0.288 0.899 1.00 . A A . 6 TRP HB2 1 1 20 5540 1 1 6 TRP HB3 H -0.425 -0.446 1.942 1.00 . A A . 6 TRP HB3 1 1 20 5541 1 1 6 TRP HD1 H -1.216 0.232 -1.781 1.00 . A A . 6 TRP HD1 1 1 20 5542 1 1 6 TRP HE1 H 0.630 1.743 -2.719 1.00 . A A . 6 TRP HE1 1 1 20 5543 1 1 6 TRP HE3 H 1.825 0.459 2.325 1.00 . A A . 6 TRP HE3 1 1 20 5544 1 1 6 TRP HH2 H 4.477 3.003 0.134 1.00 . A A . 6 TRP HH2 1 1 20 5545 1 1 6 TRP HZ2 H 3.047 2.892 -1.855 1.00 . A A . 6 TRP HZ2 1 1 20 5546 1 1 6 TRP HZ3 H 3.890 1.801 2.183 1.00 . A A . 6 TRP HZ3 1 1 20 5547 1 1 6 TRP N N -1.512 -2.870 1.562 1.00 . A A . 6 TRP N 1 1 20 5548 1 1 6 TRP NE1 N 0.636 1.383 -1.810 1.00 . A A . 6 TRP NE1 1 1 20 5549 1 1 6 TRP O O 1.326 -2.821 -0.417 1.00 . A A . 6 TRP O 1 1 20 5550 1 1 7 LEU C C 2.848 -4.540 1.556 1.00 . A A . 7 LEU C 1 1 20 5551 1 1 7 LEU CA C 2.673 -3.091 2.014 1.00 . A A . 7 LEU CA 1 1 20 5552 1 1 7 LEU CB C 3.082 -2.941 3.482 1.00 . A A . 7 LEU CB 1 1 20 5553 1 1 7 LEU CD1 C 3.118 -1.477 5.519 1.00 . A A . 7 LEU CD1 1 1 20 5554 1 1 7 LEU CD2 C 4.304 -0.745 3.438 1.00 . A A . 7 LEU CD2 1 1 20 5555 1 1 7 LEU CG C 3.104 -1.499 3.999 1.00 . A A . 7 LEU CG 1 1 20 5556 1 1 7 LEU H H 0.757 -2.434 2.627 1.00 . A A . 7 LEU H 1 1 20 5557 1 1 7 LEU HA H 3.302 -2.457 1.408 1.00 . A A . 7 LEU HA 1 1 20 5558 1 1 7 LEU HB2 H 2.388 -3.508 4.086 1.00 . A A . 7 LEU HB2 1 1 20 5559 1 1 7 LEU HB3 H 4.067 -3.361 3.608 1.00 . A A . 7 LEU HB3 1 1 20 5560 1 1 7 LEU HD11 H 4.103 -1.741 5.874 1.00 . A A . 7 LEU HD11 1 1 20 5561 1 1 7 LEU HD12 H 2.397 -2.188 5.895 1.00 . A A . 7 LEU HD12 1 1 20 5562 1 1 7 LEU HD13 H 2.862 -0.487 5.866 1.00 . A A . 7 LEU HD13 1 1 20 5563 1 1 7 LEU HD21 H 4.108 -0.467 2.412 1.00 . A A . 7 LEU HD21 1 1 20 5564 1 1 7 LEU HD22 H 5.179 -1.376 3.479 1.00 . A A . 7 LEU HD22 1 1 20 5565 1 1 7 LEU HD23 H 4.475 0.146 4.024 1.00 . A A . 7 LEU HD23 1 1 20 5566 1 1 7 LEU HG H 2.208 -0.994 3.668 1.00 . A A . 7 LEU HG 1 1 20 5567 1 1 7 LEU N N 1.292 -2.655 1.835 1.00 . A A . 7 LEU N 1 1 20 5568 1 1 7 LEU O O 3.875 -4.895 0.975 1.00 . A A . 7 LEU O 1 1 20 5569 1 1 8 ALA C C 1.647 -6.941 -0.097 1.00 . A A . 8 ALA C 1 1 20 5570 1 1 8 ALA CA C 1.856 -6.774 1.413 1.00 . A A . 8 ALA CA 1 1 20 5571 1 1 8 ALA CB C 0.802 -7.559 2.181 1.00 . A A . 8 ALA CB 1 1 20 5572 1 1 8 ALA H H 1.035 -5.018 2.268 1.00 . A A . 8 ALA H 1 1 20 5573 1 1 8 ALA HA H 2.826 -7.173 1.676 1.00 . A A . 8 ALA HA 1 1 20 5574 1 1 8 ALA HB1 H -0.182 -7.217 1.895 1.00 . A A . 8 ALA HB1 1 1 20 5575 1 1 8 ALA HB2 H 0.941 -7.408 3.241 1.00 . A A . 8 ALA HB2 1 1 20 5576 1 1 8 ALA HB3 H 0.898 -8.610 1.952 1.00 . A A . 8 ALA HB3 1 1 20 5577 1 1 8 ALA N N 1.829 -5.367 1.810 1.00 . A A . 8 ALA N 1 1 20 5578 1 1 8 ALA O O 1.959 -7.994 -0.656 1.00 . A A . 8 ALA O 1 1 20 5579 1 1 9 ASP C C 2.098 -5.433 -2.990 1.00 . A A . 9 ASP C 1 1 20 5580 1 1 9 ASP CA C 0.881 -5.935 -2.200 1.00 . A A . 9 ASP CA 1 1 20 5581 1 1 9 ASP CB C -0.353 -5.091 -2.554 1.00 . A A . 9 ASP CB 1 1 20 5582 1 1 9 ASP CG C -1.577 -5.943 -2.828 1.00 . A A . 9 ASP CG 1 1 20 5583 1 1 9 ASP H H 0.900 -5.086 -0.257 1.00 . A A . 9 ASP H 1 1 20 5584 1 1 9 ASP HA H 0.692 -6.963 -2.474 1.00 . A A . 9 ASP HA 1 1 20 5585 1 1 9 ASP HB2 H -0.579 -4.427 -1.734 1.00 . A A . 9 ASP HB2 1 1 20 5586 1 1 9 ASP HB3 H -0.143 -4.502 -3.437 1.00 . A A . 9 ASP HB3 1 1 20 5587 1 1 9 ASP N N 1.124 -5.898 -0.754 1.00 . A A . 9 ASP N 1 1 20 5588 1 1 9 ASP O O 1.984 -5.108 -4.174 1.00 . A A . 9 ASP O 1 1 20 5589 1 1 9 ASP OD1 O -1.750 -6.379 -3.985 1.00 . A A . 9 ASP OD1 1 1 20 5590 1 1 9 ASP OD2 O -2.361 -6.174 -1.885 1.00 . A A . 9 ASP OD2 1 1 20 5591 1 1 10 DAL C C 4.835 -3.473 -2.580 1.00 . A A . 10 DAL C 1 1 20 5592 1 1 10 DAL CA C 4.489 -4.912 -2.976 1.00 . A A . 10 DAL CA 1 1 20 5593 1 1 10 DAL CB C 5.636 -5.839 -2.616 1.00 . A A . 10 DAL CB 1 1 20 5594 1 1 10 DAL H H 3.295 -5.643 -1.393 1.00 . A A . 10 DAL H 1 1 20 5595 1 1 10 DAL HA H 4.344 -4.956 -4.045 1.00 . A A . 10 DAL HA 1 1 20 5596 1 1 10 DAL HB1 H 6.507 -5.576 -3.197 1.00 . A A . 10 DAL HB1 1 1 20 5597 1 1 10 DAL HB2 H 5.354 -6.859 -2.828 1.00 . A A . 10 DAL HB2 1 1 20 5598 1 1 10 DAL HB3 H 5.859 -5.736 -1.565 1.00 . A A . 10 DAL HB3 1 1 20 5599 1 1 10 DAL N N 3.260 -5.373 -2.333 1.00 . A A . 10 DAL N 1 1 20 5600 1 1 10 DAL O O 5.880 -2.953 -2.975 1.00 . A A . 10 DAL O 1 1 20 5601 1 1 11 GLY C C 4.134 -0.480 -2.509 1.00 . A A . 11 GLY C 1 1 20 5602 1 1 11 GLY CA C 4.193 -1.470 -1.365 1.00 . A A . 11 GLY CA 1 1 20 5603 1 1 11 GLY H H 3.144 -3.298 -1.515 1.00 . A A . 11 GLY H 1 1 20 5604 1 1 11 GLY HA2 H 3.445 -1.200 -0.633 1.00 . A A . 11 GLY HA2 1 1 20 5605 1 1 11 GLY HA3 H 5.169 -1.413 -0.904 1.00 . A A . 11 GLY HA3 1 1 20 5606 1 1 11 GLY N N 3.957 -2.836 -1.798 1.00 . A A . 11 GLY N 1 1 20 5607 1 1 11 GLY O O 3.052 -0.044 -2.903 1.00 . A A . 11 GLY O 1 1 20 5608 1 1 12 TRP C C 5.479 0.120 -5.505 1.00 . A A . 12 TRP C 1 1 20 5609 1 1 12 TRP CA C 5.379 0.822 -4.149 1.00 . A A . 12 TRP CA 1 1 20 5610 1 1 12 TRP CB C 6.553 1.776 -3.932 1.00 . A A . 12 TRP CB 1 1 20 5611 1 1 12 TRP CD1 C 6.693 3.125 -1.762 1.00 . A A . 12 TRP CD1 1 1 20 5612 1 1 12 TRP CD2 C 5.196 3.898 -3.239 1.00 . A A . 12 TRP CD2 1 1 20 5613 1 1 12 TRP CE2 C 5.156 4.709 -2.092 1.00 . A A . 12 TRP CE2 1 1 20 5614 1 1 12 TRP CE3 C 4.341 4.196 -4.307 1.00 . A A . 12 TRP CE3 1 1 20 5615 1 1 12 TRP CG C 6.185 2.889 -3.006 1.00 . A A . 12 TRP CG 1 1 20 5616 1 1 12 TRP CH2 C 3.469 6.062 -3.037 1.00 . A A . 12 TRP CH2 1 1 20 5617 1 1 12 TRP CZ2 C 4.295 5.791 -1.979 1.00 . A A . 12 TRP CZ2 1 1 20 5618 1 1 12 TRP CZ3 C 3.489 5.275 -4.195 1.00 . A A . 12 TRP CZ3 1 1 20 5619 1 1 12 TRP H H 6.129 -0.510 -2.684 1.00 . A A . 12 TRP H 1 1 20 5620 1 1 12 TRP HA H 4.465 1.400 -4.137 1.00 . A A . 12 TRP HA 1 1 20 5621 1 1 12 TRP HB2 H 7.379 1.233 -3.497 1.00 . A A . 12 TRP HB2 1 1 20 5622 1 1 12 TRP HB3 H 6.858 2.202 -4.875 1.00 . A A . 12 TRP HB3 1 1 20 5623 1 1 12 TRP HD1 H 7.464 2.530 -1.296 1.00 . A A . 12 TRP HD1 1 1 20 5624 1 1 12 TRP HE1 H 6.271 4.589 -0.318 1.00 . A A . 12 TRP HE1 1 1 20 5625 1 1 12 TRP HE3 H 4.339 3.601 -5.209 1.00 . A A . 12 TRP HE3 1 1 20 5626 1 1 12 TRP HH2 H 2.787 6.897 -2.991 1.00 . A A . 12 TRP HH2 1 1 20 5627 1 1 12 TRP HZ2 H 4.261 6.396 -1.088 1.00 . A A . 12 TRP HZ2 1 1 20 5628 1 1 12 TRP HZ3 H 2.826 5.523 -5.013 1.00 . A A . 12 TRP HZ3 1 1 20 5629 1 1 12 TRP N N 5.301 -0.126 -3.043 1.00 . A A . 12 TRP N 1 1 20 5630 1 1 12 TRP NE1 N 6.079 4.219 -1.205 1.00 . A A . 12 TRP NE1 1 1 20 5631 1 1 12 TRP O O 5.724 0.765 -6.527 1.00 . A A . 12 TRP O 1 1 20 5632 1 1 13 ALA C C 3.922 -1.931 -7.434 1.00 . A A . 13 ALA C 1 1 20 5633 1 1 13 ALA CA C 5.287 -1.969 -6.754 1.00 . A A . 13 ALA CA 1 1 20 5634 1 1 13 ALA CB C 5.715 -3.403 -6.485 1.00 . A A . 13 ALA CB 1 1 20 5635 1 1 13 ALA H H 5.039 -1.657 -4.680 1.00 . A A . 13 ALA H 1 1 20 5636 1 1 13 ALA HA H 6.013 -1.516 -7.409 1.00 . A A . 13 ALA HA 1 1 20 5637 1 1 13 ALA HB1 H 6.525 -3.663 -7.149 1.00 . A A . 13 ALA HB1 1 1 20 5638 1 1 13 ALA HB2 H 4.881 -4.067 -6.656 1.00 . A A . 13 ALA HB2 1 1 20 5639 1 1 13 ALA HB3 H 6.045 -3.495 -5.461 1.00 . A A . 13 ALA HB3 1 1 20 5640 1 1 13 ALA N N 5.254 -1.198 -5.517 1.00 . A A . 13 ALA N 1 1 20 5641 1 1 13 ALA O O 3.830 -1.948 -8.663 1.00 . A A . 13 ALA O 1 1 20 5642 1 1 14 SER C C 1.299 -0.508 -7.954 1.00 . A A . 14 SER C 1 1 20 5643 1 1 14 SER CA C 1.499 -1.782 -7.130 1.00 . A A . 14 SER CA 1 1 20 5644 1 1 14 SER CB C 0.491 -1.836 -5.971 1.00 . A A . 14 SER CB 1 1 20 5645 1 1 14 SER H H 3.010 -1.826 -5.652 1.00 . A A . 14 SER H 1 1 20 5646 1 1 14 SER HA H 1.340 -2.633 -7.772 1.00 . A A . 14 SER HA 1 1 20 5647 1 1 14 SER HB2 H -0.412 -1.320 -6.257 1.00 . A A . 14 SER HB2 1 1 20 5648 1 1 14 SER HB3 H 0.259 -2.867 -5.749 1.00 . A A . 14 SER HB3 1 1 20 5649 1 1 14 SER HG H 1.338 -1.901 -4.198 1.00 . A A . 14 SER HG 1 1 20 5650 1 1 14 SER N N 2.865 -1.853 -6.621 1.00 . A A . 14 SER N 1 1 20 5651 1 1 14 SER O O 0.500 -0.487 -8.892 1.00 . A A . 14 SER O 1 1 20 5652 1 1 14 SER OG O 1.012 -1.223 -4.800 1.00 . A A . 14 SER OG 1 1 20 5653 1 1 15 DAL C C 1.093 2.837 -7.549 1.00 . A A . 15 DAL C 1 1 20 5654 1 1 15 DAL CA C 1.952 1.825 -8.309 1.00 . A A . 15 DAL CA 1 1 20 5655 1 1 15 DAL CB C 3.346 2.382 -8.545 1.00 . A A . 15 DAL CB 1 1 20 5656 1 1 15 DAL H H 2.658 0.467 -6.845 1.00 . A A . 15 DAL H 1 1 20 5657 1 1 15 DAL HA H 1.503 1.641 -9.272 1.00 . A A . 15 DAL HA 1 1 20 5658 1 1 15 DAL HB1 H 3.394 2.818 -9.531 1.00 . A A . 15 DAL HB1 1 1 20 5659 1 1 15 DAL HB2 H 4.070 1.585 -8.469 1.00 . A A . 15 DAL HB2 1 1 20 5660 1 1 15 DAL HB3 H 3.563 3.138 -7.806 1.00 . A A . 15 DAL HB3 1 1 20 5661 1 1 15 DAL N N 2.038 0.549 -7.600 1.00 . A A . 15 DAL N 1 1 20 5662 1 1 15 DAL O O 1.253 4.049 -7.713 1.00 . A A . 15 DAL O 1 1 20 5663 1 1 16 ARG C C -0.027 3.610 -4.624 1.00 . A A . 16 ARG C 1 1 20 5664 1 1 16 ARG CA C -0.702 3.191 -5.932 1.00 . A A . 16 ARG CA 1 1 20 5665 1 1 16 ARG CB C -2.026 2.457 -5.637 1.00 . A A . 16 ARG CB 1 1 20 5666 1 1 16 ARG CD C -3.102 0.491 -4.493 1.00 . A A . 16 ARG CD 1 1 20 5667 1 1 16 ARG CG C -1.947 1.484 -4.466 1.00 . A A . 16 ARG CG 1 1 20 5668 1 1 16 ARG CZ C -2.798 -1.401 -2.920 1.00 . A A . 16 ARG CZ 1 1 20 5669 1 1 16 ARG H H 0.103 1.359 -6.630 1.00 . A A . 16 ARG H 1 1 20 5670 1 1 16 ARG HA H -0.906 4.082 -6.513 1.00 . A A . 16 ARG HA 1 1 20 5671 1 1 16 ARG HB2 H -2.787 3.190 -5.414 1.00 . A A . 16 ARG HB2 1 1 20 5672 1 1 16 ARG HB3 H -2.327 1.895 -6.516 1.00 . A A . 16 ARG HB3 1 1 20 5673 1 1 16 ARG HD2 H -4.010 1.024 -4.732 1.00 . A A . 16 ARG HD2 1 1 20 5674 1 1 16 ARG HD3 H -2.910 -0.247 -5.257 1.00 . A A . 16 ARG HD3 1 1 20 5675 1 1 16 ARG HE H -3.797 0.285 -2.520 1.00 . A A . 16 ARG HE 1 1 20 5676 1 1 16 ARG HG2 H -1.012 0.941 -4.521 1.00 . A A . 16 ARG HG2 1 1 20 5677 1 1 16 ARG HG3 H -1.986 2.044 -3.543 1.00 . A A . 16 ARG HG3 1 1 20 5678 1 1 16 ARG HH11 H -1.893 -1.680 -4.712 1.00 . A A . 16 ARG HH11 1 1 20 5679 1 1 16 ARG HH12 H -1.725 -2.983 -3.587 1.00 . A A . 16 ARG HH12 1 1 20 5680 1 1 16 ARG HH21 H -3.569 -1.440 -1.049 1.00 . A A . 16 ARG HH21 1 1 20 5681 1 1 16 ARG HH22 H -2.676 -2.850 -1.512 1.00 . A A . 16 ARG HH22 1 1 20 5682 1 1 16 ARG N N 0.182 2.333 -6.718 1.00 . A A . 16 ARG N 1 1 20 5683 1 1 16 ARG NE N -3.281 -0.187 -3.207 1.00 . A A . 16 ARG NE 1 1 20 5684 1 1 16 ARG NH1 N -2.080 -2.077 -3.814 1.00 . A A . 16 ARG NH1 1 1 20 5685 1 1 16 ARG NH2 N -3.033 -1.941 -1.729 1.00 . A A . 16 ARG NH2 1 1 20 5686 1 1 16 ARG O O 0.848 2.905 -4.122 1.00 . A A . 16 ARG O 1 1 20 5687 1 1 17 PRO C C -0.505 4.654 -1.564 1.00 . A A . 17 PRO C 1 1 20 5688 1 1 17 PRO CA C 0.149 5.270 -2.801 1.00 . A A . 17 PRO CA 1 1 20 5689 1 1 17 PRO CB C -0.127 6.780 -2.850 1.00 . A A . 17 PRO CB 1 1 20 5690 1 1 17 PRO CD C -1.434 5.687 -4.570 1.00 . A A . 17 PRO CD 1 1 20 5691 1 1 17 PRO CG C -0.949 7.026 -4.082 1.00 . A A . 17 PRO CG 1 1 20 5692 1 1 17 PRO HA H 1.211 5.100 -2.755 1.00 . A A . 17 PRO HA 1 1 20 5693 1 1 17 PRO HB2 H -0.665 7.073 -1.961 1.00 . A A . 17 PRO HB2 1 1 20 5694 1 1 17 PRO HB3 H 0.815 7.312 -2.892 1.00 . A A . 17 PRO HB3 1 1 20 5695 1 1 17 PRO HD2 H -2.405 5.460 -4.161 1.00 . A A . 17 PRO HD2 1 1 20 5696 1 1 17 PRO HD3 H -1.462 5.669 -5.647 1.00 . A A . 17 PRO HD3 1 1 20 5697 1 1 17 PRO HG2 H -1.790 7.657 -3.838 1.00 . A A . 17 PRO HG2 1 1 20 5698 1 1 17 PRO HG3 H -0.337 7.498 -4.838 1.00 . A A . 17 PRO HG3 1 1 20 5699 1 1 17 PRO N N -0.419 4.768 -4.052 1.00 . A A . 17 PRO N 1 1 20 5700 1 1 17 PRO O O -1.560 4.022 -1.652 1.00 . A A . 17 PRO O 1 1 20 5701 1 1 18 PRO C C -1.712 4.884 1.307 1.00 . A A . 18 PRO C 1 1 20 5702 1 1 18 PRO CA C -0.368 4.292 0.884 1.00 . A A . 18 PRO CA 1 1 20 5703 1 1 18 PRO CB C 0.702 4.694 1.902 1.00 . A A . 18 PRO CB 1 1 20 5704 1 1 18 PRO CD C 1.399 5.562 -0.217 1.00 . A A . 18 PRO CD 1 1 20 5705 1 1 18 PRO CG C 1.474 5.795 1.262 1.00 . A A . 18 PRO CG 1 1 20 5706 1 1 18 PRO HA H -0.446 3.215 0.849 1.00 . A A . 18 PRO HA 1 1 20 5707 1 1 18 PRO HB2 H 0.222 5.032 2.804 1.00 . A A . 18 PRO HB2 1 1 20 5708 1 1 18 PRO HB3 H 1.328 3.848 2.123 1.00 . A A . 18 PRO HB3 1 1 20 5709 1 1 18 PRO HD2 H 1.376 6.503 -0.746 1.00 . A A . 18 PRO HD2 1 1 20 5710 1 1 18 PRO HD3 H 2.235 4.964 -0.548 1.00 . A A . 18 PRO HD3 1 1 20 5711 1 1 18 PRO HG2 H 1.030 6.747 1.513 1.00 . A A . 18 PRO HG2 1 1 20 5712 1 1 18 PRO HG3 H 2.501 5.763 1.594 1.00 . A A . 18 PRO HG3 1 1 20 5713 1 1 18 PRO N N 0.132 4.830 -0.389 1.00 . A A . 18 PRO N 1 1 20 5714 1 1 18 PRO O O -1.999 6.053 1.043 1.00 . A A . 18 PRO O 1 1 20 5715 1 1 19 PRO C C -3.758 5.312 3.772 1.00 . A A . 19 PRO C 1 1 20 5716 1 1 19 PRO CA C -3.852 4.514 2.472 1.00 . A A . 19 PRO CA 1 1 20 5717 1 1 19 PRO CB C -4.609 3.206 2.694 1.00 . A A . 19 PRO CB 1 1 20 5718 1 1 19 PRO CD C -2.270 2.677 2.350 1.00 . A A . 19 PRO CD 1 1 20 5719 1 1 19 PRO CG C -3.582 2.141 2.866 1.00 . A A . 19 PRO CG 1 1 20 5720 1 1 19 PRO HA H -4.366 5.106 1.728 1.00 . A A . 19 PRO HA 1 1 20 5721 1 1 19 PRO HB2 H -5.234 3.291 3.569 1.00 . A A . 19 PRO HB2 1 1 20 5722 1 1 19 PRO HB3 H -5.214 3.008 1.840 1.00 . A A . 19 PRO HB3 1 1 20 5723 1 1 19 PRO HD2 H -1.511 2.625 3.114 1.00 . A A . 19 PRO HD2 1 1 20 5724 1 1 19 PRO HD3 H -1.967 2.117 1.480 1.00 . A A . 19 PRO HD3 1 1 20 5725 1 1 19 PRO HG2 H -3.503 1.881 3.905 1.00 . A A . 19 PRO HG2 1 1 20 5726 1 1 19 PRO HG3 H -3.873 1.272 2.294 1.00 . A A . 19 PRO HG3 1 1 20 5727 1 1 19 PRO N N -2.548 4.077 1.991 1.00 . A A . 19 PRO N 1 1 20 5728 1 1 19 PRO O O -2.890 5.055 4.607 1.00 . A A . 19 PRO O 1 1 20 5729 1 1 20 SER C C -6.100 7.274 5.670 1.00 . A A . 20 SER C 1 1 20 5730 1 1 20 SER CA C -4.678 7.122 5.129 1.00 . A A . 20 SER CA 1 1 20 5731 1 1 20 SER CB C -4.077 8.500 4.825 1.00 . A A . 20 SER CB 1 1 20 5732 1 1 20 SER H H -5.322 6.439 3.229 1.00 . A A . 20 SER H 1 1 20 5733 1 1 20 SER HA H -4.074 6.637 5.881 1.00 . A A . 20 SER HA 1 1 20 5734 1 1 20 SER HB2 H -4.232 9.152 5.671 1.00 . A A . 20 SER HB2 1 1 20 5735 1 1 20 SER HB3 H -3.017 8.394 4.643 1.00 . A A . 20 SER HB3 1 1 20 5736 1 1 20 SER HG H -4.135 8.918 2.910 1.00 . A A . 20 SER HG 1 1 20 5737 1 1 20 SER N N -4.657 6.282 3.933 1.00 . A A . 20 SER N 1 1 20 5738 1 1 20 SER O O -7.005 7.621 4.880 1.00 . A A . 20 SER O 1 1 20 5739 1 1 20 SER OXT O -6.297 7.042 6.881 1.00 . A A . 20 SER OXT 1 1 20 5740 1 1 20 SER OG O -4.680 9.086 3.683 1.00 . A A . 20 SER OG 1 1 21 5741 1 1 1 ASP C C -6.621 -3.251 4.699 1.00 . A A . 1 ASP C 1 1 21 5742 1 1 1 ASP CA C -6.777 -4.360 5.738 1.00 . A A . 1 ASP CA 1 1 21 5743 1 1 1 ASP CB C -7.027 -5.705 5.047 1.00 . A A . 1 ASP CB 1 1 21 5744 1 1 1 ASP CG C -6.497 -6.877 5.852 1.00 . A A . 1 ASP CG 1 1 21 5745 1 1 1 ASP H1 H -7.953 -4.847 7.357 1.00 . A A . 1 ASP H1 1 1 21 5746 1 1 1 ASP H2 H -8.782 -4.039 6.090 1.00 . A A . 1 ASP H2 1 1 21 5747 1 1 1 ASP H3 H -7.725 -3.165 7.122 1.00 . A A . 1 ASP H3 1 1 21 5748 1 1 1 ASP HA H -5.871 -4.424 6.321 1.00 . A A . 1 ASP HA 1 1 21 5749 1 1 1 ASP HB2 H -8.089 -5.839 4.907 1.00 . A A . 1 ASP HB2 1 1 21 5750 1 1 1 ASP HB3 H -6.540 -5.704 4.083 1.00 . A A . 1 ASP HB3 1 1 21 5751 1 1 1 ASP N N -7.911 -4.077 6.659 1.00 . A A . 1 ASP N 1 1 21 5752 1 1 1 ASP O O -7.381 -3.182 3.730 1.00 . A A . 1 ASP O 1 1 21 5753 1 1 1 ASP OD1 O -7.256 -7.417 6.685 1.00 . A A . 1 ASP OD1 1 1 21 5754 1 1 1 ASP OD2 O -5.324 -7.254 5.649 1.00 . A A . 1 ASP OD2 1 1 21 5755 1 1 2 ALA C C -3.884 -0.927 3.963 1.00 . A A . 2 ALA C 1 1 21 5756 1 1 2 ALA CA C -5.370 -1.273 3.997 1.00 . A A . 2 ALA CA 1 1 21 5757 1 1 2 ALA CB C -6.190 -0.057 4.398 1.00 . A A . 2 ALA CB 1 1 21 5758 1 1 2 ALA H H -5.063 -2.492 5.702 1.00 . A A . 2 ALA H 1 1 21 5759 1 1 2 ALA HA H -5.680 -1.576 3.008 1.00 . A A . 2 ALA HA 1 1 21 5760 1 1 2 ALA HB1 H -5.998 0.749 3.706 1.00 . A A . 2 ALA HB1 1 1 21 5761 1 1 2 ALA HB2 H -5.912 0.251 5.395 1.00 . A A . 2 ALA HB2 1 1 21 5762 1 1 2 ALA HB3 H -7.240 -0.307 4.377 1.00 . A A . 2 ALA HB3 1 1 21 5763 1 1 2 ALA N N -5.631 -2.383 4.911 1.00 . A A . 2 ALA N 1 1 21 5764 1 1 2 ALA O O -3.219 -1.128 2.947 1.00 . A A . 2 ALA O 1 1 21 5765 1 1 3 TYR C C -1.073 -1.285 5.131 1.00 . A A . 3 TYR C 1 1 21 5766 1 1 3 TYR CA C -1.957 -0.042 5.178 1.00 . A A . 3 TYR CA 1 1 21 5767 1 1 3 TYR CB C -1.692 0.761 6.455 1.00 . A A . 3 TYR CB 1 1 21 5768 1 1 3 TYR CD1 C -0.707 3.023 5.885 1.00 . A A . 3 TYR CD1 1 1 21 5769 1 1 3 TYR CD2 C 0.756 1.324 6.706 1.00 . A A . 3 TYR CD2 1 1 21 5770 1 1 3 TYR CE1 C 0.358 3.898 5.797 1.00 . A A . 3 TYR CE1 1 1 21 5771 1 1 3 TYR CE2 C 1.824 2.195 6.616 1.00 . A A . 3 TYR CE2 1 1 21 5772 1 1 3 TYR CG C -0.526 1.719 6.342 1.00 . A A . 3 TYR CG 1 1 21 5773 1 1 3 TYR CZ C 1.620 3.480 6.162 1.00 . A A . 3 TYR CZ 1 1 21 5774 1 1 3 TYR H H -3.954 -0.277 5.858 1.00 . A A . 3 TYR H 1 1 21 5775 1 1 3 TYR HA H -1.721 0.572 4.326 1.00 . A A . 3 TYR HA 1 1 21 5776 1 1 3 TYR HB2 H -2.570 1.340 6.699 1.00 . A A . 3 TYR HB2 1 1 21 5777 1 1 3 TYR HB3 H -1.482 0.077 7.265 1.00 . A A . 3 TYR HB3 1 1 21 5778 1 1 3 TYR HD1 H -1.696 3.350 5.589 1.00 . A A . 3 TYR HD1 1 1 21 5779 1 1 3 TYR HD2 H 0.915 0.316 7.061 1.00 . A A . 3 TYR HD2 1 1 21 5780 1 1 3 TYR HE1 H 0.199 4.906 5.447 1.00 . A A . 3 TYR HE1 1 1 21 5781 1 1 3 TYR HE2 H 2.813 1.868 6.901 1.00 . A A . 3 TYR HE2 1 1 21 5782 1 1 3 TYR HH H 3.100 4.261 5.214 1.00 . A A . 3 TYR HH 1 1 21 5783 1 1 3 TYR N N -3.370 -0.410 5.082 1.00 . A A . 3 TYR N 1 1 21 5784 1 1 3 TYR O O -0.145 -1.362 4.324 1.00 . A A . 3 TYR O 1 1 21 5785 1 1 3 TYR OH O 2.682 4.351 6.074 1.00 . A A . 3 TYR OH 1 1 21 5786 1 1 4 ALA C C -0.814 -4.276 4.693 1.00 . A A . 4 ALA C 1 1 21 5787 1 1 4 ALA CA C -0.629 -3.519 6.007 1.00 . A A . 4 ALA CA 1 1 21 5788 1 1 4 ALA CB C -1.065 -4.379 7.186 1.00 . A A . 4 ALA CB 1 1 21 5789 1 1 4 ALA H H -2.144 -2.158 6.586 1.00 . A A . 4 ALA H 1 1 21 5790 1 1 4 ALA HA H 0.419 -3.278 6.129 1.00 . A A . 4 ALA HA 1 1 21 5791 1 1 4 ALA HB1 H -2.036 -4.806 6.981 1.00 . A A . 4 ALA HB1 1 1 21 5792 1 1 4 ALA HB2 H -1.120 -3.769 8.075 1.00 . A A . 4 ALA HB2 1 1 21 5793 1 1 4 ALA HB3 H -0.347 -5.172 7.338 1.00 . A A . 4 ALA HB3 1 1 21 5794 1 1 4 ALA N N -1.382 -2.269 5.980 1.00 . A A . 4 ALA N 1 1 21 5795 1 1 4 ALA O O 0.111 -4.934 4.214 1.00 . A A . 4 ALA O 1 1 21 5796 1 1 5 GLN C C -1.521 -4.151 1.703 1.00 . A A . 5 GLN C 1 1 21 5797 1 1 5 GLN CA C -2.313 -4.807 2.834 1.00 . A A . 5 GLN CA 1 1 21 5798 1 1 5 GLN CB C -3.817 -4.733 2.545 1.00 . A A . 5 GLN CB 1 1 21 5799 1 1 5 GLN CD C -3.966 -6.793 1.083 1.00 . A A . 5 GLN CD 1 1 21 5800 1 1 5 GLN CG C -4.209 -5.298 1.190 1.00 . A A . 5 GLN CG 1 1 21 5801 1 1 5 GLN H H -2.702 -3.602 4.527 1.00 . A A . 5 GLN H 1 1 21 5802 1 1 5 GLN HA H -2.019 -5.843 2.912 1.00 . A A . 5 GLN HA 1 1 21 5803 1 1 5 GLN HB2 H -4.345 -5.287 3.308 1.00 . A A . 5 GLN HB2 1 1 21 5804 1 1 5 GLN HB3 H -4.128 -3.700 2.584 1.00 . A A . 5 GLN HB3 1 1 21 5805 1 1 5 GLN HE21 H -2.307 -6.481 0.025 1.00 . A A . 5 GLN HE21 1 1 21 5806 1 1 5 GLN HE22 H -2.706 -8.134 0.328 1.00 . A A . 5 GLN HE22 1 1 21 5807 1 1 5 GLN HG2 H -5.259 -5.106 1.024 1.00 . A A . 5 GLN HG2 1 1 21 5808 1 1 5 GLN HG3 H -3.629 -4.797 0.429 1.00 . A A . 5 GLN HG3 1 1 21 5809 1 1 5 GLN N N -2.011 -4.156 4.104 1.00 . A A . 5 GLN N 1 1 21 5810 1 1 5 GLN NE2 N -2.884 -7.174 0.411 1.00 . A A . 5 GLN NE2 1 1 21 5811 1 1 5 GLN O O -1.019 -4.834 0.810 1.00 . A A . 5 GLN O 1 1 21 5812 1 1 5 GLN OE1 O -4.742 -7.597 1.600 1.00 . A A . 5 GLN OE1 1 1 21 5813 1 1 6 TRP C C 0.798 -2.510 0.725 1.00 . A A . 6 TRP C 1 1 21 5814 1 1 6 TRP CA C -0.659 -2.059 0.762 1.00 . A A . 6 TRP CA 1 1 21 5815 1 1 6 TRP CB C -0.729 -0.563 1.080 1.00 . A A . 6 TRP CB 1 1 21 5816 1 1 6 TRP CD1 C -0.342 0.593 -1.163 1.00 . A A . 6 TRP CD1 1 1 21 5817 1 1 6 TRP CD2 C 1.277 0.954 0.337 1.00 . A A . 6 TRP CD2 1 1 21 5818 1 1 6 TRP CE2 C 1.603 1.637 -0.848 1.00 . A A . 6 TRP CE2 1 1 21 5819 1 1 6 TRP CE3 C 2.153 1.038 1.425 1.00 . A A . 6 TRP CE3 1 1 21 5820 1 1 6 TRP CG C 0.026 0.291 0.111 1.00 . A A . 6 TRP CG 1 1 21 5821 1 1 6 TRP CH2 C 3.601 2.463 0.096 1.00 . A A . 6 TRP CH2 1 1 21 5822 1 1 6 TRP CZ2 C 2.763 2.394 -0.981 1.00 . A A . 6 TRP CZ2 1 1 21 5823 1 1 6 TRP CZ3 C 3.306 1.794 1.293 1.00 . A A . 6 TRP CZ3 1 1 21 5824 1 1 6 TRP H H -1.819 -2.341 2.509 1.00 . A A . 6 TRP H 1 1 21 5825 1 1 6 TRP HA H -1.109 -2.240 -0.203 1.00 . A A . 6 TRP HA 1 1 21 5826 1 1 6 TRP HB2 H -1.759 -0.247 1.069 1.00 . A A . 6 TRP HB2 1 1 21 5827 1 1 6 TRP HB3 H -0.318 -0.391 2.062 1.00 . A A . 6 TRP HB3 1 1 21 5828 1 1 6 TRP HD1 H -1.245 0.242 -1.635 1.00 . A A . 6 TRP HD1 1 1 21 5829 1 1 6 TRP HE1 H 0.561 1.745 -2.659 1.00 . A A . 6 TRP HE1 1 1 21 5830 1 1 6 TRP HE3 H 1.943 0.526 2.354 1.00 . A A . 6 TRP HE3 1 1 21 5831 1 1 6 TRP HH2 H 4.507 3.049 0.038 1.00 . A A . 6 TRP HH2 1 1 21 5832 1 1 6 TRP HZ2 H 3.007 2.910 -1.898 1.00 . A A . 6 TRP HZ2 1 1 21 5833 1 1 6 TRP HZ3 H 3.997 1.871 2.121 1.00 . A A . 6 TRP HZ3 1 1 21 5834 1 1 6 TRP N N -1.403 -2.822 1.762 1.00 . A A . 6 TRP N 1 1 21 5835 1 1 6 TRP NE1 N 0.601 1.396 -1.747 1.00 . A A . 6 TRP NE1 1 1 21 5836 1 1 6 TRP O O 1.350 -2.778 -0.343 1.00 . A A . 6 TRP O 1 1 21 5837 1 1 7 LEU C C 2.966 -4.469 1.590 1.00 . A A . 7 LEU C 1 1 21 5838 1 1 7 LEU CA C 2.794 -3.017 2.041 1.00 . A A . 7 LEU CA 1 1 21 5839 1 1 7 LEU CB C 3.254 -2.848 3.492 1.00 . A A . 7 LEU CB 1 1 21 5840 1 1 7 LEU CD1 C 3.270 -1.389 5.535 1.00 . A A . 7 LEU CD1 1 1 21 5841 1 1 7 LEU CD2 C 4.380 -0.600 3.435 1.00 . A A . 7 LEU CD2 1 1 21 5842 1 1 7 LEU CG C 3.226 -1.408 4.015 1.00 . A A . 7 LEU CG 1 1 21 5843 1 1 7 LEU H H 0.898 -2.368 2.718 1.00 . A A . 7 LEU H 1 1 21 5844 1 1 7 LEU HA H 3.395 -2.383 1.407 1.00 . A A . 7 LEU HA 1 1 21 5845 1 1 7 LEU HB2 H 2.612 -3.449 4.121 1.00 . A A . 7 LEU HB2 1 1 21 5846 1 1 7 LEU HB3 H 4.262 -3.220 3.578 1.00 . A A . 7 LEU HB3 1 1 21 5847 1 1 7 LEU HD11 H 4.244 -1.713 5.871 1.00 . A A . 7 LEU HD11 1 1 21 5848 1 1 7 LEU HD12 H 2.515 -2.055 5.925 1.00 . A A . 7 LEU HD12 1 1 21 5849 1 1 7 LEU HD13 H 3.082 -0.386 5.887 1.00 . A A . 7 LEU HD13 1 1 21 5850 1 1 7 LEU HD21 H 4.195 -0.405 2.388 1.00 . A A . 7 LEU HD21 1 1 21 5851 1 1 7 LEU HD22 H 5.299 -1.157 3.541 1.00 . A A . 7 LEU HD22 1 1 21 5852 1 1 7 LEU HD23 H 4.464 0.338 3.965 1.00 . A A . 7 LEU HD23 1 1 21 5853 1 1 7 LEU HG H 2.302 -0.940 3.706 1.00 . A A . 7 LEU HG 1 1 21 5854 1 1 7 LEU N N 1.404 -2.593 1.908 1.00 . A A . 7 LEU N 1 1 21 5855 1 1 7 LEU O O 3.980 -4.822 0.985 1.00 . A A . 7 LEU O 1 1 21 5856 1 1 8 ALA C C 1.739 -6.888 -0.014 1.00 . A A . 8 ALA C 1 1 21 5857 1 1 8 ALA CA C 1.985 -6.711 1.489 1.00 . A A . 8 ALA CA 1 1 21 5858 1 1 8 ALA CB C 0.955 -7.499 2.287 1.00 . A A . 8 ALA CB 1 1 21 5859 1 1 8 ALA H H 1.176 -4.952 2.351 1.00 . A A . 8 ALA H 1 1 21 5860 1 1 8 ALA HA H 2.963 -7.101 1.729 1.00 . A A . 8 ALA HA 1 1 21 5861 1 1 8 ALA HB1 H 0.403 -6.827 2.928 1.00 . A A . 8 ALA HB1 1 1 21 5862 1 1 8 ALA HB2 H 1.458 -8.239 2.892 1.00 . A A . 8 ALA HB2 1 1 21 5863 1 1 8 ALA HB3 H 0.272 -7.991 1.610 1.00 . A A . 8 ALA HB3 1 1 21 5864 1 1 8 ALA N N 1.959 -5.300 1.876 1.00 . A A . 8 ALA N 1 1 21 5865 1 1 8 ALA O O 2.081 -7.925 -0.583 1.00 . A A . 8 ALA O 1 1 21 5866 1 1 9 ASP C C 2.059 -5.423 -2.921 1.00 . A A . 9 ASP C 1 1 21 5867 1 1 9 ASP CA C 0.866 -5.917 -2.090 1.00 . A A . 9 ASP CA 1 1 21 5868 1 1 9 ASP CB C -0.375 -5.075 -2.415 1.00 . A A . 9 ASP CB 1 1 21 5869 1 1 9 ASP CG C -1.394 -5.837 -3.240 1.00 . A A . 9 ASP CG 1 1 21 5870 1 1 9 ASP H H 0.903 -5.067 -0.149 1.00 . A A . 9 ASP H 1 1 21 5871 1 1 9 ASP HA H 0.667 -6.945 -2.351 1.00 . A A . 9 ASP HA 1 1 21 5872 1 1 9 ASP HB2 H -0.846 -4.767 -1.494 1.00 . A A . 9 ASP HB2 1 1 21 5873 1 1 9 ASP HB3 H -0.074 -4.198 -2.970 1.00 . A A . 9 ASP HB3 1 1 21 5874 1 1 9 ASP N N 1.150 -5.869 -0.654 1.00 . A A . 9 ASP N 1 1 21 5875 1 1 9 ASP O O 1.910 -5.115 -4.106 1.00 . A A . 9 ASP O 1 1 21 5876 1 1 9 ASP OD1 O -1.273 -5.833 -4.483 1.00 . A A . 9 ASP OD1 1 1 21 5877 1 1 9 ASP OD2 O -2.312 -6.437 -2.643 1.00 . A A . 9 ASP OD2 1 1 21 5878 1 1 10 DAL C C 4.799 -3.450 -2.611 1.00 . A A . 10 DAL C 1 1 21 5879 1 1 10 DAL CA C 4.448 -4.895 -2.979 1.00 . A A . 10 DAL CA 1 1 21 5880 1 1 10 DAL CB C 5.607 -5.815 -2.637 1.00 . A A . 10 DAL CB 1 1 21 5881 1 1 10 DAL H H 3.300 -5.606 -1.355 1.00 . A A . 10 DAL H 1 1 21 5882 1 1 10 DAL HA H 4.275 -4.954 -4.043 1.00 . A A . 10 DAL HA 1 1 21 5883 1 1 10 DAL HB1 H 6.474 -5.533 -3.215 1.00 . A A . 10 DAL HB1 1 1 21 5884 1 1 10 DAL HB2 H 5.336 -6.835 -2.865 1.00 . A A . 10 DAL HB2 1 1 21 5885 1 1 10 DAL HB3 H 5.831 -5.727 -1.585 1.00 . A A . 10 DAL HB3 1 1 21 5886 1 1 10 DAL N N 3.239 -5.350 -2.297 1.00 . A A . 10 DAL N 1 1 21 5887 1 1 10 DAL O O 5.824 -2.927 -3.053 1.00 . A A . 10 DAL O 1 1 21 5888 1 1 11 GLY C C 4.087 -0.463 -2.547 1.00 . A A . 11 GLY C 1 1 21 5889 1 1 11 GLY CA C 4.193 -1.437 -1.394 1.00 . A A . 11 GLY CA 1 1 21 5890 1 1 11 GLY H H 3.150 -3.273 -1.481 1.00 . A A . 11 GLY H 1 1 21 5891 1 1 11 GLY HA2 H 3.472 -1.162 -0.638 1.00 . A A . 11 GLY HA2 1 1 21 5892 1 1 11 GLY HA3 H 5.185 -1.370 -0.971 1.00 . A A . 11 GLY HA3 1 1 21 5893 1 1 11 GLY N N 3.949 -2.809 -1.802 1.00 . A A . 11 GLY N 1 1 21 5894 1 1 11 GLY O O 2.990 -0.031 -2.902 1.00 . A A . 11 GLY O 1 1 21 5895 1 1 12 TRP C C 5.317 0.089 -5.606 1.00 . A A . 12 TRP C 1 1 21 5896 1 1 12 TRP CA C 5.263 0.812 -4.258 1.00 . A A . 12 TRP CA 1 1 21 5897 1 1 12 TRP CB C 6.439 1.775 -4.098 1.00 . A A . 12 TRP CB 1 1 21 5898 1 1 12 TRP CD1 C 6.647 3.145 -1.950 1.00 . A A . 12 TRP CD1 1 1 21 5899 1 1 12 TRP CD2 C 5.106 3.906 -3.386 1.00 . A A . 12 TRP CD2 1 1 21 5900 1 1 12 TRP CE2 C 5.104 4.729 -2.247 1.00 . A A . 12 TRP CE2 1 1 21 5901 1 1 12 TRP CE3 C 4.217 4.196 -4.430 1.00 . A A . 12 TRP CE3 1 1 21 5902 1 1 12 TRP CG C 6.100 2.898 -3.174 1.00 . A A . 12 TRP CG 1 1 21 5903 1 1 12 TRP CH2 C 3.389 6.076 -3.150 1.00 . A A . 12 TRP CH2 1 1 21 5904 1 1 12 TRP CZ2 C 4.248 5.814 -2.116 1.00 . A A . 12 TRP CZ2 1 1 21 5905 1 1 12 TRP CZ3 C 3.371 5.279 -4.302 1.00 . A A . 12 TRP CZ3 1 1 21 5906 1 1 12 TRP H H 6.072 -0.500 -2.807 1.00 . A A . 12 TRP H 1 1 21 5907 1 1 12 TRP HA H 4.347 1.386 -4.221 1.00 . A A . 12 TRP HA 1 1 21 5908 1 1 12 TRP HB2 H 7.284 1.242 -3.688 1.00 . A A . 12 TRP HB2 1 1 21 5909 1 1 12 TRP HB3 H 6.705 2.190 -5.059 1.00 . A A . 12 TRP HB3 1 1 21 5910 1 1 12 TRP HD1 H 7.431 2.553 -1.502 1.00 . A A . 12 TRP HD1 1 1 21 5911 1 1 12 TRP HE1 H 6.274 4.625 -0.507 1.00 . A A . 12 TRP HE1 1 1 21 5912 1 1 12 TRP HE3 H 4.185 3.593 -5.325 1.00 . A A . 12 TRP HE3 1 1 21 5913 1 1 12 TRP HH2 H 2.710 6.914 -3.091 1.00 . A A . 12 TRP HH2 1 1 21 5914 1 1 12 TRP HZ2 H 4.243 6.427 -1.231 1.00 . A A . 12 TRP HZ2 1 1 21 5915 1 1 12 TRP HZ3 H 2.683 5.519 -5.100 1.00 . A A . 12 TRP HZ3 1 1 21 5916 1 1 12 TRP N N 5.231 -0.119 -3.135 1.00 . A A . 12 TRP N 1 1 21 5917 1 1 12 TRP NE1 N 6.053 4.246 -1.384 1.00 . A A . 12 TRP NE1 1 1 21 5918 1 1 12 TRP O O 5.502 0.721 -6.647 1.00 . A A . 12 TRP O 1 1 21 5919 1 1 13 ALA C C 3.720 -2.000 -7.441 1.00 . A A . 13 ALA C 1 1 21 5920 1 1 13 ALA CA C 5.109 -2.025 -6.811 1.00 . A A . 13 ALA CA 1 1 21 5921 1 1 13 ALA CB C 5.549 -3.454 -6.532 1.00 . A A . 13 ALA CB 1 1 21 5922 1 1 13 ALA H H 4.950 -1.681 -4.733 1.00 . A A . 13 ALA H 1 1 21 5923 1 1 13 ALA HA H 5.812 -1.582 -7.499 1.00 . A A . 