NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
377433 | 1g92 | 4921 | cing | 4-filtered-FRED | STAR | entry | full | 264 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1g92 # This FRED archive file contains, for PDB entry <1g92>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1g92 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1g92 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2740.33 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 $PONERATOXIN A . 1 1 stop_ save_ save_PONERATOXIN _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name PONERATOXIN _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code FLPLLILGSLLMTPPVIQAIHDAQR _Entity.Number_of_monomers 25 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 PHE . 1 1 2 LEU . 1 1 3 PRO . 1 1 4 LEU . 1 1 5 LEU . 1 1 6 ILE . 1 1 7 LEU . 1 1 8 GLY . 1 1 9 SER . 1 1 10 LEU . 1 1 11 LEU . 1 1 12 MET . 1 1 13 THR . 1 1 14 PRO . 1 1 15 PRO . 1 1 16 VAL . 1 1 17 ILE . 1 1 18 GLN . 1 1 19 ALA . 1 1 20 ILE . 1 1 21 HIS . 1 1 22 ASP . 1 1 23 ALA . 1 1 24 GLN . 1 1 25 ARG . 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 PHE 1 1 1 1 LEU 2 2 1 1 PRO 3 3 1 1 LEU 4 4 1 1 LEU 5 5 1 1 ILE 6 6 1 1 LEU 7 7 1 1 GLY 8 8 1 1 SER 9 9 1 1 LEU 10 10 1 1 LEU 11 11 1 1 MET 12 12 1 1 THR 13 13 1 1 PRO 14 14 1 1 PRO 15 15 1 1 VAL 16 16 1 1 ILE 17 17 1 1 GLN 18 18 1 1 ALA 19 19 1 1 ILE 20 20 1 1 HIS 21 21 1 1 ASP 22 22 1 1 ALA 23 23 1 1 GLN 24 24 1 1 ARG 25 25 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 PHE HA . 1 . HA 1 1 1 1 2 1 1 2 LEU H . 2 . HN 1 1 2 1 1 1 1 1 PHE HA . 1 . HA 1 1 2 1 2 1 1 2 LEU QB . 2 . HB* 1 1 3 1 1 1 1 1 PHE HA . 1 . HA 1 1 3 1 2 1 1 3 PRO HD2 . 3 . HD2 1 1 4 1 1 1 1 1 PHE HA . 1 . HA 1 1 4 1 2 1 1 3 PRO QG . 3 . HG* 1 1 5 1 1 1 1 1 PHE HA . 1 . HA 1 1 5 1 2 1 1 5 LEU HG . 5 . HG 1 1 6 1 1 1 1 1 PHE QB . 1 . HB* 1 1 6 1 2 1 1 2 LEU H . 2 . HN 1 1 7 1 1 1 1 1 PHE QB . 1 . HB* 1 1 7 1 2 1 1 3 PRO QG . 3 . HG* 1 1 8 1 1 1 1 1 PHE QB . 1 . HB* 1 1 8 1 2 1 1 4 LEU H . 4 . HN 1 1 9 1 1 1 1 1 PHE QB . 1 . HB* 1 1 9 1 2 1 1 5 LEU MD1 . 5 . HD1* 1 1 10 1 1 1 1 1 PHE QB . 1 . HB* 1 1 10 1 2 1 1 5 LEU HG . 5 . HG 1 1 11 1 1 1 1 1 PHE QD . 1 . HD* 1 1 11 1 2 1 1 2 LEU H . 2 . HN 1 1 12 1 1 1 1 1 PHE QD . 