13 ALA HA 1 1 21 5924 1 1 13 ALA HB1 H 4.773 -4.137 -6.843 1.00 . A A . 13 ALA HB1 1 1 21 5925 1 1 13 ALA HB2 H 5.734 -3.575 -5.476 1.00 . A A . 13 ALA HB2 1 1 21 5926 1 1 13 ALA HB3 H 6.453 -3.662 -7.083 1.00 . A A . 13 ALA HB3 1 1 21 5927 1 1 13 ALA N N 5.119 -1.233 -5.586 1.00 . A A . 13 ALA N 1 1 21 5928 1 1 13 ALA O O 3.581 -2.051 -8.664 1.00 . A A . 13 ALA O 1 1 21 5929 1 1 14 SER C C 1.065 -0.574 -7.877 1.00 . A A . 14 SER C 1 1 21 5930 1 1 14 SER CA C 1.308 -1.836 -7.043 1.00 . A A . 14 SER CA 1 1 21 5931 1 1 14 SER CB C 0.350 -1.874 -5.842 1.00 . A A . 14 SER CB 1 1 21 5932 1 1 14 SER H H 2.878 -1.845 -5.627 1.00 . A A . 14 SER H 1 1 21 5933 1 1 14 SER HA H 1.126 -2.698 -7.665 1.00 . A A . 14 SER HA 1 1 21 5934 1 1 14 SER HB2 H -0.576 -1.386 -6.107 1.00 . A A . 14 SER HB2 1 1 21 5935 1 1 14 SER HB3 H 0.149 -2.902 -5.577 1.00 . A A . 14 SER HB3 1 1 21 5936 1 1 14 SER HG H 1.260 -1.865 -4.100 1.00 . A A . 14 SER HG 1 1 21 5937 1 1 14 SER N N 2.694 -1.897 -6.589 1.00 . A A . 14 SER N 1 1 21 5938 1 1 14 SER O O 0.209 -0.564 -8.763 1.00 . A A . 14 SER O 1 1 21 5939 1 1 14 SER OG O 0.905 -1.213 -4.714 1.00 . A A . 14 SER OG 1 1 21 5940 1 1 15 DAL C C 0.863 2.768 -7.531 1.00 . A A . 15 DAL C 1 1 21 5941 1 1 15 DAL CA C 1.703 1.753 -8.311 1.00 . A A . 15 DAL CA 1 1 21 5942 1 1 15 DAL CB C 3.083 2.319 -8.610 1.00 . A A . 15 DAL CB 1 1 21 5943 1 1 15 DAL H H 2.494 0.414 -6.871 1.00 . A A . 15 DAL H 1 1 21 5944 1 1 15 DAL HA H 1.218 1.550 -9.253 1.00 . A A . 15 DAL HA 1 1 21 5945 1 1 15 DAL HB1 H 3.241 2.328 -9.678 1.00 . A A . 15 DAL HB1 1 1 21 5946 1 1 15 DAL HB2 H 3.835 1.704 -8.140 1.00 . A A . 15 DAL HB2 1 1 21 5947 1 1 15 DAL HB3 H 3.151 3.326 -8.227 1.00 . A A . 15 DAL HB3 1 1 21 5948 1 1 15 DAL N N 1.829 0.487 -7.588 1.00 . A A . 15 DAL N 1 1 21 5949 1 1 15 DAL O O 0.990 3.979 -7.732 1.00 . A A . 15 DAL O 1 1 21 5950 1 1 16 ARG C C -0.128 3.576 -4.562 1.00 . A A . 16 ARG C 1 1 21 5951 1 1 16 ARG CA C -0.855 3.125 -5.830 1.00 . A A . 16 ARG CA 1 1 21 5952 1 1 16 ARG CB C -2.146 2.369 -5.455 1.00 . A A . 16 ARG CB 1 1 21 5953 1 1 16 ARG CD C -2.888 0.183 -4.450 1.00 . A A . 16 ARG CD 1 1 21 5954 1 1 16 ARG CG C -1.966 1.384 -4.305 1.00 . A A . 16 ARG CG 1 1 21 5955 1 1 16 ARG CZ C -3.473 -0.469 -2.133 1.00 . A A . 16 ARG CZ 1 1 21 5956 1 1 16 ARG H H -0.049 1.295 -6.529 1.00 . A A . 16 ARG H 1 1 21 5957 1 1 16 ARG HA H -1.106 4.001 -6.415 1.00 . A A . 16 ARG HA 1 1 21 5958 1 1 16 ARG HB2 H -2.900 3.087 -5.169 1.00 . A A . 16 ARG HB2 1 1 21 5959 1 1 16 ARG HB3 H -2.501 1.812 -6.317 1.00 . A A . 16 ARG HB3 1 1 21 5960 1 1 16 ARG HD2 H -3.901 0.535 -4.577 1.00 . A A . 16 ARG HD2 1 1 21 5961 1 1 16 ARG HD3 H -2.591 -0.375 -5.325 1.00 . A A . 16 ARG HD3 1 1 21 5962 1 1 16 ARG HE H -2.301 -1.520 -3.367 1.00 . A A . 16 ARG HE 1 1 21 5963 1 1 16 ARG HG2 H -0.941 1.039 -4.297 1.00 . A A . 16 ARG HG2 1 1 21 5964 1 1 16 ARG HG3 H -2.187 1.887 -3.375 1.00 . A A . 16 ARG HG3 1 1 21 5965 1 1 16 ARG HH11 H -4.284 1.295 -2.717 1.00 . A A . 16 ARG HH11 1 1 21 5966 1 1 16 ARG HH12 H -4.676 0.796 -1.107 1.00 . A A . 16 ARG HH12 1 1 21 5967 1 1 16 ARG HH21 H -2.827 -2.170 -1.246 1.00 . A A . 16 ARG HH21 1 1 21 5968 1 1 16 ARG HH22 H -3.848 -1.167 -0.270 1.00 . A A . 16 ARG HH22 1 1 21 5969 1 1 16 ARG N N 0.006 2.268 -6.643 1.00 . A A . 16 ARG N 1 1 21 5970 1 1 16 ARG NE N -2.836 -0.702 -3.285 1.00 . A A . 16 ARG NE 1 1 21 5971 1 1 16 ARG NH1 N -4.205 0.632 -1.973 1.00 . A A . 16 ARG NH1 1 1 21 5972 1 1 16 ARG NH2 N -3.375 -1.340 -1.134 1.00 . A A . 16 ARG NH2 1 1 21 5973 1 1 16 ARG O O 0.777 2.889 -4.086 1.00 . A A . 16 ARG O 1 1 21 5974 1 1 17 PRO C C -0.502 4.667 -1.504 1.00 . A A . 17 PRO C 1 1 21 5975 1 1 17 PRO CA C 0.103 5.265 -2.775 1.00 . A A . 17 PRO CA 1 1 21 5976 1 1 17 PRO CB C -0.184 6.772 -2.842 1.00 . A A . 17 PRO CB 1 1 21 5977 1 1 17 PRO CD C -1.560 5.634 -4.477 1.00 . A A . 17 PRO CD 1 1 21 5978 1 1 17 PRO CG C -1.065 6.986 -4.039 1.00 . A A . 17 PRO CG 1 1 21 5979 1 1 17 PRO HA H 1.168 5.100 -2.766 1.00 . A A . 17 PRO HA 1 1 21 5980 1 1 17 PRO HB2 H -0.681 7.082 -1.935 1.00 . A A . 17 PRO HB2 1 1 21 5981 1 1 17 PRO HB3 H 0.751 7.307 -2.941 1.00 . A A . 17 PRO HB3 1 1 21 5982 1 1 17 PRO HD2 H -2.507 5.405 -4.016 1.00 . A A . 17 PRO HD2 1 1 21 5983 1 1 17 PRO HD3 H -1.641 5.595 -5.551 1.00 . A A . 17 PRO HD3 1 1 21 5984 1 1 17 PRO HG2 H -1.900 7.615 -3.768 1.00 . A A . 17 PRO HG2 1 1 21 5985 1 1 17 PRO HG3 H -0.494 7.448 -4.831 1.00 . A A . 17 PRO HG3 1 1 21 5986 1 1 17 PRO N N -0.510 4.737 -3.992 1.00 . A A . 17 PRO N 1 1 21 5987 1 1 17 PRO O O -1.553 4.023 -1.545 1.00 . A A . 17 PRO O 1 1 21 5988 1 1 18 PRO C C -1.624 4.933 1.393 1.00 . A A . 18 PRO C 1 1 21 5989 1 1 18 PRO CA C -0.286 4.347 0.942 1.00 . A A . 18 PRO CA 1 1 21 5990 1 1 18 PRO CB C 0.812 4.773 1.921 1.00 . A A . 18 PRO CB 1 1 21 5991 1 1 18 PRO CD C 1.435 5.614 -0.234 1.00 . A A . 18 PRO CD 1 1 21 5992 1 1 18 PRO CG C 1.558 5.868 1.240 1.00 . A A . 18 PRO CG 1 1 21 5993 1 1 18 PRO HA H -0.355 3.269 0.925 1.00 . A A . 18 PRO HA 1 1 21 5994 1 1 18 PRO HB2 H 0.357 5.125 2.832 1.00 . A A . 18 PRO HB2 1 1 21 5995 1 1 18 PRO HB3 H 1.449 3.935 2.138 1.00 . A A . 18 PRO HB3 1 1 21 5996 1 1 18 PRO HD2 H 1.385 6.548 -0.773 1.00 . A A . 18 PRO HD2 1 1 21 5997 1 1 18 PRO HD3 H 2.265 5.020 -0.584 1.00 . A A . 18 PRO HD3 1 1 21 5998 1 1 18 PRO HG2 H 1.119 6.822 1.492 1.00 . A A . 18 PRO HG2 1 1 21 5999 1 1 18 PRO HG3 H 2.596 5.843 1.538 1.00 . A A . 18 PRO HG3 1 1 21 6000 1 1 18 PRO N N 0.170 4.869 -0.353 1.00 . A A . 18 PRO N 1 1 21 6001 1 1 18 PRO O O -1.919 6.103 1.141 1.00 . A A . 18 PRO O 1 1 21 6002 1 1 19 PRO C C -3.634 5.340 3.891 1.00 . A A . 19 PRO C 1 1 21 6003 1 1 19 PRO CA C -3.745 4.550 2.589 1.00 . A A . 19 PRO CA 1 1 21 6004 1 1 19 PRO CB C -4.491 3.239 2.819 1.00 . A A . 19 PRO CB 1 1 21 6005 1 1 19 PRO CD C -2.158 2.718 2.428 1.00 . A A . 19 PRO CD 1 1 21 6006 1 1 19 PRO CG C -3.456 2.179 2.975 1.00 . A A . 19 PRO CG 1 1 21 6007 1 1 19 PRO HA H -4.273 5.142 1.857 1.00 . A A . 19 PRO HA 1 1 21 6008 1 1 19 PRO HB2 H -5.104 3.320 3.703 1.00 . A A . 19 PRO HB2 1 1 21 6009 1 1 19 PRO HB3 H -5.108 3.039 1.974 1.00 . A A . 19 PRO HB3 1 1 21 6010 1 1 19 PRO HD2 H -1.379 2.662 3.172 1.00 . A A . 19 PRO HD2 1 1 21 6011 1 1 19 PRO HD3 H -1.878 2.164 1.548 1.00 . A A . 19 PRO HD3 1 1 21 6012 1 1 19 PRO HG2 H -3.353 1.926 4.014 1.00 . A A . 19 PRO HG2 1 1 21 6013 1 1 19 PRO HG3 H -3.755 1.305 2.415 1.00 . A A . 19 PRO HG3 1 1 21 6014 1 1 19 PRO N N -2.446 4.120 2.085 1.00 . A A . 19 PRO N 1 1 21 6015 1 1 19 PRO O O -2.910 4.949 4.806 1.00 . A A . 19 PRO O 1 1 21 6016 1 1 20 SER C C -5.598 8.177 5.226 1.00 . A A . 20 SER C 1 1 21 6017 1 1 20 SER CA C -4.344 7.306 5.156 1.00 . A A . 20 SER CA 1 1 21 6018 1 1 20 SER CB C -3.089 8.187 5.168 1.00 . A A . 20 SER CB 1 1 21 6019 1 1 20 SER H H -4.916 6.716 3.202 1.00 . A A . 20 SER H 1 1 21 6020 1 1 20 SER HA H -4.324 6.659 6.021 1.00 . A A . 20 SER HA 1 1 21 6021 1 1 20 SER HB2 H -3.190 8.943 5.932 1.00 . A A . 20 SER HB2 1 1 21 6022 1 1 20 SER HB3 H -2.225 7.575 5.381 1.00 . A A . 20 SER HB3 1 1 21 6023 1 1 20 SER HG H -2.293 8.309 3.381 1.00 . A A . 20 SER HG 1 1 21 6024 1 1 20 SER N N -4.358 6.456 3.966 1.00 . A A . 20 SER N 1 1 21 6025 1 1 20 SER O O -6.264 8.167 6.283 1.00 . A A . 20 SER O 1 1 21 6026 1 1 20 SER OXT O -5.904 8.863 4.226 1.00 . A A . 20 SER OXT 1 1 21 6027 1 1 20 SER OG O -2.897 8.828 3.917 1.00 . A A . 20 SER OG 1 1 22 6028 1 1 1 ASP C C -6.189 -2.685 5.780 1.00 . A A . 1 ASP C 1 1 22 6029 1 1 1 ASP CA C -6.806 -2.585 7.175 1.00 . A A . 1 ASP CA 1 1 22 6030 1 1 1 ASP CB C -8.259 -2.100 7.077 1.00 . A A . 1 ASP CB 1 1 22 6031 1 1 1 ASP CG C -9.005 -2.230 8.392 1.00 . A A . 1 ASP CG 1 1 22 6032 1 1 1 ASP H1 H -6.228 -0.676 7.701 1.00 . A A . 1 ASP H1 1 1 22 6033 1 1 1 ASP H2 H -5.031 -1.881 7.951 1.00 . A A . 1 ASP H2 1 1 22 6034 1 1 1 ASP H3 H -6.372 -1.767 9.016 1.00 . A A . 1 ASP H3 1 1 22 6035 1 1 1 ASP HA H -6.789 -3.561 7.636 1.00 . A A . 1 ASP HA 1 1 22 6036 1 1 1 ASP HB2 H -8.266 -1.061 6.783 1.00 . A A . 1 ASP HB2 1 1 22 6037 1 1 1 ASP HB3 H -8.777 -2.684 6.331 1.00 . A A . 1 ASP HB3 1 1 22 6038 1 1 1 ASP N N -6.041 -1.642 8.038 1.00 . A A . 1 ASP N 1 1 22 6039 1 1 1 ASP O O -5.767 -3.763 5.357 1.00 . A A . 1 ASP O 1 1 22 6040 1 1 1 ASP OD1 O -9.533 -3.327 8.669 1.00 . A A . 1 ASP OD1 1 1 22 6041 1 1 1 ASP OD2 O -9.062 -1.234 9.144 1.00 . A A . 1 ASP OD2 1 1 22 6042 1 1 2 ALA C C -4.074 -1.185 3.752 1.00 . A A . 2 ALA C 1 1 22 6043 1 1 2 ALA CA C -5.570 -1.511 3.728 1.00 . A A . 2 ALA CA 1 1 22 6044 1 1 2 ALA CB C -6.314 -0.497 2.873 1.00 . A A . 2 ALA CB 1 1 22 6045 1 1 2 ALA H H -6.488 -0.729 5.469 1.00 . A A . 2 ALA H 1 1 22 6046 1 1 2 ALA HA H -5.705 -2.486 3.281 1.00 . A A . 2 ALA HA 1 1 22 6047 1 1 2 ALA HB1 H -6.263 0.475 3.341 1.00 . A A . 2 ALA HB1 1 1 22 6048 1 1 2 ALA HB2 H -7.347 -0.797 2.777 1.00 . A A . 2 ALA HB2 1 1 22 6049 1 1 2 ALA HB3 H -5.860 -0.451 1.895 1.00 . A A . 2 ALA HB3 1 1 22 6050 1 1 2 ALA N N -6.137 -1.555 5.074 1.00 . A A . 2 ALA N 1 1 22 6051 1 1 2 ALA O O -3.365 -1.453 2.783 1.00 . A A . 2 ALA O 1 1 22 6052 1 1 3 TYR C C -1.300 -1.490 4.960 1.00 . A A . 3 TYR C 1 1 22 6053 1 1 3 TYR CA C -2.186 -0.246 4.999 1.00 . A A . 3 TYR CA 1 1 22 6054 1 1 3 TYR CB C -1.951 0.539 6.295 1.00 . A A . 3 TYR CB 1 1 22 6055 1 1 3 TYR CD1 C -0.993 2.834 5.810 1.00 . A A . 3 TYR CD1 1 1 22 6056 1 1 3 TYR CD2 C 0.487 1.127 6.581 1.00 . A A . 3 TYR CD2 1 1 22 6057 1 1 3 TYR CE1 C 0.059 3.726 5.761 1.00 . A A . 3 TYR CE1 1 1 22 6058 1 1 3 TYR CE2 C 1.543 2.015 6.530 1.00 . A A . 3 TYR CE2 1 1 22 6059 1 1 3 TYR CG C -0.798 1.517 6.221 1.00 . A A . 3 TYR CG 1 1 22 6060 1 1 3 TYR CZ C 1.325 3.313 6.120 1.00 . A A . 3 TYR CZ 1 1 22 6061 1 1 3 TYR H H -4.214 -0.415 5.599 1.00 . A A . 3 TYR H 1 1 22 6062 1 1 3 TYR HA H -1.925 0.378 4.162 1.00 . A A . 3 TYR HA 1 1 22 6063 1 1 3 TYR HB2 H -2.840 1.102 6.535 1.00 . A A . 3 TYR HB2 1 1 22 6064 1 1 3 TYR HB3 H -1.746 -0.156 7.095 1.00 . A A . 3 TYR HB3 1 1 22 6065 1 1 3 TYR HD1 H -1.985 3.159 5.518 1.00 . A A . 3 TYR HD1 1 1 22 6066 1 1 3 TYR HD2 H 0.656 0.109 6.900 1.00 . A A . 3 TYR HD2 1 1 22 6067 1 1 3 TYR HE1 H -0.112 4.744 5.447 1.00 . A A . 3 TYR HE1 1 1 22 6068 1 1 3 TYR HE2 H 2.534 1.691 6.810 1.00 . A A . 3 TYR HE2 1 1 22 6069 1 1 3 TYR HH H 2.435 4.673 6.905 1.00 . A A . 3 TYR HH 1 1 22 6070 1 1 3 TYR N N -3.600 -0.605 4.860 1.00 . A A . 3 TYR N 1 1 22 6071 1 1 3 TYR O O -0.311 -1.529 4.226 1.00 . A A . 3 TYR O 1 1 22 6072 1 1 3 TYR OH O 2.375 4.201 6.071 1.00 . A A . 3 TYR OH 1 1 22 6073 1 1 4 ALA C C -1.020 -4.480 4.418 1.00 . A A . 4 ALA C 1 1 22 6074 1 1 4 ALA CA C -0.918 -3.762 5.763 1.00 . A A . 4 ALA CA 1 1 22 6075 1 1 4 ALA CB C -1.418 -4.660 6.886 1.00 . A A . 4 ALA CB 1 1 22 6076 1 1 4 ALA H H -2.478 -2.427 6.285 1.00 . A A . 4 ALA H 1 1 22 6077 1 1 4 ALA HA H 0.121 -3.524 5.954 1.00 . A A . 4 ALA HA 1 1 22 6078 1 1 4 ALA HB1 H -1.205 -4.198 7.839 1.00 . A A . 4 ALA HB1 1 1 22 6079 1 1 4 ALA HB2 H -0.921 -5.617 6.831 1.00 . A A . 4 ALA HB2 1 1 22 6080 1 1 4 ALA HB3 H -2.484 -4.802 6.786 1.00 . A A . 4 ALA HB3 1 1 22 6081 1 1 4 ALA N N -1.672 -2.511 5.734 1.00 . A A . 4 ALA N 1 1 22 6082 1 1 4 ALA O O -0.055 -5.098 3.964 1.00 . A A . 4 ALA O 1 1 22 6083 1 1 5 GLN C C -1.574 -4.296 1.404 1.00 . A A . 5 GLN C 1 1 22 6084 1 1 5 GLN CA C -2.411 -4.996 2.475 1.00 . A A . 5 GLN CA 1 1 22 6085 1 1 5 GLN CB C -3.897 -4.944 2.107 1.00 . A A . 5 GLN CB 1 1 22 6086 1 1 5 GLN CD C -4.154 -7.106 0.823 1.00 . A A . 5 GLN CD 1 1 22 6087 1 1 5 GLN CG C -4.217 -5.591 0.771 1.00 . A A . 5 GLN CG 1 1 22 6088 1 1 5 GLN H H -2.916 -3.857 4.179 1.00 . A A . 5 GLN H 1 1 22 6089 1 1 5 GLN HA H -2.099 -6.028 2.541 1.00 . A A . 5 GLN HA 1 1 22 6090 1 1 5 GLN HB2 H -4.464 -5.451 2.874 1.00 . A A . 5 GLN HB2 1 1 22 6091 1 1 5 GLN HB3 H -4.209 -3.911 2.066 1.00 . A A . 5 GLN HB3 1 1 22 6092 1 1 5 GLN HE21 H -2.218 -7.072 0.364 1.00 . A A . 5 GLN HE21 1 1 22 6093 1 1 5 GLN HE22 H -2.907 -8.639 0.596 1.00 . A A . 5 GLN HE22 1 1 22 6094 1 1 5 GLN HG2 H -5.212 -5.297 0.472 1.00 . A A . 5 GLN HG2 1 1 22 6095 1 1 5 GLN HG3 H -3.505 -5.239 0.042 1.00 . A A . 5 GLN HG3 1 1 22 6096 1 1 5 GLN N N -2.189 -4.376 3.775 1.00 . A A . 5 GLN N 1 1 22 6097 1 1 5 GLN NE2 N -2.974 -7.661 0.569 1.00 . A A . 5 GLN NE2 1 1 22 6098 1 1 5 GLN O O -1.037 -4.943 0.506 1.00 . A A . 5 GLN O 1 1 22 6099 1 1 5 GLN OE1 O -5.155 -7.771 1.089 1.00 . A A . 5 GLN OE1 1 1 22 6100 1 1 6 TRP C C 0.785 -2.611 0.606 1.00 . A A . 6 TRP C 1 1 22 6101 1 1 6 TRP CA C -0.674 -2.172 0.582 1.00 . A A . 6 TRP CA 1 1 22 6102 1 1 6 TRP CB C -0.774 -0.685 0.935 1.00 . A A . 6 TRP CB 1 1 22 6103 1 1 6 TRP CD1 C -0.303 0.529 -1.262 1.00 . A A . 6 TRP CD1 1 1 22 6104 1 1 6 TRP CD2 C 1.244 0.870 0.316 1.00 . A A . 6 TRP CD2 1 1 22 6105 1 1 6 TRP CE2 C 1.612 1.585 -0.837 1.00 . A A . 6 TRP CE2 1 1 22 6106 1 1 6 TRP CE3 C 2.071 0.937 1.441 1.00 . A A . 6 TRP CE3 1 1 22 6107 1 1 6 TRP CG C 0.012 0.200 0.020 1.00 . A A . 6 TRP CG 1 1 22 6108 1 1 6 TRP CH2 C 3.557 2.409 0.211 1.00 . A A . 6 TRP CH2 1 1 22 6109 1 1 6 TRP CZ2 C 2.767 2.357 -0.902 1.00 . A A . 6 TRP CZ2 1 1 22 6110 1 1 6 TRP CZ3 C 3.220 1.708 1.378 1.00 . A A . 6 TRP CZ3 1 1 22 6111 1 1 6 TRP H H -1.904 -2.517 2.268 1.00 . A A . 6 TRP H 1 1 22 6112 1 1 6 TRP HA H -1.073 -2.329 -0.408 1.00 . A A . 6 TRP HA 1 1 22 6113 1 1 6 TRP HB2 H -1.807 -0.380 0.887 1.00 . A A . 6 TRP HB2 1 1 22 6114 1 1 6 TRP HB3 H -0.408 -0.534 1.938 1.00 . A A . 6 TRP HB3 1 1 22 6115 1 1 6 TRP HD1 H -1.180 0.178 -1.781 1.00 . A A . 6 TRP HD1 1 1 22 6116 1 1 6 TRP HE1 H 0.648 1.727 -2.688 1.00 . A A . 6 TRP HE1 1 1 22 6117 1 1 6 TRP HE3 H 1.827 0.399 2.348 1.00 . A A . 6 TRP HE3 1 1 22 6118 1 1 6 TRP HH2 H 4.459 3.006 0.206 1.00 . A A . 6 TRP HH2 1 1 22 6119 1 1 6 TRP HZ2 H 3.043 2.899 -1.795 1.00 . A A . 6 TRP HZ2 1 1 22 6120 1 1 6 TRP HZ3 H 3.874 1.771 2.236 1.00 . A A . 6 TRP HZ3 1 1 22 6121 1 1 6 TRP N N -1.458 -2.969 1.521 1.00 . A A . 6 TRP N 1 1 22 6122 1 1 6 TRP NE1 N 0.653 1.356 -1.784 1.00 . A A . 6 TRP NE1 1 1 22 6123 1 1 6 TRP O O 1.389 -2.856 -0.440 1.00 . A A . 6 TRP O 1 1 22 6124 1 1 7 LEU C C 2.916 -4.580 1.528 1.00 . A A . 7 LEU C 1 1 22 6125 1 1 7 LEU CA C 2.721 -3.138 2.000 1.00 . A A . 7 LEU CA 1 1 22 6126 1 1 7 LEU CB C 3.114 -2.999 3.473 1.00 . A A . 7 LEU CB 1 1 22 6127 1 1 7 LEU CD1 C 3.094 -1.566 5.531 1.00 . A A . 7 LEU CD1 1 1 22 6128 1 1 7 LEU CD2 C 4.296 -0.780 3.478 1.00 . A A . 7 LEU CD2 1 1 22 6129 1 1 7 LEU CG C 3.102 -1.565 4.010 1.00 . A A . 7 LEU CG 1 1 22 6130 1 1 7 LEU H H 0.791 -2.514 2.605 1.00 . A A . 7 LEU H 1 1 22 6131 1 1 7 LEU HA H 3.347 -2.490 1.405 1.00 . A A . 7 LEU HA 1 1 22 6132 1 1 7 LEU HB2 H 2.426 -3.588 4.063 1.00 . A A . 7 LEU HB2 1 1 22 6133 1 1 7 LEU HB3 H 4.106 -3.401 3.603 1.00 . A A . 7 LEU HB3 1 1 22 6134 1 1 7 LEU HD11 H 2.873 -0.571 5.889 1.00 . A A . 7 LEU HD11 1 1 22 6135 1 1 7 LEU HD12 H 4.062 -1.875 5.897 1.00 . A A . 7 LEU HD12 1 1 22 6136 1 1 7 LEU HD13 H 2.338 -2.252 5.885 1.00 . A A . 7 LEU HD13 1 1 22 6137 1 1 7 LEU HD21 H 5.176 -1.405 3.498 1.00 . A A . 7 LEU HD21 1 1 22 6138 1 1 7 LEU HD22 H 4.458 0.091 4.097 1.00 . A A . 7 LEU HD22 1 1 22 6139 1 1 7 LEU HD23 H 4.099 -0.466 2.463 1.00 . A A . 7 LEU HD23 1 1 22 6140 1 1 7 LEU HG H 2.201 -1.071 3.675 1.00 . A A . 7 LEU HG 1 1 22 6141 1 1 7 LEU N N 1.336 -2.717 1.814 1.00 . A A . 7 LEU N 1 1 22 6142 1 1 7 LEU O O 3.953 -4.918 0.954 1.00 . A A . 7 LEU O 1 1 22 6143 1 1 8 ALA C C 1.736 -6.977 -0.162 1.00 . A A . 8 ALA C 1 1 22 6144 1 1 8 ALA CA C 1.947 -6.822 1.350 1.00 . A A . 8 ALA CA 1 1 22 6145 1 1 8 ALA CB C 0.904 -7.627 2.114 1.00 . A A . 8 ALA CB 1 1 22 6146 1 1 8 ALA H H 1.100 -5.083 2.214 1.00 . A A . 8 ALA H 1 1 22 6147 1 1 8 ALA HA H 2.921 -7.211 1.606 1.00 . A A . 8 ALA HA 1 1 22 6148 1 1 8 ALA HB1 H -0.053 -7.131 2.048 1.00 . A A . 8 ALA HB1 1 1 22 6149 1 1 8 ALA HB2 H 1.198 -7.705 3.150 1.00 . A A . 8 ALA HB2 1 1 22 6150 1 1 8 ALA HB3 H 0.827 -8.615 1.686 1.00 . A A . 8 ALA HB3 1 1 22 6151 1 1 8 ALA N N 1.902 -5.419 1.761 1.00 . A A . 8 ALA N 1 1 22 6152 1 1 8 ALA O O 2.059 -8.020 -0.732 1.00 . A A . 8 ALA O 1 1 22 6153 1 1 9 ASP C C 2.170 -5.436 -3.037 1.00 . A A . 9 ASP C 1 1 22 6154 1 1 9 ASP CA C 0.957 -5.958 -2.252 1.00 . A A . 9 ASP CA 1 1 22 6155 1 1 9 ASP CB C -0.286 -5.124 -2.600 1.00 . A A . 9 ASP CB 1 1 22 6156 1 1 9 ASP CG C -1.482 -5.987 -2.948 1.00 . A A . 9 ASP CG 1 1 22 6157 1 1 9 ASP H H 0.968 -5.127 -0.302 1.00 . A A . 9 ASP H 1 1 22 6158 1 1 9 ASP HA H 0.779 -6.985 -2.537 1.00 . A A . 9 ASP HA 1 1 22 6159 1 1 9 ASP HB2 H -0.548 -4.506 -1.755 1.00 . A A . 9 ASP HB2 1 1 22 6160 1 1 9 ASP HB3 H -0.065 -4.490 -3.447 1.00 . A A . 9 ASP HB3 1 1 22 6161 1 1 9 ASP N N 1.200 -5.933 -0.807 1.00 . A A . 9 ASP N 1 1 22 6162 1 1 9 ASP O O 2.053 -5.101 -4.218 1.00 . A A . 9 ASP O 1 1 22 6163 1 1 9 ASP OD1 O -1.606 -6.383 -4.126 1.00 . A A . 9 ASP OD1 1 1 22 6164 1 1 9 ASP OD2 O -2.295 -6.268 -2.043 1.00 . A A . 9 ASP OD2 1 1 22 6165 1 1 10 DAL C C 4.880 -3.449 -2.606 1.00 . A A . 10 DAL C 1 1 22 6166 1 1 10 DAL CA C 4.554 -4.889 -3.013 1.00 . A A . 10 DAL CA 1 1 22 6167 1 1 10 DAL CB C 5.712 -5.803 -2.654 1.00 . A A . 10 DAL CB 1 1 22 6168 1 1 10 DAL H H 3.366 -5.647 -1.439 1.00 . A A . 10 DAL H 1 1 22 6169 1 1 10 DAL HA H 4.415 -4.929 -4.083 1.00 . A A . 10 DAL HA 1 1 22 6170 1 1 10 DAL HB1 H 5.949 -5.682 -1.607 1.00 . A A . 10 DAL HB1 1 1 22 6171 1 1 10 DAL HB2 H 6.574 -5.545 -3.251 1.00 . A A . 10 DAL HB2 1 1 22 6172 1 1 10 DAL HB3 H 5.434 -6.828 -2.845 1.00 . A A . 10 DAL HB3 1 1 22 6173 1 1 10 DAL N N 3.330 -5.369 -2.377 1.00 . A A . 10 DAL N 1 1 22 6174 1 1 10 DAL O O 5.919 -2.911 -2.995 1.00 . A A . 10 DAL O 1 1 22 6175 1 1 11 GLY C C 4.130 -0.466 -2.516 1.00 . A A . 11 GLY C 1 1 22 6176 1 1 11 GLY CA C 4.207 -1.463 -1.380 1.00 . A A . 11 GLY CA 1 1 22 6177 1 1 11 GLY H H 3.184 -3.304 -1.545 1.00 . A A . 11 GLY H 1 1 22 6178 1 1 11 GLY HA2 H 3.456 -1.210 -0.645 1.00 . A A . 11 GLY HA2 1 1 22 6179 1 1 11 GLY HA3 H 5.183 -1.395 -0.921 1.00 . A A . 11 GLY HA3 1 1 22 6180 1 1 11 GLY N N 3.991 -2.829 -1.823 1.00 . A A . 11 GLY N 1 1 22 6181 1 1 11 GLY O O 3.040 -0.041 -2.902 1.00 . A A . 11 GLY O 1 1 22 6182 1 1 12 TRP C C 5.441 0.174 -5.515 1.00 . A A . 12 TRP C 1 1 22 6183 1 1 12 TRP CA C 5.350 0.865 -4.151 1.00 . A A . 12 TRP CA 1 1 22 6184 1 1 12 TRP CB C 6.520 1.824 -3.937 1.00 . A A . 12 TRP CB 1 1 22 6185 1 1 12 TRP CD1 C 6.668 3.137 -1.747 1.00 . A A . 12 TRP CD1 1 1 22 6186 1 1 12 TRP CD2 C 5.168 3.937 -3.207 1.00 . A A . 12 TRP CD2 1 1 22 6187 1 1 12 TRP CE2 C 5.133 4.729 -2.046 1.00 . A A . 12 TRP CE2 1 1 22 6188 1 1 12 TRP CE3 C 4.309 4.254 -4.268 1.00 . A A . 12 TRP CE3 1 1 22 6189 1 1 12 TRP CG C 6.156 2.922 -2.993 1.00 . A A . 12 TRP CG 1 1 22 6190 1 1 12 TRP CH2 C 3.444 6.100 -2.963 1.00 . A A . 12 TRP CH2 1 1 22 6191 1 1 12 TRP CZ2 C 4.272 5.810 -1.912 1.00 . A A . 12 TRP CZ2 1 1 22 6192 1 1 12 TRP CZ3 C 3.460 5.333 -4.135 1.00 . A A . 12 TRP CZ3 1 1 22 6193 1 1 12 TRP H H 6.124 -0.468 -2.700 1.00 . A A . 12 TRP H 1 1 22 6194 1 1 12 TRP HA H 4.433 1.438 -4.125 1.00 . A A . 12 TRP HA 1 1 22 6195 1 1 12 TRP HB2 H 7.356 1.281 -3.519 1.00 . A A . 12 TRP HB2 1 1 22 6196 1 1 12 TRP HB3 H 6.811 2.263 -4.879 1.00 . A A . 12 TRP HB3 1 1 22 6197 1 1 12 TRP HD1 H 7.439 2.533 -1.294 1.00 . A A . 12 TRP HD1 1 1 22 6198 1 1 12 TRP HE1 H 6.252 4.578 -0.277 1.00 . A A . 12 TRP HE1 1 1 22 6199 1 1 12 TRP HE3 H 4.303 3.674 -5.179 1.00 . A A . 12 TRP HE3 1 1 22 6200 1 1 12 TRP HH2 H 2.763 6.935 -2.901 1.00 . A A . 12 TRP HH2 1 1 22 6201 1 1 12 TRP HZ2 H 4.242 6.400 -1.012 1.00 . A A . 12 TRP HZ2 1 1 22 6202 1 1 12 TRP HZ3 H 2.795 5.595 -4.946 1.00 . A A . 12 TRP HZ3 1 1 22 6203 1 1 12 TRP N N 5.289 -0.093 -3.053 1.00 . A A . 12 TRP N 1 1 22 6204 1 1 12 TRP NE1 N 6.057 4.222 -1.170 1.00 . A A . 12 TRP NE1 1 1 22 6205 1 1 12 TRP O O 5.621 0.837 -6.538 1.00 . A A . 12 TRP O 1 1 22 6206 1 1 13 ALA C C 3.950 -1.880 -7.452 1.00 . A A . 13 ALA C 1 1 22 6207 1 1 13 ALA CA C 5.317 -1.913 -6.774 1.00 . A A . 13 ALA CA 1 1 22 6208 1 1 13 ALA CB C 5.758 -3.346 -6.520 1.00 . A A . 13 ALA CB 1 1 22 6209 1 1 13 ALA H H 5.118 -1.628 -4.690 1.00 . A A . 13 ALA H 1 1 22 6210 1 1 13 ALA HA H 6.038 -1.448 -7.427 1.00 . A A . 13 ALA HA 1 1 22 6211 1 1 13 ALA HB1 H 6.693 -3.525 -7.028 1.00 . A A . 13 ALA HB1 1 1 22 6212 1 1 13 ALA HB2 H 5.008 -4.027 -6.893 1.00 . A A . 13 ALA HB2 1 1 22 6213 1 1 13 ALA HB3 H 5.889 -3.500 -5.459 1.00 . A A . 13 ALA HB3 1 1 22 6214 1 1 13 ALA N N 5.283 -1.153 -5.530 1.00 . A A . 13 ALA N 1 1 22 6215 1 1 13 ALA O O 3.857 -1.884 -8.681 1.00 . A A . 13 ALA O 1 1 22 6216 1 1 14 SER C C 1.312 -0.478 -7.958 1.00 . A A . 14 SER C 1 1 22 6217 1 1 14 SER CA C 1.524 -1.758 -7.146 1.00 . A A . 14 SER CA 1 1 22 6218 1 1 14 SER CB C 0.518 -1.827 -5.987 1.00 . A A . 14 SER CB 1 1 22 6219 1 1 14 SER H H 3.038 -1.805 -5.668 1.00 . A A . 14 SER H 1 1 22 6220 1 1 14 SER HA H 1.372 -2.605 -7.795 1.00 . A A . 14 SER HA 1 1 22 6221 1 1 14 SER HB2 H -0.388 -1.312 -6.267 1.00 . A A . 14 SER HB2 1 1 22 6222 1 1 14 SER HB3 H 0.289 -2.861 -5.775 1.00 . A A . 14 SER HB3 1 1 22 6223 1 1 14 SER HG H 1.367 -1.907 -4.216 1.00 . A A . 14 SER HG 1 1 22 6224 1 1 14 SER N N 2.892 -1.822 -6.637 1.00 . A A . 14 SER N 1 1 22 6225 1 1 14 SER O O 0.512 -0.455 -8.895 1.00 . A A . 14 SER O 1 1 22 6226 1 1 14 SER OG O 1.037 -1.225 -4.810 1.00 . A A . 14 SER OG 1 1 22 6227 1 1 15 DAL C C 1.078 2.861 -7.519 1.00 . A A . 15 DAL C 1 1 22 6228 1 1 15 DAL CA C 1.944 1.865 -8.291 1.00 . A A . 15 DAL CA 1 1 22 6229 1 1 15 DAL CB C 3.332 2.437 -8.524 1.00 . A A . 15 DAL CB 1 1 22 6230 1 1 15 DAL H H 2.664 0.499 -6.842 1.00 . A A . 15 DAL H 1 1 22 6231 1 1 15 DAL HA H 1.495 1.688 -9.256 1.00 . A A . 15 DAL HA 1 1 22 6232 1 1 15 DAL HB1 H 4.057 1.637 -8.517 1.00 . A A . 15 DAL HB1 1 1 22 6233 1 1 15 DAL HB2 H 3.567 3.143 -7.741 1.00 . A A . 15 DAL HB2 1 1 22 6234 1 1 15 DAL HB3 H 3.356 2.937 -9.480 1.00 . A A . 15 DAL HB3 1 1 22 6235 1 1 15 DAL N N 2.042 0.583 -7.596 1.00 . A A . 15 DAL N 1 1 22 6236 1 1 15 DAL O O 1.231 4.076 -7.667 1.00 . A A . 15 DAL O 1 1 22 6237 1 1 16 ARG C C -0.050 3.590 -4.589 1.00 . A A . 16 ARG C 1 1 22 6238 1 1 16 ARG CA C -0.722 3.181 -5.902 1.00 . A A . 16 ARG CA 1 1 22 6239 1 1 16 ARG CB C -2.038 2.430 -5.615 1.00 . A A . 16 ARG CB 1 1 22 6240 1 1 16 ARG CD C -3.096 0.444 -4.492 1.00 . A A . 16 ARG CD 1 1 22 6241 1 1 16 ARG CG C -1.949 1.447 -4.454 1.00 . A A . 16 ARG CG 1 1 22 6242 1 1 16 ARG CZ C -2.746 -1.503 -2.999 1.00 . A A . 16 ARG CZ 1 1 22 6243 1 1 16 ARG H H 0.096 1.364 -6.624 1.00 . A A . 16 ARG H 1 1 22 6244 1 1 16 ARG HA H -0.935 4.075 -6.473 1.00 . A A . 16 ARG HA 1 1 22 6245 1 1 16 ARG HB2 H -2.807 3.153 -5.385 1.00 . A A . 16 ARG HB2 1 1 22 6246 1 1 16 ARG HB3 H -2.334 1.874 -6.500 1.00 . A A . 16 ARG HB3 1 1 22 6247 1 1 16 ARG HD2 H -4.013 0.977 -4.694 1.00 . A A . 16 ARG HD2 1 1 22 6248 1 1 16 ARG HD3 H -2.913 -0.264 -5.287 1.00 . A A . 16 ARG HD3 1 1 22 6249 1 1 16 ARG HE H -3.749 0.159 -2.515 1.00 . A A . 16 ARG HE 1 1 22 6250 1 1 16 ARG HG2 H -1.010 0.912 -4.516 1.00 . A A . 16 ARG HG2 1 1 22 6251 1 1 16 ARG HG3 H -1.993 1.996 -3.525 1.00 . A A . 16 ARG HG3 1 1 22 6252 1 1 16 ARG HH11 H -1.886 -1.710 -4.822 1.00 . A A . 16 ARG HH11 1 1 22 6253 1 1 16 ARG HH12 H -1.681 -3.053 -3.750 1.00 . A A . 16 ARG HH12 1 1 22 6254 1 1 16 ARG HH21 H -3.471 -1.616 -1.112 1.00 . A A . 16 ARG HH21 1 1 22 6255 1 1 16 ARG HH22 H -2.581 -3.002 -1.648 1.00 . A A . 16 ARG HH22 1 1 22 6256 1 1 16 ARG N N 0.169 2.340 -6.698 1.00 . A A . 16 ARG N 1 1 22 6257 1 1 16 ARG NE N -3.243 -0.282 -3.230 1.00 . A A . 16 ARG NE 1 1 22 6258 1 1 16 ARG NH1 N -2.047 -2.140 -3.935 1.00 . A A . 16 ARG NH1 1 1 22 6259 1 1 16 ARG NH2 N -2.949 -2.088 -1.823 1.00 . A A . 16 ARG NH2 1 1 22 6260 1 1 16 ARG O O 0.827 2.884 -4.092 1.00 . A A . 16 ARG O 1 1 22 6261 1 1 17 PRO C C -0.530 4.603 -1.522 1.00 . A A . 17 PRO C 1 1 22 6262 1 1 17 PRO CA C 0.120 5.234 -2.753 1.00 . A A . 17 PRO CA 1 1 22 6263 1 1 17 PRO CB C -0.162 6.744 -2.787 1.00 . A A . 17 PRO CB 1 1 22 6264 1 1 17 PRO CD C -1.463 5.662 -4.518 1.00 . A A . 17 PRO CD 1 1 22 6265 1 1 17 PRO CG C -0.978 6.998 -4.021 1.00 . A A . 17 PRO CG 1 1 22 6266 1 1 17 PRO HA H 1.184 5.068 -2.708 1.00 . A A . 17 PRO HA 1 1 22 6267 1 1 17 PRO HB2 H -0.705 7.025 -1.897 1.00 . A A . 17 PRO HB2 1 1 22 6268 1 1 17 PRO HB3 H 0.778 7.279 -2.819 1.00 . A A . 17 PRO HB3 1 1 22 6269 1 1 17 PRO HD2 H -2.434 5.431 -4.110 1.00 . A A . 17 PRO HD2 1 1 22 6270 1 1 17 PRO HD3 H -1.491 5.653 -5.596 1.00 . A A . 17 PRO HD3 1 1 22 6271 1 1 17 PRO HG2 H -1.819 7.629 -3.776 1.00 . A A . 17 PRO HG2 1 1 22 6272 1 1 17 PRO HG3 H -0.363 7.474 -4.771 1.00 . A A . 17 PRO HG3 1 1 22 6273 1 1 17 PRO N N -0.446 4.742 -4.008 1.00 . A A . 17 PRO N 1 1 22 6274 1 1 17 PRO O O -1.577 3.959 -1.617 1.00 . A A . 17 PRO O 1 1 22 6275 1 1 18 PRO C C -1.755 4.799 1.340 1.00 . A A . 18 PRO C 1 1 22 6276 1 1 18 PRO CA C -0.401 4.226 0.922 1.00 . A A . 18 PRO CA 1 1 22 6277 1 1 18 PRO CB C 0.658 4.634 1.950 1.00 . A A . 18 PRO CB 1 1 22 6278 1 1 18 PRO CD C 1.357 5.524 -0.161 1.00 . A A . 18 PRO CD 1 1 22 6279 1 1 18 PRO CG C 1.425 5.745 1.321 1.00 . A A . 18 PRO CG 1 1 22 6280 1 1 18 PRO HA H -0.465 3.148 0.880 1.00 . A A . 18 PRO HA 1 1 22 6281 1 1 18 PRO HB2 H 0.167 4.965 2.850 1.00 . A A . 18 PRO HB2 1 1 22 6282 1 1 18 PRO HB3 H 1.289 3.793 2.174 1.00 . A A . 18 PRO HB3 1 1 22 6283 1 1 18 PRO HD2 H 1.324 6.470 -0.681 1.00 . A A . 18 PRO HD2 1 1 22 6284 1 1 18 PRO HD3 H 2.201 4.940 -0.494 1.00 . A A . 18 PRO HD3 1 1 22 6285 1 1 18 PRO HG2 H 0.974 6.693 1.577 1.00 . A A . 18 PRO HG2 1 1 22 6286 1 1 18 PRO HG3 H 2.451 5.716 1.657 1.00 . A A . 18 PRO HG3 1 1 22 6287 1 1 18 PRO N N 0.099 4.779 -0.343 1.00 . A A . 18 PRO N 1 1 22 6288 1 1 18 PRO O O -2.051 5.969 1.092 1.00 . A A . 18 PRO O 1 1 22 6289 1 1 19 PRO C C -3.837 5.149 3.798 1.00 . A A . 19 PRO C 1 1 22 6290 1 1 19 PRO CA C -3.904 4.388 2.474 1.00 . A A . 19 PRO CA 1 1 22 6291 1 1 19 PRO CB C -4.651 3.068 2.647 1.00 . A A . 19 PRO CB 1 1 22 6292 1 1 19 PRO CD C -2.301 2.571 2.339 1.00 . A A . 19 PRO CD 1 1 22 6293 1 1 19 PRO CG C -3.616 2.011 2.822 1.00 . A A . 19 PRO CG 1 1 22 6294 1 1 19 PRO HA H -4.412 4.996 1.740 1.00 . A A . 19 PRO HA 1 1 22 6295 1 1 19 PRO HB2 H -5.299 3.126 3.508 1.00 . A A . 19 PRO HB2 1 1 22 6296 1 1 19 PRO HB3 H -5.234 2.882 1.774 1.00 . A A . 19 PRO HB3 1 1 22 6297 1 1 19 PRO HD2 H -1.555 2.514 3.116 1.00 . A A . 19 PRO HD2 1 1 22 6298 1 1 19 PRO HD3 H -1.976 2.031 1.466 1.00 . A A . 19 PRO HD3 1 1 22 6299 1 1 19 PRO HG2 H -3.553 1.735 3.858 1.00 . A A . 19 PRO HG2 1 1 22 6300 1 1 19 PRO HG3 H -3.886 1.148 2.231 1.00 . A A . 19 PRO HG3 1 1 22 6301 1 1 19 PRO N N -2.590 3.973 2.001 1.00 . A A . 19 PRO N 1 1 22 6302 1 1 19 PRO O O -2.924 4.941 4.599 1.00 . A A . 19 PRO O 1 1 22 6303 1 1 20 SER C C -6.267 6.796 5.856 1.00 . A A . 20 SER C 1 1 22 6304 1 1 20 SER CA C -4.867 6.830 5.242 1.00 . A A . 20 SER CA 1 1 22 6305 1 1 20 SER CB C -4.452 8.278 4.959 1.00 . A A . 20 SER CB 1 1 22 6306 1 1 20 SER H H -5.508 6.154 3.338 1.00 . A A . 20 SER H 1 1 22 6307 1 1 20 SER HA H -4.172 6.400 5.947 1.00 . A A . 20 SER HA 1 1 22 6308 1 1 20 SER HB2 H -4.639 8.882 5.834 1.00 . A A . 20 SER HB2 1 1 22 6309 1 1 20 SER HB3 H -3.398 8.307 4.722 1.00 . A A . 20 SER HB3 1 1 22 6310 1 1 20 SER HG H -4.818 9.679 3.638 1.00 . A A . 20 SER HG 1 1 22 6311 1 1 20 SER N N -4.810 6.033 4.017 1.00 . A A . 20 SER N 1 1 22 6312 1 1 20 SER O O -7.245 7.064 5.124 1.00 . A A . 20 SER O 1 1 22 6313 1 1 20 SER OXT O -6.374 6.499 7.064 1.00 . A A . 20 SER OXT 1 1 22 6314 1 1 20 SER OG O -5.180 8.820 3.869 1.00 . A A . 20 SER OG 1 1 23 6315 1 1 1 ASP C C -6.551 -1.998 5.825 1.00 . A A . 1 ASP C 1 1 23 6316 1 1 1 ASP CA C -7.248 -1.421 7.058 1.00 . A A . 1 ASP CA 1 1 23 6317 1 1 1 ASP CB C -6.213 -1.032 8.124 1.00 . A A . 1 ASP CB 1 1 23 6318 1 1 1 ASP CG C -5.135 -2.086 8.315 1.00 . A A . 1 ASP CG 1 1 23 6319 1 1 1 ASP H1 H -8.923 -2.614 6.931 1.00 . A A . 1 ASP H1 1 1 23 6320 1 1 1 ASP H2 H -8.633 -1.954 8.487 1.00 . A A . 1 ASP H2 1 1 23 6321 1 1 1 ASP H3 H -7.669 -3.251 7.910 1.00 . A A . 1 ASP H3 1 1 23 6322 1 1 1 ASP HA H -7.801 -0.540 6.765 1.00 . A A . 1 ASP HA 1 1 23 6323 1 1 1 ASP HB2 H -5.736 -0.108 7.831 1.00 . A A . 1 ASP HB2 1 1 23 6324 1 1 1 ASP HB3 H -6.718 -0.885 9.068 1.00 . A A . 1 ASP HB3 1 1 23 6325 1 1 1 ASP N N -8.204 -2.398 7.650 1.00 . A A . 1 ASP N 1 1 23 6326 1 1 1 ASP O O -6.394 -3.215 5.700 1.00 . A A . 1 ASP O 1 1 23 6327 1 1 1 ASP OD1 O -5.391 -3.075 9.033 1.00 . A A . 1 ASP OD1 1 1 23 6328 1 1 1 ASP OD2 O -4.035 -1.921 7.743 1.00 . A A . 1 ASP OD2 1 1 23 6329 1 1 2 ALA C C -3.950 -1.160 3.735 1.00 . A A . 2 ALA C 1 1 23 6330 1 1 2 ALA CA C -5.439 -1.527 3.702 1.00 . A A . 2 ALA CA 1 1 23 6331 1 1 2 ALA CB C -6.111 -0.902 2.487 1.00 . A A . 2 ALA CB 1 1 23 6332 1 1 2 ALA H H -6.278 -0.157 5.084 1.00 . A A . 2 ALA H 1 1 23 6333 1 1 2 ALA HA H -5.530 -2.600 3.617 1.00 . A A . 2 ALA HA 1 1 23 6334 1 1 2 ALA HB1 H -5.484 -1.038 1.619 1.00 . A A . 2 ALA HB1 1 1 23 6335 1 1 2 ALA HB2 H -6.261 0.153 2.662 1.00 . A A . 2 ALA HB2 1 1 23 6336 1 1 2 ALA HB3 H -7.066 -1.378 2.320 1.00 . A A . 2 ALA HB3 1 1 23 6337 1 1 2 ALA N N -6.128 -1.113 4.923 1.00 . A A . 2 ALA N 1 1 23 6338 1 1 2 ALA O O -3.258 -1.283 2.723 1.00 . A A . 2 ALA O 1 1 23 6339 1 1 3 TYR C C -1.143 -1.555 4.980 1.00 . A A . 3 TYR C 1 1 23 6340 1 1 3 TYR CA C -2.053 -0.330 5.040 1.00 . A A . 3 TYR CA 1 1 23 6341 1 1 3 TYR CB C -1.831 0.444 6.343 1.00 . A A . 3 TYR CB 1 1 23 6342 1 1 3 TYR CD1 C -0.898 2.744 5.835 1.00 . A A . 3 TYR CD1 1 1 23 6343 1 1 3 TYR CD2 C 0.593 1.071 6.657 1.00 . A A . 3 TYR CD2 1 1 23 6344 1 1 3 TYR CE1 C 0.143 3.649 5.785 1.00 . A A . 3 TYR CE1 1 1 23 6345 1 1 3 TYR CE2 C 1.638 1.972 6.606 1.00 . A A . 3 TYR CE2 1 1 23 6346 1 1 3 TYR CG C -0.691 1.437 6.273 1.00 . A A . 3 TYR CG 1 1 23 6347 1 1 3 TYR CZ C 1.409 3.259 6.169 1.00 . A A . 3 TYR CZ 1 1 23 6348 1 1 3 TYR H H -4.054 -0.632 5.671 1.00 . A A . 3 TYR H 1 1 23 6349 1 1 3 TYR HA H -1.805 0.311 4.211 1.00 . A A . 3 TYR HA 1 1 23 6350 1 1 3 TYR HB2 H -2.729 0.991 6.587 1.00 . A A . 3 TYR HB2 1 1 23 6351 1 1 3 TYR HB3 H -1.615 -0.256 7.137 1.00 . A A . 3 TYR HB3 1 1 23 6352 1 1 3 TYR HD1 H -1.890 3.050 5.524 1.00 . A A . 3 TYR HD1 1 1 23 6353 1 1 3 TYR HD2 H 0.772 0.062 6.998 1.00 . A A . 3 TYR HD2 1 1 23 6354 1 1 3 TYR HE1 H -0.037 4.659 5.450 1.00 . A A . 3 TYR HE1 1 1 23 6355 1 1 3 TYR HE2 H 2.630 1.667 6.906 1.00 . A A . 3 TYR HE2 1 1 23 6356 1 1 3 TYR HH H 2.854 4.133 5.248 1.00 . A A . 3 TYR HH 1 1 23 6357 1 1 3 TYR N N -3.459 -0.710 4.896 1.00 . A A . 3 TYR N 1 1 23 6358 1 1 3 TYR O O -0.211 -1.600 4.174 1.00 . A A . 3 TYR O 1 1 23 6359 1 1 3 TYR OH O 2.447 4.161 6.118 1.00 . A A . 3 TYR OH 1 1 23 6360 1 1 4 ALA C C -0.756 -4.507 4.492 1.00 . A A . 4 ALA C 1 1 23 6361 1 1 4 ALA CA C -0.635 -3.785 5.832 1.00 . A A . 4 ALA CA 1 1 23 6362 1 1 4 ALA CB C -1.076 -4.693 6.972 1.00 . A A . 4 ALA CB 1 1 23 6363 1 1 4 ALA H H -2.187 -2.470 6.429 1.00 . A A . 4 ALA H 1 1 23 6364 1 1 4 ALA HA H 0.402 -3.516 5.992 1.00 . A A . 4 ALA HA 1 1 23 6365 1 1 4 ALA HB1 H -1.215 -4.105 7.868 1.00 . A A . 4 ALA HB1 1 1 23 6366 1 1 4 ALA HB2 H -0.321 -5.444 7.148 1.00 . A A . 4 ALA HB2 1 1 23 6367 1 1 4 ALA HB3 H -2.007 -5.173 6.710 1.00 . A A . 4 ALA HB3 1 1 23 6368 1 1 4 ALA N N -1.425 -2.555 5.819 1.00 . A A . 4 ALA N 1 1 23 6369 1 1 4 ALA O O 0.213 -5.089 4.001 1.00 . A A . 4 ALA O 1 1 23 6370 1 1 5 GLN C C -1.415 -4.357 1.503 1.00 . A A . 5 GLN C 1 1 23 6371 1 1 5 GLN CA C -2.207 -5.067 2.602 1.00 . A A . 5 GLN CA 1 1 23 6372 1 1 5 GLN CB C -3.706 -5.030 2.285 1.00 . A A . 5 GLN CB 1 1 23 6373 1 1 5 GLN CD C -3.859 -7.122 0.873 1.00 . A A . 5 GLN CD 1 1 23 6374 1 1 5 GLN CG C -4.060 -5.618 0.930 1.00 . A A . 5 GLN CG 1 1 23 6375 1 1 5 GLN H H -2.678 -3.952 4.331 1.00 . A A . 5 GLN H 1 1 23 6376 1 1 5 GLN HA H -1.882 -6.096 2.658 1.00 . A A . 5 GLN HA 1 1 23 6377 1 1 5 GLN HB2 H -4.235 -5.587 3.044 1.00 . A A . 5 GLN HB2 1 1 23 6378 1 1 5 GLN HB3 H -4.040 -4.004 2.306 1.00 . A A . 5 GLN HB3 1 1 23 6379 1 1 5 GLN HE21 H -5.754 -7.427 1.405 1.00 . A A . 5 GLN HE21 1 1 23 6380 1 1 5 GLN HE22 H -4.809 -8.849 1.140 1.00 . A A . 5 GLN HE22 1 1 23 6381 1 1 5 GLN HG2 H -5.096 -5.400 0.716 1.00 . A A . 5 GLN HG2 1 1 23 6382 1 1 5 GLN HG3 H -3.434 -5.157 0.182 1.00 . A A . 5 GLN HG3 1 1 23 6383 1 1 5 GLN N N -1.952 -4.444 3.895 1.00 . A A . 5 GLN N 1 1 23 6384 1 1 5 GLN NE2 N -4.914 -7.875 1.169 1.00 . A A . 5 GLN NE2 1 1 23 6385 1 1 5 GLN O O -0.892 -5.000 0.593 1.00 . A A . 5 GLN O 1 1 23 6386 1 1 5 GLN OE1 O -2.767 -7.602 0.568 1.00 . A A . 5 GLN OE1 1 1 23 6387 1 1 6 TRP C C 0.888 -2.630 0.623 1.00 . A A . 6 TRP C 1 1 23 6388 1 1 6 TRP CA C -0.580 -2.222 0.638 1.00 . A A . 6 TRP CA 1 1 23 6389 1 1 6 TRP CB C -0.701 -0.734 0.980 1.00 . A A . 6 TRP CB 1 1 23 6390 1 1 6 TRP CD1 C -0.312 0.473 -1.236 1.00 . A A . 6 TRP CD1 1 1 23 6391 1 1 6 TRP CD2 C 1.277 0.845 0.295 1.00 . A A . 6 TRP CD2 1 1 23 6392 1 1 6 TRP CE2 C 1.601 1.558 -0.872 1.00 . A A . 6 TRP CE2 1 1 23 6393 1 1 6 TRP CE3 C 2.134 0.930 1.396 1.00 . A A . 6 TRP CE3 1 1 23 6394 1 1 6 TRP CG C 0.046 0.156 0.038 1.00 . A A . 6 TRP CG 1 1 23 6395 1 1 6 TRP CH2 C 3.564 2.415 0.117 1.00 . A A . 6 TRP CH2 1 1 23 6396 1 1 6 TRP CZ2 C 2.744 2.345 -0.974 1.00 . A A . 6 TRP CZ2 1 1 23 6397 1 1 6 TRP CZ3 C 3.270 1.716 1.296 1.00 . A A . 6 TRP CZ3 1 1 23 6398 1 1 6 TRP H H -1.754 -2.578 2.364 1.00 . A A . 6 TRP H 1 1 23 6399 1 1 6 TRP HA H -1.004 -2.397 -0.339 1.00 . A A . 6 TRP HA 1 1 23 6400 1 1 6 TRP HB2 H -1.739 -0.450 0.955 1.00 . A A . 6 TRP HB2 1 1 23 6401 1 1 6 TRP HB3 H -0.312 -0.568 1.972 1.00 . A A . 6 TRP HB3 1 1 23 6402 1 1 6 TRP HD1 H -1.199 0.108 -1.727 1.00 . A A . 6 TRP HD1 1 1 23 6403 1 1 6 TRP HE1 H 0.583 1.674 -2.696 1.00 . A A . 6 TRP HE1 1 1 23 6404 1 1 6 TRP HE3 H 1.923 0.395 2.312 1.00 . A A . 6 TRP HE3 1 1 23 6405 1 1 6 TRP HH2 H 4.457 3.024 0.083 1.00 . A A . 6 TRP HH2 1 1 23 6406 1 1 6 TRP HZ2 H 2.988 2.885 -1.877 1.00 . A A . 6 TRP HZ2 1 1 23 6407 1 1 6 TRP HZ3 H 3.946 1.794 2.135 1.00 . A A . 6 TRP HZ3 1 1 23 6408 1 1 6 TRP N N -1.322 -3.027 1.607 1.00 . A A . 6 TRP N 1 1 23 6409 1 1 6 TRP NE1 N 0.619 1.310 -1.790 1.00 . A A . 6 TRP NE1 1 1 23 6410 1 1 6 TRP O O 1.469 -2.866 -0.437 1.00 . A A . 6 TRP O 1 1 23 6411 1 1 7 LEU C C 3.084 -4.548 1.500 1.00 . A A . 7 LEU C 1 1 23 6412 1 1 7 LEU CA C 2.869 -3.108 1.970 1.00 . A A . 7 LEU CA 1 1 23 6413 1 1 7 LEU CB C 3.293 -2.953 3.433 1.00 . A A . 7 LEU CB 1 1 23 6414 1 1 7 LEU CD1 C 3.231 -1.534 5.503 1.00 . A A . 7 LEU CD1 1 1 23 6415 1 1 7 LEU CD2 C 4.339 -0.666 3.431 1.00 . A A . 7 LEU CD2 1 1 23 6416 1 1 7 LEU CG C 3.207 -1.525 3.982 1.00 . A A . 7 LEU CG 1 1 23 6417 1 1 7 LEU H H 0.943 -2.523 2.619 1.00 . A A . 7 LEU H 1 1 23 6418 1 1 7 LEU HA H 3.466 -2.449 1.359 1.00 . A A . 7 LEU HA 1 1 23 6419 1 1 7 LEU HB2 H 2.658 -3.587 4.036 1.00 . A A . 7 LEU HB2 1 1 23 6420 1 1 7 LEU HB3 H 4.309 -3.295 3.532 1.00 . A A . 7 LEU HB3 1 1 23 6421 1 1 7 LEU HD11 H 2.770 -2.441 5.865 1.00 . A A . 7 LEU HD11 1 1 23 6422 1 1 7 LEU HD12 H 2.685 -0.680 5.875 1.00 . A A . 7 LEU HD12 1 1 23 6423 1 1 7 LEU HD13 H 4.253 -1.486 5.848 1.00 . A A . 7 LEU HD13 1 1 23 6424 1 1 7 LEU HD21 H 4.176 -0.485 2.378 1.00 . A A . 7 LEU HD21 1 1 23 6425 1 1 7 LEU HD22 H 5.280 -1.179 3.566 1.00 . A A . 7 LEU HD22 1 1 23 6426 1 1 7 LEU HD23 H 4.364 0.277 3.958 1.00 . A A . 7 LEU HD23 1 1 23 6427 1 1 7 LEU HG H 2.272 -1.084 3.669 1.00 . A A . 7 LEU HG 1 1 23 6428 1 1 7 LEU N N 1.472 -2.718 1.816 1.00 . A A . 7 LEU N 1 1 23 6429 1 1 7 LEU O O 4.119 -4.868 0.912 1.00 . A A . 7 LEU O 1 1 23 6430 1 1 8 ALA C C 1.907 -6.977 -0.160 1.00 . A A . 8 ALA C 1 1 23 6431 1 1 8 ALA CA C 2.157 -6.810 1.345 1.00 . A A . 8 ALA CA 1 1 23 6432 1 1 8 ALA CB C 1.156 -7.636 2.141 1.00 . A A . 8 ALA CB 1 1 23 6433 1 1 8 ALA H H 1.290 -5.085 2.214 1.00 . A A . 8 ALA H 1 1 23 6434 1 1 8 ALA HA H 3.148 -7.175 1.574 1.00 . A A . 8 ALA HA 1 1 23 6435 1 1 8 ALA HB1 H 0.170 -7.210 2.033 1.00 . A A . 8 ALA HB1 1 1 23 6436 1 1 8 ALA HB2 H 1.437 -7.634 3.184 1.00 . A A . 8 ALA HB2 1 1 23 6437 1 1 8 ALA HB3 H 1.153 -8.651 1.772 1.00 . A A . 8 ALA HB3 1 1 23 6438 1 1 8 ALA N N 2.091 -5.407 1.751 1.00 . A A . 8 ALA N 1 1 23 6439 1 1 8 ALA O O 2.241 -8.013 -0.736 1.00 . A A . 8 ALA O 1 1 23 6440 1 1 9 ASP C C 2.220 -5.459 -3.053 1.00 . A A . 9 ASP C 1 1 23 6441 1 1 9 ASP CA C 1.038 -5.986 -2.229 1.00 . A A . 9 ASP CA 1 1 23 6442 1 1 9 ASP CB C -0.221 -5.165 -2.544 1.00 . A A . 9 ASP CB 1 1 23 6443 1 1 9 ASP CG C -1.406 -6.039 -2.905 1.00 . A A . 9 ASP CG 1 1 23 6444 1 1 9 ASP H H 1.085 -5.150 -0.281 1.00 . A A . 9 ASP H 1 1 23 6445 1 1 9 ASP HA H 0.859 -7.016 -2.502 1.00 . A A . 9 ASP HA 1 1 23 6446 1 1 9 ASP HB2 H -0.487 -4.573 -1.681 1.00 . A A . 9 ASP HB2 1 1 23 6447 1 1 9 ASP HB3 H -0.017 -4.505 -3.375 1.00 . A A . 9 ASP HB3 1 1 23 6448 1 1 9 ASP N N 1.323 -5.950 -0.792 1.00 . A A . 9 ASP N 1 1 23 6449 1 1 9 ASP O O 2.069 -5.154 -4.239 1.00 . A A . 9 ASP O 1 1 23 6450 1 1 9 ASP OD1 O -1.483 -6.482 -4.071 1.00 . A A . 9 ASP OD1 1 1 23 6451 1 1 9 ASP OD2 O -2.255 -6.281 -2.023 1.00 . A A . 9 ASP OD2 1 1 23 6452 1 1 10 DAL C C 4.918 -3.419 -2.697 1.00 . A A . 10 DAL C 1 1 23 6453 1 1 10 DAL CA C 4.591 -4.860 -3.098 1.00 . A A . 10 DAL CA 1 1 23 6454 1 1 10 DAL CB C 5.767 -5.767 -2.781 1.00 . A A . 10 DAL CB 1 1 23 6455 1 1 10 DAL H H 3.456 -5.606 -1.480 1.00 . A A . 10 DAL H 1 1 23 6456 1 1 10 DAL HA H 4.415 -4.897 -4.163 1.00 . A A . 10 DAL HA 1 1 23 6457 1 1 10 DAL HB1 H 6.012 -5.679 -1.734 1.00 . A A . 10 DAL HB1 1 1 23 6458 1 1 10 DAL HB2 H 6.618 -5.474 -3.377 1.00 . A A . 10 DAL HB2 1 1 23 6459 1 1 10 DAL HB3 H 5.504 -6.790 -3.005 1.00 . A A . 10 DAL HB3 1 1 23 6460 1 1 10 DAL N N 3.393 -5.351 -2.423 1.00 . A A . 10 DAL N 1 1 23 6461 1 1 10 DAL O O 5.938 -2.871 -3.118 1.00 . A A . 10 DAL O 1 1 23 6462 1 1 11 GLY C C 4.161 -0.445 -2.571 1.00 . A A . 11 GLY C 1 1 23 6463 1 1 11 GLY CA C 4.269 -1.444 -1.439 1.00 . A A . 11 GLY CA 1 1 23 6464 1 1 11 GLY H H 3.257 -3.294 -1.578 1.00 . A A . 11 GLY H 1 1 23 6465 1 1 11 GLY HA2 H 3.533 -1.197 -0.688 1.00 . A A . 11 GLY HA2 1 1 23 6466 1 1 11 GLY HA3 H 5.254 -1.371 -1.002 1.00 . A A . 11 GLY HA3 1 1 23 6467 1 1 11 GLY N N 4.051 -2.810 -1.881 1.00 . A A . 11 GLY N 1 1 23 6468 1 1 11 GLY O O 3.061 -0.022 -2.929 1.00 . A A . 11 GLY O 1 1 23 6469 1 1 12 TRP C C 5.428 0.203 -5.599 1.00 . A A . 12 TRP C 1 1 23 6470 1 1 12 TRP CA C 5.335 0.891 -4.234 1.00 . A A . 12 TRP CA 1 1 23 6471 1 1 12 TRP CB C 6.486 1.877 -4.031 1.00 . A A . 12 TRP CB 1 1 23 6472 1 1 12 TRP CD1 C 6.625 3.212 -1.853 1.00 . A A . 12 TRP CD1 1 1 23 6473 1 1 12 TRP CD2 C 5.087 3.960 -3.300 1.00 . A A . 12 TRP CD2 1 1 23 6474 1 1 12 TRP CE2 C 5.046 4.761 -2.146 1.00 . A A . 12 TRP CE2 1 1 23 6475 1 1 12 TRP CE3 C 4.207 4.245 -4.353 1.00 . A A . 12 TRP CE3 1 1 23 6476 1 1 12 TRP CG C 6.104 2.973 -3.091 1.00 . A A . 12 TRP CG 1 1 23 6477 1 1 12 TRP CH2 C 3.311 6.080 -3.053 1.00 . A A . 12 TRP CH2 1 1 23 6478 1 1 12 TRP CZ2 C 4.159 5.822 -2.010 1.00 . A A . 12 TRP CZ2 1 1 23 6479 1 1 12 TRP CZ3 C 3.332 5.304 -4.219 1.00 . A A . 12 TRP CZ3 1 1 23 6480 1 1 12 TRP H H 6.150 -0.443 -2.806 1.00 . A A . 12 TRP H 1 1 23 6481 1 1 12 TRP HA H 4.405 1.443 -4.199 1.00 . A A . 12 TRP HA 1 1 23 6482 1 1 12 TRP HB2 H 7.334 1.354 -3.614 1.00 . A A . 12 TRP HB2 1 1 23 6483 1 1 12 TRP HB3 H 6.762 2.317 -4.977 1.00 . A A . 12 TRP HB3 1 1 23 6484 1 1 12 TRP HD1 H 7.417 2.632 -1.404 1.00 . A A . 12 TRP HD1 1 1 23 6485 1 1 12 TRP HE1 H 6.192 4.655 -0.390 1.00 . A A . 12 TRP HE1 1 1 23 6486 1 1 12 TRP HE3 H 4.206 3.658 -5.259 1.00 . A A . 12 TRP HE3 1 1 23 6487 1 1 12 TRP HH2 H 2.610 6.899 -2.990 1.00 . A A . 12 TRP HH2 1 1 23 6488 1 1 12 TRP HZ2 H 4.124 6.419 -1.115 1.00 . A A . 12 TRP HZ2 1 1 23 6489 1 1 12 TRP HZ3 H 2.650 5.541 -5.024 1.00 . A A . 12 TRP HZ3 1 1 23 6490 1 1 12 TRP N N 5.306 -0.068 -3.136 1.00 . A A . 12 TRP N 1 1 23 6491 1 1 12 TRP NE1 N 5.994 4.286 -1.277 1.00 . A A . 12 TRP NE1 1 1 23 6492 1 1 12 TRP O O 5.632 0.864 -6.619 1.00 . A A . 12 TRP O 1 1 23 6493 1 1 13 ALA C C 3.890 -1.873 -7.514 1.00 . A A . 13 ALA C 1 1 23 6494 1 1 13 ALA CA C 5.270 -1.880 -6.862 1.00 . A A . 13 ALA CA 1 1 23 6495 1 1 13 ALA CB C 5.743 -3.304 -6.614 1.00 . A A . 13 ALA CB 1 1 23 6496 1 1 13 ALA H H 5.057 -1.592 -4.780 1.00 . A A . 13 ALA H 1 1 23 6497 1 1 13 ALA HA H 5.971 -1.403 -7.528 1.00 . A A . 13 ALA HA 1 1 23 6498 1 1 13 ALA HB1 H 4.944 -3.995 -6.840 1.00 . A A . 13 ALA HB1 1 1 23 6499 1 1 13 ALA HB2 H 6.032 -3.414 -5.580 1.00 . A A . 13 ALA HB2 1 1 23 6500 1 1 13 ALA HB3 H 6.590 -3.514 -7.249 1.00 . A A . 13 ALA HB3 1 1 23 6501 1 1 13 ALA N N 5.242 -1.120 -5.618 1.00 . A A . 13 ALA N 1 1 23 6502 1 1 13 ALA O O 3.772 -1.899 -8.741 1.00 . A A . 13 ALA O 1 1 23 6503 1 1 14 SER C C 1.204 -0.500 -7.956 1.00 . A A . 14 SER C 1 1 23 6504 1 1 14 SER CA C 1.468 -1.779 -7.155 1.00 . A A . 14 SER CA 1 1 23 6505 1 1 14 SER CB C 0.490 -1.877 -5.974 1.00 . A A . 14 SER CB 1 1 23 6506 1 1 14 SER H H 3.014 -1.784 -5.713 1.00 . A A . 14 SER H 1 1 23 6507 1 1 14 SER HA H 1.319 -2.627 -7.805 1.00 . A A . 14 SER HA 1 1 23 6508 1 1 14 SER HB2 H -0.441 -1.399 -6.238 1.00 . A A . 14 SER HB2 1 1 23 6509 1 1 14 SER HB3 H 0.307 -2.918 -5.748 1.00 . A A . 14 SER HB3 1 1 23 6510 1 1 14 SER HG H 1.375 -1.909 -4.218 1.00 . A A . 14 SER HG 1 1 23 6511 1 1 14 SER N N 2.848 -1.816 -6.678 1.00 . A A . 14 SER N 1 1 23 6512 1 1 14 SER O O 0.355 -0.484 -8.849 1.00 . A A . 14 SER O 1 1 23 6513 1 1 14 SER OG O 1.012 -1.245 -4.813 1.00 . A A . 14 SER OG 1 1 23 6514 1 1 15 DAL C C 0.918 2.824 -7.525 1.00 . A A . 15 DAL C 1 1 23 6515 1 1 15 DAL CA C 1.793 1.850 -8.320 1.00 . A A . 15 DAL CA 1 1 23 6516 1 1 15 DAL CB C 3.161 2.458 -8.587 1.00 . A A . 15 DAL CB 1 1 23 6517 1 1 15 DAL H H 2.602 0.492 -6.910 1.00 . A A . 15 DAL H 1 1 23 6518 1 1 15 DAL HA H 1.324 1.662 -9.274 1.00 . A A . 15 DAL HA 1 1 23 6519 1 1 15 DAL HB1 H 3.314 3.304 -7.934 1.00 . A A . 15 DAL HB1 1 1 23 6520 1 1 15 DAL HB2 H 3.213 2.783 -9.615 1.00 . A A . 15 DAL HB2 1 1 23 6521 1 1 15 DAL HB3 H 3.926 1.719 -8.404 1.00 . A A . 15 DAL HB3 1 1 23 6522 1 1 15 DAL N N 1.941 0.569 -7.631 1.00 . A A . 15 DAL N 1 1 23 6523 1 1 15 DAL O O 1.018 4.042 -7.693 1.00 . A A . 15 DAL O 1 1 23 6524 1 1 16 ARG C C -0.137 3.544 -4.558 1.00 . A A . 16 ARG C 1 1 23 6525 1 1 16 ARG CA C -0.836 3.093 -5.843 1.00 . A A . 16 ARG CA 1 1 23 6526 1 1 16 ARG CB C -2.105 2.289 -5.493 1.00 . A A . 16 ARG CB 1 1 23 6527 1 1 16 ARG CD C -2.752 0.031 -4.584 1.00 . A A . 16 ARG CD 1 1 23 6528 1 1 16 ARG CG C -1.899 1.273 -4.374 1.00 . A A . 16 ARG CG 1 1 23 6529 1 1 16 ARG CZ C -3.349 -0.778 -2.320 1.00 . A A . 16 ARG CZ 1 1 23 6530 1 1 16 ARG H H 0.027 1.303 -6.577 1.00 . A A . 16 ARG H 1 1 23 6531 1 1 16 ARG HA H -1.109 3.971 -6.414 1.00 . A A . 16 ARG HA 1 1 23 6532 1 1 16 ARG HB2 H -2.879 2.976 -5.186 1.00 . A A . 16 ARG HB2 1 1 23 6533 1 1 16 ARG HB3 H -2.444 1.749 -6.373 1.00 . A A . 16 ARG HB3 1 1 23 6534 1 1 16 ARG HD2 H -3.782 0.333 -4.706 1.00 . A A . 16 ARG HD2 1 1 23 6535 1 1 16 ARG HD3 H -2.417 -0.469 -5.479 1.00 . A A . 16 ARG HD3 1 1 23 6536 1 1 16 ARG HE H -2.057 -1.668 -3.561 1.00 . A A . 16 ARG HE 1 1 23 6537 1 1 16 ARG HG2 H -0.858 0.982 -4.353 1.00 . A A . 16 ARG HG2 1 1 23 6538 1 1 16 ARG HG3 H -2.167 1.730 -3.433 1.00 . A A . 16 ARG HG3 1 1 23 6539 1 1 16 ARG HH11 H -4.287 0.939 -2.849 1.00 . A A . 16 ARG HH11 1 1 23 6540 1 1 16 ARG HH12 H -4.683 0.332 -1.277 1.00 . A A . 16 ARG HH12 1 1 23 6541 1 1 16 ARG HH21 H -2.591 -2.462 -1.493 1.00 . A A . 16 ARG HH21 1 1 23 6542 1 1 16 ARG HH22 H -3.719 -1.595 -0.506 1.00 . A A . 16 ARG HH22 1 1 23 6543 1 1 16 ARG N N 0.060 2.279 -6.664 1.00 . A A . 16 ARG N 1 1 23 6544 1 1 16 ARG NE N -2.661 -0.902 -3.460 1.00 . A A . 16 ARG NE 1 1 23 6545 1 1 16 ARG NH1 N -4.174 0.249 -2.134 1.00 . A A . 16 ARG NH1 1 1 23 6546 1 1 16 ARG NH2 N -3.209 -1.687 -1.361 1.00 . A A . 16 ARG NH2 1 1 23 6547 1 1 16 ARG O O 0.780 2.874 -4.080 1.00 . A A . 16 ARG O 1 1 23 6548 1 1 17 PRO C C -0.581 4.575 -1.489 1.00 . A A . 17 PRO C 1 1 23 6549 1 1 17 PRO CA C 0.024 5.211 -2.742 1.00 . A A . 17 PRO CA 1 1 23 6550 1 1 17 PRO CB C -0.307 6.710 -2.787 1.00 . A A . 17 PRO CB 1 1 23 6551 1 1 17 PRO CD C -1.626 5.561 -4.461 1.00 . A A . 17 PRO CD 1 1 23 6552 1 1 17 PRO CG C -1.172 6.920 -3.997 1.00 . A A . 17 PRO CG 1 1 23 6553 1 1 17 PRO HA H 1.092 5.077 -2.722 1.00 . A A . 17 PRO HA 1 1 23 6554 1 1 17 PRO HB2 H -0.829 6.988 -1.884 1.00 . A A . 17 PRO HB2 1 1 23 6555 1 1 17 PRO HB3 H 0.614 7.274 -2.859 1.00 . A A . 17 PRO HB3 1 1 23 6556 1 1 17 PRO HD2 H -2.573 5.301 -4.016 1.00 . A A . 17 PRO HD2 1 1 23 6557 1 1 17 PRO HD3 H -1.692 5.537 -5.536 1.00 . A A . 17 PRO HD3 1 1 23 6558 1 1 17 PRO HG2 H -2.026 7.525 -3.732 1.00 . A A . 17 PRO HG2 1 1 23 6559 1 1 17 PRO HG3 H -0.599 7.406 -4.773 1.00 . A A . 17 PRO HG3 1 1 23 6560 1 1 17 PRO N N -0.559 4.685 -3.976 1.00 . A A . 17 PRO N 1 1 23 6561 1 1 17 PRO O O -1.624 3.920 -1.552 1.00 . A A . 17 PRO O 1 1 23 6562 1 1 18 PRO C C -1.729 4.754 1.400 1.00 . A A . 18 PRO C 1 1 23 6563 1 1 18 PRO CA C -0.376 4.202 0.949 1.00 . A A . 18 PRO CA 1 1 23 6564 1 1 18 PRO CB C 0.703 4.628 1.948 1.00 . A A . 18 PRO CB 1 1 23 6565 1 1 18 PRO CD C 1.335 5.518 -0.187 1.00 . A A . 18 PRO CD 1 1 23 6566 1 1 18 PRO CG C 1.449 5.739 1.292 1.00 . A A . 18 PRO CG 1 1 23 6567 1 1 18 PRO HA H -0.425 3.122 0.909 1.00 . A A . 18 PRO HA 1 1 23 6568 1 1 18 PRO HB2 H 0.230 4.964 2.856 1.00 . A A . 18 PRO HB2 1 1 23 6569 1 1 18 PRO HB3 H 1.345 3.794 2.165 1.00 . A A . 18 PRO HB3 1 1 23 6570 1 1 18 PRO HD2 H 1.274 6.463 -0.705 1.00 . A A . 18 PRO HD2 1 1 23 6571 1 1 18 PRO HD3 H 2.175 4.944 -0.548 1.00 . A A . 18 PRO HD3 1 1 23 6572 1 1 18 PRO HG2 H 1.006 6.686 1.562 1.00 . A A . 18 PRO HG2 1 1 23 6573 1 1 18 PRO HG3 H 2.485 5.712 1.595 1.00 . A A . 18 PRO HG3 1 1 23 6574 1 1 18 PRO N N 0.081 4.759 -0.331 1.00 . A A . 18 PRO N 1 1 23 6575 1 1 18 PRO O O -2.034 5.929 1.188 1.00 . A A . 18 PRO O 1 1 23 6576 1 1 19 PRO C C -3.786 5.035 3.883 1.00 . A A . 19 PRO C 1 1 23 6577 1 1 19 PRO CA C -3.864 4.301 2.545 1.00 . A A . 19 PRO CA 1 1 23 6578 1 1 19 PRO CB C -4.600 2.972 2.702 1.00 . A A . 19 PRO CB 1 1 23 6579 1 1 19 PRO CD C -2.253 2.495 2.340 1.00 . A A . 19 PRO CD 1 1 23 6580 1 1 19 PRO CG C -3.556 1.918 2.835 1.00 . A A . 19 PRO CG 1 1 23 6581 1 1 19 PRO HA H -4.386 4.919 1.830 1.00 . A A . 19 PRO HA 1 1 23 6582 1 1 19 PRO HB2 H -5.233 3.008 3.575 1.00 . A A . 19 PRO HB2 1 1 23 6583 1 1 19 PRO HB3 H -5.197 2.802 1.835 1.00 . A A . 19 PRO HB3 1 1 23 6584 1 1 19 PRO HD2 H -1.490 2.419 3.098 1.00 . A A . 19 PRO HD2 1 1 23 6585 1 1 19 PRO HD3 H -1.946 1.979 1.444 1.00 . A A . 19 PRO HD3 1 1 23 6586 1 1 19 PRO HG2 H -3.472 1.622 3.864 1.00 . A A . 19 PRO HG2 1 1 23 6587 1 1 19 PRO HG3 H -3.833 1.066 2.232 1.00 . A A . 19 PRO HG3 1 1 23 6588 1 1 19 PRO N N -2.552 3.905 2.046 1.00 . A A . 19 PRO N 1 1 23 6589 1 1 19 PRO O O -2.863 4.815 4.669 1.00 . A A . 19 PRO O 1 1 23 6590 1 1 20 SER C C -6.211 6.664 5.979 1.00 . A A . 20 SER C 1 1 23 6591 1 1 20 SER CA C -4.807 6.678 5.375 1.00 . A A . 20 SER CA 1 1 23 6592 1 1 20 SER CB C -4.356 8.121 5.124 1.00 . A A . 20 SER CB 1 1 23 6593 1 1 20 SER H H -5.468 6.040 3.466 1.00 . A A . 20 SER H 1 1 23 6594 1 1 20 SER HA H -4.126 6.217 6.074 1.00 . A A . 20 SER HA 1 1 23 6595 1 1 20 SER HB2 H -4.244 8.281 4.063 1.00 . A A . 20 SER HB2 1 1 23 6596 1 1 20 SER HB3 H -5.099 8.802 5.514 1.00 . A A . 20 SER HB3 1 1 23 6597 1 1 20 SER HG H -3.271 8.675 6.660 1.00 . A A . 20 SER HG 1 1 23 6598 1 1 20 SER N N -4.761 5.909 4.133 1.00 . A A . 20 SER N 1 1 23 6599 1 1 20 SER O O -7.170 7.029 5.264 1.00 . A A . 20 SER O 1 1 23 6600 1 1 20 SER OXT O -6.339 6.287 7.163 1.00 . A A . 20 SER OXT 1 1 23 6601 1 1 20 SER OG O -3.116 8.387 5.758 1.00 . A A . 20 SER OG 1 1 24 6602 1 1 1 ASP C C -6.353 -2.703 5.801 1.00 . A A . 1 ASP C 1 1 24 6603 1 1 1 ASP CA C -6.925 -2.613 7.216 1.00 . A A . 1 ASP CA 1 1 24 6604 1 1 1 ASP CB C -5.932 -3.197 8.225 1.00 . A A . 1 ASP CB 1 1 24 6605 1 1 1 ASP CG C -4.704 -2.324 8.401 1.00 . A A . 1 ASP CG 1 1 24 6606 1 1 1 ASP H1 H -8.560 -3.241 8.301 1.00 . A A . 1 ASP H1 1 1 24 6607 1 1 1 ASP H2 H -8.022 -4.355 7.111 1.00 . A A . 1 ASP H2 1 1 24 6608 1 1 1 ASP H3 H -8.876 -2.941 6.644 1.00 . A A . 1 ASP H3 1 1 24 6609 1 1 1 ASP HA H -7.106 -1.576 7.457 1.00 . A A . 1 ASP HA 1 1 24 6610 1 1 1 ASP HB2 H -6.420 -3.297 9.184 1.00 . A A . 1 ASP HB2 1 1 24 6611 1 1 1 ASP HB3 H -5.614 -4.172 7.885 1.00 . A A . 1 ASP HB3 1 1 24 6612 1 1 1 ASP N N -8.211 -3.354 7.328 1.00 . A A . 1 ASP N 1 1 24 6613 1 1 1 ASP O O -6.226 -3.794 5.241 1.00 . A A . 1 ASP O 1 1 24 6614 1 1 1 ASP OD1 O -3.722 -2.525 7.657 1.00 . A A . 1 ASP OD1 1 1 24 6615 1 1 1 ASP OD2 O -4.726 -1.438 9.281 1.00 . A A . 1 ASP OD2 1 1 24 6616 1 1 2 ALA C C -3.960 -1.161 3.880 1.00 . A A . 2 ALA C 1 1 24 6617 1 1 2 ALA CA C -5.456 -1.489 3.879 1.00 . A A . 2 ALA CA 1 1 24 6618 1 1 2 ALA CB C -6.213 -0.467 3.046 1.00 . A A . 2 ALA CB 1 1 24 6619 1 1 2 ALA H H -6.139 -0.713 5.729 1.00 . A A . 2 ALA H 1 1 24 6620 1 1 2 ALA HA H -5.598 -2.457 3.423 1.00 . A A . 2 ALA HA 1 1 24 6621 1 1 2 ALA HB1 H -6.313 0.450 3.606 1.00 . A A . 2 ALA HB1 1 1 24 6622 1 1 2 ALA HB2 H -7.193 -0.853 2.808 1.00 . A A . 2 ALA HB2 1 1 24 6623 1 1 2 ALA HB3 H -5.670 -0.275 2.133 1.00 . A A . 2 ALA HB3 1 1 24 6624 1 1 2 ALA N N -6.012 -1.547 5.230 1.00 . A A . 2 ALA N 1 1 24 6625 1 1 2 ALA O O -3.271 -1.409 2.890 1.00 . A A . 2 ALA O 1 1 24 6626 1 1 3 TYR C C -1.156 -1.481 5.027 1.00 . A A . 3 TYR C 1 1 24 6627 1 1 3 TYR CA C -2.044 -0.240 5.094 1.00 . A A . 3 TYR CA 1 1 24 6628 1 1 3 TYR CB C -1.781 0.537 6.388 1.00 . A A . 3 TYR CB 1 1 24 6629 1 1 3 TYR CD1 C -0.835 2.822 5.847 1.00 . A A . 3 TYR CD1 1 1 24 6630 1 1 3 TYR CD2 C 0.655 1.144 6.662 1.00 . A A . 3 TYR CD2 1 1 24 6631 1 1 3 TYR CE1 C 0.213 3.719 5.777 1.00 . A A . 3 TYR CE1 1 1 24 6632 1 1 3 TYR CE2 C 1.706 2.037 6.590 1.00 . A A . 3 TYR CE2 1 1 24 6633 1 1 3 TYR CG C -0.632 1.517 6.291 1.00 . A A . 3 TYR CG 1 1 24 6634 1 1 3 TYR CZ C 1.480 3.323 6.148 1.00 . A A . 3 TYR CZ 1 1 24 6635 1 1 3 TYR H H -4.058 -0.422 5.742 1.00 . A A . 3 TYR H 1 1 24 6636 1 1 3 TYR HA H -1.803 0.390 4.255 1.00 . A A . 3 TYR HA 1 1 24 6637 1 1 3 TYR HB2 H -2.665 1.097 6.653 1.00 . A A . 3 TYR HB2 1 1 24 6638 1 1 3 TYR HB3 H -1.555 -0.163 7.179 1.00 . A A . 3 TYR HB3 1 1 24 6639 1 1 3 TYR HD1 H -1.829 3.132 5.545 1.00 . A A . 3 TYR HD1 1 1 24 6640 1 1 3 TYR HD2 H 0.830 0.135 7.007 1.00 . A A . 3 TYR HD2 1 1 24 6641 1 1 3 TYR HE1 H 0.036 4.727 5.437 1.00 . A A . 3 TYR HE1 1 1 24 6642 1 1 3 TYR HE2 H 2.699 1.726 6.879 1.00 . A A . 3 TYR HE2 1 1 24 6643 1 1 3 TYR HH H 2.598 4.690 6.910 1.00 . A A . 3 TYR HH 1 1 24 6644 1 1 3 TYR N N -3.461 -0.599 4.986 1.00 . A A . 3 TYR N 1 1 24 6645 1 1 3 TYR O O -0.191 -1.518 4.261 1.00 . A A . 3 TYR O 1 1 24 6646 1 1 3 TYR OH O 2.525 4.216 6.078 1.00 . A A . 3 TYR OH 1 1 24 6647 1 1 4 ALA C C -0.877 -4.468 4.481 1.00 . A A . 4 ALA C 1 1 24 6648 1 1 4 ALA CA C -0.741 -3.750 5.822 1.00 . A A . 4 ALA CA 1 1 24 6649 1 1 4 ALA CB C -1.208 -4.649 6.958 1.00 . A A . 4 ALA CB 1 1 24 6650 1 1 4 ALA H H -2.286 -2.418 6.391 1.00 . A A . 4 ALA H 1 1 24 6651 1 1 4 ALA HA H 0.302 -3.509 5.985 1.00 . A A . 4 ALA HA 1 1 24 6652 1 1 4 ALA HB1 H -1.289 -4.069 7.865 1.00 . A A . 4 ALA HB1 1 1 24 6653 1 1 4 ALA HB2 H -0.494 -5.446 7.103 1.00 . A A . 4 ALA HB2 1 1 24 6654 1 1 4 ALA HB3 H -2.172 -5.070 6.711 1.00 . A A . 4 ALA HB3 1 1 24 6655 1 1 4 ALA N N -1.498 -2.502 5.814 1.00 . A A . 4 ALA N 1 1 24 6656 1 1 4 ALA O O 0.071 -5.098 4.009 1.00 . A A . 4 ALA O 1 1 24 6657 1 1 5 GLN C C -1.498 -4.271 1.478 1.00 . A A . 5 GLN C 1 1 24 6658 1 1 5 GLN CA C -2.312 -4.971 2.566 1.00 . A A . 5 GLN CA 1 1 24 6659 1 1 5 GLN CB C -3.805 -4.910 2.235 1.00 . A A . 5 GLN CB 1 1 24 6660 1 1 5 GLN CD C -3.982 -7.054 0.907 1.00 . A A . 5 GLN CD 1 1 24 6661 1 1 5 GLN CG C -4.161 -5.547 0.903 1.00 . A A . 5 GLN CG 1 1 24 6662 1 1 5 GLN H H -2.770 -3.824 4.279 1.00 . A A . 5 GLN H 1 1 24 6663 1 1 5 GLN HA H -2.003 -6.004 2.624 1.00 . A A . 5 GLN HA 1 1 24 6664 1 1 5 GLN HB2 H -4.356 -5.419 3.012 1.00 . A A . 5 GLN HB2 1 1 24 6665 1 1 5 GLN HB3 H -4.113 -3.876 2.207 1.00 . A A . 5 GLN HB3 1 1 24 6666 1 1 5 GLN HE21 H -2.442 -6.907 -0.348 1.00 . A A . 5 GLN HE21 1 1 24 6667 1 1 5 GLN HE22 H -2.860 -8.509 0.145 1.00 . A A . 5 GLN HE22 1 1 24 6668 1 1 5 GLN HG2 H -5.193 -5.323 0.675 1.00 . A A . 5 GLN HG2 1 1 24 6669 1 1 5 GLN HG3 H -3.526 -5.124 0.141 1.00 . A A . 5 GLN HG3 1 1 24 6670 1 1 5 GLN N N -2.058 -4.352 3.861 1.00 . A A . 5 GLN N 1 1 24 6671 1 1 5 GLN NE2 N -2.995 -7.539 0.159 1.00 . A A . 5 GLN NE2 1 1 24 6672 1 1 5 GLN O O -0.979 -4.919 0.569 1.00 . A A . 5 GLN O 1 1 24 6673 1 1 5 GLN OE1 O -4.721 -7.776 1.576 1.00 . A A . 5 GLN OE1 1 1 24 6674 1 1 6 TRP C C 0.843 -2.576 0.632 1.00 . A A . 6 TRP C 1 1 24 6675 1 1 6 TRP CA C -0.619 -2.146 0.634 1.00 . A A . 6 TRP CA 1 1 24 6676 1 1 6 TRP CB C -0.721 -0.658 0.984 1.00 . A A . 6 TRP CB 1 1 24 6677 1 1 6 TRP CD1 C -0.306 0.542 -1.230 1.00 . A A . 6 TRP CD1 1 1 24 6678 1 1 6 TRP CD2 C 1.275 0.904 0.310 1.00 . A A . 6 TRP CD2 1 1 24 6679 1 1 6 TRP CE2 C 1.614 1.610 -0.857 1.00 . A A . 6 TRP CE2 1 1 24 6680 1 1 6 TRP CE3 C 2.125 0.985 1.417 1.00 . A A . 6 TRP CE3 1 1 24 6681 1 1 6 TRP CG C 0.040 0.225 0.047 1.00 . A A . 6 TRP CG 1 1 24 6682 1 1 6 TRP CH2 C 3.578 2.453 0.141 1.00 . A A . 6 TRP CH2 1 1 24 6683 1 1 6 TRP CZ2 C 2.765 2.386 -0.954 1.00 . A A . 6 TRP CZ2 1 1 24 6684 1 1 6 TRP CZ3 C 3.269 1.761 1.321 1.00 . A A . 6 TRP CZ3 1 1 24 6685 1 1 6 TRP H H -1.813 -2.492 2.347 1.00 . A A . 6 TRP H 1 1 24 6686 1 1 6 TRP HA H -1.036 -2.310 -0.348 1.00 . A A . 6 TRP HA 1 1 24 6687 1 1 6 TRP HB2 H -1.756 -0.359 0.956 1.00 . A A . 6 TRP HB2 1 1 24 6688 1 1 6 TRP HB3 H -0.334 -0.500 1.977 1.00 . A A . 6 TRP HB3 1 1 24 6689 1 1 6 TRP HD1 H -1.193 0.184 -1.726 1.00 . A A . 6 TRP HD1 1 1 24 6690 1 1 6 TRP HE1 H 0.611 1.729 -2.689 1.00 . A A . 6 TRP HE1 1 1 24 6691 1 1 6 TRP HE3 H 1.903 0.456 2.334 1.00 . A A . 6 TRP HE3 1 1 24 6692 1 1 6 TRP HH2 H 4.477 3.053 0.111 1.00 . A A . 6 TRP HH2 1 1 24 6693 1 1 6 TRP HZ2 H 3.020 2.920 -1.858 1.00 . A A . 6 TRP HZ2 1 1 24 6694 1 1 6 TRP HZ3 H 3.941 1.835 2.164 1.00 . A A . 6 TRP HZ3 1 1 24 6695 1 1 6 TRP N N -1.382 -2.944 1.591 1.00 . A A . 6 TRP N 1 1 24 6696 1 1 6 TRP NE1 N 0.637 1.368 -1.781 1.00 . A A . 6 TRP NE1 1 1 24 6697 1 1 6 TRP O O 1.429 -2.818 -0.425 1.00 . A A . 6 TRP O 1 1 24 6698 1 1 7 LEU C C 3.003 -4.529 1.523 1.00 . A A . 7 LEU C 1 1 24 6699 1 1 7 LEU CA C 2.808 -3.086 1.989 1.00 . A A . 7 LEU CA 1 1 24 6700 1 1 7 LEU CB C 3.231 -2.934 3.453 1.00 . A A . 7 LEU CB 1 1 24 6701 1 1 7 LEU CD1 C 3.225 -1.495 5.509 1.00 . A A . 7 LEU CD1 1 1 24 6702 1 1 7 LEU CD2 C 4.358 -0.685 3.429 1.00 . A A . 7 LEU CD2 1 1 24 6703 1 1 7 LEU CG C 3.198 -1.498 3.989 1.00 . A A . 7 LEU CG 1 1 24 6704 1 1 7 LEU H H 0.886 -2.473 2.630 1.00 . A A . 7 LEU H 1 1 24 6705 1 1 7 LEU HA H 3.417 -2.438 1.378 1.00 . A A . 7 LEU HA 1 1 24 6706 1 1 7 LEU HB2 H 2.570 -3.537 4.058 1.00 . A A . 7 LEU HB2 1 1 24 6707 1 1 7 LEU HB3 H 4.233 -3.313 3.560 1.00 . A A . 7 LEU HB3 1 1 24 6708 1 1 7 LEU HD11 H 4.226 -1.711 5.852 1.00 . A A . 7 LEU HD11 1 1 24 6709 1 1 7 LEU HD12 H 2.546 -2.248 5.883 1.00 . A A . 7 LEU HD12 1 1 24 6710 1 1 7 LEU HD13 H 2.921 -0.524 5.871 1.00 . A A . 7 LEU HD13 1 1 24 6711 1 1 7 LEU HD21 H 4.473 0.221 4.006 1.00 . A A . 7 LEU HD21 1 1 24 6712 1 1 7 LEU HD22 H 4.158 -0.430 2.398 1.00 . A A . 7 LEU HD22 1 1 24 6713 1 1 7 LEU HD23 H 5.267 -1.266 3.487 1.00 . A A . 7 LEU HD23 1 1 24 6714 1 1 7 LEU HG H 2.278 -1.027 3.674 1.00 . A A . 7 LEU HG 1 1 24 6715 1 1 7 LEU N N 1.417 -2.675 1.829 1.00 . A A . 7 LEU N 1 1 24 6716 1 1 7 LEU O O 4.036 -4.868 0.943 1.00 . A A . 7 LEU O 1 1 24 6717 1 1 8 ALA C C 1.816 -6.939 -0.144 1.00 . A A . 8 ALA C 1 1 24 6718 1 1 8 ALA CA C 2.040 -6.775 1.365 1.00 . A A . 8 ALA CA 1 1 24 6719 1 1 8 ALA CB C 1.008 -7.581 2.142 1.00 . A A . 8 ALA CB 1 1 24 6720 1 1 8 ALA H H 1.194 -5.034 2.226 1.00 . A A . 8 ALA H 1 1 24 6721 1 1 8 ALA HA H 3.019 -7.158 1.614 1.00 . A A . 8 ALA HA 1 1 24 6722 1 1 8 ALA HB1 H 0.910 -8.562 1.701 1.00 . A A . 8 ALA HB1 1 1 24 6723 1 1 8 ALA HB2 H 0.055 -7.074 2.108 1.00 . A A . 8 ALA HB2 1 1 24 6724 1 1 8 ALA HB3 H 1.328 -7.678 3.169 1.00 . A A . 8 ALA HB3 1 1 24 6725 1 1 8 ALA N N 1.994 -5.370 1.768 1.00 . A A . 8 ALA N 1 1 24 6726 1 1 8 ALA O O 2.157 -7.976 -0.715 1.00 . A A . 8 ALA O 1 1 24 6727 1 1 9 ASP C C 2.190 -5.420 -3.029 1.00 . A A . 9 ASP C 1 1 24 6728 1 1 9 ASP CA C 0.991 -5.944 -2.228 1.00 . A A . 9 ASP CA 1 1 24 6729 1 1 9 ASP CB C -0.260 -5.120 -2.565 1.00 . A A . 9 ASP CB 1 1 24 6730 1 1 9 ASP CG C -1.305 -5.933 -3.302 1.00 . A A . 9 ASP CG 1 1 24 6731 1 1 9 ASP H H 1.004 -5.107 -0.280 1.00 . A A . 9 ASP H 1 1 24 6732 1 1 9 ASP HA H 0.814 -6.972 -2.504 1.00 . A A . 9 ASP HA 1 1 24 6733 1 1 9 ASP HB2 H -0.700 -4.750 -1.652 1.00 . A A . 9 ASP HB2 1 1 24 6734 1 1 9 ASP HB3 H 0.023 -4.283 -3.187 1.00 . A A . 9 ASP HB3 1 1 24 6735 1 1 9 ASP N N 1.249 -5.909 -0.786 1.00 . A A . 9 ASP N 1 1 24 6736 1 1 9 ASP O O 2.059 -5.097 -4.212 1.00 . A A . 9 ASP O 1 1 24 6737 1 1 9 ASP OD1 O -1.197 -6.057 -4.541 1.00 . A A . 9 ASP OD1 1 1 24 6738 1 1 9 ASP OD2 O -2.233 -6.446 -2.642 1.00 . A A . 9 ASP OD2 1 1 24 6739 1 1 10 DAL C C 4.898 -3.414 -2.640 1.00 . A A . 10 DAL C 1 1 24 6740 1 1 10 DAL CA C 4.573 -4.858 -3.036 1.00 . A A . 10 DAL CA 1 1 24 6741 1 1 10 DAL CB C 5.739 -5.765 -2.688 1.00 . A A . 10 DAL CB 1 1 24 6742 1 1 10 DAL H H 3.406 -5.610 -1.444 1.00 . A A . 10 DAL H 1 1 24 6743 1 1 10 DAL HA H 4.420 -4.903 -4.104 1.00 . A A . 10 DAL HA 1 1 24 6744 1 1 10 DAL HB1 H 6.599 -5.490 -3.278 1.00 . A A . 10 DAL HB1 1 1 24 6745 1 1 10 DAL HB2 H 5.472 -6.791 -2.895 1.00 . A A . 10 DAL HB2 1 1 24 6746 1 1 10 DAL HB3 H 5.972 -5.658 -1.639 1.00 . A A . 10 DAL HB3 1 1 24 6747 1 1 10 DAL N N 3.358 -5.340 -2.383 1.00 . A A . 10 DAL N 1 1 24 6748 1 1 10 DAL O O 5.925 -2.872 -3.053 1.00 . A A . 10 DAL O 1 1 24 6749 1 1 11 GLY C C 4.145 -0.437 -2.546 1.00 . A A . 11 GLY C 1 1 24 6750 1 1 11 GLY CA C 4.242 -1.428 -1.406 1.00 . A A . 11 GLY CA 1 1 24 6751 1 1 11 GLY H H 3.224 -3.275 -1.542 1.00 . A A . 11 GLY H 1 1 24 6752 1 1 11 GLY HA2 H 3.503 -1.173 -0.661 1.00 . A A . 11 GLY HA2 1 1 24 6753 1 1 11 GLY HA3 H 5.225 -1.354 -0.964 1.00 . A A . 11 GLY HA3 1 1 24 6754 1 1 11 GLY N N 4.023 -2.797 -1.840 1.00 . A A . 11 GLY N 1 1 24 6755 1 1 11 GLY O O 3.049 -0.013 -2.914 1.00 . A A . 11 GLY O 1 1 24 6756 1 1 12 TRP C C 5.425 0.179 -5.572 1.00 . A A . 12 TRP C 1 1 24 6757 1 1 12 TRP CA C 5.335 0.880 -4.214 1.00 . A A . 12 TRP CA 1 1 24 6758 1 1 12 TRP CB C 6.493 1.857 -4.017 1.00 . A A . 12 TRP CB 1 1 24 6759 1 1 12 TRP CD1 C 6.641 3.205 -1.848 1.00 . A A . 12 TRP CD1 1 1 24 6760 1 1 12 TRP CD2 C 5.110 3.955 -3.302 1.00 . A A . 12 TRP CD2 1 1 24 6761 1 1 12 TRP CE2 C 5.074 4.764 -2.154 1.00 . A A . 12 TRP CE2 1 1 24 6762 1 1 12 TRP CE3 C 4.234 4.240 -4.358 1.00 . A A . 12 TRP CE3 1 1 24 6763 1 1 12 TRP CG C 6.119 2.962 -3.085 1.00 . A A . 12 TRP CG 1 1 24 6764 1 1 12 TRP CH2 C 3.350 6.090 -3.071 1.00 . A A . 12 TRP CH2 1 1 24 6765 1 1 12 TRP CZ2 C 4.196 5.832 -2.026 1.00 . A A . 12 TRP CZ2 1 1 24 6766 1 1 12 TRP CZ3 C 3.366 5.305 -4.231 1.00 . A A . 12 TRP CZ3 1 1 24 6767 1 1 12 TRP H H 6.135 -0.445 -2.770 1.00 . A A . 12 TRP H 1 1 24 6768 1 1 12 TRP HA H 4.409 1.441 -4.185 1.00 . A A . 12 TRP HA 1 1 24 6769 1 1 12 TRP HB2 H 7.338 1.330 -3.596 1.00 . A A . 12 TRP HB2 1 1 24 6770 1 1 12 TRP HB3 H 6.774 2.289 -4.966 1.00 . A A . 12 TRP HB3 1 1 24 6771 1 1 12 TRP HD1 H 7.429 2.622 -1.394 1.00 . A A . 12 TRP HD1 1 1 24 6772 1 1 12 TRP HE1 H 6.218 4.661 -0.396 1.00 . A A . 12 TRP HE1 1 1 24 6773 1 1 12 TRP HE3 H 4.228 3.646 -5.260 1.00 . A A . 12 TRP HE3 1 1 24 6774 1 1 12 TRP HH2 H 2.655 6.914 -3.014 1.00 . A A . 12 TRP HH2 1 1 24 6775 1 1 12 TRP HZ2 H 4.165 6.435 -1.135 1.00 . A A . 12 TRP HZ2 1 1 24 6776 1 1 12 TRP HZ3 H 2.686 5.542 -5.039 1.00 . A A . 12 TRP HZ3 1 1 24 6777 1 1 12 TRP N N 5.295 -0.070 -3.108 1.00 . A A . 12 TRP N 1 1 24 6778 1 1 12 TRP NE1 N 6.018 4.288 -1.281 1.00 . A A . 12 TRP NE1 1 1 24 6779 1 1 12 TRP O O 5.637 0.829 -6.598 1.00 . A A . 12 TRP O 1 1 24 6780 1 1 13 ALA C C 3.875 -1.896 -7.473 1.00 . A A . 13 ALA C 1 1 24 6781 1 1 13 ALA CA C 5.252 -1.914 -6.817 1.00 . A A . 13 ALA CA 1 1 24 6782 1 1 13 ALA CB C 5.704 -3.341 -6.554 1.00 . A A . 13 ALA CB 1 1 24 6783 1 1 13 ALA H H 5.037 -1.605 -4.738 1.00 . A A . 13 ALA H 1 1 24 6784 1 1 13 ALA HA H 5.962 -1.451 -7.484 1.00 . A A . 13 ALA HA 1 1 24 6785 1 1 13 ALA HB1 H 6.014 -3.438 -5.524 1.00 . A A . 13 ALA HB1 1 1 24 6786 1 1 13 ALA HB2 H 6.534 -3.577 -7.203 1.00 . A A . 13 ALA HB2 1 1 24 6787 1 1 13 ALA HB3 H 4.888 -4.020 -6.750 1.00 . A A . 13 ALA HB3 1 1 24 6788 1 1 13 ALA N N 5.228 -1.142 -5.580 1.00 . A A . 13 ALA N 1 1 24 6789 1 1 13 ALA O O 3.761 -1.921 -8.700 1.00 . A A . 13 ALA O 1 1 24 6790 1 1 14 SER C C 1.209 -0.511 -7.938 1.00 . A A . 14 SER C 1 1 24 6791 1 1 14 SER CA C 1.455 -1.783 -7.121 1.00 . A A . 14 SER CA 1 1 24 6792 1 1 14 SER CB C 0.473 -1.855 -5.941 1.00 . A A . 14 SER CB 1 1 24 6793 1 1 14 SER H H 2.996 -1.799 -5.674 1.00 . A A . 14 SER H 1 1 24 6794 1 1 14 SER HA H 1.298 -2.637 -7.761 1.00 . A A . 14 SER HA 1 1 24 6795 1 1 14 SER HB2 H -0.449 -1.364 -6.212 1.00 . A A . 14 SER HB2 1 1 24 6796 1 1 14 SER HB3 H 0.272 -2.890 -5.706 1.00 . A A . 14 SER HB3 1 1 24 6797 1 1 14 SER HG H 1.350 -1.885 -4.182 1.00 . A A . 14 SER HG 1 1 24 6798 1 1 14 SER N N 2.832 -1.831 -6.640 1.00 . A A . 14 SER N 1 1 24 6799 1 1 14 SER O O 0.374 -0.500 -8.844 1.00 . A A . 14 SER O 1 1 24 6800 1 1 14 SER OG O 1.003 -1.220 -4.785 1.00 . A A . 14 SER OG 1 1 24 6801 1 1 15 DAL C C 0.943 2.821 -7.537 1.00 . A A . 15 DAL C 1 1 24 6802 1 1 15 DAL CA C 1.813 1.833 -8.319 1.00 . A A . 15 DAL CA 1 1 24 6803 1 1 15 DAL CB C 3.188 2.427 -8.586 1.00 . A A . 15 DAL CB 1 1 24 6804 1 1 15 DAL H H 2.597 0.486 -6.883 1.00 . A A . 15 DAL H 1 1 24 6805 1 1 15 DAL HA H 1.347 1.637 -9.272 1.00 . A A . 15 DAL HA 1 1 24 6806 1 1 15 DAL HB1 H 3.313 2.573 -9.648 1.00 . A A . 15 DAL HB1 1 1 24 6807 1 1 15 DAL HB2 H 3.949 1.752 -8.223 1.00 . A A . 15 DAL HB2 1 1 24 6808 1 1 15 DAL HB3 H 3.276 3.376 -8.079 1.00 . A A . 15 DAL HB3 1 1 24 6809 1 1 15 DAL N N 1.947 0.558 -7.614 1.00 . A A . 15 DAL N 1 1 24 6810 1 1 15 DAL O O 1.057 4.037 -7.711 1.00 . A A . 15 DAL O 1 1 24 6811 1 1 16 ARG C C -0.117 3.564 -4.580 1.00 . A A . 16 ARG C 1 1 24 6812 1 1 16 ARG CA C -0.817 3.121 -5.867 1.00 . A A . 16 ARG CA 1 1 24 6813 1 1 16 ARG CB C -2.102 2.339 -5.525 1.00 . A A . 16 ARG CB 1 1 24 6814 1 1 16 ARG CD C -2.910 0.190 -4.493 1.00 . A A . 16 ARG CD 1 1 24 6815 1 1 16 ARG CG C -1.932 1.350 -4.378 1.00 . A A . 16 ARG CG 1 1 24 6816 1 1 16 ARG CZ C -3.453 -0.420 -2.154 1.00 . A A . 16 ARG CZ 1 1 24 6817 1 1 16 ARG H H 0.029 1.316 -6.585 1.00 . A A . 16 ARG H 1 1 24 6818 1 1 16 ARG HA H -1.072 4.002 -6.442 1.00 . A A . 16 ARG HA 1 1 24 6819 1 1 16 ARG HB2 H -2.875 3.042 -5.252 1.00 . A A . 16 ARG HB2 1 1 24 6820 1 1 16 ARG HB3 H -2.427 1.782 -6.399 1.00 . A A . 16 ARG HB3 1 1 24 6821 1 1 16 ARG HD2 H -3.909 0.585 -4.596 1.00 . A A . 16 ARG HD2 1 1 24 6822 1 1 16 ARG HD3 H -2.660 -0.385 -5.372 1.00 . A A . 16 ARG HD3 1 1 24 6823 1 1 16 ARG HE H -2.376 -1.536 -3.418 1.00 . A A . 16 ARG HE 1 1 24 6824 1 1 16 ARG HG2 H -0.925 0.960 -4.398 1.00 . A A . 16 ARG HG2 1 1 24 6825 1 1 16 ARG HG3 H -2.104 1.863 -3.443 1.00 . A A . 16 ARG HG3 1 1 24 6826 1 1 16 ARG HH11 H -4.197 1.376 -2.726 1.00 . A A . 16 ARG HH11 1 1 24 6827 1 1 16 ARG HH12 H -4.559 0.909 -1.100 1.00 . A A . 16 ARG HH12 1 1 24 6828 1 1 16 ARG HH21 H -2.860 -2.145 -1.276 1.00 . A A . 16 ARG HH21 1 1 24 6829 1 1 16 ARG HH22 H -3.800 -1.089 -0.275 1.00 . A A . 16 ARG HH22 1 1 24 6830 1 1 16 ARG N N 0.073 2.291 -6.678 1.00 . A A . 16 ARG N 1 1 24 6831 1 1 16 ARG NE N -2.866 -0.692 -3.325 1.00 . A A . 16 ARG NE 1 1 24 6832 1 1 16 ARG NH1 N -4.125 0.715 -1.980 1.00 . A A . 16 ARG NH1 1 1 24 6833 1 1 16 ARG NH2 N -3.364 -1.289 -1.153 1.00 . A A . 16 ARG NH2 1 1 24 6834 1 1 16 ARG O O 0.794 2.888 -4.102 1.00 . A A . 16 ARG O 1 1 24 6835 1 1 17 PRO C C -0.556 4.607 -1.509 1.00 . A A . 17 PRO C 1 1 24 6836 1 1 17 PRO CA C 0.055 5.232 -2.764 1.00 . A A . 17 PRO CA 1 1 24 6837 1 1 17 PRO CB C -0.258 6.735 -2.817 1.00 . A A . 17 PRO CB 1 1 24 6838 1 1 17 PRO CD C -1.588 5.594 -4.486 1.00 . A A . 17 PRO CD 1 1 24 6839 1 1 17 PRO CG C -1.120 6.949 -4.027 1.00 . A A . 17 PRO CG 1 1 24 6840 1 1 17 PRO HA H 1.123 5.087 -2.742 1.00 . A A . 17 PRO HA 1 1 24 6841 1 1 17 PRO HB2 H -0.777 7.024 -1.915 1.00 . A A . 17 PRO HB2 1 1 24 6842 1 1 17 PRO HB3 H 0.670 7.287 -2.892 1.00 . A A . 17 PRO HB3 1 1 24 6843 1 1 17 PRO HD2 H -2.537 5.345 -4.040 1.00 . A A . 17 PRO HD2 1 1 24 6844 1 1 17 PRO HD3 H -1.655 5.565 -5.562 1.00 . A A . 17 PRO HD3 1 1 24 6845 1 1 17 PRO HG2 H -1.968 7.564 -3.766 1.00 . A A . 17 PRO HG2 1 1 24 6846 1 1 17 PRO HG3 H -0.542 7.426 -4.805 1.00 . A A . 17 PRO HG3 1 1 24 6847 1 1 17 PRO N N -0.530 4.709 -3.998 1.00 . A A . 17 PRO N 1 1 24 6848 1 1 17 PRO O O -1.599 3.954 -1.570 1.00 . A A . 17 PRO O 1 1 24 6849 1 1 18 PRO C C -1.711 4.806 1.380 1.00 . A A . 18 PRO C 1 1 24 6850 1 1 18 PRO CA C -0.356 4.254 0.936 1.00 . A A . 18 PRO CA 1 1 24 6851 1 1 18 PRO CB C 0.720 4.694 1.934 1.00 . A A . 18 PRO CB 1 1 24 6852 1 1 18 PRO CD C 1.361 5.556 -0.209 1.00 . A A . 18 PRO CD 1 1 24 6853 1 1 18 PRO CG C 1.464 5.800 1.268 1.00 . A A . 18 PRO CG 1 1 24 6854 1 1 18 PRO HA H -0.401 3.175 0.907 1.00 . A A . 18 PRO HA 1 1 24 6855 1 1 18 PRO HB2 H 0.244 5.038 2.837 1.00 . A A . 18 PRO HB2 1 1 24 6856 1 1 18 PRO HB3 H 1.365 3.864 2.160 1.00 . A A . 18 PRO HB3 1 1 24 6857 1 1 18 PRO HD2 H 1.308 6.494 -0.742 1.00 . A A . 18 PRO HD2 1 1 24 6858 1 1 18 PRO HD3 H 2.200 4.973 -0.554 1.00 . A A . 18 PRO HD3 1 1 24 6859 1 1 18 PRO HG2 H 1.014 6.749 1.521 1.00 . A A . 18 PRO HG2 1 1 24 6860 1 1 18 PRO HG3 H 2.499 5.783 1.578 1.00 . A A . 18 PRO HG3 1 1 24 6861 1 1 18 PRO N N 0.104 4.800 -0.349 1.00 . A A . 18 PRO N 1 1 24 6862 1 1 18 PRO O O -2.022 5.976 1.149 1.00 . A A . 18 PRO O 1 1 24 6863 1 1 19 PRO C C -3.764 5.116 3.863 1.00 . A A . 19 PRO C 1 1 24 6864 1 1 19 PRO CA C -3.841 4.361 2.536 1.00 . A A . 19 PRO CA 1 1 24 6865 1 1 19 PRO CB C -4.571 3.032 2.713 1.00 . A A . 19 PRO CB 1 1 24 6866 1 1 19 PRO CD C -2.222 2.560 2.360 1.00 . A A . 19 PRO CD 1 1 24 6867 1 1 19 PRO CG C -3.521 1.987 2.869 1.00 . A A . 19 PRO CG 1 1 24 6868 1 1 19 PRO HA H -4.366 4.967 1.812 1.00 . A A . 19 PRO HA 1 1 24 6869 1 1 19 PRO HB2 H -5.208 3.080 3.582 1.00 . A A . 19 PRO HB2 1 1 24 6870 1 1 19 PRO HB3 H -5.162 2.843 1.847 1.00 . A A . 19 PRO HB3 1 1 24 6871 1 1 19 PRO HD2 H -1.458 2.500 3.118 1.00 . A A . 19 PRO HD2 1 1 24 6872 1 1 19 PRO HD3 H -1.914 2.030 1.473 1.00 . A A . 19 PRO HD3 1 1 24 6873 1 1 19 PRO HG2 H -3.435 1.714 3.904 1.00 . A A . 19 PRO HG2 1 1 24 6874 1 1 19 PRO HG3 H -3.793 1.119 2.285 1.00 . A A . 19 PRO HG3 1 1 24 6875 1 1 19 PRO N N -2.529 3.964 2.041 1.00 . A A . 19 PRO N 1 1 24 6876 1 1 19 PRO O O -2.986 4.757 4.747 1.00 . A A . 19 PRO O 1 1 24 6877 1 1 20 SER C C -5.891 7.793 5.304 1.00 . A A . 20 SER C 1 1 24 6878 1 1 20 SER CA C -4.604 6.973 5.211 1.00 . A A . 20 SER CA 1 1 24 6879 1 1 20 SER CB C -3.384 7.900 5.266 1.00 . A A . 20 SER CB 1 1 24 6880 1 1 20 SER H H -5.174 6.400 3.251 1.00 . A A . 20 SER H 1 1 24 6881 1 1 20 SER HA H -4.565 6.297 6.053 1.00 . A A . 20 SER HA 1 1 24 6882 1 1 20 SER HB2 H -3.485 8.576 6.101 1.00 . A A . 20 SER HB2 1 1 24 6883 1 1 20 SER HB3 H -2.490 7.306 5.392 1.00 . A A . 20 SER HB3 1 1 24 6884 1 1 20 SER HG H -3.364 9.593 4.279 1.00 . A A . 20 SER HG 1 1 24 6885 1 1 20 SER N N -4.577 6.164 3.992 1.00 . A A . 20 SER N 1 1 24 6886 1 1 20 SER O O -6.542 7.749 6.368 1.00 . A A . 20 SER O 1 1 24 6887 1 1 20 SER OXT O -6.237 8.472 4.312 1.00 . A A . 20 SER OXT 1 1 24 6888 1 1 20 SER OG O -3.261 8.661 4.076 1.00 . A A . 20 SER OG 1 1 25 6889 1 1 1 ASP C C -5.782 -2.522 5.902 1.00 . A A . 1 ASP C 1 1 25 6890 1 1 1 ASP CA C -6.071 -3.867 6.570 1.00 . A A . 1 ASP CA 1 1 25 6891 1 1 1 ASP CB C -4.826 -4.759 6.521 1.00 . A A . 1 ASP CB 1 1 25 6892 1 1 1 ASP CG C -4.531 -5.415 7.857 1.00 . A A . 1 ASP CG 1 1 25 6893 1 1 1 ASP H1 H -7.519 -5.333 6.549 1.00 . A A . 1 ASP H1 1 1 25 6894 1 1 1 ASP H2 H -6.847 -4.976 5.011 1.00 . A A . 1 ASP H2 1 1 25 6895 1 1 1 ASP H3 H -7.958 -3.889 5.738 1.00 . A A . 1 ASP H3 1 1 25 6896 1 1 1 ASP HA H -6.339 -3.693 7.601 1.00 . A A . 1 ASP HA 1 1 25 6897 1 1 1 ASP HB2 H -4.974 -5.535 5.785 1.00 . A A . 1 ASP HB2 1 1 25 6898 1 1 1 ASP HB3 H -3.972 -4.160 6.239 1.00 . A A . 1 ASP HB3 1 1 25 6899 1 1 1 ASP N N -7.200 -4.580 5.907 1.00 . A A . 1 ASP N 1 1 25 6900 1 1 1 ASP O O -5.553 -1.524 6.588 1.00 . A A . 1 ASP O 1 1 25 6901 1 1 1 ASP OD1 O -4.094 -4.701 8.786 1.00 . A A . 1 ASP OD1 1 1 25 6902 1 1 1 ASP OD2 O -4.736 -6.641 7.975 1.00 . A A . 1 ASP OD2 1 1 25 6903 1 1 2 ALA C C -4.048 -0.927 3.805 1.00 . A A . 2 ALA C 1 1 25 6904 1 1 2 ALA CA C -5.532 -1.292 3.787 1.00 . A A . 2 ALA CA 1 1 25 6905 1 1 2 ALA CB C -6.382 -0.131 4.292 1.00 . A A . 2 ALA CB 1 1 25 6906 1 1 2 ALA H H -5.980 -3.340 4.082 1.00 . A A . 2 ALA H 1 1 25 6907 1 1 2 ALA HA H -5.821 -1.493 2.765 1.00 . A A . 2 ALA HA 1 1 25 6908 1 1 2 ALA HB1 H -6.922 0.304 3.465 1.00 . A A . 2 ALA HB1 1 1 25 6909 1 1 2 ALA HB2 H -5.744 0.616 4.738 1.00 . A A . 2 ALA HB2 1 1 25 6910 1 1 2 ALA HB3 H -7.083 -0.492 5.029 1.00 . A A . 2 ALA HB3 1 1 25 6911 1 1 2 ALA N N -5.792 -2.507 4.563 1.00 . A A . 2 ALA N 1 1 25 6912 1 1 2 ALA O O -3.355 -1.092 2.802 1.00 . A A . 2 ALA O 1 1 25 6913 1 1 3 TYR C C -1.258 -1.286 5.058 1.00 . A A . 3 TYR C 1 1 25 6914 1 1 3 TYR CA C -2.157 -0.052 5.085 1.00 . A A . 3 TYR CA 1 1 25 6915 1 1 3 TYR CB C -1.933 0.750 6.370 1.00 . A A . 3 TYR CB 1 1 25 6916 1 1 3 TYR CD1 C -0.956 3.023 5.824 1.00 . A A . 3 TYR CD1 1 1 25 6917 1 1 3 TYR CD2 C 0.500 1.340 6.689 1.00 . A A . 3 TYR CD2 1 1 25 6918 1 1 3 TYR CE1 C 0.102 3.909 5.765 1.00 . A A . 3 TYR CE1 1 1 25 6919 1 1 3 TYR CE2 C 1.562 2.222 6.628 1.00 . A A . 3 TYR CE2 1 1 25 6920 1 1 3 TYR CG C -0.775 1.721 6.288 1.00 . A A . 3 TYR CG 1 1 25 6921 1 1 3 TYR CZ C 1.357 3.504 6.166 1.00 . A A . 3 TYR CZ 1 1 25 6922 1 1 3 TYR H H -4.166 -0.325 5.715 1.00 . A A . 3 TYR H 1 1 25 6923 1 1 3 TYR HA H -1.905 0.566 4.241 1.00 . A A . 3 TYR HA 1 1 25 6924 1 1 3 TYR HB2 H -2.824 1.319 6.591 1.00 . A A . 3 TYR HB2 1 1 25 6925 1 1 3 TYR HB3 H -1.737 0.067 7.183 1.00 . A A . 3 TYR HB3 1 1 25 6926 1 1 3 TYR HD1 H -1.939 3.339 5.499 1.00 . A A . 3 TYR HD1 1 1 25 6927 1 1 3 TYR HD2 H 0.659 0.334 7.049 1.00 . A A . 3 TYR HD2 1 1 25 6928 1 1 3 TYR HE1 H -0.058 4.915 5.409 1.00 . A A . 3 TYR HE1 1 1 25 6929 1 1 3 TYR HE2 H 2.546 1.905 6.941 1.00 . A A . 3 TYR HE2 1 1 25 6930 1 1 3 TYR HH H 2.475 4.868 6.935 1.00 . A A . 3 TYR HH 1 1 25 6931 1 1 3 TYR N N -3.563 -0.433 4.949 1.00 . A A . 3 TYR N 1 1 25 6932 1 1 3 TYR O O -0.321 -1.356 4.261 1.00 . A A . 3 TYR O 1 1 25 6933 1 1 3 TYR OH O 2.412 4.387 6.107 1.00 . A A . 3 TYR OH 1 1 25 6934 1 1 4 ALA C C -0.951 -4.271 4.641 1.00 . A A . 4 ALA C 1 1 25 6935 1 1 4 ALA CA C -0.788 -3.505 5.953 1.00 . A A . 4 ALA CA 1 1 25 6936 1 1 4 ALA CB C -1.215 -4.367 7.134 1.00 . A A . 4 ALA CB 1 1 25 6937 1 1 4 ALA H H -2.329 -2.163 6.511 1.00 . A A . 4 ALA H 1 1 25 6938 1 1 4 ALA HA H 0.255 -3.246 6.080 1.00 . A A . 4 ALA HA 1 1 25 6939 1 1 4 ALA HB1 H -0.755 -5.341 7.054 1.00 . A A . 4 ALA HB1 1 1 25 6940 1 1 4 ALA HB2 H -2.289 -4.475 7.130 1.00 . A A . 4 ALA HB2 1 1 25 6941 1 1 4 ALA HB3 H -0.904 -3.896 8.055 1.00 . A A . 4 ALA HB3 1 1 25 6942 1 1 4 ALA N N -1.560 -2.267 5.912 1.00 . A A . 4 ALA N 1 1 25 6943 1 1 4 ALA O O -0.018 -4.929 4.179 1.00 . A A . 4 ALA O 1 1 25 6944 1 1 5 GLN C C -1.612 -4.156 1.642 1.00 . A A . 5 GLN C 1 1 25 6945 1 1 5 GLN CA C -2.421 -4.812 2.762 1.00 . A A . 5 GLN CA 1 1 25 6946 1 1 5 GLN CB C -3.920 -4.741 2.449 1.00 . A A . 5 GLN CB 1 1 25 6947 1 1 5 GLN CD C -4.110 -6.816 1.015 1.00 . A A . 5 GLN CD 1 1 25 6948 1 1 5 GLN CG C -4.291 -5.311 1.090 1.00 . A A . 5 GLN CG 1 1 25 6949 1 1 5 GLN H H -2.836 -3.602 4.443 1.00 . A A . 5 GLN H 1 1 25 6950 1 1 5 GLN HA H -2.125 -5.847 2.847 1.00 . A A . 5 GLN HA 1 1 25 6951 1 1 5 GLN HB2 H -4.459 -5.292 3.205 1.00 . A A . 5 GLN HB2 1 1 25 6952 1 1 5 GLN HB3 H -4.232 -3.708 2.479 1.00 . A A . 5 GLN HB3 1 1 25 6953 1 1 5 GLN HE21 H -2.334 -6.593 0.142 1.00 . A A . 5 GLN HE21 1 1 25 6954 1 1 5 GLN HE22 H -2.842 -8.222 0.406 1.00 . A A . 5 GLN HE22 1 1 25 6955 1 1 5 GLN HG2 H -5.326 -5.078 0.887 1.00 . A A . 5 GLN HG2 1 1 25 6956 1 1 5 GLN HG3 H -3.667 -4.849 0.341 1.00 . A A . 5 GLN HG3 1 1 25 6957 1 1 5 GLN N N -2.139 -4.157 4.033 1.00 . A A . 5 GLN N 1 1 25 6958 1 1 5 GLN NE2 N -2.981 -7.254 0.466 1.00 . A A . 5 GLN NE2 1 1 25 6959 1 1 5 GLN O O -1.102 -4.838 0.754 1.00 . A A . 5 GLN O 1 1 25 6960 1 1 5 GLN OE1 O -4.975 -7.578 1.447 1.00 . A A . 5 GLN OE1 1 1 25 6961 1 1 6 TRP C C 0.729 -2.508 0.711 1.00 . A A . 6 TRP C 1 1 25 6962 1 1 6 TRP CA C -0.729 -2.065 0.716 1.00 . A A . 6 TRP CA 1 1 25 6963 1 1 6 TRP CB C -0.812 -0.566 1.023 1.00 . A A . 6 TRP CB 1 1 25 6964 1 1 6 TRP CD1 C -0.369 0.586 -1.213 1.00 . A A . 6 TRP CD1 1 1 25 6965 1 1 6 TRP CD2 C 1.213 0.948 0.327 1.00 . A A . 6 TRP CD2 1 1 25 6966 1 1 6 TRP CE2 C 1.568 1.628 -0.851 1.00 . A A . 6 TRP CE2 1 1 25 6967 1 1 6 TRP CE3 C 2.061 1.034 1.435 1.00 . A A . 6 TRP CE3 1 1 25 6968 1 1 6 TRP CG C -0.033 0.285 0.071 1.00 . A A . 6 TRP CG 1 1 25 6969 1 1 6 TRP CH2 C 3.543 2.455 0.140 1.00 . A A . 6 TRP CH2 1 1 25 6970 1 1 6 TRP CZ2 C 2.732 2.384 -0.957 1.00 . A A . 6 TRP CZ2 1 1 25 6971 1 1 6 TRP CZ3 C 3.218 1.788 1.330 1.00 . A A . 6 TRP CZ3 1 1 25 6972 1 1 6 TRP H H -1.912 -2.345 2.448 1.00 . A A . 6 TRP H 1 1 25 6973 1 1 6 TRP HA H -1.158 -2.253 -0.256 1.00 . A A . 6 TRP HA 1 1 25 6974 1 1 6 TRP HB2 H -1.842 -0.254 0.981 1.00 . A A . 6 TRP HB2 1 1 25 6975 1 1 6 TRP HB3 H -0.430 -0.387 2.015 1.00 . A A . 6 TRP HB3 1 1 25 6976 1 1 6 TRP HD1 H -1.260 0.235 -1.706 1.00 . A A . 6 TRP HD1 1 1 25 6977 1 1 6 TRP HE1 H 0.572 1.734 -2.688 1.00 . A A . 6 TRP HE1 1 1 25 6978 1 1 6 TRP HE3 H 1.827 0.523 2.359 1.00 . A A . 6 TRP HE3 1 1 25 6979 1 1 6 TRP HH2 H 4.451 3.040 0.103 1.00 . A A . 6 TRP HH2 1 1 25 6980 1 1 6 TRP HZ2 H 2.998 2.899 -1.868 1.00 . A A . 6 TRP HZ2 1 1 25 6981 1 1 6 TRP HZ3 H 3.888 1.866 2.175 1.00 . A A . 6 TRP HZ3 1 1 25 6982 1 1 6 TRP N N -1.489 -2.826 1.706 1.00 . A A . 6 TRP N 1 1 25 6983 1 1 6 TRP NE1 N 0.589 1.387 -1.774 1.00 . A A . 6 TRP NE1 1 1 25 6984 1 1 6 TRP O O 1.302 -2.787 -0.343 1.00 . A A . 6 TRP O 1 1 25 6985 1 1 7 LEU C C 2.884 -4.449 1.619 1.00 . A A . 7 LEU C 1 1 25 6986 1 1 7 LEU CA C 2.704 -2.997 2.066 1.00 . A A . 7 LEU CA 1 1 25 6987 1 1 7 LEU CB C 3.137 -2.829 3.526 1.00 . A A . 7 LEU CB 1 1 25 6988 1 1 7 LEU CD1 C 3.065 -1.389 5.581 1.00 . A A . 7 LEU CD1 1 1 25 6989 1 1 7 LEU CD2 C 4.246 -0.572 3.532 1.00 . A A . 7 LEU CD2 1 1 25 6990 1 1 7 LEU CG C 3.077 -1.393 4.060 1.00 . A A . 7 LEU CG 1 1 25 6991 1 1 7 LEU H H 0.793 -2.348 2.705 1.00 . A A . 7 LEU H 1 1 25 6992 1 1 7 LEU HA H 3.315 -2.363 1.442 1.00 . A A . 7 LEU HA 1 1 25 6993 1 1 7 LEU HB2 H 2.496 -3.446 4.139 1.00 . A A . 7 LEU HB2 1 1 25 6994 1 1 7 LEU HB3 H 4.149 -3.186 3.624 1.00 . A A . 7 LEU HB3 1 1 25 6995 1 1 7 LEU HD11 H 2.597 -0.482 5.934 1.00 . A A . 7 LEU HD11 1 1 25 6996 1 1 7 LEU HD12 H 4.079 -1.437 5.950 1.00 . A A . 7 LEU HD12 1 1 25 6997 1 1 7 LEU HD13 H 2.510 -2.243 5.940 1.00 . A A . 7 LEU HD13 1 1 25 6998 1 1 7 LEU HD21 H 4.305 0.360 4.076 1.00 . A A . 7 LEU HD21 1 1 25 6999 1 1 7 LEU HD22 H 4.097 -0.365 2.481 1.00 . A A . 7 LEU HD22 1 1 25 7000 1 1 7 LEU HD23 H 5.164 -1.124 3.664 1.00 . A A . 7 LEU HD23 1 1 25 7001 1 1 7 LEU HG H 2.163 -0.929 3.721 1.00 . A A . 7 LEU HG 1 1 25 7002 1 1 7 LEU N N 1.315 -2.578 1.906 1.00 . A A . 7 LEU N 1 1 25 7003 1 1 7 LEU O O 3.908 -4.802 1.030 1.00 . A A . 7 LEU O 1 1 25 7004 1 1 8 ALA C C 1.655 -6.876 0.008 1.00 . A A . 8 ALA C 1 1 25 7005 1 1 8 ALA CA C 1.904 -6.691 1.510 1.00 . A A . 8 ALA CA 1 1 25 7006 1 1 8 ALA CB C 0.877 -7.476 2.315 1.00 . A A . 8 ALA CB 1 1 25 7007 1 1 8 ALA H H 1.084 -4.931 2.355 1.00 . A A . 8 ALA H 1 1 25 7008 1 1 8 ALA HA H 2.883 -7.078 1.751 1.00 . A A . 8 ALA HA 1 1 25 7009 1 1 8 ALA HB1 H 0.950 -7.201 3.357 1.00 . A A . 8 ALA HB1 1 1 25 7010 1 1 8 ALA HB2 H 1.068 -8.533 2.208 1.00 . A A . 8 ALA HB2 1 1 25 7011 1 1 8 ALA HB3 H -0.115 -7.250 1.952 1.00 . A A . 8 ALA HB3 1 1 25 7012 1 1 8 ALA N N 1.874 -5.279 1.892 1.00 . A A . 8 ALA N 1 1 25 7013 1 1 8 ALA O O 1.983 -7.923 -0.553 1.00 . A A . 8 ALA O 1 1 25 7014 1 1 9 ASP C C 2.003 -5.432 -2.906 1.00 . A A . 9 ASP C 1 1 25 7015 1 1 9 ASP CA C 0.802 -5.909 -2.078 1.00 . A A . 9 ASP CA 1 1 25 7016 1 1 9 ASP CB C -0.431 -5.060 -2.415 1.00 . A A . 9 ASP CB 1 1 25 7017 1 1 9 ASP CG C -1.501 -5.853 -3.140 1.00 . A A . 9 ASP CG 1 1 25 7018 1 1 9 ASP H H 0.849 -5.044 -0.144 1.00 . A A . 9 ASP H 1 1 25 7019 1 1 9 ASP HA H 0.596 -6.938 -2.333 1.00 . A A . 9 ASP HA 1 1 25 7020 1 1 9 ASP HB2 H -0.857 -4.672 -1.502 1.00 . A A . 9 ASP HB2 1 1 25 7021 1 1 9 ASP HB3 H -0.133 -4.234 -3.045 1.00 . A A . 9 ASP HB3 1 1 25 7022 1 1 9 ASP N N 1.083 -5.854 -0.641 1.00 . A A . 9 ASP N 1 1 25 7023 1 1 9 ASP O O 1.866 -5.144 -4.098 1.00 . A A . 9 ASP O 1 1 25 7024 1 1 9 ASP OD1 O -1.416 -5.969 -4.381 1.00 . A A . 9 ASP OD1 1 1 25 7025 1 1 9 ASP OD2 O -2.423 -6.359 -2.466 1.00 . A A . 9 ASP OD2 1 1 25 7026 1 1 10 DAL C C 4.765 -3.470 -2.569 1.00 . A A . 10 DAL C 1 1 25 7027 1 1 10 DAL CA C 4.393 -4.906 -2.949 1.00 . A A . 10 DAL CA 1 1 25 7028 1 1 10 DAL CB C 5.537 -5.846 -2.612 1.00 . A A . 10 DAL CB 1 1 25 7029 1 1 10 DAL H H 3.228 -5.588 -1.325 1.00 . A A . 10 DAL H 1 1 25 7030 1 1 10 DAL HA H 4.221 -4.955 -4.014 1.00 . A A . 10 DAL HA 1 1 25 7031 1 1 10 DAL HB1 H 5.243 -6.862 -2.827 1.00 . A A . 10 DAL HB1 1 1 25 7032 1 1 10 DAL HB2 H 5.776 -5.753 -1.563 1.00 . A A . 10 DAL HB2 1 1 25 7033 1 1 10 DAL HB3 H 6.402 -5.587 -3.204 1.00 . A A . 10 DAL HB3 1 1 25 7034 1 1 10 DAL N N 3.177 -5.348 -2.272 1.00 . A A . 10 DAL N 1 1 25 7035 1 1 10 DAL O O 5.802 -2.961 -3.000 1.00 . A A . 10 DAL O 1 1 25 7036 1 1 11 GLY C C 4.102 -0.473 -2.492 1.00 . A A . 11 GLY C 1 1 25 7037 1 1 11 GLY CA C 4.182 -1.455 -1.344 1.00 . A A . 11 GLY CA 1 1 25 7038 1 1 11 GLY H H 3.110 -3.273 -1.452 1.00 . A A . 11 GLY H 1 1 25 7039 1 1 11 GLY HA2 H 3.458 -1.173 -0.593 1.00 . A A . 11 GLY HA2 1 1 25 7040 1 1 11 GLY HA3 H 5.171 -1.407 -0.911 1.00 . A A . 11 GLY HA3 1 1 25 7041 1 1 11 GLY N N 3.919 -2.821 -1.763 1.00 . A A . 11 GLY N 1 1 25 7042 1 1 11 GLY O O 3.014 -0.032 -2.862 1.00 . A A . 11 GLY O 1 1 25 7043 1 1 12 TRP C C 5.395 0.092 -5.524 1.00 . A A . 12 TRP C 1 1 25 7044 1 1 12 TRP CA C 5.313 0.807 -4.173 1.00 . A A . 12 TRP CA 1 1 25 7045 1 1 12 TRP CB C 6.485 1.770 -3.982 1.00 . A A . 12 TRP CB 1 1 25 7046 1 1 12 TRP CD1 C 6.643 3.141 -1.829 1.00 . A A . 12 TRP CD1 1 1 25 7047 1 1 12 TRP CD2 C 5.129 3.895 -3.298 1.00 . A A . 12 TRP CD2 1 1 25 7048 1 1 12 TRP CE2 C 5.098 4.718 -2.160 1.00 . A A . 12 TRP CE2 1 1 25 7049 1 1 12 TRP CE3 C 4.261 4.179 -4.361 1.00 . A A . 12 TRP CE3 1 1 25 7050 1 1 12 TRP CG C 6.123 2.891 -3.065 1.00 . A A . 12 TRP CG 1 1 25 7051 1 1 12 TRP CH2 C 3.398 6.057 -3.101 1.00 . A A . 12 TRP CH2 1 1 25 7052 1 1 12 TRP CZ2 C 4.235 5.799 -2.049 1.00 . A A . 12 TRP CZ2 1 1 25 7053 1 1 12 TRP CZ3 C 3.407 5.258 -4.252 1.00 . A A . 12 TRP CZ3 1 1 25 7054 1 1 12 TRP H H 6.092 -0.520 -2.719 1.00 . A A . 12 TRP H 1 1 25 7055 1 1 12 TRP HA H 4.396 1.380 -4.152 1.00 . A A . 12 TRP HA 1 1 25 7056 1 1 12 TRP HB2 H 7.320 1.236 -3.551 1.00 . A A . 12 TRP HB2 1 1 25 7057 1 1 12 TRP HB3 H 6.776 2.186 -4.935 1.00 . A A . 12 TRP HB3 1 1 25 7058 1 1 12 TRP HD1 H 7.420 2.553 -1.365 1.00 . A A . 12 TRP HD1 1 1 25 7059 1 1 12 TRP HE1 H 6.232 4.620 -0.396 1.00 . A A . 12 TRP HE1 1 1 25 7060 1 1 12 TRP HE3 H 4.251 3.575 -5.256 1.00 . A A . 12 TRP HE3 1 1 25 7061 1 1 12 TRP HH2 H 2.713 6.890 -3.057 1.00 . A A . 12 TRP HH2 1 1 25 7062 1 1 12 TRP HZ2 H 4.208 6.413 -1.165 1.00 . A A . 12 TRP HZ2 1 1 25 7063 1 1 12 TRP HZ3 H 2.735 5.495 -5.065 1.00 . A A . 12 TRP HZ3 1 1 25 7064 1 1 12 TRP N N 5.258 -0.132 -3.058 1.00 . A A . 12 TRP N 1 1 25 7065 1 1 12 TRP NE1 N 6.031 4.239 -1.277 1.00 . A A . 12 TRP NE1 1 1 25 7066 1 1 12 TRP O O 5.626 0.727 -6.555 1.00 . A A . 12 TRP O 1 1 25 7067 1 1 13 ALA C C 3.805 -1.983 -7.404 1.00 . A A . 13 ALA C 1 1 25 7068 1 1 13 ALA CA C 5.183 -2.010 -6.749 1.00 . A A . 13 ALA CA 1 1 25 7069 1 1 13 ALA CB C 5.621 -3.439 -6.471 1.00 . A A . 13 ALA CB 1 1 25 7070 1 1 13 ALA H H 4.965 -1.675 -4.675 1.00 . A A . 13 ALA H 1 1 25 7071 1 1 13 ALA HA H 5.897 -1.563 -7.422 1.00 . A A . 13 ALA HA 1 1 25 7072 1 1 13 ALA HB1 H 6.653 -3.558 -6.761 1.00 . A A . 13 ALA HB1 1 1 25 7073 1 1 13 ALA HB2 H 5.006 -4.121 -7.040 1.00 . A A . 13 ALA HB2 1 1 25 7074 1 1 13 ALA HB3 H 5.515 -3.651 -5.418 1.00 . A A . 13 ALA HB3 1 1 25 7075 1 1 13 ALA N N 5.170 -1.226 -5.520 1.00 . A A . 13 ALA N 1 1 25 7076 1 1 13 ALA O O 3.688 -2.031 -8.630 1.00 . A A . 13 ALA O 1 1 25 7077 1 1 14 SER C C 1.162 -0.555 -7.886 1.00 . A A . 14 SER C 1 1 25 7078 1 1 14 SER CA C 1.386 -1.820 -7.052 1.00 . A A . 14 SER CA 1 1 25 7079 1 1 14 SER CB C 0.405 -1.860 -5.870 1.00 . A A . 14 SER CB 1 1 25 7080 1 1 14 SER H H 2.929 -1.834 -5.606 1.00 . A A . 14 SER H 1 1 25 7081 1 1 14 SER HA H 1.215 -2.680 -7.679 1.00 . A A . 14 SER HA 1 1 25 7082 1 1 14 SER HB2 H -0.515 -1.371 -6.151 1.00 . A A . 14 SER HB2 1 1 25 7083 1 1 14 SER HB3 H 0.199 -2.889 -5.610 1.00 . A A . 14 SER HB3 1 1 25 7084 1 1 14 SER HG H 1.288 -1.853 -4.113 1.00 . A A . 14 SER HG 1 1 25 7085 1 1 14 SER N N 2.764 -1.883 -6.571 1.00 . A A . 14 SER N 1 1 25 7086 1 1 14 SER O O 0.324 -0.541 -8.789 1.00 . A A . 14 SER O 1 1 25 7087 1 1 14 SER OG O 0.938 -1.201 -4.729 1.00 . A A . 14 SER OG 1 1 25 7088 1 1 15 DAL C C 0.958 2.785 -7.537 1.00 . A A . 15 DAL C 1 1 25 7089 1 1 15 DAL CA C 1.814 1.771 -8.301 1.00 . A A . 15 DAL CA 1 1 25 7090 1 1 15 DAL CB C 3.200 2.336 -8.567 1.00 . A A . 15 DAL CB 1 1 25 7091 1 1 15 DAL H H 2.573 0.427 -6.849 1.00 . A A . 15 DAL H 1 1 25 7092 1 1 15 DAL HA H 1.350 1.572 -9.254 1.00 . A A . 15 DAL HA 1 1 25 7093 1 1 15 DAL HB1 H 3.187 3.406 -8.429 1.00 . A A . 15 DAL HB1 1 1 25 7094 1 1 15 DAL HB2 H 3.489 2.107 -9.582 1.00 . A A . 15 DAL HB2 1 1 25 7095 1 1 15 DAL HB3 H 3.907 1.893 -7.882 1.00 . A A . 15 DAL HB3 1 1 25 7096 1 1 15 DAL N N 1.922 0.503 -7.579 1.00 . A A . 15 DAL N 1 1 25 7097 1 1 15 DAL O O 1.088 3.995 -7.732 1.00 . A A . 15 DAL O 1 1 25 7098 1 1 16 ARG C C -0.097 3.589 -4.589 1.00 . A A . 16 ARG C 1 1 25 7099 1 1 16 ARG CA C -0.798 3.137 -5.872 1.00 . A A . 16 ARG CA 1 1 25 7100 1 1 16 ARG CB C -2.094 2.377 -5.523 1.00 . A A . 16 ARG CB 1 1 25 7101 1 1 16 ARG CD C -2.831 0.173 -4.555 1.00 . A A . 16 ARG CD 1 1 25 7102 1 1 16 ARG CG C -1.932 1.388 -4.374 1.00 . A A . 16 ARG CG 1 1 25 7103 1 1 16 ARG CZ C -3.455 -0.539 -2.266 1.00 . A A . 16 ARG CZ 1 1 25 7104 1 1 16 ARG H H 0.025 1.309 -6.557 1.00 . A A . 16 ARG H 1 1 25 7105 1 1 16 ARG HA H -1.039 4.013 -6.461 1.00 . A A . 16 ARG HA 1 1 25 7106 1 1 16 ARG HB2 H -2.853 3.093 -5.247 1.00 . A A . 16 ARG HB2 1 1 25 7107 1 1 16 ARG HB3 H -2.432 1.823 -6.394 1.00 . A A . 16 ARG HB3 1 1 25 7108 1 1 16 ARG HD2 H -3.847 0.510 -4.692 1.00 . A A . 16 ARG HD2 1 1 25 7109 1 1 16 ARG HD3 H -2.510 -0.364 -5.434 1.00 . A A . 16 ARG HD3 1 1 25 7110 1 1 16 ARG HE H -2.221 -1.532 -3.487 1.00 . A A . 16 ARG HE 1 1 25 7111 1 1 16 ARG HG2 H -0.903 1.058 -4.337 1.00 . A A . 16 ARG HG2 1 1 25 7112 1 1 16 ARG HG3 H -2.188 1.881 -3.448 1.00 . A A . 16 ARG HG3 1 1 25 7113 1 1 16 ARG HH11 H -4.299 1.214 -2.837 1.00 . A A . 16 ARG HH11 1 1 25 7114 1 1 16 ARG HH12 H -4.720 0.672 -1.248 1.00 . A A . 16 ARG HH12 1 1 25 7115 1 1 16 ARG HH21 H -2.786 -2.239 -1.395 1.00 . A A . 16 ARG HH21 1 1 25 7116 1 1 16 ARG HH22 H -3.860 -1.285 -0.428 1.00 . A A . 16 ARG HH22 1 1 25 7117 1 1 16 ARG N N 0.082 2.282 -6.668 1.00 . A A . 16 ARG N 1 1 25 7118 1 1 16 ARG NE N -2.782 -0.732 -3.405 1.00 . A A . 16 ARG NE 1 1 25 7119 1 1 16 ARG NH1 N -4.221 0.538 -2.105 1.00 . A A . 16 ARG NH1 1 1 25 7120 1 1 16 ARG NH2 N -3.359 -1.427 -1.282 1.00 . A A . 16 ARG NH2 1 1 25 7121 1 1 16 ARG O O 0.794 2.900 -4.091 1.00 . A A . 16 ARG O 1 1 25 7122 1 1 17 PRO C C -0.534 4.679 -1.544 1.00 . A A . 17 PRO C 1 1 25 7123 1 1 17 PRO CA C 0.099 5.279 -2.799 1.00 . A A . 17 PRO CA 1 1 25 7124 1 1 17 PRO CB C -0.186 6.786 -2.870 1.00 . A A . 17 PRO CB 1 1 25 7125 1 1 17 PRO CD C -1.524 5.652 -4.538 1.00 . A A . 17 PRO CD 1 1 25 7126 1 1 17 PRO CG C -1.039 7.003 -4.086 1.00 . A A . 17 PRO CG 1 1 25 7127 1 1 17 PRO HA H 1.163 5.114 -2.767 1.00 . A A . 17 PRO HA 1 1 25 7128 1 1 17 PRO HB2 H -0.704 7.093 -1.973 1.00 . A A . 17 PRO HB2 1 1 25 7129 1 1 17 PRO HB3 H 0.751 7.322 -2.945 1.00 . A A . 17 PRO HB3 1 1 25 7130 1 1 17 PRO HD2 H -2.483 5.424 -4.101 1.00 . A A . 17 PRO HD2 1 1 25 7131 1 1 17 PRO HD3 H -1.579 5.615 -5.614 1.00 . A A . 17 PRO HD3 1 1 25 7132 1 1 17 PRO HG2 H -1.880 7.631 -3.832 1.00 . A A . 17 PRO HG2 1 1 25 7133 1 1 17 PRO HG3 H -0.450 7.467 -4.864 1.00 . A A . 17 PRO HG3 1 1 25 7134 1 1 17 PRO N N -0.488 4.752 -4.029 1.00 . A A . 17 PRO N 1 1 25 7135 1 1 17 PRO O O -1.590 4.046 -1.609 1.00 . A A . 17 PRO O 1 1 25 7136 1 1 18 PRO C C -1.718 4.933 1.320 1.00 . A A . 18 PRO C 1 1 25 7137 1 1 18 PRO CA C -0.370 4.345 0.902 1.00 . A A . 18 PRO CA 1 1 25 7138 1 1 18 PRO CB C 0.703 4.769 1.910 1.00 . A A . 18 PRO CB 1 1 25 7139 1 1 18 PRO CD C 1.385 5.602 -0.231 1.00 . A A . 18 PRO CD 1 1 25 7140 1 1 18 PRO CG C 1.474 5.857 1.245 1.00 . A A . 18 PRO CG 1 1 25 7141 1 1 18 PRO HA H -0.440 3.266 0.882 1.00 . A A . 18 PRO HA 1 1 25 7142 1 1 18 PRO HB2 H 0.225 5.126 2.806 1.00 . A A . 18 PRO HB2 1 1 25 7143 1 1 18 PRO HB3 H 1.329 3.928 2.147 1.00 . A A . 18 PRO HB3 1 1 25 7144 1 1 18 PRO HD2 H 1.357 6.536 -0.772 1.00 . A A . 18 PRO HD2 1 1 25 7145 1 1 18 PRO HD3 H 2.218 5.001 -0.560 1.00 . A A . 18 PRO HD3 1 1 25 7146 1 1 18 PRO HG2 H 1.036 6.815 1.485 1.00 . A A . 18 PRO HG2 1 1 25 7147 1 1 18 PRO HG3 H 2.504 5.825 1.569 1.00 . A A . 18 PRO HG3 1 1 25 7148 1 1 18 PRO N N 0.117 4.869 -0.380 1.00 . A A . 18 PRO N 1 1 25 7149 1 1 18 PRO O O -2.002 6.105 1.066 1.00 . A A . 18 PRO O 1 1 25 7150 1 1 19 PRO C C -3.798 5.333 3.762 1.00 . A A . 19 PRO C 1 1 25 7151 1 1 19 PRO CA C -3.872 4.552 2.452 1.00 . A A . 19 PRO CA 1 1 25 7152 1 1 19 PRO CB C -4.633 3.242 2.646 1.00 . A A . 19 PRO CB 1 1 25 7153 1 1 19 PRO CD C -2.290 2.714 2.326 1.00 . A A . 19 PRO CD 1 1 25 7154 1 1 19 PRO CG C -3.609 2.175 2.823 1.00 . A A . 19 PRO CG 1 1 25 7155 1 1 19 PRO HA H -4.375 5.153 1.708 1.00 . A A . 19 PRO HA 1 1 25 7156 1 1 19 PRO HB2 H -5.272 3.318 3.511 1.00 . A A . 19 PRO HB2 1 1 25 7157 1 1 19 PRO HB3 H -5.224 3.055 1.780 1.00 . A A . 19 PRO HB3 1 1 25 7158 1 1 19 PRO HD2 H -1.538 2.650 3.096 1.00 . A A . 19 PRO HD2 1 1 25 7159 1 1 19 PRO HD3 H -1.981 2.166 1.452 1.00 . A A . 19 PRO HD3 1 1 25 7160 1 1 19 PRO HG2 H -3.541 1.908 3.861 1.00 . A A . 19 PRO HG2 1 1 25 7161 1 1 19 PRO HG3 H -3.893 1.310 2.242 1.00 . A A . 19 PRO HG3 1 1 25 7162 1 1 19 PRO N N -2.562 4.119 1.983 1.00 . A A . 19 PRO N 1 1 25 7163 1 1 19 PRO O O -3.322 4.821 4.776 1.00 . A A . 19 PRO O 1 1 25 7164 1 1 20 SER C C -5.470 7.138 5.814 1.00 . A A . 20 SER C 1 1 25 7165 1 1 20 SER CA C -4.268 7.433 4.917 1.00 . A A . 20 SER CA 1 1 25 7166 1 1 20 SER CB C -4.264 8.912 4.511 1.00 . A A . 20 SER CB 1 1 25 7167 1 1 20 SER H H -4.644 6.925 2.893 1.00 . A A . 20 SER H 1 1 25 7168 1 1 20 SER HA H -3.365 7.221 5.469 1.00 . A A . 20 SER HA 1 1 25 7169 1 1 20 SER HB2 H -4.443 9.522 5.384 1.00 . A A . 20 SER HB2 1 1 25 7170 1 1 20 SER HB3 H -3.302 9.163 4.088 1.00 . A A . 20 SER HB3 1 1 25 7171 1 1 20 SER HG H -6.070 9.473 3.997 1.00 . A A . 20 SER HG 1 1 25 7172 1 1 20 SER N N -4.276 6.576 3.732 1.00 . A A . 20 SER N 1 1 25 7173 1 1 20 SER O O -6.613 7.168 5.307 1.00 . A A . 20 SER O 1 1 25 7174 1 1 20 SER OXT O -5.258 6.876 7.016 1.00 . A A . 20 SER OXT 1 1 25 7175 1 1 20 SER OG O -5.270 9.186 3.550 1.00 . A A . 20 SER OG 1 1 26 7176 1 1 1 ASP C C -6.374 -3.014 5.637 1.00 . A A . 1 ASP C 1 1 26 7177 1 1 1 ASP CA C -6.833 -3.177 7.087 1.00 . A A . 1 ASP CA 1 1 26 7178 1 1 1 ASP CB C -6.759 -4.649 7.512 1.00 . A A . 1 ASP CB 1 1 26 7179 1 1 1 ASP CG C -5.330 -5.129 7.697 1.00 . A A . 1 ASP CG 1 1 26 7180 1 1 1 ASP H1 H -8.845 -3.272 6.649 1.00 . A A . 1 ASP H1 1 1 26 7181 1 1 1 ASP H2 H -8.261 -1.696 6.997 1.00 . A A . 1 ASP H2 1 1 26 7182 1 1 1 ASP H3 H -8.486 -2.828 8.266 1.00 . A A . 1 ASP H3 1 1 26 7183 1 1 1 ASP HA H -6.190 -2.591 7.726 1.00 . A A . 1 ASP HA 1 1 26 7184 1 1 1 ASP HB2 H -7.285 -4.774 8.447 1.00 . A A . 1 ASP HB2 1 1 26 7185 1 1 1 ASP HB3 H -7.230 -5.260 6.755 1.00 . A A . 1 ASP HB3 1 1 26 7186 1 1 1 ASP N N -8.232 -2.701 7.266 1.00 . A A . 1 ASP N 1 1 26 7187 1 1 1 ASP O O -6.422 -3.960 4.847 1.00 . A A . 1 ASP O 1 1 26 7188 1 1 1 ASP OD1 O -4.799 -4.993 8.820 1.00 . A A . 1 ASP OD1 1 1 26 7189 1 1 1 ASP OD2 O -4.743 -5.640 6.720 1.00 . A A . 1 ASP OD2 1 1 26 7190 1 1 2 ALA C C -3.977 -1.173 3.913 1.00 . A A . 2 ALA C 1 1 26 7191 1 1 2 ALA CA C -5.469 -1.508 3.941 1.00 . A A . 2 ALA CA 1 1 26 7192 1 1 2 ALA CB C -6.275 -0.367 3.345 1.00 . A A . 2 ALA CB 1 1 26 7193 1 1 2 ALA H H -5.926 -1.092 5.967 1.00 . A A . 2 ALA H 1 1 26 7194 1 1 2 ALA HA H -5.638 -2.386 3.334 1.00 . A A . 2 ALA HA 1 1 26 7195 1 1 2 ALA HB1 H -7.296 -0.426 3.694 1.00 . A A . 2 ALA HB1 1 1 26 7196 1 1 2 ALA HB2 H -6.258 -0.440 2.268 1.00 . A A . 2 ALA HB2 1 1 26 7197 1 1 2 ALA HB3 H -5.844 0.574 3.649 1.00 . A A . 2 ALA HB3 1 1 26 7198 1 1 2 ALA N N -5.934 -1.804 5.294 1.00 . A A . 2 ALA N 1 1 26 7199 1 1 2 ALA O O -3.289 -1.476 2.938 1.00 . A A . 2 ALA O 1 1 26 7200 1 1 3 TYR C C -1.176 -1.411 5.030 1.00 . A A . 3 TYR C 1 1 26 7201 1 1 3 TYR CA C -2.066 -0.172 5.074 1.00 . A A . 3 TYR CA 1 1 26 7202 1 1 3 TYR CB C -1.798 0.634 6.351 1.00 . A A . 3 TYR CB 1 1 26 7203 1 1 3 TYR CD1 C -0.864 2.927 5.814 1.00 . A A . 3 TYR CD1 1 1 26 7204 1 1 3 TYR CD2 C 0.646 1.235 6.562 1.00 . A A . 3 TYR CD2 1 1 26 7205 1 1 3 TYR CE1 C 0.184 3.824 5.725 1.00 . A A . 3 TYR CE1 1 1 26 7206 1 1 3 TYR CE2 C 1.697 2.128 6.471 1.00 . A A . 3 TYR CE2 1 1 26 7207 1 1 3 TYR CG C -0.651 1.615 6.234 1.00 . A A . 3 TYR CG 1 1 26 7208 1 1 3 TYR CZ C 1.460 3.420 6.053 1.00 . A A . 3 TYR CZ 1 1 26 7209 1 1 3 TYR H H -4.080 -0.328 5.728 1.00 . A A . 3 TYR H 1 1 26 7210 1 1 3 TYR HA H -1.834 0.441 4.220 1.00 . A A . 3 TYR HA 1 1 26 7211 1 1 3 TYR HB2 H -2.683 1.197 6.607 1.00 . A A . 3 TYR HB2 1 1 26 7212 1 1 3 TYR HB3 H -1.570 -0.049 7.156 1.00 . A A . 3 TYR HB3 1 1 26 7213 1 1 3 TYR HD1 H -1.865 3.243 5.547 1.00 . A A . 3 TYR HD1 1 1 26 7214 1 1 3 TYR HD2 H 0.829 0.221 6.888 1.00 . A A . 3 TYR HD2 1 1 26 7215 1 1 3 TYR HE1 H -0.002 4.837 5.406 1.00 . A A . 3 TYR HE1 1 1 26 7216 1 1 3 TYR HE2 H 2.697 1.812 6.727 1.00 . A A . 3 TYR HE2 1 1 26 7217 1 1 3 TYR HH H 2.818 4.352 5.057 1.00 . A A . 3 TYR HH 1 1 26 7218 1 1 3 TYR N N -3.481 -0.544 4.984 1.00 . A A . 3 TYR N 1 1 26 7219 1 1 3 TYR O O -0.198 -1.453 4.281 1.00 . A A . 3 TYR O 1 1 26 7220 1 1 3 TYR OH O 2.505 4.313 5.964 1.00 . A A . 3 TYR OH 1 1 26 7221 1 1 4 ALA C C -0.907 -4.413 4.520 1.00 . A A . 4 ALA C 1 1 26 7222 1 1 4 ALA CA C -0.775 -3.673 5.851 1.00 . A A . 4 ALA CA 1 1 26 7223 1 1 4 ALA CB C -1.247 -4.551 7.001 1.00 . A A . 4 ALA CB 1 1 26 7224 1 1 4 ALA H H -2.329 -2.337 6.384 1.00 . A A . 4 ALA H 1 1 26 7225 1 1 4 ALA HA H 0.267 -3.430 6.014 1.00 . A A . 4 ALA HA 1 1 26 7226 1 1 4 ALA HB1 H -2.237 -4.925 6.785 1.00 . A A . 4 ALA HB1 1 1 26 7227 1 1 4 ALA HB2 H -1.273 -3.969 7.910 1.00 . A A . 4 ALA HB2 1 1 26 7228 1 1 4 ALA HB3 H -0.567 -5.381 7.123 1.00 . A A . 4 ALA HB3 1 1 26 7229 1 1 4 ALA N N -1.531 -2.425 5.820 1.00 . A A . 4 ALA N 1 1 26 7230 1 1 4 ALA O O 0.037 -5.067 4.071 1.00 . A A . 4 ALA O 1 1 26 7231 1 1 5 GLN C C -1.516 -4.235 1.498 1.00 . A A . 5 GLN C 1 1 26 7232 1 1 5 GLN CA C -2.326 -4.926 2.595 1.00 . A A . 5 GLN CA 1 1 26 7233 1 1 5 GLN CB C -3.820 -4.880 2.260 1.00 . A A . 5 GLN CB 1 1 26 7234 1 1 5 GLN CD C -4.024 -7.067 1.007 1.00 . A A . 5 GLN CD 1 1 26 7235 1 1 5 GLN CG C -4.170 -5.557 0.946 1.00 . A A . 5 GLN CG 1 1 26 7236 1 1 5 GLN H H -2.787 -3.741 4.282 1.00 . A A . 5 GLN H 1 1 26 7237 1 1 5 GLN HA H -2.011 -5.956 2.667 1.00 . A A . 5 GLN HA 1 1 26 7238 1 1 5 GLN HB2 H -4.371 -5.367 3.051 1.00 . A A . 5 GLN HB2 1 1 26 7239 1 1 5 GLN HB3 H -4.130 -3.848 2.200 1.00 . A A . 5 GLN HB3 1 1 26 7240 1 1 5 GLN HE21 H -5.943 -7.265 1.500 1.00 . A A . 5 GLN HE21 1 1 26 7241 1 1 5 GLN HE22 H -5.046 -8.735 1.369 1.00 . A A . 5 GLN HE22 1 1 26 7242 1 1 5 GLN HG2 H -5.193 -5.319 0.693 1.00 . A A . 5 GLN HG2 1 1 26 7243 1 1 5 GLN HG3 H -3.513 -5.177 0.181 1.00 . A A . 5 GLN HG3 1 1 26 7244 1 1 5 GLN N N -2.078 -4.289 3.883 1.00 . A A . 5 GLN N 1 1 26 7245 1 1 5 GLN NE2 N -5.115 -7.759 1.324 1.00 . A A . 5 GLN NE2 1 1 26 7246 1 1 5 GLN O O -1.008 -4.889 0.587 1.00 . A A . 5 GLN O 1 1 26 7247 1 1 5 GLN OE1 O -2.943 -7.607 0.773 1.00 . A A . 5 GLN OE1 1 1 26 7248 1 1 6 TRP C C 0.834 -2.554 0.641 1.00 . A A . 6 TRP C 1 1 26 7249 1 1 6 TRP CA C -0.628 -2.121 0.641 1.00 . A A . 6 TRP CA 1 1 26 7250 1 1 6 TRP CB C -0.728 -0.630 0.978 1.00 . A A . 6 TRP CB 1 1 26 7251 1 1 6 TRP CD1 C -0.298 0.553 -1.243 1.00 . A A . 6 TRP CD1 1 1 26 7252 1 1 6 TRP CD2 C 1.274 0.920 0.305 1.00 . A A . 6 TRP CD2 1 1 26 7253 1 1 6 TRP CE2 C 1.622 1.618 -0.864 1.00 . A A . 6 TRP CE2 1 1 26 7254 1 1 6 TRP CE3 C 2.118 1.006 1.416 1.00 . A A . 6 TRP CE3 1 1 26 7255 1 1 6 TRP CG C 0.039 0.243 0.039 1.00 . A A . 6 TRP CG 1 1 26 7256 1 1 6 TRP CH2 C 3.582 2.461 0.141 1.00 . A A . 6 TRP CH2 1 1 26 7257 1 1 6 TRP CZ2 C 2.775 2.390 -0.959 1.00 . A A . 6 TRP CZ2 1 1 26 7258 1 1 6 TRP CZ3 C 3.263 1.777 1.323 1.00 . A A . 6 TRP CZ3 1 1 26 7259 1 1 6 TRP H H -1.811 -2.451 2.364 1.00 . A A . 6 TRP H 1 1 26 7260 1 1 6 TRP HA H -1.047 -2.293 -0.339 1.00 . A A . 6 TRP HA 1 1 26 7261 1 1 6 TRP HB2 H -1.762 -0.330 0.945 1.00 . A A . 6 TRP HB2 1 1 26 7262 1 1 6 TRP HB3 H -0.345 -0.466 1.972 1.00 . A A . 6 TRP HB3 1 1 26 7263 1 1 6 TRP HD1 H -1.184 0.193 -1.742 1.00 . A A . 6 TRP HD1 1 1 26 7264 1 1 6 TRP HE1 H 0.631 1.729 -2.702 1.00 . A A . 6 TRP HE1 1 1 26 7265 1 1 6 TRP HE3 H 1.889 0.482 2.334 1.00 . A A . 6 TRP HE3 1 1 26 7266 1 1 6 TRP HH2 H 4.481 3.059 0.113 1.00 . A A . 6 TRP HH2 1 1 26 7267 1 1 6 TRP HZ2 H 3.037 2.918 -1.865 1.00 . A A . 6 TRP HZ2 1 1 26 7268 1 1 6 TRP HZ3 H 3.929 1.856 2.171 1.00 . A A . 6 TRP HZ3 1 1 26 7269 1 1 6 TRP N N -1.389 -2.909 1.606 1.00 . A A . 6 TRP N 1 1 26 7270 1 1 6 TRP NE1 N 0.650 1.373 -1.793 1.00 . A A . 6 TRP NE1 1 1 26 7271 1 1 6 TRP O O 1.419 -2.801 -0.414 1.00 . A A . 6 TRP O 1 1 26 7272 1 1 7 LEU C C 2.991 -4.510 1.542 1.00 . A A . 7 LEU C 1 1 26 7273 1 1 7 LEU CA C 2.797 -3.064 2.003 1.00 . A A . 7 LEU CA 1 1 26 7274 1 1 7 LEU CB C 3.218 -2.908 3.466 1.00 . A A . 7 LEU CB 1 1 26 7275 1 1 7 LEU CD1 C 3.214 -1.444 5.502 1.00 . A A . 7 LEU CD1 1 1 26 7276 1 1 7 LEU CD2 C 4.429 -0.706 3.439 1.00 . A A . 7 LEU CD2 1 1 26 7277 1 1 7 LEU CG C 3.224 -1.466 3.982 1.00 . A A . 7 LEU CG 1 1 26 7278 1 1 7 LEU H H 0.875 -2.445 2.637 1.00 . A A . 7 LEU H 1 1 26 7279 1 1 7 LEU HA H 3.409 -2.419 1.390 1.00 . A A . 7 LEU HA 1 1 26 7280 1 1 7 LEU HB2 H 2.537 -3.484 4.077 1.00 . A A . 7 LEU HB2 1 1 26 7281 1 1 7 LEU HB3 H 4.209 -3.314 3.584 1.00 . A A . 7 LEU HB3 1 1 26 7282 1 1 7 LEU HD11 H 3.214 -0.421 5.847 1.00 . A A . 7 LEU HD11 1 1 26 7283 1 1 7 LEU HD12 H 4.093 -1.950 5.875 1.00 . A A . 7 LEU HD12 1 1 26 7284 1 1 7 LEU HD13 H 2.329 -1.947 5.863 1.00 . A A . 7 LEU HD13 1 1 26 7285 1 1 7 LEU HD21 H 4.645 0.134 4.083 1.00 . A A . 7 LEU HD21 1 1 26 7286 1 1 7 LEU HD22 H 4.210 -0.348 2.443 1.00 . A A . 7 LEU HD22 1 1 26 7287 1 1 7 LEU HD23 H 5.285 -1.363 3.405 1.00 . A A . 7 LEU HD23 1 1 26 7288 1 1 7 LEU HG H 2.330 -0.965 3.638 1.00 . A A . 7 LEU HG 1 1 26 7289 1 1 7 LEU N N 1.407 -2.651 1.839 1.00 . A A . 7 LEU N 1 1 26 7290 1 1 7 LEU O O 4.018 -4.848 0.950 1.00 . A A . 7 LEU O 1 1 26 7291 1 1 8 ALA C C 1.795 -6.937 -0.092 1.00 . A A . 8 ALA C 1 1 26 7292 1 1 8 ALA CA C 2.038 -6.761 1.413 1.00 . A A . 8 ALA CA 1 1 26 7293 1 1 8 ALA CB C 1.020 -7.567 2.208 1.00 . A A . 8 ALA CB 1 1 26 7294 1 1 8 ALA H H 1.196 -5.018 2.276 1.00 . A A . 8 ALA H 1 1 26 7295 1 1 8 ALA HA H 3.022 -7.139 1.652 1.00 . A A . 8 ALA HA 1 1 26 7296 1 1 8 ALA HB1 H 0.925 -8.553 1.777 1.00 . A A . 8 ALA HB1 1 1 26 7297 1 1 8 ALA HB2 H 0.062 -7.068 2.178 1.00 . A A . 8 ALA HB2 1 1 26 7298 1 1 8 ALA HB3 H 1.349 -7.652 3.233 1.00 . A A . 8 ALA HB3 1 1 26 7299 1 1 8 ALA N N 1.991 -5.354 1.808 1.00 . A A . 8 ALA N 1 1 26 7300 1 1 8 ALA O O 2.114 -7.986 -0.655 1.00 . A A . 8 ALA O 1 1 26 7301 1 1 9 ASP C C 2.148 -5.444 -3.003 1.00 . A A . 9 ASP C 1 1 26 7302 1 1 9 ASP CA C 0.959 -5.957 -2.178 1.00 . A A . 9 ASP CA 1 1 26 7303 1 1 9 ASP CB C -0.297 -5.136 -2.510 1.00 . A A . 9 ASP CB 1 1 26 7304 1 1 9 ASP CG C -1.508 -6.011 -2.769 1.00 . A A . 9 ASP CG 1 1 26 7305 1 1 9 ASP H H 1.007 -5.096 -0.240 1.00 . A A . 9 ASP H 1 1 26 7306 1 1 9 ASP HA H 0.780 -6.990 -2.440 1.00 . A A . 9 ASP HA 1 1 26 7307 1 1 9 ASP HB2 H -0.523 -4.479 -1.684 1.00 . A A . 9 ASP HB2 1 1 26 7308 1 1 9 ASP HB3 H -0.111 -4.540 -3.394 1.00 . A A . 9 ASP HB3 1 1 26 7309 1 1 9 ASP N N 1.236 -5.907 -0.739 1.00 . A A . 9 ASP N 1 1 26 7310 1 1 9 ASP O O 2.002 -5.144 -4.191 1.00 . A A . 9 ASP O 1 1 26 7311 1 1 9 ASP OD1 O -1.703 -6.426 -3.930 1.00 . A A . 9 ASP OD1 1 1 26 7312 1 1 9 ASP OD2 O -2.262 -6.280 -1.810 1.00 . A A . 9 ASP OD2 1 1 26 7313 1 1 10 DAL C C 4.871 -3.430 -2.658 1.00 . A A . 10 DAL C 1 1 26 7314 1 1 10 DAL CA C 4.526 -4.869 -3.052 1.00 . A A . 10 DAL CA 1 1 26 7315 1 1 10 DAL CB C 5.691 -5.789 -2.734 1.00 . A A . 10 DAL CB 1 1 26 7316 1 1 10 DAL H H 3.384 -5.596 -1.429 1.00 . A A . 10 DAL H 1 1 26 7317 1 1 10 DAL HA H 4.349 -4.909 -4.117 1.00 . A A . 10 DAL HA 1 1 26 7318 1 1 10 DAL HB1 H 5.963 -5.671 -1.696 1.00 . A A . 10 DAL HB1 1 1 26 7319 1 1 10 DAL HB2 H 6.533 -5.534 -3.360 1.00 . A A . 10 DAL HB2 1 1 26 7320 1 1 10 DAL HB3 H 5.402 -6.813 -2.916 1.00 . A A . 10 DAL HB3 1 1 26 7321 1 1 10 DAL N N 3.323 -5.345 -2.373 1.00 . A A . 10 DAL N 1 1 26 7322 1 1 10 DAL O O 5.900 -2.898 -3.081 1.00 . A A . 10 DAL O 1 1 26 7323 1 1 11 GLY C C 4.160 -0.445 -2.551 1.00 . A A . 11 GLY C 1 1 26 7324 1 1 11 GLY CA C 4.249 -1.439 -1.413 1.00 . A A . 11 GLY CA 1 1 26 7325 1 1 11 GLY H H 3.211 -3.276 -1.542 1.00 . A A . 11 GLY H 1 1 26 7326 1 1 11 GLY HA2 H 3.514 -1.177 -0.665 1.00 . A A . 11 GLY HA2 1 1 26 7327 1 1 11 GLY HA3 H 5.233 -1.379 -0.972 1.00 . A A . 11 GLY HA3 1 1 26 7328 1 1 11 GLY N N 4.011 -2.805 -1.847 1.00 . A A . 11 GLY N 1 1 26 7329 1 1 11 GLY O O 3.067 -0.014 -2.920 1.00 . A A . 11 GLY O 1 1 26 7330 1 1 12 TRP C C 5.454 0.176 -5.573 1.00 . A A . 12 TRP C 1 1 26 7331 1 1 12 TRP CA C 5.360 0.872 -4.212 1.00 . A A . 12 TRP CA 1 1 26 7332 1 1 12 TRP CB C 6.520 1.847 -4.007 1.00 . A A . 12 TRP CB 1 1 26 7333 1 1 12 TRP CD1 C 6.659 3.208 -1.844 1.00 . A A . 12 TRP CD1 1 1 26 7334 1 1 12 TRP CD2 C 5.125 3.940 -3.303 1.00 . A A . 12 TRP CD2 1 1 26 7335 1 1 12 TRP CE2 C 5.082 4.755 -2.159 1.00 . A A . 12 TRP CE2 1 1 26 7336 1 1 12 TRP CE3 C 4.248 4.214 -4.362 1.00 . A A . 12 TRP CE3 1 1 26 7337 1 1 12 TRP CG C 6.139 2.955 -3.080 1.00 . A A . 12 TRP CG 1 1 26 7338 1 1 12 TRP CH2 C 3.352 6.066 -3.087 1.00 . A A . 12 TRP CH2 1 1 26 7339 1 1 12 TRP CZ2 C 4.198 5.818 -2.039 1.00 . A A . 12 TRP CZ2 1 1 26 7340 1 1 12 TRP CZ3 C 3.374 5.274 -4.243 1.00 . A A . 12 TRP CZ3 1 1 26 7341 1 1 12 TRP H H 6.151 -0.462 -2.770 1.00 . A A . 12 TRP H 1 1 26 7342 1 1 12 TRP HA H 4.435 1.434 -4.185 1.00 . A A . 12 TRP HA 1 1 26 7343 1 1 12 TRP HB2 H 7.360 1.320 -3.578 1.00 . A A . 12 TRP HB2 1 1 26 7344 1 1 12 TRP HB3 H 6.808 2.277 -4.954 1.00 . A A . 12 TRP HB3 1 1 26 7345 1 1 12 TRP HD1 H 7.450 2.633 -1.386 1.00 . A A . 12 TRP HD1 1 1 26 7346 1 1 12 TRP HE1 H 6.225 4.670 -0.400 1.00 . A A . 12 TRP HE1 1 1 26 7347 1 1 12 TRP HE3 H 4.248 3.615 -5.261 1.00 . A A . 12 TRP HE3 1 1 26 7348 1 1 12 TRP HH2 H 2.651 6.886 -3.035 1.00 . A A . 12 TRP HH2 1 1 26 7349 1 1 12 TRP HZ2 H 4.162 6.426 -1.151 1.00 . A A . 12 TRP HZ2 1 1 26 7350 1 1 12 TRP HZ3 H 2.694 5.503 -5.053 1.00 . A A . 12 TRP HZ3 1 1 26 7351 1 1 12 TRP N N 5.313 -0.081 -3.109 1.00 . A A . 12 TRP N 1 1 26 7352 1 1 12 TRP NE1 N 6.028 4.290 -1.283 1.00 . A A . 12 TRP NE1 1 1 26 7353 1 1 12 TRP O O 5.683 0.828 -6.594 1.00 . A A . 12 TRP O 1 1 26 7354 1 1 13 ALA C C 3.892 -1.897 -7.488 1.00 . A A . 13 ALA C 1 1 26 7355 1 1 13 ALA CA C 5.269 -1.910 -6.830 1.00 . A A . 13 ALA CA 1 1 26 7356 1 1 13 ALA CB C 5.729 -3.335 -6.571 1.00 . A A . 13 ALA CB 1 1 26 7357 1 1 13 ALA H H 5.038 -1.607 -4.752 1.00 . A A . 13 ALA H 1 1 26 7358 1 1 13 ALA HA H 5.976 -1.441 -7.495 1.00 . A A . 13 ALA HA 1 1 26 7359 1 1 13 ALA HB1 H 4.908 -4.017 -6.739 1.00 . A A . 13 ALA HB1 1 1 26 7360 1 1 13 ALA HB2 H 6.069 -3.425 -5.550 1.00 . A A . 13 ALA HB2 1 1 26 7361 1 1 13 ALA HB3 H 6.539 -3.575 -7.243 1.00 . A A . 13 ALA HB3 1 1 26 7362 1 1 13 ALA N N 5.241 -1.143 -5.589 1.00 . A A . 13 ALA N 1 1 26 7363 1 1 13 ALA O O 3.779 -1.927 -8.715 1.00 . A A . 13 ALA O 1 1 26 7364 1 1 14 SER C C 1.220 -0.511 -7.951 1.00 . A A . 14 SER C 1 1 26 7365 1 1 14 SER CA C 1.469 -1.786 -7.140 1.00 . A A . 14 SER CA 1 1 26 7366 1 1 14 SER CB C 0.488 -1.866 -5.960 1.00 . A A . 14 SER CB 1 1 26 7367 1 1 14 SER H H 3.009 -1.795 -5.691 1.00 . A A . 14 SER H 1 1 26 7368 1 1 14 SER HA H 1.316 -2.638 -7.782 1.00 . A A . 14 SER HA 1 1 26 7369 1 1 14 SER HB2 H -0.440 -1.388 -6.232 1.00 . A A . 14 SER HB2 1 1 26 7370 1 1 14 SER HB3 H 0.300 -2.903 -5.722 1.00 . A A . 14 SER HB3 1 1 26 7371 1 1 14 SER HG H 1.361 -1.881 -4.198 1.00 . A A . 14 SER HG 1 1 26 7372 1 1 14 SER N N 2.847 -1.830 -6.657 1.00 . A A . 14 SER N 1 1 26 7373 1 1 14 SER O O 0.382 -0.499 -8.856 1.00 . A A . 14 SER O 1 1 26 7374 1 1 14 SER OG O 1.010 -1.222 -4.806 1.00 . A A . 14 SER OG 1 1 26 7375 1 1 15 DAL C C 0.951 2.819 -7.541 1.00 . A A . 15 DAL C 1 1 26 7376 1 1 15 DAL CA C 1.823 1.835 -8.323 1.00 . A A . 15 DAL CA 1 1 26 7377 1 1 15 DAL CB C 3.196 2.434 -8.580 1.00 . A A . 15 DAL CB 1 1 26 7378 1 1 15 DAL H H 2.608 0.481 -6.895 1.00 . A A . 15 DAL H 1 1 26 7379 1 1 15 DAL HA H 1.362 1.645 -9.279 1.00 . A A . 15 DAL HA 1 1 26 7380 1 1 15 DAL HB1 H 3.935 1.647 -8.589 1.00 . A A . 15 DAL HB1 1 1 26 7381 1 1 15 DAL HB2 H 3.431 3.142 -7.800 1.00 . A A . 15 DAL HB2 1 1 26 7382 1 1 15 DAL HB3 H 3.192 2.936 -9.535 1.00 . A A . 15 DAL HB3 1 1 26 7383 1 1 15 DAL N N 1.957 0.556 -7.624 1.00 . A A . 15 DAL N 1 1 26 7384 1 1 15 DAL O O 1.069 4.035 -7.706 1.00 . A A . 15 DAL O 1 1 26 7385 1 1 16 ARG C C -0.115 3.562 -4.596 1.00 . A A . 16 ARG C 1 1 26 7386 1 1 16 ARG CA C -0.816 3.110 -5.880 1.00 . A A . 16 ARG CA 1 1 26 7387 1 1 16 ARG CB C -2.093 2.319 -5.533 1.00 . A A . 16 ARG CB 1 1 26 7388 1 1 16 ARG CD C -2.836 0.135 -4.532 1.00 . A A . 16 ARG CD 1 1 26 7389 1 1 16 ARG CG C -1.909 1.332 -4.387 1.00 . A A . 16 ARG CG 1 1 26 7390 1 1 16 ARG CZ C -3.392 -0.582 -2.228 1.00 . A A . 16 ARG CZ 1 1 26 7391 1 1 16 ARG H H 0.032 1.309 -6.602 1.00 . A A . 16 ARG H 1 1 26 7392 1 1 16 ARG HA H -1.079 3.988 -6.457 1.00 . A A . 16 ARG HA 1 1 26 7393 1 1 16 ARG HB2 H -2.870 3.016 -5.256 1.00 . A A . 16 ARG HB2 1 1 26 7394 1 1 16 ARG HB3 H -2.416 1.758 -6.404 1.00 . A A . 16 ARG HB3 1 1 26 7395 1 1 16 ARG HD2 H -3.851 0.491 -4.625 1.00 . A A . 16 ARG HD2 1 1 26 7396 1 1 16 ARG HD3 H -2.563 -0.405 -5.425 1.00 . A A . 16 ARG HD3 1 1 26 7397 1 1 16 ARG HE H -2.207 -1.581 -3.493 1.00 . A A . 16 ARG HE 1 1 26 7398 1 1 16 ARG HG2 H -0.885 0.984 -4.385 1.00 . A A . 16 ARG HG2 1 1 26 7399 1 1 16 ARG HG3 H -2.122 1.833 -3.454 1.00 . A A . 16 ARG HG3 1 1 26 7400 1 1 16 ARG HH11 H -4.222 1.190 -2.760 1.00 . A A . 16 ARG HH11 1 1 26 7401 1 1 16 ARG HH12 H -4.606 0.641 -1.163 1.00 . A A . 16 ARG HH12 1 1 26 7402 1 1 16 ARG HH21 H -2.723 -2.299 -1.392 1.00 . A A . 16 ARG HH21 1 1 26 7403 1 1 16 ARG HH22 H -3.754 -1.338 -0.385 1.00 . A A . 16 ARG HH22 1 1 26 7404 1 1 16 ARG N N 0.077 2.285 -6.690 1.00 . A A . 16 ARG N 1 1 26 7405 1 1 16 ARG NE N -2.756 -0.775 -3.388 1.00 . A A . 16 ARG NE 1 1 26 7406 1 1 16 ARG NH1 N -4.134 0.506 -2.035 1.00 . A A . 16 ARG NH1 1 1 26 7407 1 1 16 ARG NH2 N -3.281 -1.480 -1.255 1.00 . A A . 16 ARG NH2 1 1 26 7408 1 1 16 ARG O O 0.792 2.886 -4.112 1.00 . A A . 16 ARG O 1 1 26 7409 1 1 17 PRO C C -0.557 4.622 -1.536 1.00 . A A . 17 PRO C 1 1 26 7410 1 1 17 PRO CA C 0.063 5.237 -2.792 1.00 . A A . 17 PRO CA 1 1 26 7411 1 1 17 PRO CB C -0.239 6.741 -2.854 1.00 . A A . 17 PRO CB 1 1 26 7412 1 1 17 PRO CD C -1.579 5.597 -4.514 1.00 . A A . 17 PRO CD 1 1 26 7413 1 1 17 PRO CG C -1.109 6.954 -4.059 1.00 . A A . 17 PRO CG 1 1 26 7414 1 1 17 PRO HA H 1.128 5.083 -2.766 1.00 . A A . 17 PRO HA 1 1 26 7415 1 1 17 PRO HB2 H -0.748 7.040 -1.950 1.00 . A A . 17 PRO HB2 1 1 26 7416 1 1 17 PRO HB3 H 0.692 7.286 -2.940 1.00 . A A . 17 PRO HB3 1 1 26 7417 1 1 17 PRO HD2 H -2.529 5.352 -4.068 1.00 . A A . 17 PRO HD2 1 1 26 7418 1 1 17 PRO HD3 H -1.645 5.566 -5.589 1.00 . A A . 17 PRO HD3 1 1 26 7419 1 1 17 PRO HG2 H -1.956 7.567 -3.791 1.00 . A A . 17 PRO HG2 1 1 26 7420 1 1 17 PRO HG3 H -0.536 7.431 -4.841 1.00 . A A . 17 PRO HG3 1 1 26 7421 1 1 17 PRO N N -0.524 4.712 -4.022 1.00 . A A . 17 PRO N 1 1 26 7422 1 1 17 PRO O O -1.606 3.977 -1.599 1.00 . A A . 17 PRO O 1 1 26 7423 1 1 18 PRO C C -1.727 4.842 1.337 1.00 . A A . 18 PRO C 1 1 26 7424 1 1 18 PRO CA C -0.373 4.277 0.907 1.00 . A A . 18 PRO CA 1 1 26 7425 1 1 18 PRO CB C 0.700 4.708 1.909 1.00 . A A . 18 PRO CB 1 1 26 7426 1 1 18 PRO CD C 1.360 5.561 -0.232 1.00 . A A . 18 PRO CD 1 1 26 7427 1 1 18 PRO CG C 1.462 5.804 1.245 1.00 . A A . 18 PRO CG 1 1 26 7428 1 1 18 PRO HA H -0.428 3.197 0.880 1.00 . A A . 18 PRO HA 1 1 26 7429 1 1 18 PRO HB2 H 0.223 5.061 2.808 1.00 . A A . 18 PRO HB2 1 1 26 7430 1 1 18 PRO HB3 H 1.334 3.872 2.144 1.00 . A A . 18 PRO HB3 1 1 26 7431 1 1 18 PRO HD2 H 1.314 6.500 -0.765 1.00 . A A . 18 PRO HD2 1 1 26 7432 1 1 18 PRO HD3 H 2.196 4.972 -0.576 1.00 . A A . 18 PRO HD3 1 1 26 7433 1 1 18 PRO HG2 H 1.025 6.758 1.496 1.00 . A A . 18 PRO HG2 1 1 26 7434 1 1 18 PRO HG3 H 2.495 5.772 1.557 1.00 . A A . 18 PRO HG3 1 1 26 7435 1 1 18 PRO N N 0.099 4.814 -0.376 1.00 . A A . 18 PRO N 1 1 26 7436 1 1 18 PRO O O -2.037 6.006 1.076 1.00 . A A . 18 PRO O 1 1 26 7437 1 1 19 PRO C C -3.783 5.222 3.802 1.00 . A A . 19 PRO C 1 1 26 7438 1 1 19 PRO CA C -3.860 4.427 2.500 1.00 . A A . 19 PRO CA 1 1 26 7439 1 1 19 PRO CB C -4.590 3.105 2.719 1.00 . A A . 19 PRO CB 1 1 26 7440 1 1 19 PRO CD C -2.243 2.619 2.369 1.00 . A A . 19 PRO CD 1 1 26 7441 1 1 19 PRO CG C -3.544 2.058 2.885 1.00 . A A . 19 PRO CG 1 1 26 7442 1 1 19 PRO HA H -4.386 5.010 1.757 1.00 . A A . 19 PRO HA 1 1 26 7443 1 1 19 PRO HB2 H -5.213 3.177 3.598 1.00 . A A . 19 PRO HB2 1 1 26 7444 1 1 19 PRO HB3 H -5.196 2.898 1.867 1.00 . A A . 19 PRO HB3 1 1 26 7445 1 1 19 PRO HD2 H -1.482 2.577 3.131 1.00 . A A . 19 PRO HD2 1 1 26 7446 1 1 19 PRO HD3 H -1.933 2.070 1.495 1.00 . A A . 19 PRO HD3 1 1 26 7447 1 1 19 PRO HG2 H -3.458 1.795 3.923 1.00 . A A . 19 PRO HG2 1 1 26 7448 1 1 19 PRO HG3 H -3.820 1.185 2.311 1.00 . A A . 19 PRO HG3 1 1 26 7449 1 1 19 PRO N N -2.547 4.016 2.018 1.00 . A A . 19 PRO N 1 1 26 7450 1 1 19 PRO O O -3.096 4.824 4.744 1.00 . A A . 19 PRO O 1 1 26 7451 1 1 20 SER C C -5.790 6.984 5.845 1.00 . A A . 20 SER C 1 1 26 7452 1 1 20 SER CA C -4.514 7.202 5.033 1.00 . A A . 20 SER CA 1 1 26 7453 1 1 20 SER CB C -4.391 8.676 4.633 1.00 . A A . 20 SER CB 1 1 26 7454 1 1 20 SER H H -5.024 6.609 3.063 1.00 . A A . 20 SER H 1 1 26 7455 1 1 20 SER HA H -3.665 6.934 5.644 1.00 . A A . 20 SER HA 1 1 26 7456 1 1 20 SER HB2 H -4.553 9.296 5.502 1.00 . A A . 20 SER HB2 1 1 26 7457 1 1 20 SER HB3 H -3.400 8.858 4.241 1.00 . A A . 20 SER HB3 1 1 26 7458 1 1 20 SER HG H -4.896 9.399 2.883 1.00 . A A . 20 SER HG 1 1 26 7459 1 1 20 SER N N -4.496 6.347 3.847 1.00 . A A . 20 SER N 1 1 26 7460 1 1 20 SER O O -6.891 7.051 5.255 1.00 . A A . 20 SER O 1 1 26 7461 1 1 20 SER OXT O -5.678 6.747 7.066 1.00 . A A . 20 SER OXT 1 1 26 7462 1 1 20 SER OG O -5.345 9.022 3.643 1.00 . A A . 20 SER OG 1 1 27 7463 1 1 1 ASP C C -5.823 -3.300 5.434 1.00 . A A . 1 ASP C 1 1 27 7464 1 1 1 ASP CA C -6.304 -3.746 6.815 1.00 . A A . 1 ASP CA 1 1 27 7465 1 1 1 ASP CB C -7.816 -3.528 6.952 1.00 . A A . 1 ASP CB 1 1 27 7466 1 1 1 ASP CG C -8.616 -4.350 5.958 1.00 . A A . 1 ASP CG 1 1 27 7467 1 1 1 ASP H1 H -4.588 -3.092 7.749 1.00 . A A . 1 ASP H1 1 1 27 7468 1 1 1 ASP H2 H -5.901 -3.410 8.807 1.00 . A A . 1 ASP H2 1 1 27 7469 1 1 1 ASP H3 H -5.905 -1.998 7.832 1.00 . A A . 1 ASP H3 1 1 27 7470 1 1 1 ASP HA H -6.086 -4.797 6.938 1.00 . A A . 1 ASP HA 1 1 27 7471 1 1 1 ASP HB2 H -8.124 -3.806 7.949 1.00 . A A . 1 ASP HB2 1 1 27 7472 1 1 1 ASP HB3 H -8.038 -2.483 6.790 1.00 . A A . 1 ASP HB3 1 1 27 7473 1 1 1 ASP N N -5.613 -2.994 7.898 1.00 . A A . 1 ASP N 1 1 27 7474 1 1 1 ASP O O -5.260 -4.095 4.682 1.00 . A A . 1 ASP O 1 1 27 7475 1 1 1 ASP OD1 O -8.907 -5.526 6.259 1.00 . A A . 1 ASP OD1 1 1 27 7476 1 1 1 ASP OD2 O -8.950 -3.816 4.879 1.00 . A A . 1 ASP OD2 1 1 27 7477 1 1 2 ALA C C -4.143 -1.147 3.812 1.00 . A A . 2 ALA C 1 1 27 7478 1 1 2 ALA CA C -5.634 -1.471 3.822 1.00 . A A . 2 ALA CA 1 1 27 7479 1 1 2 ALA CB C -6.443 -0.228 3.496 1.00 . A A . 2 ALA CB 1 1 27 7480 1 1 2 ALA H H -6.498 -1.440 5.756 1.00 . A A . 2 ALA H 1 1 27 7481 1 1 2 ALA HA H -5.835 -2.212 3.062 1.00 . A A . 2 ALA HA 1 1 27 7482 1 1 2 ALA HB1 H -5.961 0.314 2.696 1.00 . A A . 2 ALA HB1 1 1 27 7483 1 1 2 ALA HB2 H -6.505 0.401 4.371 1.00 . A A . 2 ALA HB2 1 1 27 7484 1 1 2 ALA HB3 H -7.437 -0.516 3.188 1.00 . A A . 2 ALA HB3 1 1 27 7485 1 1 2 ALA N N -6.046 -2.024 5.111 1.00 . A A . 2 ALA N 1 1 27 7486 1 1 2 ALA O O -3.440 -1.465 2.853 1.00 . A A . 2 ALA O 1 1 27 7487 1 1 3 TYR C C -1.373 -1.396 4.980 1.00 . A A . 3 TYR C 1 1 27 7488 1 1 3 TYR CA C -2.254 -0.149 5.007 1.00 . A A . 3 TYR CA 1 1 27 7489 1 1 3 TYR CB C -2.014 0.649 6.293 1.00 . A A . 3 TYR CB 1 1 27 7490 1 1 3 TYR CD1 C 0.436 1.173 6.597 1.00 . A A . 3 TYR CD1 1 1 27 7491 1 1 3 TYR CD2 C -0.992 2.913 5.799 1.00 . A A . 3 TYR CD2 1 1 27 7492 1 1 3 TYR CE1 C 1.515 2.033 6.549 1.00 . A A . 3 TYR CE1 1 1 27 7493 1 1 3 TYR CE2 C 0.084 3.777 5.754 1.00 . A A . 3 TYR CE2 1 1 27 7494 1 1 3 TYR CG C -0.834 1.594 6.221 1.00 . A A . 3 TYR CG 1 1 27 7495 1 1 3 TYR CZ C 1.335 3.333 6.128 1.00 . A A . 3 TYR CZ 1 1 27 7496 1 1 3 TYR H H -4.283 -0.292 5.618 1.00 . A A . 3 TYR H 1 1 27 7497 1 1 3 TYR HA H -1.999 0.464 4.160 1.00 . A A . 3 TYR HA 1 1 27 7498 1 1 3 TYR HB2 H -2.891 1.238 6.513 1.00 . A A . 3 TYR HB2 1 1 27 7499 1 1 3 TYR HB3 H -1.838 -0.040 7.106 1.00 . A A . 3 TYR HB3 1 1 27 7500 1 1 3 TYR HD1 H 0.575 0.154 6.925 1.00 . A A . 3 TYR HD1 1 1 27 7501 1 1 3 TYR HD2 H -1.972 3.260 5.495 1.00 . A A . 3 TYR HD2 1 1 27 7502 1 1 3 TYR HE1 H 2.495 1.686 6.842 1.00 . A A . 3 TYR HE1 1 1 27 7503 1 1 3 TYR HE2 H -0.058 4.796 5.431 1.00 . A A . 3 TYR HE2 1 1 27 7504 1 1 3 TYR HH H 2.507 4.628 6.934 1.00 . A A . 3 TYR HH 1 1 27 7505 1 1 3 TYR N N -3.668 -0.514 4.887 1.00 . A A . 3 TYR N 1 1 27 7506 1 1 3 TYR O O -0.382 -1.446 4.250 1.00 . A A . 3 TYR O 1 1 27 7507 1 1 3 TYR OH O 2.408 4.193 6.083 1.00 . A A . 3 TYR OH 1 1 27 7508 1 1 4 ALA C C -1.119 -4.395 4.468 1.00 . A A . 4 ALA C 1 1 27 7509 1 1 4 ALA CA C -1.014 -3.664 5.805 1.00 . A A . 4 ALA CA 1 1 27 7510 1 1 4 ALA CB C -1.526 -4.545 6.937 1.00 . A A . 4 ALA CB 1 1 27 7511 1 1 4 ALA H H -2.565 -2.311 6.306 1.00 . A A . 4 ALA H 1 1 27 7512 1 1 4 ALA HA H 0.027 -3.433 5.997 1.00 . A A . 4 ALA HA 1 1 27 7513 1 1 4 ALA HB1 H -1.651 -3.948 7.828 1.00 . A A . 4 ALA HB1 1 1 27 7514 1 1 4 ALA HB2 H -0.815 -5.334 7.129 1.00 . A A . 4 ALA HB2 1 1 27 7515 1 1 4 ALA HB3 H -2.475 -4.976 6.656 1.00 . A A . 4 ALA HB3 1 1 27 7516 1 1 4 ALA N N -1.756 -2.407 5.761 1.00 . A A . 4 ALA N 1 1 27 7517 1 1 4 ALA O O -0.171 -5.057 4.041 1.00 . A A . 4 ALA O 1 1 27 7518 1 1 5 GLN C C -1.637 -4.198 1.433 1.00 . A A . 5 GLN C 1 1 27 7519 1 1 5 GLN CA C -2.486 -4.885 2.502 1.00 . A A . 5 GLN CA 1 1 27 7520 1 1 5 GLN CB C -3.969 -4.830 2.120 1.00 . A A . 5 GLN CB 1 1 27 7521 1 1 5 GLN CD C -4.028 -6.918 0.695 1.00 . A A . 5 GLN CD 1 1 27 7522 1 1 5 GLN CG C -4.271 -5.420 0.753 1.00 . A A . 5 GLN CG 1 1 27 7523 1 1 5 GLN H H -2.986 -3.702 4.181 1.00 . A A . 5 GLN H 1 1 27 7524 1 1 5 GLN HA H -2.180 -5.918 2.580 1.00 . A A . 5 GLN HA 1 1 27 7525 1 1 5 GLN HB2 H -4.538 -5.376 2.857 1.00 . A A . 5 GLN HB2 1 1 27 7526 1 1 5 GLN HB3 H -4.290 -3.799 2.121 1.00 . A A . 5 GLN HB3 1 1 27 7527 1 1 5 GLN HE21 H -5.907 -7.275 1.252 1.00 . A A . 5 GLN HE21 1 1 27 7528 1 1 5 GLN HE22 H -4.926 -8.671 0.977 1.00 . A A . 5 GLN HE22 1 1 27 7529 1 1 5 GLN HG2 H -5.306 -5.229 0.512 1.00 . A A . 5 GLN HG2 1 1 27 7530 1 1 5 GLN HG3 H -3.637 -4.939 0.024 1.00 . A A . 5 GLN HG3 1 1 27 7531 1 1 5 GLN N N -2.271 -4.255 3.799 1.00 . A A . 5 GLN N 1 1 27 7532 1 1 5 GLN NE2 N -5.058 -7.700 1.006 1.00 . A A . 5 GLN NE2 1 1 27 7533 1 1 5 GLN O O -1.102 -4.856 0.541 1.00 . A A . 5 GLN O 1 1 27 7534 1 1 5 GLN OE1 O -2.928 -7.368 0.377 1.00 . A A . 5 GLN OE1 1 1 27 7535 1 1 6 TRP C C 0.745 -2.544 0.641 1.00 . A A . 6 TRP C 1 1 27 7536 1 1 6 TRP CA C -0.710 -2.090 0.602 1.00 . A A . 6 TRP CA 1 1 27 7537 1 1 6 TRP CB C -0.799 -0.599 0.940 1.00 . A A . 6 TRP CB 1 1 27 7538 1 1 6 TRP CD1 C -0.302 0.593 -1.263 1.00 . A A . 6 TRP CD1 1 1 27 7539 1 1 6 TRP CD2 C 1.248 0.914 0.316 1.00 . A A . 6 TRP CD2 1 1 27 7540 1 1 6 TRP CE2 C 1.633 1.614 -0.840 1.00 . A A . 6 TRP CE2 1 1 27 7541 1 1 6 TRP CE3 C 2.074 0.972 1.444 1.00 . A A . 6 TRP CE3 1 1 27 7542 1 1 6 TRP CG C 0.004 0.266 0.022 1.00 . A A . 6 TRP CG 1 1 27 7543 1 1 6 TRP CH2 C 3.592 2.406 0.208 1.00 . A A . 6 TRP CH2 1 1 27 7544 1 1 6 TRP CZ2 C 2.804 2.362 -0.907 1.00 . A A . 6 TRP CZ2 1 1 27 7545 1 1 6 TRP CZ3 C 3.237 1.720 1.378 1.00 . A A . 6 TRP CZ3 1 1 27 7546 1 1 6 TRP H H -1.952 -2.410 2.285 1.00 . A A . 6 TRP H 1 1 27 7547 1 1 6 TRP HA H -1.103 -2.254 -0.389 1.00 . A A . 6 TRP HA 1 1 27 7548 1 1 6 TRP HB2 H -1.828 -0.285 0.880 1.00 . A A . 6 TRP HB2 1 1 27 7549 1 1 6 TRP HB3 H -0.440 -0.441 1.944 1.00 . A A . 6 TRP HB3 1 1 27 7550 1 1 6 TRP HD1 H -1.185 0.256 -1.782 1.00 . A A . 6 TRP HD1 1 1 27 7551 1 1 6 TRP HE1 H 0.676 1.762 -2.695 1.00 . A A . 6 TRP HE1 1 1 27 7552 1 1 6 TRP HE3 H 1.816 0.446 2.353 1.00 . A A . 6 TRP HE3 1 1 27 7553 1 1 6 TRP HH2 H 4.505 2.985 0.201 1.00 . A A . 6 TRP HH2 1 1 27 7554 1 1 6 TRP HZ2 H 3.093 2.892 -1.803 1.00 . A A . 6 TRP HZ2 1 1 27 7555 1 1 6 TRP HZ3 H 3.889 1.776 2.238 1.00 . A A . 6 TRP HZ3 1 1 27 7556 1 1 6 TRP N N -1.508 -2.872 1.543 1.00 . A A . 6 TRP N 1 1 27 7557 1 1 6 TRP NE1 N 0.672 1.398 -1.788 1.00 . A A . 6 TRP NE1 1 1 27 7558 1 1 6 TRP O O 1.353 -2.805 -0.398 1.00 . A A . 6 TRP O 1 1 27 7559 1 1 7 LEU C C 2.843 -4.531 1.595 1.00 . A A . 7 LEU C 1 1 27 7560 1 1 7 LEU CA C 2.663 -3.082 2.054 1.00 . A A . 7 LEU CA 1 1 27 7561 1 1 7 LEU CB C 3.045 -2.937 3.529 1.00 . A A . 7 LEU CB 1 1 27 7562 1 1 7 LEU CD1 C 2.996 -1.490 5.578 1.00 . A A . 7 LEU CD1 1 1 27 7563 1 1 7 LEU CD2 C 4.244 -0.727 3.545 1.00 . A A . 7 LEU CD2 1 1 27 7564 1 1 7 LEU CG C 3.034 -1.499 4.058 1.00 . A A . 7 LEU CG 1 1 27 7565 1 1 7 LEU H H 0.736 -2.431 2.638 1.00 . A A . 7 LEU H 1 1 27 7566 1 1 7 LEU HA H 3.302 -2.447 1.460 1.00 . A A . 7 LEU HA 1 1 27 7567 1 1 7 LEU HB2 H 2.351 -3.520 4.117 1.00 . A A . 7 LEU HB2 1 1 27 7568 1 1 7 LEU HB3 H 4.034 -3.341 3.669 1.00 . A A . 7 LEU HB3 1 1 27 7569 1 1 7 LEU HD11 H 3.945 -1.830 5.965 1.00 . A A . 7 LEU HD11 1 1 27 7570 1 1 7 LEU HD12 H 2.211 -2.147 5.922 1.00 . A A . 7 LEU HD12 1 1 27 7571 1 1 7 LEU HD13 H 2.804 -0.486 5.927 1.00 . A A . 7 LEU HD13 1 1 27 7572 1 1 7 LEU HD21 H 4.080 -0.441 2.516 1.00 . A A . 7 LEU HD21 1 1 27 7573 1 1 7 LEU HD22 H 5.124 -1.350 3.609 1.00 . A A . 7 LEU HD22 1 1 27 7574 1 1 7 LEU HD23 H 4.386 0.160 4.145 1.00 . A A . 7 LEU HD23 1 1 27 7575 1 1 7 LEU HG H 2.144 -1.001 3.702 1.00 . A A . 7 LEU HG 1 1 27 7576 1 1 7 LEU N N 1.285 -2.646 1.854 1.00 . A A . 7 LEU N 1 1 27 7577 1 1 7 LEU O O 3.883 -4.889 1.040 1.00 . A A . 7 LEU O 1 1 27 7578 1 1 8 ALA C C 1.620 -6.923 -0.090 1.00 . A A . 8 ALA C 1 1 27 7579 1 1 8 ALA CA C 1.841 -6.760 1.419 1.00 . A A . 8 ALA CA 1 1 27 7580 1 1 8 ALA CB C 0.795 -7.549 2.195 1.00 . A A . 8 ALA CB 1 1 27 7581 1 1 8 ALA H H 1.009 -5.002 2.257 1.00 . A A . 8 ALA H 1 1 27 7582 1 1 8 ALA HA H 2.814 -7.156 1.672 1.00 . A A . 8 ALA HA 1 1 27 7583 1 1 8 ALA HB1 H 0.638 -8.505 1.718 1.00 . A A . 8 ALA HB1 1 1 27 7584 1 1 8 ALA HB2 H -0.134 -6.998 2.211 1.00 . A A . 8 ALA HB2 1 1 27 7585 1 1 8 ALA HB3 H 1.139 -7.704 3.207 1.00 . A A . 8 ALA HB3 1 1 27 7586 1 1 8 ALA N N 1.813 -5.353 1.819 1.00 . A A . 8 ALA N 1 1 27 7587 1 1 8 ALA O O 1.927 -7.974 -0.655 1.00 . A A . 8 ALA O 1 1 27 7588 1 1 9 ASP C C 2.067 -5.430 -2.978 1.00 . A A . 9 ASP C 1 1 27 7589 1 1 9 ASP CA C 0.843 -5.905 -2.183 1.00 . A A . 9 ASP CA 1 1 27 7590 1 1 9 ASP CB C -0.370 -5.031 -2.532 1.00 . A A . 9 ASP CB 1 1 27 7591 1 1 9 ASP CG C -1.530 -5.840 -3.075 1.00 . A A . 9 ASP CG 1 1 27 7592 1 1 9 ASP H H 0.877 -5.064 -0.238 1.00 . A A . 9 ASP H 1 1 27 7593 1 1 9 ASP HA H 0.628 -6.926 -2.460 1.00 . A A . 9 ASP HA 1 1 27 7594 1 1 9 ASP HB2 H -0.703 -4.512 -1.647 1.00 . A A . 9 ASP HB2 1 1 27 7595 1 1 9 ASP HB3 H -0.081 -4.305 -3.279 1.00 . A A . 9 ASP HB3 1 1 27 7596 1 1 9 ASP N N 1.095 -5.876 -0.740 1.00 . A A . 9 ASP N 1 1 27 7597 1 1 9 ASP O O 1.960 -5.127 -4.169 1.00 . A A . 9 ASP O 1 1 27 7598 1 1 9 ASP OD1 O -1.526 -6.146 -4.287 1.00 . A A . 9 ASP OD1 1 1 27 7599 1 1 9 ASP OD2 O -2.444 -6.168 -2.290 1.00 . A A . 9 ASP OD2 1 1 27 7600 1 1 10 DAL C C 4.821 -3.486 -2.559 1.00 . A A . 10 DAL C 1 1 27 7601 1 1 10 DAL CA C 4.459 -4.920 -2.959 1.00 . A A . 10 DAL CA 1 1 27 7602 1 1 10 DAL CB C 5.593 -5.863 -2.601 1.00 . A A . 10 DAL CB 1 1 27 7603 1 1 10 DAL H H 3.252 -5.610 -1.370 1.00 . A A . 10 DAL H 1 1 27 7604 1 1 10 DAL HA H 4.313 -4.960 -4.028 1.00 . A A . 10 DAL HA 1 1 27 7605 1 1 10 DAL HB1 H 6.468 -5.610 -3.178 1.00 . A A . 10 DAL HB1 1 1 27 7606 1 1 10 DAL HB2 H 5.298 -6.879 -2.818 1.00 . A A . 10 DAL HB2 1 1 27 7607 1 1 10 DAL HB3 H 5.815 -5.769 -1.548 1.00 . A A . 10 DAL HB3 1 1 27 7608 1 1 10 DAL N N 3.225 -5.362 -2.316 1.00 . A A . 10 DAL N 1 1 27 7609 1 1 10 DAL O O 5.868 -2.973 -2.959 1.00 . A A . 10 DAL O 1 1 27 7610 1 1 11 GLY C C 4.144 -0.491 -2.472 1.00 . A A . 11 GLY C 1 1 27 7611 1 1 11 GLY CA C 4.204 -1.483 -1.331 1.00 . A A . 11 GLY CA 1 1 27 7612 1 1 11 GLY H H 3.139 -3.301 -1.481 1.00 . A A . 11 GLY H 1 1 27 7613 1 1 11 GLY HA2 H 3.462 -1.210 -0.594 1.00 . A A . 11 GLY HA2 1 1 27 7614 1 1 11 GLY HA3 H 5.183 -1.436 -0.876 1.00 . A A . 11 GLY HA3 1 1 27 7615 1 1 11 GLY N N 3.954 -2.845 -1.768 1.00 . A A . 11 GLY N 1 1 27 7616 1 1 11 GLY O O 3.063 -0.036 -2.848 1.00 . A A . 11 GLY O 1 1 27 7617 1 1 12 TRP C C 5.468 0.087 -5.488 1.00 . A A . 12 TRP C 1 1 27 7618 1 1 12 TRP CA C 5.382 0.791 -4.131 1.00 . A A . 12 TRP CA 1 1 27 7619 1 1 12 TRP CB C 6.563 1.739 -3.922 1.00 . A A . 12 TRP CB 1 1 27 7620 1 1 12 TRP CD1 C 6.719 3.076 -1.747 1.00 . A A . 12 TRP CD1 1 1 27 7621 1 1 12 TRP CD2 C 5.227 3.871 -3.216 1.00 . A A . 12 TRP CD2 1 1 27 7622 1 1 12 TRP CE2 C 5.198 4.677 -2.065 1.00 . A A . 12 TRP CE2 1 1 27 7623 1 1 12 TRP CE3 C 4.372 4.184 -4.282 1.00 . A A . 12 TRP CE3 1 1 27 7624 1 1 12 TRP CG C 6.207 2.851 -2.991 1.00 . A A . 12 TRP CG 1 1 27 7625 1 1 12 TRP CH2 C 3.523 6.052 -2.999 1.00 . A A . 12 TRP CH2 1 1 27 7626 1 1 12 TRP CZ2 C 4.347 5.767 -1.944 1.00 . A A . 12 TRP CZ2 1 1 27 7627 1 1 12 TRP CZ3 C 3.532 5.271 -4.162 1.00 . A A . 12 TRP CZ3 1 1 27 7628 1 1 12 TRP H H 6.135 -0.556 -2.681 1.00 . A A . 12 TRP H 1 1 27 7629 1 1 12 TRP HA H 4.471 1.374 -4.112 1.00 . A A . 12 TRP HA 1 1 27 7630 1 1 12 TRP HB2 H 7.390 1.191 -3.495 1.00 . A A . 12 TRP HB2 1 1 27 7631 1 1 12 TRP HB3 H 6.862 2.166 -4.867 1.00 . A A . 12 TRP HB3 1 1 27 7632 1 1 12 TRP HD1 H 7.485 2.470 -1.285 1.00 . A A . 12 TRP HD1 1 1 27 7633 1 1 12 TRP HE1 H 6.315 4.536 -0.293 1.00 . A A . 12 TRP HE1 1 1 27 7634 1 1 12 TRP HE3 H 4.362 3.594 -5.187 1.00 . A A . 12 TRP HE3 1 1 27 7635 1 1 12 TRP HH2 H 2.848 6.894 -2.948 1.00 . A A . 12 TRP HH2 1 1 27 7636 1 1 12 TRP HZ2 H 4.321 6.368 -1.051 1.00 . A A . 12 TRP HZ2 1 1 27 7637 1 1 12 TRP HZ3 H 2.870 5.530 -4.977 1.00 . A A . 12 TRP HZ3 1 1 27 7638 1 1 12 TRP N N 5.308 -0.156 -3.025 1.00 . A A . 12 TRP N 1 1 27 7639 1 1 12 TRP NE1 N 6.117 4.172 -1.182 1.00 . A A . 12 TRP NE1 1 1 27 7640 1 1 12 TRP O O 5.733 0.726 -6.508 1.00 . A A . 12 TRP O 1 1 27 7641 1 1 13 ALA C C 3.854 -1.936 -7.407 1.00 . A A . 13 ALA C 1 1 27 7642 1 1 13 ALA CA C 5.222 -1.996 -6.737 1.00 . A A . 13 ALA CA 1 1 27 7643 1 1 13 ALA CB C 5.629 -3.436 -6.470 1.00 . A A . 13 ALA CB 1 1 27 7644 1 1 13 ALA H H 4.977 -1.676 -4.664 1.00 . A A . 13 ALA H 1 1 27 7645 1 1 13 ALA HA H 5.952 -1.554 -7.397 1.00 . A A . 13 ALA HA 1 1 27 7646 1 1 13 ALA HB1 H 5.907 -3.547 -5.433 1.00 . A A . 13 ALA HB1 1 1 27 7647 1 1 13 ALA HB2 H 6.470 -3.690 -7.097 1.00 . A A . 13 ALA HB2 1 1 27 7648 1 1 13 ALA HB3 H 4.802 -4.092 -6.695 1.00 . A A . 13 ALA HB3 1 1 27 7649 1 1 13 ALA N N 5.208 -1.224 -5.500 1.00 . A A . 13 ALA N 1 1 27 7650 1 1 13 ALA O O 3.754 -1.940 -8.635 1.00 . A A . 13 ALA O 1 1 27 7651 1 1 14 SER C C 1.252 -0.490 -7.915 1.00 . A A . 14 SER C 1 1 27 7652 1 1 14 SER CA C 1.434 -1.762 -7.084 1.00 . A A . 14 SER CA 1 1 27 7653 1 1 14 SER CB C 0.435 -1.787 -5.917 1.00 . A A . 14 SER CB 1 1 27 7654 1 1 14 SER H H 2.956 -1.839 -5.617 1.00 . A A . 14 SER H 1 1 27 7655 1 1 14 SER HA H 1.255 -2.615 -7.719 1.00 . A A . 14 SER HA 1 1 27 7656 1 1 14 SER HB2 H -0.445 -1.224 -6.186 1.00 . A A . 14 SER HB2 1 1 27 7657 1 1 14 SER HB3 H 0.154 -2.810 -5.709 1.00 . A A . 14 SER HB3 1 1 27 7658 1 1 14 SER HG H 1.299 -1.922 -4.155 1.00 . A A . 14 SER HG 1 1 27 7659 1 1 14 SER N N 2.804 -1.855 -6.585 1.00 . A A . 14 SER N 1 1 27 7660 1 1 14 SER O O 0.455 -0.463 -8.855 1.00 . A A . 14 SER O 1 1 27 7661 1 1 14 SER OG O 0.994 -1.220 -4.739 1.00 . A A . 14 SER OG 1 1 27 7662 1 1 15 DAL C C 1.096 2.863 -7.519 1.00 . A A . 15 DAL C 1 1 27 7663 1 1 15 DAL CA C 1.937 1.835 -8.278 1.00 . A A . 15 DAL CA 1 1 27 7664 1 1 15 DAL CB C 3.339 2.369 -8.520 1.00 . A A . 15 DAL CB 1 1 27 7665 1 1 15 DAL H H 2.621 0.472 -6.807 1.00 . A A . 15 DAL H 1 1 27 7666 1 1 15 DAL HA H 1.482 1.655 -9.239 1.00 . A A . 15 DAL HA 1 1 27 7667 1 1 15 DAL HB1 H 3.411 2.737 -9.531 1.00 . A A . 15 DAL HB1 1 1 27 7668 1 1 15 DAL HB2 H 4.057 1.575 -8.374 1.00 . A A . 15 DAL HB2 1 1 27 7669 1 1 15 DAL HB3 H 3.544 3.172 -7.828 1.00 . A A . 15 DAL HB3 1 1 27 7670 1 1 15 DAL N N 2.003 0.560 -7.564 1.00 . A A . 15 DAL N 1 1 27 7671 1 1 15 DAL O O 1.278 4.071 -7.684 1.00 . A A . 15 DAL O 1 1 27 7672 1 1 16 ARG C C -0.013 3.650 -4.591 1.00 . A A . 16 ARG C 1 1 27 7673 1 1 16 ARG CA C -0.693 3.248 -5.901 1.00 . A A . 16 ARG CA 1 1 27 7674 1 1 16 ARG CB C -2.031 2.539 -5.609 1.00 . A A . 16 ARG CB 1 1 27 7675 1 1 16 ARG CD C -3.170 0.629 -4.429 1.00 . A A . 16 ARG CD 1 1 27 7676 1 1 16 ARG CG C -1.969 1.567 -4.436 1.00 . A A . 16 ARG CG 1 1 27 7677 1 1 16 ARG CZ C -2.813 -1.319 -2.940 1.00 . A A . 16 ARG CZ 1 1 27 7678 1 1 16 ARG H H 0.081 1.402 -6.600 1.00 . A A . 16 ARG H 1 1 27 7679 1 1 16 ARG HA H -0.879 4.144 -6.480 1.00 . A A . 16 ARG HA 1 1 27 7680 1 1 16 ARG HB2 H -2.778 3.286 -5.388 1.00 . A A . 16 ARG HB2 1 1 27 7681 1 1 16 ARG HB3 H -2.341 1.980 -6.488 1.00 . A A . 16 ARG HB3 1 1 27 7682 1 1 16 ARG HD2 H -4.065 1.212 -4.590 1.00 . A A . 16 ARG HD2 1 1 27 7683 1 1 16 ARG HD3 H -3.059 -0.084 -5.233 1.00 . A A . 16 ARG HD3 1 1 27 7684 1 1 16 ARG HE H -3.785 0.355 -2.439 1.00 . A A . 16 ARG HE 1 1 27 7685 1 1 16 ARG HG2 H -1.064 0.980 -4.513 1.00 . A A . 16 ARG HG2 1 1 27 7686 1 1 16 ARG HG3 H -1.958 2.131 -3.515 1.00 . A A . 16 ARG HG3 1 1 27 7687 1 1 16 ARG HH11 H -1.994 -1.539 -4.781 1.00 . A A . 16 ARG HH11 1 1 27 7688 1 1 16 ARG HH12 H -1.780 -2.881 -3.711 1.00 . A A . 16 ARG HH12 1 1 27 7689 1 1 16 ARG HH21 H -3.497 -1.418 -1.038 1.00 . A A . 16 ARG HH21 1 1 27 7690 1 1 16 ARG HH22 H -2.634 -2.815 -1.590 1.00 . A A . 16 ARG HH22 1 1 27 7691 1 1 16 ARG N N 0.176 2.375 -6.688 1.00 . A A . 16 ARG N 1 1 27 7692 1 1 16 ARG NE N -3.301 -0.094 -3.163 1.00 . A A . 16 ARG NE 1 1 27 7693 1 1 16 ARG NH1 N -2.140 -1.965 -3.890 1.00 . A A . 16 ARG NH1 1 1 27 7694 1 1 16 ARG NH2 N -2.996 -1.898 -1.759 1.00 . A A . 16 ARG NH2 1 1 27 7695 1 1 16 ARG O O 0.850 2.928 -4.091 1.00 . A A . 16 ARG O 1 1 27 7696 1 1 17 PRO C C -0.475 4.684 -1.528 1.00 . A A . 17 PRO C 1 1 27 7697 1 1 17 PRO CA C 0.188 5.298 -2.761 1.00 . A A . 17 PRO CA 1 1 27 7698 1 1 17 PRO CB C -0.066 6.813 -2.803 1.00 . A A . 17 PRO CB 1 1 27 7699 1 1 17 PRO CD C -1.385 5.748 -4.530 1.00 . A A . 17 PRO CD 1 1 27 7700 1 1 17 PRO CG C -0.876 7.077 -4.039 1.00 . A A . 17 PRO CG 1 1 27 7701 1 1 17 PRO HA H 1.248 5.112 -2.716 1.00 . A A . 17 PRO HA 1 1 27 7702 1 1 17 PRO HB2 H -0.605 7.109 -1.915 1.00 . A A . 17 PRO HB2 1 1 27 7703 1 1 17 PRO HB3 H 0.883 7.331 -2.837 1.00 . A A . 17 PRO HB3 1 1 27 7704 1 1 17 PRO HD2 H -2.361 5.537 -4.122 1.00 . A A . 17 PRO HD2 1 1 27 7705 1 1 17 PRO HD3 H -1.413 5.734 -5.608 1.00 . A A . 17 PRO HD3 1 1 27 7706 1 1 17 PRO HG2 H -1.706 7.724 -3.798 1.00 . A A . 17 PRO HG2 1 1 27 7707 1 1 17 PRO HG3 H -0.252 7.537 -4.790 1.00 . A A . 17 PRO HG3 1 1 27 7708 1 1 17 PRO N N -0.386 4.811 -4.015 1.00 . A A . 17 PRO N 1 1 27 7709 1 1 17 PRO O O -1.542 4.073 -1.620 1.00 . A A . 17 PRO O 1 1 27 7710 1 1 18 PRO C C -1.690 4.897 1.327 1.00 . A A . 18 PRO C 1 1 27 7711 1 1 18 PRO CA C -0.345 4.300 0.916 1.00 . A A . 18 PRO CA 1 1 27 7712 1 1 18 PRO CB C 0.719 4.699 1.944 1.00 . A A . 18 PRO CB 1 1 27 7713 1 1 18 PRO CD C 1.445 5.546 -0.176 1.00 . A A . 18 PRO CD 1 1 27 7714 1 1 18 PRO CG C 1.513 5.785 1.303 1.00 . A A . 18 PRO CG 1 1 27 7715 1 1 18 PRO HA H -0.426 3.223 0.879 1.00 . A A . 18 PRO HA 1 1 27 7716 1 1 18 PRO HB2 H 0.233 5.052 2.837 1.00 . A A . 18 PRO HB2 1 1 27 7717 1 1 18 PRO HB3 H 1.332 3.847 2.180 1.00 . A A . 18 PRO HB3 1 1 27 7718 1 1 18 PRO HD2 H 1.443 6.485 -0.709 1.00 . A A . 18 PRO HD2 1 1 27 7719 1 1 18 PRO HD3 H 2.271 4.931 -0.498 1.00 . A A . 18 PRO HD3 1 1 27 7720 1 1 18 PRO HG2 H 1.083 6.745 1.546 1.00 . A A . 18 PRO HG2 1 1 27 7721 1 1 18 PRO HG3 H 2.538 5.737 1.642 1.00 . A A . 18 PRO HG3 1 1 27 7722 1 1 18 PRO N N 0.165 4.839 -0.352 1.00 . A A . 18 PRO N 1 1 27 7723 1 1 18 PRO O O -1.960 6.074 1.081 1.00 . A A . 18 PRO O 1 1 27 7724 1 1 19 PRO C C -3.783 5.295 3.760 1.00 . A A . 19 PRO C 1 1 27 7725 1 1 19 PRO CA C -3.858 4.530 2.439 1.00 . A A . 19 PRO CA 1 1 27 7726 1 1 19 PRO CB C -4.635 3.227 2.611 1.00 . A A . 19 PRO CB 1 1 27 7727 1 1 19 PRO CD C -2.296 2.674 2.312 1.00 . A A . 19 PRO CD 1 1 27 7728 1 1 19 PRO CG C -3.626 2.147 2.793 1.00 . A A . 19 PRO CG 1 1 27 7729 1 1 19 PRO HA H -4.346 5.146 1.698 1.00 . A A . 19 PRO HA 1 1 27 7730 1 1 19 PRO HB2 H -5.285 3.303 3.469 1.00 . A A . 19 PRO HB2 1 1 27 7731 1 1 19 PRO HB3 H -5.217 3.053 1.736 1.00 . A A . 19 PRO HB3 1 1 27 7732 1 1 19 PRO HD2 H -1.552 2.596 3.090 1.00 . A A . 19 PRO HD2 1 1 27 7733 1 1 19 PRO HD3 H -1.984 2.128 1.437 1.00 . A A . 19 PRO HD3 1 1 27 7734 1 1 19 PRO HG2 H -3.573 1.874 3.830 1.00 . A A . 19 PRO HG2 1 1 27 7735 1 1 19 PRO HG3 H -3.914 1.288 2.204 1.00 . A A . 19 PRO HG3 1 1 27 7736 1 1 19 PRO N N -2.549 4.086 1.977 1.00 . A A . 19 PRO N 1 1 27 7737 1 1 19 PRO O O -2.950 4.995 4.616 1.00 . A A . 19 PRO O 1 1 27 7738 1 1 20 SER C C -6.038 7.823 5.271 1.00 . A A . 20 SER C 1 1 27 7739 1 1 20 SER CA C -4.698 7.099 5.132 1.00 . A A . 20 SER CA 1 1 27 7740 1 1 20 SER CB C -3.550 8.115 5.134 1.00 . A A . 20 SER CB 1 1 27 7741 1 1 20 SER H H -5.299 6.477 3.196 1.00 . A A . 20 SER H 1 1 27 7742 1 1 20 SER HA H -4.576 6.435 5.975 1.00 . A A . 20 SER HA 1 1 27 7743 1 1 20 SER HB2 H -3.708 8.832 5.926 1.00 . A A . 20 SER HB2 1 1 27 7744 1 1 20 SER HB3 H -2.616 7.599 5.298 1.00 . A A . 20 SER HB3 1 1 27 7745 1 1 20 SER HG H -2.595 8.716 3.531 1.00 . A A . 20 SER HG 1 1 27 7746 1 1 20 SER N N -4.661 6.286 3.916 1.00 . A A . 20 SER N 1 1 27 7747 1 1 20 SER O O -6.662 7.706 6.347 1.00 . A A . 20 SER O 1 1 27 7748 1 1 20 SER OXT O -6.451 8.502 4.306 1.00 . A A . 20 SER OXT 1 1 27 7749 1 1 20 SER OG O -3.476 8.811 3.900 1.00 . A A . 20 SER OG 1 1 28 7750 1 1 1 ASP C C -6.371 -2.113 5.887 1.00 . A A . 1 ASP C 1 1 28 7751 1 1 1 ASP CA C -7.083 -1.613 7.145 1.00 . A A . 1 ASP CA 1 1 28 7752 1 1 1 ASP CB C -6.073 -0.973 8.109 1.00 . A A . 1 ASP CB 1 1 28 7753 1 1 1 ASP CG C -4.898 -1.884 8.423 1.00 . A A . 1 ASP CG 1 1 28 7754 1 1 1 ASP H1 H -7.084 -3.457 8.070 1.00 . A A . 1 ASP H1 1 1 28 7755 1 1 1 ASP H2 H -8.524 -3.084 7.214 1.00 . A A . 1 ASP H2 1 1 28 7756 1 1 1 ASP H3 H -8.201 -2.331 8.721 1.00 . A A . 1 ASP H3 1 1 28 7757 1 1 1 ASP HA H -7.816 -0.874 6.860 1.00 . A A . 1 ASP HA 1 1 28 7758 1 1 1 ASP HB2 H -5.691 -0.066 7.666 1.00 . A A . 1 ASP HB2 1 1 28 7759 1 1 1 ASP HB3 H -6.575 -0.731 9.034 1.00 . A A . 1 ASP HB3 1 1 28 7760 1 1 1 ASP N N -7.786 -2.721 7.851 1.00 . A A . 1 ASP N 1 1 28 7761 1 1 1 ASP O O -6.024 -3.292 5.784 1.00 . A A . 1 ASP O 1 1 28 7762 1 1 1 ASP OD1 O -5.021 -2.715 9.347 1.00 . A A . 1 ASP OD1 1 1 28 7763 1 1 1 ASP OD2 O -3.856 -1.766 7.744 1.00 . A A . 1 ASP OD2 1 1 28 7764 1 1 2 ALA C C -3.984 -1.181 3.722 1.00 . A A . 2 ALA C 1 1 28 7765 1 1 2 ALA CA C -5.474 -1.544 3.687 1.00 . A A . 2 ALA CA 1 1 28 7766 1 1 2 ALA CB C -6.160 -0.853 2.515 1.00 . A A . 2 ALA CB 1 1 28 7767 1 1 2 ALA H H -6.446 -0.280 5.083 1.00 . A A . 2 ALA H 1 1 28 7768 1 1 2 ALA HA H -5.566 -2.611 3.542 1.00 . A A . 2 ALA HA 1 1 28 7769 1 1 2 ALA HB1 H -6.970 -0.241 2.882 1.00 . A A . 2 ALA HB1 1 1 28 7770 1 1 2 ALA HB2 H -6.550 -1.597 1.837 1.00 . A A . 2 ALA HB2 1 1 28 7771 1 1 2 ALA HB3 H -5.446 -0.231 1.995 1.00 . A A . 2 ALA HB3 1 1 28 7772 1 1 2 ALA N N -6.150 -1.204 4.937 1.00 . A A . 2 ALA N 1 1 28 7773 1 1 2 ALA O O -3.286 -1.325 2.717 1.00 . A A . 2 ALA O 1 1 28 7774 1 1 3 TYR C C -1.185 -1.566 4.960 1.00 . A A . 3 TYR C 1 1 28 7775 1 1 3 TYR CA C -2.089 -0.336 5.022 1.00 . A A . 3 TYR CA 1 1 28 7776 1 1 3 TYR CB C -1.866 0.430 6.330 1.00 . A A . 3 TYR CB 1 1 28 7777 1 1 3 TYR CD1 C -0.917 2.727 5.842 1.00 . A A . 3 TYR CD1 1 1 28 7778 1 1 3 TYR CD2 C 0.560 1.041 6.665 1.00 . A A . 3 TYR CD2 1 1 28 7779 1 1 3 TYR CE1 C 0.130 3.628 5.806 1.00 . A A . 3 TYR CE1 1 1 28 7780 1 1 3 TYR CE2 C 1.611 1.938 6.627 1.00 . A A . 3 TYR CE2 1 1 28 7781 1 1 3 TYR CG C -0.719 1.416 6.273 1.00 . A A . 3 TYR CG 1 1 28 7782 1 1 3 TYR CZ C 1.390 3.229 6.197 1.00 . A A . 3 TYR CZ 1 1 28 7783 1 1 3 TYR H H -4.096 -0.618 5.647 1.00 . A A . 3 TYR H 1 1 28 7784 1 1 3 TYR HA H -1.839 0.307 4.197 1.00 . A A . 3 TYR HA 1 1 28 7785 1 1 3 TYR HB2 H -2.761 0.982 6.575 1.00 . A A . 3 TYR HB2 1 1 28 7786 1 1 3 TYR HB3 H -1.658 -0.276 7.122 1.00 . A A . 3 TYR HB3 1 1 28 7787 1 1 3 TYR HD1 H -1.905 3.040 5.525 1.00 . A A . 3 TYR HD1 1 1 28 7788 1 1 3 TYR HD2 H 0.731 0.029 7.000 1.00 . A A . 3 TYR HD2 1 1 28 7789 1 1 3 TYR HE1 H -0.042 4.640 5.476 1.00 . A A . 3 TYR HE1 1 1 28 7790 1 1 3 TYR HE2 H 2.598 1.625 6.933 1.00 . A A . 3 TYR HE2 1 1 28 7791 1 1 3 TYR HH H 2.515 4.559 7.015 1.00 . A A . 3 TYR HH 1 1 28 7792 1 1 3 TYR N N -3.497 -0.712 4.878 1.00 . A A . 3 TYR N 1 1 28 7793 1 1 3 TYR O O -0.243 -1.606 4.167 1.00 . A A . 3 TYR O 1 1 28 7794 1 1 3 TYR OH O 2.434 4.125 6.161 1.00 . A A . 3 TYR OH 1 1 28 7795 1 1 4 ALA C C -0.824 -4.520 4.441 1.00 . A A . 4 ALA C 1 1 28 7796 1 1 4 ALA CA C -0.710 -3.813 5.789 1.00 . A A . 4 ALA CA 1 1 28 7797 1 1 4 ALA CB C -1.174 -4.728 6.915 1.00 . A A . 4 ALA CB 1 1 28 7798 1 1 4 ALA H H -2.260 -2.492 6.378 1.00 . A A . 4 ALA H 1 1 28 7799 1 1 4 ALA HA H 0.328 -3.556 5.964 1.00 . A A . 4 ALA HA 1 1 28 7800 1 1 4 ALA HB1 H -1.193 -5.750 6.564 1.00 . A A . 4 ALA HB1 1 1 28 7801 1 1 4 ALA HB2 H -2.166 -4.438 7.229 1.00 . A A . 4 ALA HB2 1 1 28 7802 1 1 4 ALA HB3 H -0.494 -4.647 7.749 1.00 . A A . 4 ALA HB3 1 1 28 7803 1 1 4 ALA N N -1.488 -2.575 5.780 1.00 . A A . 4 ALA N 1 1 28 7804 1 1 4 ALA O O 0.150 -5.089 3.944 1.00 . A A . 4 ALA O 1 1 28 7805 1 1 5 GLN C C -1.456 -4.361 1.461 1.00 . A A . 5 GLN C 1 1 28 7806 1 1 5 GLN CA C -2.270 -5.070 2.545 1.00 . A A . 5 GLN CA 1 1 28 7807 1 1 5 GLN CB C -3.764 -5.008 2.213 1.00 . A A . 5 GLN CB 1 1 28 7808 1 1 5 GLN CD C -4.067 -7.117 0.843 1.00 . A A . 5 GLN CD 1 1 28 7809 1 1 5 GLN CG C -4.115 -5.598 0.857 1.00 . A A . 5 GLN CG 1 1 28 7810 1 1 5 GLN H H -2.749 -3.979 4.287 1.00 . A A . 5 GLN H 1 1 28 7811 1 1 5 GLN HA H -1.960 -6.103 2.596 1.00 . A A . 5 GLN HA 1 1 28 7812 1 1 5 GLN HB2 H -4.312 -5.551 2.969 1.00 . A A . 5 GLN HB2 1 1 28 7813 1 1 5 GLN HB3 H -4.081 -3.976 2.224 1.00 . A A . 5 GLN HB3 1 1 28 7814 1 1 5 GLN HE21 H -3.464 -7.110 -1.055 1.00 . A A . 5 GLN HE21 1 1 28 7815 1 1 5 GLN HE22 H -3.650 -8.667 -0.331 1.00 . A A . 5 GLN HE22 1 1 28 7816 1 1 5 GLN HG2 H -5.112 -5.283 0.588 1.00 . A A . 5 GLN HG2 1 1 28 7817 1 1 5 GLN HG3 H -3.412 -5.223 0.129 1.00 . A A . 5 GLN HG3 1 1 28 7818 1 1 5 GLN N N -2.020 -4.460 3.845 1.00 . A A . 5 GLN N 1 1 28 7819 1 1 5 GLN NE2 N -3.689 -7.689 -0.296 1.00 . A A . 5 GLN NE2 1 1 28 7820 1 1 5 GLN O O -0.920 -5.005 0.560 1.00 . A A . 5 GLN O 1 1 28 7821 1 1 5 GLN OE1 O -4.367 -7.770 1.843 1.00 . A A . 5 GLN OE1 1 1 28 7822 1 1 6 TRP C C 0.865 -2.640 0.614 1.00 . A A . 6 TRP C 1 1 28 7823 1 1 6 TRP CA C -0.602 -2.225 0.616 1.00 . A A . 6 TRP CA 1 1 28 7824 1 1 6 TRP CB C -0.718 -0.738 0.968 1.00 . A A . 6 TRP CB 1 1 28 7825 1 1 6 TRP CD1 C -0.311 0.486 -1.237 1.00 . A A . 6 TRP CD1 1 1 28 7826 1 1 6 TRP CD2 C 1.269 0.840 0.306 1.00 . A A . 6 TRP CD2 1 1 28 7827 1 1 6 TRP CE2 C 1.605 1.560 -0.855 1.00 . A A . 6 TRP CE2 1 1 28 7828 1 1 6 TRP CE3 C 2.121 0.915 1.413 1.00 . A A . 6 TRP CE3 1 1 28 7829 1 1 6 TRP CG C 0.038 0.157 0.037 1.00 . A A . 6 TRP CG 1 1 28 7830 1 1 6 TRP CH2 C 3.565 2.402 0.151 1.00 . A A . 6 TRP CH2 1 1 28 7831 1 1 6 TRP CZ2 C 2.751 2.343 -0.944 1.00 . A A . 6 TRP CZ2 1 1 28 7832 1 1 6 TRP CZ3 C 3.260 1.697 1.324 1.00 . A A . 6 TRP CZ3 1 1 28 7833 1 1 6 TRP H H -1.806 -2.584 2.320 1.00 . A A . 6 TRP H 1 1 28 7834 1 1 6 TRP HA H -1.015 -2.391 -0.367 1.00 . A A . 6 TRP HA 1 1 28 7835 1 1 6 TRP HB2 H -1.755 -0.449 0.939 1.00 . A A . 6 TRP HB2 1 1 28 7836 1 1 6 TRP HB3 H -0.335 -0.580 1.962 1.00 . A A . 6 TRP HB3 1 1 28 7837 1 1 6 TRP HD1 H -1.197 0.128 -1.736 1.00 . A A . 6 TRP HD1 1 1 28 7838 1 1 6 TRP HE1 H 0.599 1.693 -2.684 1.00 . A A . 6 TRP HE1 1 1 28 7839 1 1 6 TRP HE3 H 1.902 0.376 2.324 1.00 . A A . 6 TRP HE3 1 1 28 7840 1 1 6 TRP HH2 H 4.460 3.008 0.126 1.00 . A A . 6 TRP HH2 1 1 28 7841 1 1 6 TRP HZ2 H 3.003 2.887 -1.843 1.00 . A A . 6 TRP HZ2 1 1 28 7842 1 1 6 TRP HZ3 H 3.932 1.767 2.168 1.00 . A A . 6 TRP HZ3 1 1 28 7843 1 1 6 TRP N N -1.361 -3.032 1.570 1.00 . A A . 6 TRP N 1 1 28 7844 1 1 6 TRP NE1 N 0.627 1.322 -1.780 1.00 . A A . 6 TRP NE1 1 1 28 7845 1 1 6 TRP O O 1.454 -2.875 -0.442 1.00 . A A . 6 TRP O 1 1 28 7846 1 1 7 LEU C C 3.052 -4.565 1.497 1.00 . A A . 7 LEU C 1 1 28 7847 1 1 7 LEU CA C 2.835 -3.127 1.974 1.00 . A A . 7 LEU CA 1 1 28 7848 1 1 7 LEU CB C 3.250 -2.979 3.440 1.00 . A A . 7 LEU CB 1 1 28 7849 1 1 7 LEU CD1 C 3.167 -1.562 5.511 1.00 . A A . 7 LEU CD1 1 1 28 7850 1 1 7 LEU CD2 C 4.326 -0.706 3.464 1.00 . A A . 7 LEU CD2 1 1 28 7851 1 1 7 LEU CG C 3.173 -1.550 3.990 1.00 . A A . 7 LEU CG 1 1 28 7852 1 1 7 LEU H H 0.905 -2.537 2.612 1.00 . A A . 7 LEU H 1 1 28 7853 1 1 7 LEU HA H 3.437 -2.466 1.370 1.00 . A A . 7 LEU HA 1 1 28 7854 1 1 7 LEU HB2 H 2.606 -3.608 4.039 1.00 . A A . 7 LEU HB2 1 1 28 7855 1 1 7 LEU HB3 H 4.263 -3.329 3.546 1.00 . A A . 7 LEU HB3 1 1 28 7856 1 1 7 LEU HD11 H 2.975 -0.565 5.877 1.00 . A A . 7 LEU HD11 1 1 28 7857 1 1 7 LEU HD12 H 4.128 -1.899 5.872 1.00 . A A . 7 LEU HD12 1 1 28 7858 1 1 7 LEU HD13 H 2.395 -2.230 5.863 1.00 . A A . 7 LEU HD13 1 1 28 7859 1 1 7 LEU HD21 H 4.157 -0.472 2.422 1.00 . A A . 7 LEU HD21 1 1 28 7860 1 1 7 LEU HD22 H 5.250 -1.255 3.564 1.00 . A A . 7 LEU HD22 1 1 28 7861 1 1 7 LEU HD23 H 4.389 0.212 4.031 1.00 . A A . 7 LEU HD23 1 1 28 7862 1 1 7 LEU HG H 2.249 -1.097 3.660 1.00 . A A . 7 LEU HG 1 1 28 7863 1 1 7 LEU N N 1.439 -2.734 1.812 1.00 . A A . 7 LEU N 1 1 28 7864 1 1 7 LEU O O 4.091 -4.884 0.917 1.00 . A A . 7 LEU O 1 1 28 7865 1 1 8 ALA C C 1.893 -6.980 -0.187 1.00 . A A . 8 ALA C 1 1 28 7866 1 1 8 ALA CA C 2.123 -6.824 1.321 1.00 . A A . 8 ALA CA 1 1 28 7867 1 1 8 ALA CB C 1.108 -7.652 2.098 1.00 . A A . 8 ALA CB 1 1 28 7868 1 1 8 ALA H H 1.251 -5.102 2.194 1.00 . A A . 8 ALA H 1 1 28 7869 1 1 8 ALA HA H 3.109 -7.193 1.562 1.00 . A A . 8 ALA HA 1 1 28 7870 1 1 8 ALA HB1 H 1.402 -8.692 2.078 1.00 . A A . 8 ALA HB1 1 1 28 7871 1 1 8 ALA HB2 H 0.133 -7.544 1.647 1.00 . A A . 8 ALA HB2 1 1 28 7872 1 1 8 ALA HB3 H 1.071 -7.309 3.122 1.00 . A A . 8 ALA HB3 1 1 28 7873 1 1 8 ALA N N 2.056 -5.423 1.735 1.00 . A A . 8 ALA N 1 1 28 7874 1 1 8 ALA O O 2.243 -8.009 -0.767 1.00 . A A . 8 ALA O 1 1 28 7875 1 1 9 ASP C C 2.239 -5.448 -3.063 1.00 . A A . 9 ASP C 1 1 28 7876 1 1 9 ASP CA C 1.044 -5.977 -2.259 1.00 . A A . 9 ASP CA 1 1 28 7877 1 1 9 ASP CB C -0.207 -5.149 -2.583 1.00 . A A . 9 ASP CB 1 1 28 7878 1 1 9 ASP CG C -1.255 -5.949 -3.331 1.00 . A A . 9 ASP CG 1 1 28 7879 1 1 9 ASP H H 1.059 -5.157 -0.304 1.00 . A A . 9 ASP H 1 1 28 7880 1 1 9 ASP HA H 0.865 -7.004 -2.542 1.00 . A A . 9 ASP HA 1 1 28 7881 1 1 9 ASP HB2 H -0.646 -4.791 -1.665 1.00 . A A . 9 ASP HB2 1 1 28 7882 1 1 9 ASP HB3 H 0.076 -4.303 -3.193 1.00 . A A . 9 ASP HB3 1 1 28 7883 1 1 9 ASP N N 1.310 -5.952 -0.818 1.00 . A A . 9 ASP N 1 1 28 7884 1 1 9 ASP O O 2.104 -5.131 -4.247 1.00 . A A . 9 ASP O 1 1 28 7885 1 1 9 ASP OD1 O -2.099 -6.589 -2.668 1.00 . A A . 9 ASP OD1 1 1 28 7886 1 1 9 ASP OD2 O -1.233 -5.936 -4.580 1.00 . A A . 9 ASP OD2 1 1 28 7887 1 1 10 DAL C C 4.930 -3.417 -2.662 1.00 . A A . 10 DAL C 1 1 28 7888 1 1 10 DAL CA C 4.614 -4.860 -3.069 1.00 . A A . 10 DAL CA 1 1 28 7889 1 1 10 DAL CB C 5.787 -5.763 -2.730 1.00 . A A . 10 DAL CB 1 1 28 7890 1 1 10 DAL H H 3.453 -5.616 -1.475 1.00 . A A . 10 DAL H 1 1 28 7891 1 1 10 DAL HA H 4.458 -4.898 -4.137 1.00 . A A . 10 DAL HA 1 1 28 7892 1 1 10 DAL HB1 H 5.544 -6.782 -2.991 1.00 . A A . 10 DAL HB1 1 1 28 7893 1 1 10 DAL HB2 H 5.990 -5.700 -1.671 1.00 . A A . 10 DAL HB2 1 1 28 7894 1 1 10 DAL HB3 H 6.658 -5.446 -3.284 1.00 . A A . 10 DAL HB3 1 1 28 7895 1 1 10 DAL N N 3.404 -5.352 -2.416 1.00 . A A . 10 DAL N 1 1 28 7896 1 1 10 DAL O O 5.952 -2.864 -3.074 1.00 . A A . 10 DAL O 1 1 28 7897 1 1 11 GLY C C 4.157 -0.450 -2.541 1.00 . A A . 11 GLY C 1 1 28 7898 1 1 11 GLY CA C 4.262 -1.447 -1.408 1.00 . A A . 11 GLY CA 1 1 28 7899 1 1 11 GLY H H 3.259 -3.301 -1.557 1.00 . A A . 11 GLY H 1 1 28 7900 1 1 11 GLY HA2 H 3.519 -1.204 -0.661 1.00 . A A . 11 GLY HA2 1 1 28 7901 1 1 11 GLY HA3 H 5.243 -1.370 -0.964 1.00 . A A . 11 GLY HA3 1 1 28 7902 1 1 11 GLY N N 4.053 -2.814 -1.853 1.00 . A A . 11 GLY N 1 1 28 7903 1 1 11 GLY O O 3.059 -0.028 -2.903 1.00 . A A . 11 GLY O 1 1 28 7904 1 1 12 TRP C C 5.429 0.186 -5.564 1.00 . A A . 12 TRP C 1 1 28 7905 1 1 12 TRP CA C 5.338 0.880 -4.203 1.00 . A A . 12 TRP CA 1 1 28 7906 1 1 12 TRP CB C 6.491 1.861 -4.001 1.00 . A A . 12 TRP CB 1 1 28 7907 1 1 12 TRP CD1 C 6.634 3.182 -1.816 1.00 . A A . 12 TRP CD1 1 1 28 7908 1 1 12 TRP CD2 C 5.108 3.953 -3.265 1.00 . A A . 12 TRP CD2 1 1 28 7909 1 1 12 TRP CE2 C 5.071 4.748 -2.106 1.00 . A A . 12 TRP CE2 1 1 28 7910 1 1 12 TRP CE3 C 4.235 4.254 -4.319 1.00 . A A . 12 TRP CE3 1 1 28 7911 1 1 12 TRP CG C 6.115 2.955 -3.058 1.00 . A A . 12 TRP CG 1 1 28 7912 1 1 12 TRP CH2 C 3.353 6.089 -3.010 1.00 . A A . 12 TRP CH2 1 1 28 7913 1 1 12 TRP CZ2 C 4.196 5.815 -1.967 1.00 . A A . 12 TRP CZ2 1 1 28 7914 1 1 12 TRP CZ3 C 3.369 5.319 -4.181 1.00 . A A . 12 TRP CZ3 1 1 28 7915 1 1 12 TRP H H 6.147 -0.451 -2.770 1.00 . A A . 12 TRP H 1 1 28 7916 1 1 12 TRP HA H 4.410 1.436 -4.170 1.00 . A A . 12 TRP HA 1 1 28 7917 1 1 12 TRP HB2 H 7.340 1.335 -3.589 1.00 . A A . 12 TRP HB2 1 1 28 7918 1 1 12 TRP HB3 H 6.766 2.303 -4.947 1.00 . A A . 12 TRP HB3 1 1 28 7919 1 1 12 TRP HD1 H 7.419 2.592 -1.368 1.00 . A A . 12 TRP HD1 1 1 28 7920 1 1 12 TRP HE1 H 6.210 4.620 -0.347 1.00 . A A . 12 TRP HE1 1 1 28 7921 1 1 12 TRP HE3 H 4.229 3.671 -5.229 1.00 . A A . 12 TRP HE3 1 1 28 7922 1 1 12 TRP HH2 H 2.660 6.914 -2.944 1.00 . A A . 12 TRP HH2 1 1 28 7923 1 1 12 TRP HZ2 H 4.165 6.407 -1.068 1.00 . A A . 12 TRP HZ2 1 1 28 7924 1 1 12 TRP HZ3 H 2.692 5.569 -4.986 1.00 . A A . 12 TRP HZ3 1 1 28 7925 1 1 12 TRP N N 5.304 -0.075 -3.103 1.00 . A A . 12 TRP N 1 1 28 7926 1 1 12 TRP NE1 N 6.012 4.259 -1.237 1.00 . A A . 12 TRP NE1 1 1 28 7927 1 1 12 TRP O O 5.655 0.839 -6.585 1.00 . A A . 12 TRP O 1 1 28 7928 1 1 13 ALA C C 3.859 -1.877 -7.470 1.00 . A A . 13 ALA C 1 1 28 7929 1 1 13 ALA CA C 5.239 -1.898 -6.820 1.00 . A A . 13 ALA CA 1 1 28 7930 1 1 13 ALA CB C 5.692 -3.327 -6.566 1.00 . A A . 13 ALA CB 1 1 28 7931 1 1 13 ALA H H 5.014 -1.597 -4.742 1.00 . A A . 13 ALA H 1 1 28 7932 1 1 13 ALA HA H 5.944 -1.431 -7.488 1.00 . A A . 13 ALA HA 1 1 28 7933 1 1 13 ALA HB1 H 6.421 -3.606 -7.311 1.00 . A A . 13 ALA HB1 1 1 28 7934 1 1 13 ALA HB2 H 4.843 -3.991 -6.625 1.00 . A A . 13 ALA HB2 1 1 28 7935 1 1 13 ALA HB3 H 6.136 -3.395 -5.584 1.00 . A A . 13 ALA HB3 1 1 28 7936 1 1 13 ALA N N 5.216 -1.133 -5.580 1.00 . A A . 13 ALA N 1 1 28 7937 1 1 13 ALA O O 3.739 -1.887 -8.696 1.00 . A A . 13 ALA O 1 1 28 7938 1 1 14 SER C C 1.203 -0.497 -7.922 1.00 . A A . 14 SER C 1 1 28 7939 1 1 14 SER CA C 1.441 -1.769 -7.103 1.00 . A A . 14 SER CA 1 1 28 7940 1 1 14 SER CB C 0.467 -1.830 -5.915 1.00 . A A . 14 SER CB 1 1 28 7941 1 1 14 SER H H 2.990 -1.800 -5.665 1.00 . A A . 14 SER H 1 1 28 7942 1 1 14 SER HA H 1.275 -2.623 -7.738 1.00 . A A . 14 SER HA 1 1 28 7943 1 1 14 SER HB2 H -0.451 -1.328 -6.178 1.00 . A A . 14 SER HB2 1 1 28 7944 1 1 14 SER HB3 H 0.255 -2.864 -5.681 1.00 . A A . 14 SER HB3 1 1 28 7945 1 1 14 SER HG H 1.350 -1.876 -4.159 1.00 . A A . 14 SER HG 1 1 28 7946 1 1 14 SER N N 2.821 -1.822 -6.630 1.00 . A A . 14 SER N 1 1 28 7947 1 1 14 SER O O 0.384 -0.489 -8.842 1.00 . A A . 14 SER O 1 1 28 7948 1 1 14 SER OG O 1.013 -1.206 -4.762 1.00 . A A . 14 SER OG 1 1 28 7949 1 1 15 DAL C C 0.950 2.845 -7.510 1.00 . A A . 15 DAL C 1 1 28 7950 1 1 15 DAL CA C 1.811 1.847 -8.290 1.00 . A A . 15 DAL CA 1 1 28 7951 1 1 15 DAL CB C 3.191 2.427 -8.557 1.00 . A A . 15 DAL CB 1 1 28 7952 1 1 15 DAL H H 2.571 0.499 -6.842 1.00 . A A . 15 DAL H 1 1 28 7953 1 1 15 DAL HA H 1.344 1.656 -9.243 1.00 . A A . 15 DAL HA 1 1 28 7954 1 1 15 DAL HB1 H 3.191 3.481 -8.323 1.00 . A A . 15 DAL HB1 1 1 28 7955 1 1 15 DAL HB2 H 3.440 2.289 -9.598 1.00 . A A . 15 DAL HB2 1 1 28 7956 1 1 15 DAL HB3 H 3.919 1.921 -7.942 1.00 . A A . 15 DAL HB3 1 1 28 7957 1 1 15 DAL N N 1.932 0.572 -7.583 1.00 . A A . 15 DAL N 1 1 28 7958 1 1 15 DAL O O 1.081 4.059 -7.681 1.00 . A A . 15 DAL O 1 1 28 7959 1 1 16 ARG C C -0.124 3.586 -4.551 1.00 . A A . 16 ARG C 1 1 28 7960 1 1 16 ARG CA C -0.813 3.166 -5.851 1.00 . A A . 16 ARG CA 1 1 28 7961 1 1 16 ARG CB C -2.120 2.409 -5.537 1.00 . A A . 16 ARG CB 1 1 28 7962 1 1 16 ARG CD C -3.134 0.413 -4.385 1.00 . A A . 16 ARG CD 1 1 28 7963 1 1 16 ARG CG C -2.002 1.433 -4.373 1.00 . A A . 16 ARG CG 1 1 28 7964 1 1 16 ARG CZ C -2.824 -1.447 -2.775 1.00 . A A . 16 ARG CZ 1 1 28 7965 1 1 16 ARG H H 0.013 1.349 -6.566 1.00 . A A . 16 ARG H 1 1 28 7966 1 1 16 ARG HA H -1.041 4.056 -6.423 1.00 . A A . 16 ARG HA 1 1 28 7967 1 1 16 ARG HB2 H -2.888 3.129 -5.296 1.00 . A A . 16 ARG HB2 1 1 28 7968 1 1 16 ARG HB3 H -2.428 1.847 -6.414 1.00 . A A . 16 ARG HB3 1 1 28 7969 1 1 16 ARG HD2 H -4.052 0.921 -4.642 1.00 . A A . 16 ARG HD2 1 1 28 7970 1 1 16 ARG HD3 H -2.922 -0.338 -5.131 1.00 . A A . 16 ARG HD3 1 1 28 7971 1 1 16 ARG HE H -3.816 0.249 -2.404 1.00 . A A . 16 ARG HE 1 1 28 7972 1 1 16 ARG HG2 H -1.056 0.911 -4.446 1.00 . A A . 16 ARG HG2 1 1 28 7973 1 1 16 ARG HG3 H -2.039 1.988 -3.447 1.00 . A A . 16 ARG HG3 1 1 28 7974 1 1 16 ARG HH11 H -1.932 -1.768 -4.566 1.00 . A A . 16 ARG HH11 1 1 28 7975 1 1 16 ARG HH12 H -1.758 -3.046 -3.414 1.00 . A A . 16 ARG HH12 1 1 28 7976 1 1 16 ARG HH21 H -3.579 -1.442 -0.897 1.00 . A A . 16 ARG HH21 1 1 28 7977 1 1 16 ARG HH22 H -2.694 -2.865 -1.335 1.00 . A A . 16 ARG HH22 1 1 28 7978 1 1 16 ARG N N 0.070 2.325 -6.657 1.00 . A A . 16 ARG N 1 1 28 7979 1 1 16 ARG NE N -3.306 -0.238 -3.084 1.00 . A A . 16 ARG NE 1 1 28 7980 1 1 16 ARG NH1 N -2.113 -2.143 -3.659 1.00 . A A . 16 ARG NH1 1 1 28 7981 1 1 16 ARG NH2 N -3.050 -1.960 -1.569 1.00 . A A . 16 ARG NH2 1 1 28 7982 1 1 16 ARG O O 0.768 2.890 -4.066 1.00 . A A . 16 ARG O 1 1 28 7983 1 1 17 PRO C C -0.563 4.593 -1.480 1.00 . A A . 17 PRO C 1 1 28 7984 1 1 17 PRO CA C 0.056 5.236 -2.721 1.00 . A A . 17 PRO CA 1 1 28 7985 1 1 17 PRO CB C -0.250 6.741 -2.749 1.00 . A A . 17 PRO CB 1 1 28 7986 1 1 17 PRO CD C -1.560 5.642 -4.463 1.00 . A A . 17 PRO CD 1 1 28 7987 1 1 17 PRO CG C -1.087 6.984 -3.971 1.00 . A A . 17 PRO CG 1 1 28 7988 1 1 17 PRO HA H 1.123 5.086 -2.695 1.00 . A A . 17 PRO HA 1 1 28 7989 1 1 17 PRO HB2 H -0.784 7.013 -1.851 1.00 . A A . 17 PRO HB2 1 1 28 7990 1 1 17 PRO HB3 H 0.681 7.291 -2.794 1.00 . A A . 17 PRO HB3 1 1 28 7991 1 1 17 PRO HD2 H -2.522 5.398 -4.042 1.00 . A A . 17 PRO HD2 1 1 28 7992 1 1 17 PRO HD3 H -1.603 5.633 -5.539 1.00 . A A . 17 PRO HD3 1 1 28 7993 1 1 17 PRO HG2 H -1.934 7.603 -3.713 1.00 . A A . 17 PRO HG2 1 1 28 7994 1 1 17 PRO HG3 H -0.490 7.470 -4.729 1.00 . A A . 17 PRO HG3 1 1 28 7995 1 1 17 PRO N N -0.523 4.735 -3.967 1.00 . A A . 17 PRO N 1 1 28 7996 1 1 17 PRO O O -1.609 3.945 -1.557 1.00 . A A . 17 PRO O 1 1 28 7997 1 1 18 PRO C C -1.733 4.754 1.401 1.00 . A A . 18 PRO C 1 1 28 7998 1 1 18 PRO CA C -0.380 4.199 0.957 1.00 . A A . 18 PRO CA 1 1 28 7999 1 1 18 PRO CB C 0.693 4.613 1.969 1.00 . A A . 18 PRO CB 1 1 28 8000 1 1 18 PRO CD C 1.349 5.512 -0.154 1.00 . A A . 18 PRO CD 1 1 28 8001 1 1 18 PRO CG C 1.446 5.728 1.327 1.00 . A A . 18 PRO CG 1 1 28 8002 1 1 18 PRO HA H -0.433 3.120 0.910 1.00 . A A . 18 PRO HA 1 1 28 8003 1 1 18 PRO HB2 H 0.215 4.943 2.876 1.00 . A A . 18 PRO HB2 1 1 28 8004 1 1 18 PRO HB3 H 1.332 3.776 2.183 1.00 . A A . 18 PRO HB3 1 1 28 8005 1 1 18 PRO HD2 H 1.301 6.459 -0.670 1.00 . A A . 18 PRO HD2 1 1 28 8006 1 1 18 PRO HD3 H 2.188 4.933 -0.506 1.00 . A A . 18 PRO HD3 1 1 28 8007 1 1 18 PRO HG2 H 0.998 6.674 1.596 1.00 . A A . 18 PRO HG2 1 1 28 8008 1 1 18 PRO HG3 H 2.479 5.700 1.642 1.00 . A A . 18 PRO HG3 1 1 28 8009 1 1 18 PRO N N 0.091 4.763 -0.314 1.00 . A A . 18 PRO N 1 1 28 8010 1 1 18 PRO O O -2.032 5.931 1.189 1.00 . A A . 18 PRO O 1 1 28 8011 1 1 19 PRO C C -3.799 5.034 3.878 1.00 . A A . 19 PRO C 1 1 28 8012 1 1 19 PRO CA C -3.874 4.306 2.535 1.00 . A A . 19 PRO CA 1 1 28 8013 1 1 19 PRO CB C -4.616 2.979 2.682 1.00 . A A . 19 PRO CB 1 1 28 8014 1 1 19 PRO CD C -2.268 2.496 2.338 1.00 . A A . 19 PRO CD 1 1 28 8015 1 1 19 PRO CG C -3.575 1.924 2.830 1.00 . A A . 19 PRO CG 1 1 28 8016 1 1 19 PRO HA H -4.390 4.930 1.820 1.00 . A A . 19 PRO HA 1 1 28 8017 1 1 19 PRO HB2 H -5.260 3.017 3.546 1.00 . A A . 19 PRO HB2 1 1 28 8018 1 1 19 PRO HB3 H -5.200 2.810 1.807 1.00 . A A . 19 PRO HB3 1 1 28 8019 1 1 19 PRO HD2 H -1.508 2.418 3.098 1.00 . A A . 19 PRO HD2 1 1 28 8020 1 1 19 PRO HD3 H -1.959 1.979 1.444 1.00 . A A . 19 PRO HD3 1 1 28 8021 1 1 19 PRO HG2 H -3.497 1.636 3.862 1.00 . A A . 19 PRO HG2 1 1 28 8022 1 1 19 PRO HG3 H -3.849 1.068 2.231 1.00 . A A . 19 PRO HG3 1 1 28 8023 1 1 19 PRO N N -2.562 3.907 2.042 1.00 . A A . 19 PRO N 1 1 28 8024 1 1 19 PRO O O -2.888 4.797 4.672 1.00 . A A . 19 PRO O 1 1 28 8025 1 1 20 SER C C -6.164 7.381 5.536 1.00 . A A . 20 SER C 1 1 28 8026 1 1 20 SER CA C -4.812 6.688 5.368 1.00 . A A . 20 SER CA 1 1 28 8027 1 1 20 SER CB C -3.684 7.725 5.407 1.00 . A A . 20 SER CB 1 1 28 8028 1 1 20 SER H H -5.461 6.064 3.447 1.00 . A A . 20 SER H 1 1 28 8029 1 1 20 SER HA H -4.676 5.994 6.185 1.00 . A A . 20 SER HA 1 1 28 8030 1 1 20 SER HB2 H -3.873 8.428 6.204 1.00 . A A . 20 SER HB2 1 1 28 8031 1 1 20 SER HB3 H -2.744 7.225 5.585 1.00 . A A . 20 SER HB3 1 1 28 8032 1 1 20 SER HG H -2.733 8.298 3.792 1.00 . A A . 20 SER HG 1 1 28 8033 1 1 20 SER N N -4.764 5.921 4.122 1.00 . A A . 20 SER N 1 1 28 8034 1 1 20 SER O O -6.791 7.199 6.601 1.00 . A A . 20 SER O 1 1 28 8035 1 1 20 SER OXT O -6.584 8.101 4.604 1.00 . A A . 20 SER OXT 1 1 28 8036 1 1 20 SER OG O -3.598 8.438 4.184 1.00 . A A . 20 SER OG 1 1 29 8037 1 1 1 ASP C C -5.771 -2.519 5.862 1.00 . A A . 1 ASP C 1 1 29 8038 1 1 1 ASP CA C -6.115 -3.866 6.499 1.00 . A A . 1 ASP CA 1 1 29 8039 1 1 1 ASP CB C -6.623 -3.668 7.933 1.00 . A A . 1 ASP CB 1 1 29 8040 1 1 1 ASP CG C -7.967 -4.332 8.168 1.00 . A A . 1 ASP CG 1 1 29 8041 1 1 1 ASP H1 H -4.596 -4.892 5.560 1.00 . A A . 1 ASP H1 1 1 29 8042 1 1 1 ASP H2 H -5.222 -5.664 6.959 1.00 . A A . 1 ASP H2 1 1 29 8043 1 1 1 ASP H3 H -4.198 -4.296 7.117 1.00 . A A . 1 ASP H3 1 1 29 8044 1 1 1 ASP HA H -6.884 -4.346 5.912 1.00 . A A . 1 ASP HA 1 1 29 8045 1 1 1 ASP HB2 H -5.909 -4.092 8.623 1.00 . A A . 1 ASP HB2 1 1 29 8046 1 1 1 ASP HB3 H -6.725 -2.611 8.131 1.00 . A A . 1 ASP HB3 1 1 29 8047 1 1 1 ASP N N -4.926 -4.760 6.537 1.00 . A A . 1 ASP N 1 1 29 8048 1 1 1 ASP O O -5.388 -1.576 6.557 1.00 . A A . 1 ASP O 1 1 29 8049 1 1 1 ASP OD1 O -7.983 -5.517 8.563 1.00 . A A . 1 ASP OD1 1 1 29 8050 1 1 1 ASP OD2 O -9.003 -3.666 7.959 1.00 . A A . 1 ASP OD2 1 1 29 8051 1 1 2 ALA C C -4.123 -0.900 3.792 1.00 . A A . 2 ALA C 1 1 29 8052 1 1 2 ALA CA C -5.617 -1.224 3.777 1.00 . A A . 2 ALA CA 1 1 29 8053 1 1 2 ALA CB C -6.430 -0.050 4.310 1.00 . A A . 2 ALA CB 1 1 29 8054 1 1 2 ALA H H -6.217 -3.238 4.045 1.00 . A A . 2 ALA H 1 1 29 8055 1 1 2 ALA HA H -5.919 -1.397 2.753 1.00 . A A . 2 ALA HA 1 1 29 8056 1 1 2 ALA HB1 H -6.171 0.127 5.343 1.00 . A A . 2 ALA HB1 1 1 29 8057 1 1 2 ALA HB2 H -7.482 -0.278 4.237 1.00 . A A . 2 ALA HB2 1 1 29 8058 1 1 2 ALA HB3 H -6.211 0.832 3.728 1.00 . A A . 2 ALA HB3 1 1 29 8059 1 1 2 ALA N N -5.910 -2.445 4.533 1.00 . A A . 2 ALA N 1 1 29 8060 1 1 2 ALA O O -3.431 -1.106 2.794 1.00 . A A . 2 ALA O 1 1 29 8061 1 1 3 TYR C C -1.344 -1.300 5.041 1.00 . A A . 3 TYR C 1 1 29 8062 1 1 3 TYR CA C -2.216 -0.047 5.065 1.00 . A A . 3 TYR CA 1 1 29 8063 1 1 3 TYR CB C -1.980 0.750 6.352 1.00 . A A . 3 TYR CB 1 1 29 8064 1 1 3 TYR CD1 C -0.960 3.009 5.829 1.00 . A A . 3 TYR CD1 1 1 29 8065 1 1 3 TYR CD2 C 0.465 1.288 6.670 1.00 . A A . 3 TYR CD2 1 1 29 8066 1 1 3 TYR CE1 C 0.114 3.875 5.778 1.00 . A A . 3 TYR CE1 1 1 29 8067 1 1 3 TYR CE2 C 1.543 2.149 6.617 1.00 . A A . 3 TYR CE2 1 1 29 8068 1 1 3 TYR CG C -0.803 1.698 6.276 1.00 . A A . 3 TYR CG 1 1 29 8069 1 1 3 TYR CZ C 1.362 3.441 6.171 1.00 . A A . 3 TYR CZ 1 1 29 8070 1 1 3 TYR H H -4.234 -0.254 5.686 1.00 . A A . 3 TYR H 1 1 29 8071 1 1 3 TYR HA H -1.947 0.565 4.222 1.00 . A A . 3 TYR HA 1 1 29 8072 1 1 3 TYR HB2 H -2.860 1.338 6.571 1.00 . A A . 3 TYR HB2 1 1 29 8073 1 1 3 TYR HB3 H -1.802 0.063 7.166 1.00 . A A . 3 TYR HB3 1 1 29 8074 1 1 3 TYR HD1 H -1.939 3.348 5.511 1.00 . A A . 3 TYR HD1 1 1 29 8075 1 1 3 TYR HD2 H 0.605 0.274 7.017 1.00 . A A . 3 TYR HD2 1 1 29 8076 1 1 3 TYR HE1 H -0.027 4.888 5.436 1.00 . A A . 3 TYR HE1 1 1 29 8077 1 1 3 TYR HE2 H 2.521 1.809 6.924 1.00 . A A . 3 TYR HE2 1 1 29 8078 1 1 3 TYR HH H 2.868 4.227 5.268 1.00 . A A . 3 TYR HH 1 1 29 8079 1 1 3 TYR N N -3.631 -0.395 4.926 1.00 . A A . 3 TYR N 1 1 29 8080 1 1 3 TYR O O -0.383 -1.376 4.274 1.00 . A A . 3 TYR O 1 1 29 8081 1 1 3 TYR OH O 2.434 4.303 6.121 1.00 . A A . 3 TYR OH 1 1 29 8082 1 1 4 ALA C C -1.089 -4.288 4.576 1.00 . A A . 4 ALA C 1 1 29 8083 1 1 4 ALA CA C -0.951 -3.548 5.905 1.00 . A A . 4 ALA CA 1 1 29 8084 1 1 4 ALA CB C -1.433 -4.422 7.055 1.00 . A A . 4 ALA CB 1 1 29 8085 1 1 4 ALA H H -2.481 -2.184 6.440 1.00 . A A . 4 ALA H 1 1 29 8086 1 1 4 ALA HA H 0.093 -3.314 6.069 1.00 . A A . 4 ALA HA 1 1 29 8087 1 1 4 ALA HB1 H -0.627 -5.062 7.384 1.00 . A A . 4 ALA HB1 1 1 29 8088 1 1 4 ALA HB2 H -2.262 -5.029 6.724 1.00 . A A . 4 ALA HB2 1 1 29 8089 1 1 4 ALA HB3 H -1.752 -3.795 7.875 1.00 . A A . 4 ALA HB3 1 1 29 8090 1 1 4 ALA N N -1.695 -2.292 5.864 1.00 . A A . 4 ALA N 1 1 29 8091 1 1 4 ALA O O -0.146 -4.936 4.118 1.00 . A A . 4 ALA O 1 1 29 8092 1 1 5 GLN C C -1.686 -4.137 1.571 1.00 . A A . 5 GLN C 1 1 29 8093 1 1 5 GLN CA C -2.525 -4.799 2.664 1.00 . A A . 5 GLN CA 1 1 29 8094 1 1 5 GLN CB C -4.016 -4.710 2.320 1.00 . A A . 5 GLN CB 1 1 29 8095 1 1 5 GLN CD C -4.142 -6.765 0.849 1.00 . A A . 5 GLN CD 1 1 29 8096 1 1 5 GLN CG C -4.363 -5.266 0.948 1.00 . A A . 5 GLN CG 1 1 29 8097 1 1 5 GLN H H -2.972 -3.621 4.360 1.00 . A A . 5 GLN H 1 1 29 8098 1 1 5 GLN HA H -2.241 -5.838 2.742 1.00 . A A . 5 GLN HA 1 1 29 8099 1 1 5 GLN HB2 H -4.578 -5.261 3.060 1.00 . A A . 5 GLN HB2 1 1 29 8100 1 1 5 GLN HB3 H -4.319 -3.673 2.351 1.00 . A A . 5 GLN HB3 1 1 29 8101 1 1 5 GLN HE21 H -2.330 -6.482 0.073 1.00 . A A . 5 GLN HE21 1 1 29 8102 1 1 5 GLN HE22 H -2.812 -8.128 0.274 1.00 . A A . 5 GLN HE22 1 1 29 8103 1 1 5 GLN HG2 H -5.402 -5.056 0.741 1.00 . A A . 5 GLN HG2 1 1 29 8104 1 1 5 GLN HG3 H -3.744 -4.775 0.213 1.00 . A A . 5 GLN HG3 1 1 29 8105 1 1 5 GLN N N -2.266 -4.165 3.951 1.00 . A A . 5 GLN N 1 1 29 8106 1 1 5 GLN NE2 N -2.977 -7.165 0.348 1.00 . A A . 5 GLN NE2 1 1 29 8107 1 1 5 GLN O O -1.156 -4.815 0.692 1.00 . A A . 5 GLN O 1 1 29 8108 1 1 5 GLN OE1 O -5.010 -7.556 1.219 1.00 . A A . 5 GLN OE1 1 1 29 8109 1 1 6 TRP C C 0.680 -2.517 0.694 1.00 . A A . 6 TRP C 1 1 29 8110 1 1 6 TRP CA C -0.770 -2.044 0.683 1.00 . A A . 6 TRP CA 1 1 29 8111 1 1 6 TRP CB C -0.828 -0.549 1.011 1.00 . A A . 6 TRP CB 1 1 29 8112 1 1 6 TRP CD1 C -0.331 0.613 -1.209 1.00 . A A . 6 TRP CD1 1 1 29 8113 1 1 6 TRP CD2 C 1.228 0.944 0.360 1.00 . A A . 6 TRP CD2 1 1 29 8114 1 1 6 TRP CE2 C 1.612 1.627 -0.808 1.00 . A A . 6 TRP CE2 1 1 29 8115 1 1 6 TRP CE3 C 2.059 1.012 1.483 1.00 . A A . 6 TRP CE3 1 1 29 8116 1 1 6 TRP CG C -0.021 0.299 0.079 1.00 . A A . 6 TRP CG 1 1 29 8117 1 1 6 TRP CH2 C 3.580 2.421 0.222 1.00 . A A . 6 TRP CH2 1 1 29 8118 1 1 6 TRP CZ2 C 2.787 2.368 -0.889 1.00 . A A . 6 TRP CZ2 1 1 29 8119 1 1 6 TRP CZ3 C 3.227 1.752 1.402 1.00 . A A . 6 TRP CZ3 1 1 29 8120 1 1 6 TRP H H -1.999 -2.330 2.383 1.00 . A A . 6 TRP H 1 1 29 8121 1 1 6 TRP HA H -1.187 -2.210 -0.299 1.00 . A A . 6 TRP HA 1 1 29 8122 1 1 6 TRP HB2 H -1.852 -0.216 0.963 1.00 . A A . 6 TRP HB2 1 1 29 8123 1 1 6 TRP HB3 H -0.453 -0.391 2.010 1.00 . A A . 6 TRP HB3 1 1 29 8124 1 1 6 TRP HD1 H -1.218 0.276 -1.719 1.00 . A A . 6 TRP HD1 1 1 29 8125 1 1 6 TRP HE1 H 0.649 1.757 -2.660 1.00 . A A . 6 TRP HE1 1 1 29 8126 1 1 6 TRP HE3 H 1.804 0.499 2.400 1.00 . A A . 6 TRP HE3 1 1 29 8127 1 1 6 TRP HH2 H 4.497 2.994 0.203 1.00 . A A . 6 TRP HH2 1 1 29 8128 1 1 6 TRP HZ2 H 3.076 2.884 -1.793 1.00 . A A . 6 TRP HZ2 1 1 29 8129 1 1 6 TRP HZ3 H 3.884 1.816 2.258 1.00 . A A . 6 TRP HZ3 1 1 29 8130 1 1 6 TRP N N -1.559 -2.808 1.648 1.00 . A A . 6 TRP N 1 1 29 8131 1 1 6 TRP NE1 N 0.646 1.404 -1.748 1.00 . A A . 6 TRP NE1 1 1 29 8132 1 1 6 TRP O O 1.263 -2.793 -0.356 1.00 . A A . 6 TRP O 1 1 29 8133 1 1 7 LEU C C 2.781 -4.514 1.621 1.00 . A A . 7 LEU C 1 1 29 8134 1 1 7 LEU CA C 2.622 -3.061 2.074 1.00 . A A . 7 LEU CA 1 1 29 8135 1 1 7 LEU CB C 3.034 -2.911 3.541 1.00 . A A . 7 LEU CB 1 1 29 8136 1 1 7 LEU CD1 C 3.005 -1.468 5.595 1.00 . A A . 7 LEU CD1 1 1 29 8137 1 1 7 LEU CD2 C 4.205 -0.686 3.542 1.00 . A A . 7 LEU CD2 1 1 29 8138 1 1 7 LEU CG C 3.014 -1.474 4.074 1.00 . A A . 7 LEU CG 1 1 29 8139 1 1 7 LEU H H 0.715 -2.383 2.690 1.00 . A A . 7 LEU H 1 1 29 8140 1 1 7 LEU HA H 3.256 -2.436 1.464 1.00 . A A . 7 LEU HA 1 1 29 8141 1 1 7 LEU HB2 H 2.360 -3.504 4.142 1.00 . A A . 7 LEU HB2 1 1 29 8142 1 1 7 LEU HB3 H 4.030 -3.302 3.658 1.00 . A A . 7 LEU HB3 1 1 29 8143 1 1 7 LEU HD11 H 2.216 -2.112 5.953 1.00 . A A . 7 LEU HD11 1 1 29 8144 1 1 7 LEU HD12 H 2.836 -0.461 5.949 1.00 . A A . 7 LEU HD12 1 1 29 8145 1 1 7 LEU HD13 H 3.956 -1.824 5.963 1.00 . A A . 7 LEU HD13 1 1 29 8146 1 1 7 LEU HD21 H 4.287 0.248 4.079 1.00 . A A . 7 LEU HD21 1 1 29 8147 1 1 7 LEU HD22 H 4.062 -0.482 2.490 1.00 . A A . 7 LEU HD22 1 1 29 8148 1 1 7 LEU HD23 H 5.108 -1.261 3.678 1.00 . A A . 7 LEU HD23 1 1 29 8149 1 1 7 LEU HG H 2.112 -0.985 3.736 1.00 . A A . 7 LEU HG 1 1 29 8150 1 1 7 LEU N N 1.245 -2.613 1.896 1.00 . A A . 7 LEU N 1 1 29 8151 1 1 7 LEU O O 3.810 -4.886 1.054 1.00 . A A . 7 LEU O 1 1 29 8152 1 1 8 ALA C C 1.534 -6.904 -0.034 1.00 . A A . 8 ALA C 1 1 29 8153 1 1 8 ALA CA C 1.756 -6.734 1.474 1.00 . A A . 8 ALA CA 1 1 29 8154 1 1 8 ALA CB C 0.698 -7.502 2.253 1.00 . A A . 8 ALA CB 1 1 29 8155 1 1 8 ALA H H 0.954 -4.962 2.312 1.00 . A A . 8 ALA H 1 1 29 8156 1 1 8 ALA HA H 2.723 -7.142 1.731 1.00 . A A . 8 ALA HA 1 1 29 8157 1 1 8 ALA HB1 H -0.282 -7.133 1.990 1.00 . A A . 8 ALA HB1 1 1 29 8158 1 1 8 ALA HB2 H 0.862 -7.367 3.312 1.00 . A A . 8 ALA HB2 1 1 29 8159 1 1 8 ALA HB3 H 0.765 -8.553 2.010 1.00 . A A . 8 ALA HB3 1 1 29 8160 1 1 8 ALA N N 1.747 -5.325 1.865 1.00 . A A . 8 ALA N 1 1 29 8161 1 1 8 ALA O O 1.849 -7.956 -0.594 1.00 . A A . 8 ALA O 1 1 29 8162 1 1 9 ASP C C 1.965 -5.438 -2.933 1.00 . A A . 9 ASP C 1 1 29 8163 1 1 9 ASP CA C 0.744 -5.908 -2.131 1.00 . A A . 9 ASP CA 1 1 29 8164 1 1 9 ASP CB C -0.474 -5.042 -2.483 1.00 . A A . 9 ASP CB 1 1 29 8165 1 1 9 ASP CG C -1.555 -5.829 -3.198 1.00 . A A . 9 ASP CG 1 1 29 8166 1 1 9 ASP H H 0.772 -5.053 -0.191 1.00 . A A . 9 ASP H 1 1 29 8167 1 1 9 ASP HA H 0.531 -6.932 -2.397 1.00 . A A . 9 ASP HA 1 1 29 8168 1 1 9 ASP HB2 H -0.895 -4.633 -1.578 1.00 . A A . 9 ASP HB2 1 1 29 8169 1 1 9 ASP HB3 H -0.160 -4.232 -3.126 1.00 . A A . 9 ASP HB3 1 1 29 8170 1 1 9 ASP N N 0.997 -5.866 -0.688 1.00 . A A . 9 ASP N 1 1 29 8171 1 1 9 ASP O O 1.853 -5.136 -4.123 1.00 . A A . 9 ASP O 1 1 29 8172 1 1 9 ASP OD1 O -1.407 -6.072 -4.415 1.00 . A A . 9 ASP OD1 1 1 29 8173 1 1 9 ASP OD2 O -2.550 -6.202 -2.542 1.00 . A A . 9 ASP OD2 1 1 29 8174 1 1 10 DAL C C 4.741 -3.513 -2.539 1.00 . A A . 10 DAL C 1 1 29 8175 1 1 10 DAL CA C 4.362 -4.944 -2.931 1.00 . A A . 10 DAL CA 1 1 29 8176 1 1 10 DAL CB C 5.490 -5.896 -2.577 1.00 . A A . 10 DAL CB 1 1 29 8177 1 1 10 DAL H H 3.161 -5.628 -1.333 1.00 . A A . 10 DAL H 1 1 29 8178 1 1 10 DAL HA H 4.209 -4.987 -3.999 1.00 . A A . 10 DAL HA 1 1 29 8179 1 1 10 DAL HB1 H 5.717 -5.802 -1.525 1.00 . A A . 10 DAL HB1 1 1 29 8180 1 1 10 DAL HB2 H 6.365 -5.650 -3.159 1.00 . A A . 10 DAL HB2 1 1 29 8181 1 1 10 DAL HB3 H 5.186 -6.910 -2.791 1.00 . A A . 10 DAL HB3 1 1 29 8182 1 1 10 DAL N N 3.129 -5.377 -2.279 1.00 . A A . 10 DAL N 1 1 29 8183 1 1 10 DAL O O 5.790 -3.012 -2.949 1.00 . A A . 10 DAL O 1 1 29 8184 1 1 11 GLY C C 4.102 -0.509 -2.458 1.00 . A A . 11 GLY C 1 1 29 8185 1 1 11 GLY CA C 4.156 -1.498 -1.314 1.00 . A A . 11 GLY CA 1 1 29 8186 1 1 11 GLY H H 3.069 -3.305 -1.449 1.00 . A A . 11 GLY H 1 1 29 8187 1 1 11 GLY HA2 H 3.423 -1.213 -0.574 1.00 . A A . 11 GLY HA2 1 1 29 8188 1 1 11 GLY HA3 H 5.138 -1.460 -0.867 1.00 . A A . 11 GLY HA3 1 1 29 8189 1 1 11 GLY N N 3.887 -2.859 -1.744 1.00 . A A . 11 GLY N 1 1 29 8190 1 1 11 GLY O O 3.024 -0.050 -2.838 1.00 . A A . 11 GLY O 1 1 29 8191 1 1 12 TRP C C 5.430 0.052 -5.473 1.00 . A A . 12 TRP C 1 1 29 8192 1 1 12 TRP CA C 5.350 0.762 -4.119 1.00 . A A . 12 TRP CA 1 1 29 8193 1 1 12 TRP CB C 6.539 1.701 -3.914 1.00 . A A . 12 TRP CB 1 1 29 8194 1 1 12 TRP CD1 C 6.706 3.053 -1.749 1.00 . A A . 12 TRP CD1 1 1 29 8195 1 1 12 TRP CD2 C 5.218 3.846 -3.224 1.00 . A A . 12 TRP CD2 1 1 29 8196 1 1 12 TRP CE2 C 5.195 4.661 -2.079 1.00 . A A . 12 TRP CE2 1 1 29 8197 1 1 12 TRP CE3 C 4.363 4.155 -4.291 1.00 . A A . 12 TRP CE3 1 1 29 8198 1 1 12 TRP CG C 6.191 2.822 -2.991 1.00 . A A . 12 TRP CG 1 1 29 8199 1 1 12 TRP CH2 C 3.527 6.040 -3.022 1.00 . A A . 12 TRP CH2 1 1 29 8200 1 1 12 TRP CZ2 C 4.351 5.758 -1.966 1.00 . A A . 12 TRP CZ2 1 1 29 8201 1 1 12 TRP CZ3 C 3.530 5.250 -4.179 1.00 . A A . 12 TRP CZ3 1 1 29 8202 1 1 12 TRP H H 6.093 -0.583 -2.663 1.00 . A A . 12 TRP H 1 1 29 8203 1 1 12 TRP HA H 4.444 1.352 -4.101 1.00 . A A . 12 TRP HA 1 1 29 8204 1 1 12 TRP HB2 H 7.361 1.148 -3.482 1.00 . A A . 12 TRP HB2 1 1 29 8205 1 1 12 TRP HB3 H 6.843 2.119 -4.861 1.00 . A A . 12 TRP HB3 1 1 29 8206 1 1 12 TRP HD1 H 7.469 2.447 -1.283 1.00 . A A . 12 TRP HD1 1 1 29 8207 1 1 12 TRP HE1 H 6.314 4.529 -0.308 1.00 . A A . 12 TRP HE1 1 1 29 8208 1 1 12 TRP HE3 H 4.348 3.558 -5.191 1.00 . A A . 12 TRP HE3 1 1 29 8209 1 1 12 TRP HH2 H 2.858 6.886 -2.976 1.00 . A A . 12 TRP HH2 1 1 29 8210 1 1 12 TRP HZ2 H 4.330 6.366 -1.077 1.00 . A A . 12 TRP HZ2 1 1 29 8211 1 1 12 TRP HZ3 H 2.868 5.506 -4.995 1.00 . A A . 12 TRP HZ3 1 1 29 8212 1 1 12 TRP N N 5.269 -0.181 -3.010 1.00 . A A . 12 TRP N 1 1 29 8213 1 1 12 TRP NE1 N 6.112 4.158 -1.193 1.00 . A A . 12 TRP NE1 1 1 29 8214 1 1 12 TRP O O 5.675 0.690 -6.500 1.00 . A A . 12 TRP O 1 1 29 8215 1 1 13 ALA C C 3.830 -1.983 -7.380 1.00 . A A . 13 ALA C 1 1 29 8216 1 1 13 ALA CA C 5.199 -2.040 -6.710 1.00 . A A . 13 ALA CA 1 1 29 8217 1 1 13 ALA CB C 5.605 -3.479 -6.435 1.00 . A A . 13 ALA CB 1 1 29 8218 1 1 13 ALA H H 4.973 -1.714 -4.635 1.00 . A A . 13 ALA H 1 1 29 8219 1 1 13 ALA HA H 5.929 -1.603 -7.373 1.00 . A A . 13 ALA HA 1 1 29 8220 1 1 13 ALA HB1 H 4.767 -4.134 -6.625 1.00 . A A . 13 ALA HB1 1 1 29 8221 1 1 13 ALA HB2 H 5.913 -3.577 -5.405 1.00 . A A . 13 ALA HB2 1 1 29 8222 1 1 13 ALA HB3 H 6.425 -3.747 -7.083 1.00 . A A . 13 ALA HB3 1 1 29 8223 1 1 13 ALA N N 5.188 -1.262 -5.477 1.00 . A A . 13 ALA N 1 1 29 8224 1 1 13 ALA O O 3.728 -2.009 -8.608 1.00 . A A . 13 ALA O 1 1 29 8225 1 1 14 SER C C 1.218 -0.519 -7.885 1.00 . A A . 14 SER C 1 1 29 8226 1 1 14 SER CA C 1.410 -1.792 -7.056 1.00 . A A . 14 SER CA 1 1 29 8227 1 1 14 SER CB C 0.413 -1.821 -5.886 1.00 . A A . 14 SER CB 1 1 29 8228 1 1 14 SER H H 2.934 -1.851 -5.591 1.00 . A A . 14 SER H 1 1 29 8229 1 1 14 SER HA H 1.232 -2.646 -7.690 1.00 . A A . 14 SER HA 1 1 29 8230 1 1 14 SER HB2 H -0.489 -1.303 -6.171 1.00 . A A . 14 SER HB2 1 1 29 8231 1 1 14 SER HB3 H 0.176 -2.847 -5.644 1.00 . A A . 14 SER HB3 1 1 29 8232 1 1 14 SER HG H 1.279 -1.864 -4.121 1.00 . A A . 14 SER HG 1 1 29 8233 1 1 14 SER N N 2.780 -1.882 -6.559 1.00 . A A . 14 SER N 1 1 29 8234 1 1 14 SER O O 0.397 -0.488 -8.804 1.00 . A A . 14 SER O 1 1 29 8235 1 1 14 SER OG O 0.951 -1.194 -4.730 1.00 . A A . 14 SER OG 1 1 29 8236 1 1 15 DAL C C 1.063 2.825 -7.505 1.00 . A A . 15 DAL C 1 1 29 8237 1 1 15 DAL CA C 1.907 1.802 -8.270 1.00 . A A . 15 DAL CA 1 1 29 8238 1 1 15 DAL CB C 3.305 2.343 -8.520 1.00 . A A . 15 DAL CB 1 1 29 8239 1 1 15 DAL H H 2.621 0.438 -6.814 1.00 . A A . 15 DAL H 1 1 29 8240 1 1 15 DAL HA H 1.448 1.618 -9.228 1.00 . A A . 15 DAL HA 1 1 29 8241 1 1 15 DAL HB1 H 3.652 2.002 -9.484 1.00 . A A . 15 DAL HB1 1 1 29 8242 1 1 15 DAL HB2 H 3.973 1.988 -7.750 1.00 . A A . 15 DAL HB2 1 1 29 8243 1 1 15 DAL HB3 H 3.282 3.422 -8.508 1.00 . A A . 15 DAL HB3 1 1 29 8244 1 1 15 DAL N N 1.985 0.527 -7.556 1.00 . A A . 15 DAL N 1 1 29 8245 1 1 15 DAL O O 1.230 4.035 -7.675 1.00 . A A . 15 DAL O 1 1 29 8246 1 1 16 ARG C C -0.017 3.618 -4.573 1.00 . A A . 16 ARG C 1 1 29 8247 1 1 16 ARG CA C -0.713 3.194 -5.867 1.00 . A A . 16 ARG CA 1 1 29 8248 1 1 16 ARG CB C -2.030 2.460 -5.541 1.00 . A A . 16 ARG CB 1 1 29 8249 1 1 16 ARG CD C -3.002 0.421 -4.432 1.00 . A A . 16 ARG CD 1 1 29 8250 1 1 16 ARG CG C -1.918 1.487 -4.373 1.00 . A A . 16 ARG CG 1 1 29 8251 1 1 16 ARG CZ C -3.506 -0.133 -2.071 1.00 . A A . 16 ARG CZ 1 1 29 8252 1 1 16 ARG H H 0.074 1.358 -6.569 1.00 . A A . 16 ARG H 1 1 29 8253 1 1 16 ARG HA H -0.929 4.081 -6.450 1.00 . A A . 16 ARG HA 1 1 29 8254 1 1 16 ARG HB2 H -2.786 3.192 -5.298 1.00 . A A . 16 ARG HB2 1 1 29 8255 1 1 16 ARG HB3 H -2.353 1.897 -6.413 1.00 . A A . 16 ARG HB3 1 1 29 8256 1 1 16 ARG HD2 H -3.964 0.907 -4.493 1.00 . A A . 16 ARG HD2 1 1 29 8257 1 1 16 ARG HD3 H -2.848 -0.178 -5.317 1.00 . A A . 16 ARG HD3 1 1 29 8258 1 1 16 ARG HE H -2.574 -1.339 -3.367 1.00 . A A . 16 ARG HE 1 1 29 8259 1 1 16 ARG HG2 H -0.951 1.005 -4.410 1.00 . A A . 16 ARG HG2 1 1 29 8260 1 1 16 ARG HG3 H -2.015 2.037 -3.448 1.00 . A A . 16 ARG HG3 1 1 29 8261 1 1 16 ARG HH11 H -4.102 1.725 -2.621 1.00 . A A . 16 ARG HH11 1 1 29 8262 1 1 16 ARG HH12 H -4.451 1.290 -0.982 1.00 . A A . 16 ARG HH12 1 1 29 8263 1 1 16 ARG HH21 H -3.035 -1.902 -1.208 1.00 . A A . 16 ARG HH21 1 1 29 8264 1 1 16 ARG HH22 H -3.844 -0.769 -0.179 1.00 . A A . 16 ARG HH22 1 1 29 8265 1 1 16 ARG N N 0.158 2.330 -6.662 1.00 . A A . 16 ARG N 1 1 29 8266 1 1 16 ARG NE N -2.987 -0.456 -3.261 1.00 . A A . 16 ARG NE 1 1 29 8267 1 1 16 ARG NH1 N -4.065 1.059 -1.876 1.00 . A A . 16 ARG NH1 1 1 29 8268 1 1 16 ARG NH2 N -3.458 -1.006 -1.070 1.00 . A A . 16 ARG NH2 1 1 29 8269 1 1 16 ARG O O 0.855 2.906 -4.073 1.00 . A A . 16 ARG O 1 1 29 8270 1 1 17 PRO C C -0.459 4.692 -1.521 1.00 . A A . 17 PRO C 1 1 29 8271 1 1 17 PRO CA C 0.197 5.289 -2.766 1.00 . A A . 17 PRO CA 1 1 29 8272 1 1 17 PRO CB C -0.054 6.802 -2.828 1.00 . A A . 17 PRO CB 1 1 29 8273 1 1 17 PRO CD C -1.401 5.710 -4.518 1.00 . A A . 17 PRO CD 1 1 29 8274 1 1 17 PRO CG C -0.890 7.047 -4.050 1.00 . A A . 17 PRO CG 1 1 29 8275 1 1 17 PRO HA H 1.257 5.100 -2.726 1.00 . A A . 17 PRO HA 1 1 29 8276 1 1 17 PRO HB2 H -0.574 7.114 -1.934 1.00 . A A . 17 PRO HB2 1 1 29 8277 1 1 17 PRO HB3 H 0.895 7.318 -2.891 1.00 . A A . 17 PRO HB3 1 1 29 8278 1 1 17 PRO HD2 H -2.368 5.500 -4.092 1.00 . A A . 17 PRO HD2 1 1 29 8279 1 1 17 PRO HD3 H -1.445 5.683 -5.594 1.00 . A A . 17 PRO HD3 1 1 29 8280 1 1 17 PRO HG2 H -1.719 7.692 -3.800 1.00 . A A . 17 PRO HG2 1 1 29 8281 1 1 17 PRO HG3 H -0.284 7.504 -4.819 1.00 . A A . 17 PRO HG3 1 1 29 8282 1 1 17 PRO N N -0.389 4.784 -4.006 1.00 . A A . 17 PRO N 1 1 29 8283 1 1 17 PRO O O -1.522 4.072 -1.601 1.00 . A A . 17 PRO O 1 1 29 8284 1 1 18 PRO C C -1.673 4.946 1.330 1.00 . A A . 18 PRO C 1 1 29 8285 1 1 18 PRO CA C -0.326 4.348 0.926 1.00 . A A . 18 PRO CA 1 1 29 8286 1 1 18 PRO CB C 0.739 4.760 1.947 1.00 . A A . 18 PRO CB 1 1 29 8287 1 1 18 PRO CD C 1.457 5.587 -0.183 1.00 . A A . 18 PRO CD 1 1 29 8288 1 1 18 PRO CG C 1.529 5.841 1.293 1.00 . A A . 18 PRO CG 1 1 29 8289 1 1 18 PRO HA H -0.405 3.270 0.903 1.00 . A A . 18 PRO HA 1 1 29 8290 1 1 18 PRO HB2 H 0.253 5.121 2.838 1.00 . A A . 18 PRO HB2 1 1 29 8291 1 1 18 PRO HB3 H 1.354 3.912 2.191 1.00 . A A . 18 PRO HB3 1 1 29 8292 1 1 18 PRO HD2 H 1.447 6.521 -0.725 1.00 . A A . 18 PRO HD2 1 1 29 8293 1 1 18 PRO HD3 H 2.286 4.974 -0.502 1.00 . A A . 18 PRO HD3 1 1 29 8294 1 1 18 PRO HG2 H 1.097 6.803 1.528 1.00 . A A . 18 PRO HG2 1 1 29 8295 1 1 18 PRO HG3 H 2.554 5.799 1.630 1.00 . A A . 18 PRO HG3 1 1 29 8296 1 1 18 PRO N N 0.181 4.870 -0.349 1.00 . A A . 18 PRO N 1 1 29 8297 1 1 18 PRO O O -1.945 6.121 1.073 1.00 . A A . 18 PRO O 1 1 29 8298 1 1 19 PRO C C -3.774 5.378 3.741 1.00 . A A . 19 PRO C 1 1 29 8299 1 1 19 PRO CA C -3.842 4.583 2.438 1.00 . A A . 19 PRO CA 1 1 29 8300 1 1 19 PRO CB C -4.612 3.280 2.641 1.00 . A A . 19 PRO CB 1 1 29 8301 1 1 19 PRO CD C -2.273 2.732 2.329 1.00 . A A . 19 PRO CD 1 1 29 8302 1 1 19 PRO CG C -3.598 2.205 2.820 1.00 . A A . 19 PRO CG 1 1 29 8303 1 1 19 PRO HA H -4.336 5.179 1.685 1.00 . A A . 19 PRO HA 1 1 29 8304 1 1 19 PRO HB2 H -5.248 3.366 3.508 1.00 . A A . 19 PRO HB2 1 1 29 8305 1 1 19 PRO HB3 H -5.209 3.093 1.778 1.00 . A A . 19 PRO HB3 1 1 29 8306 1 1 19 PRO HD2 H -1.526 2.661 3.103 1.00 . A A . 19 PRO HD2 1 1 29 8307 1 1 19 PRO HD3 H -1.965 2.180 1.457 1.00 . A A . 19 PRO HD3 1 1 29 8308 1 1 19 PRO HG2 H -3.537 1.936 3.857 1.00 . A A . 19 PRO HG2 1 1 29 8309 1 1 19 PRO HG3 H -3.888 1.342 2.236 1.00 . A A . 19 PRO HG3 1 1 29 8310 1 1 19 PRO N N -2.531 4.139 1.984 1.00 . A A . 19 PRO N 1 1 29 8311 1 1 19 PRO O O -3.046 5.014 4.665 1.00 . A A . 19 PRO O 1 1 29 8312 1 1 20 SER C C -6.010 7.642 5.397 1.00 . A A . 20 SER C 1 1 29 8313 1 1 20 SER CA C -4.572 7.322 4.991 1.00 . A A . 20 SER CA 1 1 29 8314 1 1 20 SER CB C -3.794 8.618 4.739 1.00 . A A . 20 SER CB 1 1 29 8315 1 1 20 SER H H -5.097 6.705 3.033 1.00 . A A . 20 SER H 1 1 29 8316 1 1 20 SER HA H -4.098 6.782 5.798 1.00 . A A . 20 SER HA 1 1 29 8317 1 1 20 SER HB2 H -3.996 9.317 5.537 1.00 . A A . 20 SER HB2 1 1 29 8318 1 1 20 SER HB3 H -2.736 8.400 4.713 1.00 . A A . 20 SER HB3 1 1 29 8319 1 1 20 SER HG H -4.912 9.803 3.649 1.00 . A A . 20 SER HG 1 1 29 8320 1 1 20 SER N N -4.540 6.468 3.804 1.00 . A A . 20 SER N 1 1 29 8321 1 1 20 SER O O -6.353 7.417 6.577 1.00 . A A . 20 SER O 1 1 29 8322 1 1 20 SER OXT O -6.781 8.116 4.534 1.00 . A A . 20 SER OXT 1 1 29 8323 1 1 20 SER OG O -4.168 9.213 3.507 1.00 . A A . 20 SER OG 1 1 30 8324 1 1 1 ASP C C -5.800 -2.493 5.739 1.00 . A A . 1 ASP C 1 1 30 8325 1 1 1 ASP CA C -6.129 -3.861 6.334 1.00 . A A . 1 ASP CA 1 1 30 8326 1 1 1 ASP CB C -6.945 -3.699 7.621 1.00 . A A . 1 ASP CB 1 1 30 8327 1 1 1 ASP CG C -7.806 -4.912 7.918 1.00 . A A . 1 ASP CG 1 1 30 8328 1 1 1 ASP H1 H -4.358 -4.742 5.760 1.00 . A A . 1 ASP H1 1 1 30 8329 1 1 1 ASP H2 H -5.174 -5.545 7.038 1.00 . A A . 1 ASP H2 1 1 30 8330 1 1 1 ASP H3 H -4.343 -4.074 7.339 1.00 . A A . 1 ASP H3 1 1 30 8331 1 1 1 ASP HA H -6.707 -4.426 5.617 1.00 . A A . 1 ASP HA 1 1 30 8332 1 1 1 ASP HB2 H -6.271 -3.548 8.451 1.00 . A A . 1 ASP HB2 1 1 30 8333 1 1 1 ASP HB3 H -7.590 -2.837 7.525 1.00 . A A . 1 ASP HB3 1 1 30 8334 1 1 1 ASP N N -4.890 -4.624 6.646 1.00 . A A . 1 ASP N 1 1 30 8335 1 1 1 ASP O O -5.456 -1.559 6.466 1.00 . A A . 1 ASP O 1 1 30 8336 1 1 1 ASP OD1 O -8.958 -4.955 7.436 1.00 . A A . 1 ASP OD1 1 1 30 8337 1 1 1 ASP OD2 O -7.329 -5.819 8.633 1.00 . A A . 1 ASP OD2 1 1 30 8338 1 1 2 ALA C C -4.132 -0.809 3.725 1.00 . A A . 2 ALA C 1 1 30 8339 1 1 2 ALA CA C -5.624 -1.148 3.689 1.00 . A A . 2 ALA CA 1 1 30 8340 1 1 2 ALA CB C -6.458 0.004 4.241 1.00 . A A . 2 ALA CB 1 1 30 8341 1 1 2 ALA H H -6.185 -3.179 3.897 1.00 . A A . 2 ALA H 1 1 30 8342 1 1 2 ALA HA H -5.912 -1.300 2.659 1.00 . A A . 2 ALA HA 1 1 30 8343 1 1 2 ALA HB1 H -6.386 0.851 3.575 1.00 . A A . 2 ALA HB1 1 1 30 8344 1 1 2 ALA HB2 H -6.091 0.282 5.217 1.00 . A A . 2 ALA HB2 1 1 30 8345 1 1 2 ALA HB3 H -7.490 -0.304 4.319 1.00 . A A . 2 ALA HB3 1 1 30 8346 1 1 2 ALA N N -5.907 -2.391 4.410 1.00 . A A . 2 ALA N 1 1 30 8347 1 1 2 ALA O O -3.429 -0.999 2.732 1.00 . A A . 2 ALA O 1 1 30 8348 1 1 3 TYR C C -1.366 -1.212 5.011 1.00 . A A . 3 TYR C 1 1 30 8349 1 1 3 TYR CA C -2.241 0.040 5.022 1.00 . A A . 3 TYR CA 1 1 30 8350 1 1 3 TYR CB C -2.020 0.843 6.307 1.00 . A A . 3 TYR CB 1 1 30 8351 1 1 3 TYR CD1 C -1.013 3.106 5.774 1.00 . A A . 3 TYR CD1 1 1 30 8352 1 1 3 TYR CD2 C 0.419 1.403 6.640 1.00 . A A . 3 TYR CD2 1 1 30 8353 1 1 3 TYR CE1 C 0.056 3.980 5.723 1.00 . A A . 3 TYR CE1 1 1 30 8354 1 1 3 TYR CE2 C 1.491 2.272 6.587 1.00 . A A . 3 TYR CE2 1 1 30 8355 1 1 3 TYR CG C -0.850 1.801 6.233 1.00 . A A . 3 TYR CG 1 1 30 8356 1 1 3 TYR CZ C 1.304 3.559 6.129 1.00 . A A . 3 TYR CZ 1 1 30 8357 1 1 3 TYR H H -4.263 -0.189 5.627 1.00 . A A . 3 TYR H 1 1 30 8358 1 1 3 TYR HA H -1.966 0.649 4.179 1.00 . A A . 3 TYR HA 1 1 30 8359 1 1 3 TYR HB2 H -2.905 1.424 6.519 1.00 . A A . 3 TYR HB2 1 1 30 8360 1 1 3 TYR HB3 H -1.839 0.160 7.124 1.00 . A A . 3 TYR HB3 1 1 30 8361 1 1 3 TYR HD1 H -1.991 3.436 5.444 1.00 . A A . 3 TYR HD1 1 1 30 8362 1 1 3 TYR HD2 H 0.563 0.394 6.998 1.00 . A A . 3 TYR HD2 1 1 30 8363 1 1 3 TYR HE1 H -0.091 4.989 5.370 1.00 . A A . 3 TYR HE1 1 1 30 8364 1 1 3 TYR HE2 H 2.469 1.942 6.904 1.00 . A A . 3 TYR HE2 1 1 30 8365 1 1 3 TYR HH H 2.403 4.942 6.890 1.00 . A A . 3 TYR HH 1 1 30 8366 1 1 3 TYR N N -3.653 -0.314 4.869 1.00 . A A . 3 TYR N 1 1 30 8367 1 1 3 TYR O O -0.410 -1.297 4.238 1.00 . A A . 3 TYR O 1 1 30 8368 1 1 3 TYR OH O 2.369 4.429 6.079 1.00 . A A . 3 TYR OH 1 1 30 8369 1 1 4 ALA C C -1.112 -4.206 4.588 1.00 . A A . 4 ALA C 1 1 30 8370 1 1 4 ALA CA C -0.966 -3.446 5.906 1.00 . A A . 4 ALA CA 1 1 30 8371 1 1 4 ALA CB C -1.440 -4.301 7.073 1.00 . A A . 4 ALA CB 1 1 30 8372 1 1 4 ALA H H -2.493 -2.076 6.429 1.00 . A A . 4 ALA H 1 1 30 8373 1 1 4 ALA HA H 0.079 -3.209 6.059 1.00 . A A . 4 ALA HA 1 1 30 8374 1 1 4 ALA HB1 H -0.694 -5.049 7.298 1.00 . A A . 4 ALA HB1 1 1 30 8375 1 1 4 ALA HB2 H -2.368 -4.787 6.810 1.00 . A A . 4 ALA HB2 1 1 30 8376 1 1 4 ALA HB3 H -1.595 -3.675 7.939 1.00 . A A . 4 ALA HB3 1 1 30 8377 1 1 4 ALA N N -1.711 -2.192 5.851 1.00 . A A . 4 ALA N 1 1 30 8378 1 1 4 ALA O O -0.178 -4.873 4.141 1.00 . A A . 4 ALA O 1 1 30 8379 1 1 5 GLN C C -1.719 -4.084 1.577 1.00 . A A . 5 GLN C 1 1 30 8380 1 1 5 GLN CA C -2.556 -4.728 2.683 1.00 . A A . 5 GLN CA 1 1 30 8381 1 1 5 GLN CB C -4.049 -4.635 2.346 1.00 . A A . 5 GLN CB 1 1 30 8382 1 1 5 GLN CD C -4.187 -6.714 0.910 1.00 . A A . 5 GLN CD 1 1 30 8383 1 1 5 GLN CG C -4.409 -5.214 0.987 1.00 . A A . 5 GLN CG 1 1 30 8384 1 1 5 GLN H H -2.987 -3.518 4.360 1.00 . A A . 5 GLN H 1 1 30 8385 1 1 5 GLN HA H -2.277 -5.768 2.773 1.00 . A A . 5 GLN HA 1 1 30 8386 1 1 5 GLN HB2 H -4.609 -5.169 3.100 1.00 . A A . 5 GLN HB2 1 1 30 8387 1 1 5 GLN HB3 H -4.344 -3.596 2.360 1.00 . A A . 5 GLN HB3 1 1 30 8388 1 1 5 GLN HE21 H -2.792 -6.469 -0.490 1.00 . A A . 5 GLN HE21 1 1 30 8389 1 1 5 GLN HE22 H -3.109 -8.102 -0.023 1.00 . A A . 5 GLN HE22 1 1 30 8390 1 1 5 GLN HG2 H -5.450 -5.009 0.787 1.00 . A A . 5 GLN HG2 1 1 30 8391 1 1 5 GLN HG3 H -3.798 -4.735 0.238 1.00 . A A . 5 GLN HG3 1 1 30 8392 1 1 5 GLN N N -2.288 -4.078 3.960 1.00 . A A . 5 GLN N 1 1 30 8393 1 1 5 GLN NE2 N -3.270 -7.137 0.045 1.00 . A A . 5 GLN NE2 1 1 30 8394 1 1 5 GLN O O -1.214 -4.774 0.692 1.00 . A A . 5 GLN O 1 1 30 8395 1 1 5 GLN OE1 O -4.833 -7.486 1.619 1.00 . A A . 5 GLN OE1 1 1 30 8396 1 1 6 TRP C C 0.673 -2.480 0.693 1.00 . A A . 6 TRP C 1 1 30 8397 1 1 6 TRP CA C -0.777 -2.010 0.673 1.00 . A A . 6 TRP CA 1 1 30 8398 1 1 6 TRP CB C -0.840 -0.509 0.976 1.00 . A A . 6 TRP CB 1 1 30 8399 1 1 6 TRP CD1 C -0.337 0.630 -1.255 1.00 . A A . 6 TRP CD1 1 1 30 8400 1 1 6 TRP CD2 C 1.223 0.968 0.313 1.00 . A A . 6 TRP CD2 1 1 30 8401 1 1 6 TRP CE2 C 1.611 1.639 -0.860 1.00 . A A . 6 TRP CE2 1 1 30 8402 1 1 6 TRP CE3 C 2.052 1.041 1.436 1.00 . A A . 6 TRP CE3 1 1 30 8403 1 1 6 TRP CG C -0.029 0.326 0.036 1.00 . A A . 6 TRP CG 1 1 30 8404 1 1 6 TRP CH2 C 3.581 2.434 0.166 1.00 . A A . 6 TRP CH2 1 1 30 8405 1 1 6 TRP CZ2 C 2.790 2.374 -0.946 1.00 . A A . 6 TRP CZ2 1 1 30 8406 1 1 6 TRP CZ3 C 3.224 1.776 1.351 1.00 . A A . 6 TRP CZ3 1 1 30 8407 1 1 6 TRP H H -1.988 -2.271 2.389 1.00 . A A . 6 TRP H 1 1 30 8408 1 1 6 TRP HA H -1.192 -2.192 -0.306 1.00 . A A . 6 TRP HA 1 1 30 8409 1 1 6 TRP HB2 H -1.863 -0.179 0.916 1.00 . A A . 6 TRP HB2 1 1 30 8410 1 1 6 TRP HB3 H -0.472 -0.335 1.975 1.00 . A A . 6 TRP HB3 1 1 30 8411 1 1 6 TRP HD1 H -1.225 0.292 -1.763 1.00 . A A . 6 TRP HD1 1 1 30 8412 1 1 6 TRP HE1 H 0.650 1.757 -2.715 1.00 . A A . 6 TRP HE1 1 1 30 8413 1 1 6 TRP HE3 H 1.793 0.537 2.357 1.00 . A A . 6 TRP HE3 1 1 30 8414 1 1 6 TRP HH2 H 4.500 3.003 0.144 1.00 . A A . 6 TRP HH2 1 1 30 8415 1 1 6 TRP HZ2 H 3.081 2.882 -1.853 1.00 . A A . 6 TRP HZ2 1 1 30 8416 1 1 6 TRP HZ3 H 3.879 1.844 2.207 1.00 . A A . 6 TRP HZ3 1 1 30 8417 1 1 6 TRP N N -1.567 -2.757 1.650 1.00 . A A . 6 TRP N 1 1 30 8418 1 1 6 TRP NE1 N 0.645 1.413 -1.800 1.00 . A A . 6 TRP NE1 1 1 30 8419 1 1 6 TRP O O 1.257 -2.774 -0.351 1.00 . A A . 6 TRP O 1 1 30 8420 1 1 7 LEU C C 2.775 -4.459 1.639 1.00 . A A . 7 LEU C 1 1 30 8421 1 1 7 LEU CA C 2.614 -3.003 2.082 1.00 . A A . 7 LEU CA 1 1 30 8422 1 1 7 LEU CB C 3.023 -2.843 3.550 1.00 . A A . 7 LEU CB 1 1 30 8423 1 1 7 LEU CD1 C 2.953 -1.391 5.596 1.00 . A A . 7 LEU CD1 1 1 30 8424 1 1 7 LEU CD2 C 4.195 -0.617 3.566 1.00 . A A . 7 LEU CD2 1 1 30 8425 1 1 7 LEU CG C 2.994 -1.403 4.076 1.00 . A A . 7 LEU CG 1 1 30 8426 1 1 7 LEU H H 0.706 -2.314 2.687 1.00 . A A . 7 LEU H 1 1 30 8427 1 1 7 LEU HA H 3.249 -2.381 1.470 1.00 . A A . 7 LEU HA 1 1 30 8428 1 1 7 LEU HB2 H 2.353 -3.438 4.153 1.00 . A A . 7 LEU HB2 1 1 30 8429 1 1 7 LEU HB3 H 4.023 -3.227 3.669 1.00 . A A . 7 LEU HB3 1 1 30 8430 1 1 7 LEU HD11 H 2.185 -2.068 5.941 1.00 . A A . 7 LEU HD11 1 1 30 8431 1 1 7 LEU HD12 H 2.734 -0.392 5.942 1.00 . A A . 7 LEU HD12 1 1 30 8432 1 1 7 LEU HD13 H 3.911 -1.705 5.985 1.00 . A A . 7 LEU HD13 1 1 30 8433 1 1 7 LEU HD21 H 5.093 -1.202 3.702 1.00 . A A . 7 LEU HD21 1 1 30 8434 1 1 7 LEU HD22 H 4.281 0.308 4.120 1.00 . A A . 7 LEU HD22 1 1 30 8435 1 1 7 LEU HD23 H 4.064 -0.396 2.517 1.00 . A A . 7 LEU HD23 1 1 30 8436 1 1 7 LEU HG H 2.099 -0.916 3.717 1.00 . A A . 7 LEU HG 1 1 30 8437 1 1 7 LEU N N 1.237 -2.557 1.898 1.00 . A A . 7 LEU N 1 1 30 8438 1 1 7 LEU O O 3.803 -4.833 1.072 1.00 . A A . 7 LEU O 1 1 30 8439 1 1 8 ALA C C 1.545 -6.861 -0.001 1.00 . A A . 8 ALA C 1 1 30 8440 1 1 8 ALA CA C 1.751 -6.681 1.508 1.00 . A A . 8 ALA CA 1 1 30 8441 1 1 8 ALA CB C 0.682 -7.442 2.280 1.00 . A A . 8 ALA CB 1 1 30 8442 1 1 8 ALA H H 0.949 -4.904 2.336 1.00 . A A . 8 ALA H 1 1 30 8443 1 1 8 ALA HA H 2.713 -7.091 1.778 1.00 . A A . 8 ALA HA 1 1 30 8444 1 1 8 ALA HB1 H 0.768 -8.497 2.070 1.00 . A A . 8 ALA HB1 1 1 30 8445 1 1 8 ALA HB2 H -0.295 -7.093 1.981 1.00 . A A . 8 ALA HB2 1 1 30 8446 1 1 8 ALA HB3 H 0.815 -7.274 3.339 1.00 . A A . 8 ALA HB3 1 1 30 8447 1 1 8 ALA N N 1.742 -5.269 1.890 1.00 . A A . 8 ALA N 1 1 30 8448 1 1 8 ALA O O 1.895 -7.903 -0.558 1.00 . A A . 8 ALA O 1 1 30 8449 1 1 9 ASP C C 1.969 -5.433 -2.901 1.00 . A A . 9 ASP C 1 1 30 8450 1 1 9 ASP CA C 0.739 -5.888 -2.103 1.00 . A A . 9 ASP CA 1 1 30 8451 1 1 9 ASP CB C -0.467 -5.011 -2.466 1.00 . A A . 9 ASP CB 1 1 30 8452 1 1 9 ASP CG C -1.444 -5.720 -3.384 1.00 . A A . 9 ASP CG 1 1 30 8453 1 1 9 ASP H H 0.728 -5.033 -0.164 1.00 . A A . 9 ASP H 1 1 30 8454 1 1 9 ASP HA H 0.517 -6.911 -2.365 1.00 . A A . 9 ASP HA 1 1 30 8455 1 1 9 ASP HB2 H -0.989 -4.734 -1.564 1.00 . A A . 9 ASP HB2 1 1 30 8456 1 1 9 ASP HB3 H -0.119 -4.117 -2.964 1.00 . A A . 9 ASP HB3 1 1 30 8457 1 1 9 ASP N N 0.982 -5.839 -0.659 1.00 . A A . 9 ASP N 1 1 30 8458 1 1 9 ASP O O 1.868 -5.146 -4.096 1.00 . A A . 9 ASP O 1 1 30 8459 1 1 9 ASP OD1 O -2.335 -6.428 -2.869 1.00 . A A . 9 ASP OD1 1 1 30 8460 1 1 9 ASP OD2 O -1.319 -5.566 -4.617 1.00 . A A . 9 ASP OD2 1 1 30 8461 1 1 10 DAL C C 4.749 -3.513 -2.508 1.00 . A A . 10 DAL C 1 1 30 8462 1 1 10 DAL CA C 4.368 -4.948 -2.885 1.00 . A A . 10 DAL CA 1 1 30 8463 1 1 10 DAL CB C 5.491 -5.900 -2.512 1.00 . A A . 10 DAL CB 1 1 30 8464 1 1 10 DAL H H 3.152 -5.606 -1.289 1.00 . A A . 10 DAL H 1 1 30 8465 1 1 10 DAL HA H 4.223 -5.003 -3.954 1.00 . A A . 10 DAL HA 1 1 30 8466 1 1 10 DAL HB1 H 5.197 -6.912 -2.744 1.00 . A A . 10 DAL HB1 1 1 30 8467 1 1 10 DAL HB2 H 5.692 -5.816 -1.454 1.00 . A A . 10 DAL HB2 1 1 30 8468 1 1 10 DAL HB3 H 6.380 -5.644 -3.069 1.00 . A A . 10 DAL HB3 1 1 30 8469 1 1 10 DAL N N 3.128 -5.368 -2.237 1.00 . A A . 10 DAL N 1 1 30 8470 1 1 10 DAL O O 5.793 -3.015 -2.934 1.00 . A A . 10 DAL O 1 1 30 8471 1 1 11 GLY C C 4.116 -0.513 -2.452 1.00 . A A . 11 GLY C 1 1 30 8472 1 1 11 GLY CA C 4.173 -1.488 -1.296 1.00 . A A . 11 GLY CA 1 1 30 8473 1 1 11 GLY H H 3.087 -3.296 -1.403 1.00 . A A . 11 GLY H 1 1 30 8474 1 1 11 GLY HA2 H 3.442 -1.193 -0.557 1.00 . A A . 11 GLY HA2 1 1 30 8475 1 1 11 GLY HA3 H 5.157 -1.446 -0.853 1.00 . A A . 11 GLY HA3 1 1 30 8476 1 1 11 GLY N N 3.902 -2.853 -1.711 1.00 . A A . 11 GLY N 1 1 30 8477 1 1 11 GLY O O 3.037 -0.056 -2.832 1.00 . A A . 11 GLY O 1 1 30 8478 1 1 12 TRP C C 5.426 0.001 -5.482 1.00 . A A . 12 TRP C 1 1 30 8479 1 1 12 TRP CA C 5.356 0.730 -4.138 1.00 . A A . 12 TRP CA 1 1 30 8480 1 1 12 TRP CB C 6.546 1.670 -3.952 1.00 . A A . 12 TRP CB 1 1 30 8481 1 1 12 TRP CD1 C 6.721 3.036 -1.798 1.00 . A A . 12 TRP CD1 1 1 30 8482 1 1 12 TRP CD2 C 5.240 3.831 -3.278 1.00 . A A . 12 TRP CD2 1 1 30 8483 1 1 12 TRP CE2 C 5.223 4.653 -2.138 1.00 . A A . 12 TRP CE2 1 1 30 8484 1 1 12 TRP CE3 C 4.387 4.141 -4.347 1.00 . A A . 12 TRP CE3 1 1 30 8485 1 1 12 TRP CG C 6.205 2.801 -3.038 1.00 . A A . 12 TRP CG 1 1 30 8486 1 1 12 TRP CH2 C 3.566 6.039 -3.089 1.00 . A A . 12 TRP CH2 1 1 30 8487 1 1 12 TRP CZ2 C 4.388 5.757 -2.031 1.00 . A A . 12 TRP CZ2 1 1 30 8488 1 1 12 TRP CZ3 C 3.563 5.243 -4.241 1.00 . A A . 12 TRP CZ3 1 1 30 8489 1 1 12 TRP H H 6.105 -0.598 -2.669 1.00 . A A . 12 TRP H 1 1 30 8490 1 1 12 TRP HA H 4.450 1.321 -4.124 1.00 . A A . 12 TRP HA 1 1 30 8491 1 1 12 TRP HB2 H 7.371 1.122 -3.521 1.00 . A A . 12 TRP HB2 1 1 30 8492 1 1 12 TRP HB3 H 6.843 2.078 -4.906 1.00 . A A . 12 TRP HB3 1 1 30 8493 1 1 12 TRP HD1 H 7.479 2.426 -1.328 1.00 . A A . 12 TRP HD1 1 1 30 8494 1 1 12 TRP HE1 H 6.339 4.522 -0.365 1.00 . A A . 12 TRP HE1 1 1 30 8495 1 1 12 TRP HE3 H 4.367 3.539 -5.244 1.00 . A A . 12 TRP HE3 1 1 30 8496 1 1 12 TRP HH2 H 2.904 6.892 -3.048 1.00 . A A . 12 TRP HH2 1 1 30 8497 1 1 12 TRP HZ2 H 4.372 6.370 -1.146 1.00 . A A . 12 TRP HZ2 1 1 30 8498 1 1 12 TRP HZ3 H 2.904 5.500 -5.059 1.00 . A A . 12 TRP HZ3 1 1 30 8499 1 1 12 TRP N N 5.279 -0.198 -3.016 1.00 . A A . 12 TRP N 1 1 30 8500 1 1 12 TRP NE1 N 6.135 4.148 -1.248 1.00 . A A . 12 TRP NE1 1 1 30 8501 1 1 12 TRP O O 5.672 0.622 -6.518 1.00 . A A . 12 TRP O 1 1 30 8502 1 1 13 ALA C C 3.798 -2.050 -7.348 1.00 . A A . 13 ALA C 1 1 30 8503 1 1 13 ALA CA C 5.172 -2.107 -6.688 1.00 . A A . 13 ALA CA 1 1 30 8504 1 1 13 ALA CB C 5.572 -3.545 -6.396 1.00 . A A . 13 ALA CB 1 1 30 8505 1 1 13 ALA H H 4.957 -1.749 -4.618 1.00 . A A . 13 ALA H 1 1 30 8506 1 1 13 ALA HA H 5.899 -1.683 -7.362 1.00 . A A . 13 ALA HA 1 1 30 8507 1 1 13 ALA HB1 H 6.322 -3.856 -7.107 1.00 . A A . 13 ALA HB1 1 1 30 8508 1 1 13 ALA HB2 H 4.707 -4.185 -6.481 1.00 . A A . 13 ALA HB2 1 1 30 8509 1 1 13 ALA HB3 H 5.974 -3.612 -5.396 1.00 . A A . 13 ALA HB3 1 1 30 8510 1 1 13 ALA N N 5.173 -1.312 -5.466 1.00 . A A . 13 ALA N 1 1 30 8511 1 1 13 ALA O O 3.686 -2.085 -8.575 1.00 . A A . 13 ALA O 1 1 30 8512 1 1 14 SER C C 1.206 -0.585 -7.865 1.00 . A A . 14 SER C 1 1 30 8513 1 1 14 SER CA C 1.383 -1.839 -7.005 1.00 . A A . 14 SER CA 1 1 30 8514 1 1 14 SER CB C 0.398 -1.824 -5.825 1.00 . A A . 14 SER CB 1 1 30 8515 1 1 14 SER H H 2.918 -1.894 -5.553 1.00 . A A . 14 SER H 1 1 30 8516 1 1 14 SER HA H 1.187 -2.705 -7.616 1.00 . A A . 14 SER HA 1 1 30 8517 1 1 14 SER HB2 H -0.495 -1.290 -6.111 1.00 . A A . 14 SER HB2 1 1 30 8518 1 1 14 SER HB3 H 0.138 -2.840 -5.563 1.00 . A A . 14 SER HB3 1 1 30 8519 1 1 14 SER HG H 1.277 -1.857 -4.067 1.00 . A A . 14 SER HG 1 1 30 8520 1 1 14 SER N N 2.756 -1.934 -6.518 1.00 . A A . 14 SER N 1 1 30 8521 1 1 14 SER O O 0.400 -0.571 -8.797 1.00 . A A . 14 SER O 1 1 30 8522 1 1 14 SER OG O 0.961 -1.190 -4.685 1.00 . A A . 14 SER OG 1 1 30 8523 1 1 15 DAL C C 1.090 2.777 -7.555 1.00 . A A . 15 DAL C 1 1 30 8524 1 1 15 DAL CA C 1.916 1.722 -8.293 1.00 . A A . 15 DAL CA 1 1 30 8525 1 1 15 DAL CB C 3.323 2.234 -8.556 1.00 . A A . 15 DAL CB 1 1 30 8526 1 1 15 DAL H H 2.599 0.387 -6.796 1.00 . A A . 15 DAL H 1 1 30 8527 1 1 15 DAL HA H 1.453 1.523 -9.246 1.00 . A A . 15 DAL HA 1 1 30 8528 1 1 15 DAL HB1 H 4.029 1.660 -7.976 1.00 . A A . 15 DAL HB1 1 1 30 8529 1 1 15 DAL HB2 H 3.387 3.275 -8.276 1.00 . A A . 15 DAL HB2 1 1 30 8530 1 1 15 DAL HB3 H 3.550 2.129 -9.606 1.00 . A A . 15 DAL HB3 1 1 30 8531 1 1 15 DAL N N 1.974 0.464 -7.548 1.00 . A A . 15 DAL N 1 1 30 8532 1 1 15 DAL O O 1.278 3.980 -7.756 1.00 . A A . 15 DAL O 1 1 30 8533 1 1 16 ARG C C 0.006 3.640 -4.632 1.00 . A A . 16 ARG C 1 1 30 8534 1 1 16 ARG CA C -0.681 3.222 -5.934 1.00 . A A . 16 ARG CA 1 1 30 8535 1 1 16 ARG CB C -2.028 2.538 -5.627 1.00 . A A . 16 ARG CB 1 1 30 8536 1 1 16 ARG CD C -3.181 0.651 -4.426 1.00 . A A . 16 ARG CD 1 1 30 8537 1 1 16 ARG CG C -1.978 1.585 -4.439 1.00 . A A . 16 ARG CG 1 1 30 8538 1 1 16 ARG CZ C -2.881 -1.254 -2.870 1.00 . A A . 16 ARG CZ 1 1 30 8539 1 1 16 ARG H H 0.073 1.351 -6.587 1.00 . A A . 16 ARG H 1 1 30 8540 1 1 16 ARG HA H -0.855 4.108 -6.531 1.00 . A A . 16 ARG HA 1 1 30 8541 1 1 16 ARG HB2 H -2.763 3.299 -5.418 1.00 . A A . 16 ARG HB2 1 1 30 8542 1 1 16 ARG HB3 H -2.348 1.969 -6.496 1.00 . A A . 16 ARG HB3 1 1 30 8543 1 1 16 ARG HD2 H -4.071 1.230 -4.626 1.00 . A A . 16 ARG HD2 1 1 30 8544 1 1 16 ARG HD3 H -3.056 -0.090 -5.202 1.00 . A A . 16 ARG HD3 1 1 30 8545 1 1 16 ARG HE H -3.824 0.455 -2.435 1.00 . A A . 16 ARG HE 1 1 30 8546 1 1 16 ARG HG2 H -1.073 0.994 -4.498 1.00 . A A . 16 ARG HG2 1 1 30 8547 1 1 16 ARG HG3 H -1.973 2.164 -3.527 1.00 . A A . 16 ARG HG3 1 1 30 8548 1 1 16 ARG HH11 H -2.047 -1.553 -4.692 1.00 . A A . 16 ARG HH11 1 1 30 8549 1 1 16 ARG HH12 H -1.872 -2.862 -3.575 1.00 . A A . 16 ARG HH12 1 1 30 8550 1 1 16 ARG HH21 H -3.587 -1.275 -0.973 1.00 . A A . 16 ARG HH21 1 1 30 8551 1 1 16 ARG HH22 H -2.747 -2.707 -1.467 1.00 . A A . 16 ARG HH22 1 1 30 8552 1 1 16 ARG N N 0.175 2.320 -6.703 1.00 . A A . 16 ARG N 1 1 30 8553 1 1 16 ARG NE N -3.341 -0.027 -3.139 1.00 . A A . 16 ARG NE 1 1 30 8554 1 1 16 ARG NH1 N -2.211 -1.946 -3.789 1.00 . A A . 16 ARG NH1 1 1 30 8555 1 1 16 ARG NH2 N -3.088 -1.789 -1.672 1.00 . A A . 16 ARG NH2 1 1 30 8556 1 1 16 ARG O O 0.859 2.917 -4.118 1.00 . A A . 16 ARG O 1 1 30 8557 1 1 17 PRO C C -0.440 4.732 -1.592 1.00 . A A . 17 PRO C 1 1 30 8558 1 1 17 PRO CA C 0.229 5.320 -2.834 1.00 . A A . 17 PRO CA 1 1 30 8559 1 1 17 PRO CB C -0.012 6.836 -2.899 1.00 . A A . 17 PRO CB 1 1 30 8560 1 1 17 PRO CD C -1.340 5.757 -4.611 1.00 . A A . 17 PRO CD 1 1 30 8561 1 1 17 PRO CG C -0.815 7.088 -4.142 1.00 . A A . 17 PRO CG 1 1 30 8562 1 1 17 PRO HA H 1.287 5.125 -2.786 1.00 . A A . 17 PRO HA 1 1 30 8563 1 1 17 PRO HB2 H -0.551 7.150 -2.018 1.00 . A A . 17 PRO HB2 1 1 30 8564 1 1 17 PRO HB3 H 0.942 7.345 -2.938 1.00 . A A . 17 PRO HB3 1 1 30 8565 1 1 17 PRO HD2 H -2.318 5.565 -4.200 1.00 . A A . 17 PRO HD2 1 1 30 8566 1 1 17 PRO HD3 H -1.368 5.725 -5.687 1.00 . A A . 17 PRO HD3 1 1 30 8567 1 1 17 PRO HG2 H -1.637 7.750 -3.915 1.00 . A A . 17 PRO HG2 1 1 30 8568 1 1 17 PRO HG3 H -0.183 7.527 -4.900 1.00 . A A . 17 PRO HG3 1 1 30 8569 1 1 17 PRO N N -0.352 4.817 -4.078 1.00 . A A . 17 PRO N 1 1 30 8570 1 1 17 PRO O O -1.509 4.124 -1.676 1.00 . A A . 17 PRO O 1 1 30 8571 1 1 18 PRO C C -1.667 5.000 1.251 1.00 . A A . 18 PRO C 1 1 30 8572 1 1 18 PRO CA C -0.323 4.389 0.857 1.00 . A A . 18 PRO CA 1 1 30 8573 1 1 18 PRO CB C 0.738 4.797 1.885 1.00 . A A . 18 PRO CB 1 1 30 8574 1 1 18 PRO CD C 1.479 5.607 -0.246 1.00 . A A . 18 PRO CD 1 1 30 8575 1 1 18 PRO CG C 1.549 5.863 1.230 1.00 . A A . 18 PRO CG 1 1 30 8576 1 1 18 PRO HA H -0.410 3.312 0.837 1.00 . A A . 18 PRO HA 1 1 30 8577 1 1 18 PRO HB2 H 0.248 5.172 2.768 1.00 . A A . 18 PRO HB2 1 1 30 8578 1 1 18 PRO HB3 H 1.340 3.944 2.143 1.00 . A A . 18 PRO HB3 1 1 30 8579 1 1 18 PRO HD2 H 1.481 6.540 -0.790 1.00 . A A . 18 PRO HD2 1 1 30 8580 1 1 18 PRO HD3 H 2.302 4.985 -0.561 1.00 . A A . 18 PRO HD3 1 1 30 8581 1 1 18 PRO HG2 H 1.132 6.832 1.461 1.00 . A A . 18 PRO HG2 1 1 30 8582 1 1 18 PRO HG3 H 2.572 5.804 1.571 1.00 . A A . 18 PRO HG3 1 1 30 8583 1 1 18 PRO N N 0.196 4.904 -0.417 1.00 . A A . 18 PRO N 1 1 30 8584 1 1 18 PRO O O -1.929 6.175 0.985 1.00 . A A . 18 PRO O 1 1 30 8585 1 1 19 PRO C C -3.776 5.441 3.666 1.00 . A A . 19 PRO C 1 1 30 8586 1 1 19 PRO CA C -3.843 4.657 2.356 1.00 . A A . 19 PRO CA 1 1 30 8587 1 1 19 PRO CB C -4.625 3.359 2.543 1.00 . A A . 19 PRO CB 1 1 30 8588 1 1 19 PRO CD C -2.286 2.796 2.264 1.00 . A A . 19 PRO CD 1 1 30 8589 1 1 19 PRO CG C -3.619 2.279 2.743 1.00 . A A . 19 PRO CG 1 1 30 8590 1 1 19 PRO HA H -4.326 5.263 1.603 1.00 . A A . 19 PRO HA 1 1 30 8591 1 1 19 PRO HB2 H -5.278 3.448 3.398 1.00 . A A . 19 PRO HB2 1 1 30 8592 1 1 19 PRO HB3 H -5.205 3.174 1.668 1.00 . A A . 19 PRO HB3 1 1 30 8593 1 1 19 PRO HD2 H -1.547 2.727 3.047 1.00 . A A . 19 PRO HD2 1 1 30 8594 1 1 19 PRO HD3 H -1.970 2.237 1.399 1.00 . A A . 19 PRO HD3 1 1 30 8595 1 1 19 PRO HG2 H -3.572 2.017 3.784 1.00 . A A . 19 PRO HG2 1 1 30 8596 1 1 19 PRO HG3 H -3.906 1.414 2.162 1.00 . A A . 19 PRO HG3 1 1 30 8597 1 1 19 PRO N N -2.533 4.203 1.908 1.00 . A A . 19 PRO N 1 1 30 8598 1 1 19 PRO O O -2.883 5.224 4.486 1.00 . A A . 19 PRO O 1 1 30 8599 1 1 20 SER C C -5.457 6.417 6.206 1.00 . A A . 20 SER C 1 1 30 8600 1 1 20 SER CA C -4.782 7.173 5.062 1.00 . A A . 20 SER CA 1 1 30 8601 1 1 20 SER CB C -5.519 8.490 4.788 1.00 . A A . 20 SER CB 1 1 30 8602 1 1 20 SER H H -5.413 6.480 3.161 1.00 . A A . 20 SER H 1 1 30 8603 1 1 20 SER HA H -3.765 7.398 5.351 1.00 . A A . 20 SER HA 1 1 30 8604 1 1 20 SER HB2 H -5.732 8.982 5.725 1.00 . A A . 20 SER HB2 1 1 30 8605 1 1 20 SER HB3 H -4.895 9.128 4.181 1.00 . A A . 20 SER HB3 1 1 30 8606 1 1 20 SER HG H -7.447 8.137 4.744 1.00 . A A . 20 SER HG 1 1 30 8607 1 1 20 SER N N -4.728 6.354 3.853 1.00 . A A . 20 SER N 1 1 30 8608 1 1 20 SER O O -6.595 5.936 6.012 1.00 . A A . 20 SER O 1 1 30 8609 1 1 20 SER OXT O -4.840 6.309 7.286 1.00 . A A . 20 SER OXT 1 1 30 8610 1 1 20 SER OG O -6.742 8.264 4.105 1.00 . A A . 20 SER OG 1 1 stop_ save_
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