1 . HD* 1 1 12 1 2 1 1 3 PRO HA . 3 . HA 1 1 13 1 1 1 1 1 PHE QD . 1 . HD* 1 1 13 1 2 1 1 3 PRO HD2 . 3 . HD2 1 1 14 1 1 1 1 1 PHE QD . 1 . HD* 1 1 14 1 2 1 1 3 PRO HD3 . 3 . HD1 1 1 15 1 1 1 1 1 PHE QD . 1 . HD* 1 1 15 1 2 1 1 3 PRO QG . 3 . HG* 1 1 16 1 1 1 1 1 PHE QD . 1 . HD* 1 1 16 1 2 1 1 4 LEU H . 4 . HN 1 1 17 1 1 1 1 1 PHE QD . 1 . HD* 1 1 17 1 2 1 1 5 LEU MD1 . 5 . HD1* 1 1 18 1 1 1 1 1 PHE QD . 1 . HD* 1 1 18 1 2 1 1 5 LEU HG . 5 . HG 1 1 19 1 1 1 1 1 PHE QE . 1 . HE* 1 1 19 1 2 1 1 3 PRO HA . 3 . HA 1 1 20 1 1 1 1 1 PHE QE . 1 . HE* 1 1 20 1 2 1 1 3 PRO HB2 . 3 . HB2 1 1 21 1 1 1 1 1 PHE QE . 1 . HE* 1 1 21 1 2 1 1 3 PRO HD2 . 3 . HD2 1 1 22 1 1 1 1 1 PHE QE . 1 . HE* 1 1 22 1 2 1 1 3 PRO HD3 . 3 . HD1 1 1 23 1 1 1 1 1 PHE QE . 1 . HE* 1 1 23 1 2 1 1 3 PRO QG . 3 . HG* 1 1 24 1 1 1 1 1 PHE QE . 1 . HE* 1 1 24 1 2 1 1 5 LEU QB . 5 . HB2 1 1 25 1 1 1 1 2 LEU H . 2 . HN 1 1 25 1 2 1 1 2 LEU HA . 2 . HA 1 1 26 1 1 1 1 2 LEU H . 2 . HN 1 1 26 1 2 1 1 3 PRO HD2 . 3 . HD2 1 1 27 1 1 1 1 2 LEU H . 2 . HN 1 1 27 1 2 1 1 3 PRO HD3 . 3 . HD1 1 1 28 1 1 1 1 2 LEU H . 2 . HN 1 1 28 1 2 1 1 5 LEU QB . 5 . HB2 1 1 29 1 1 1 1 2 LEU HA . 2 . HA 1 1 29 1 2 1 1 3 PRO HD2 . 3 . HD2 1 1 30 1 1 1 1 2 LEU HA . 2 . HA 1 1 30 1 2 1 1 3 PRO HD3 . 3 . HD1 1 1 31 1 1 1 1 2 LEU HA . 2 . HA 1 1 31 1 2 1 1 4 LEU H . 4 . HN 1 1 32 1 1 1 1 2 LEU HA . 2 . HA 1 1 32 1 2 1 1 5 LEU QB . 5 . HB1 1 1 33 1 1 1 1 2 LEU HA . 2 . HA 1 1 33 1 2 1 1 6 ILE MD . 6 . HD1* 1 1 34 1 1 1 1 2 LEU QB . 2 . HB* 1 1 34 1 2 1 1 4 LEU H . 4 . HN 1 1 35 1 1 1 1 2 LEU QB . 2 . HB* 1 1 35 1 2 1 1 5 LEU H . 5 . HN 1 1 36 1 1 1 1 2 LEU MD2 . 2 . HD2* 1 1 36 1 2 1 1 3 PRO HB3 . 3 . HB1 1 1 37 1 1 1 1 3 PRO HA . 3 . HA 1 1 37 1 2 1 1 6 ILE H . 6 . HN 1 1 38 1 1 1 1 3 PRO HA . 3 . HA 1 1 38 1 2 1 1 6 ILE MD . 6 . HD1* 1 1 39 1 1 1 1 3 PRO HA . 3 . HA 1 1 39 1 2 1 1 6 ILE HG12 . 6 . HG12 1 1 40 1 1 1 1 3 PRO HA . 3 . HA 1 1 40 1 2 1 1 6 ILE MG . 6 . HG2* 1 1 41 1 1 1 1 3 PRO HB2 . 3 . HB2 1 1 41 1 2 1 1 4 LEU MD2 . 4 . HD2* 1 1 42 1 1 1 1 3 PRO HB2 . 3 . HB2 1 1 42 1 2 1 1 6 ILE MD . 6 . HD1* 1 1 43 1 1 1 1 3 PRO HB3 . 3 . HB1 1 1 43 1 2 1 1 6 ILE MD . 6 . HD1* 1 1 44 1 1 1 1 3 PRO HD2 . 3 . HD2 1 1 44 1 2 1 1 6 ILE MD . 6 . HD1* 1 1 45 1 1 1 1 3 PRO HD3 . 3 . HD1 1 1 45 1 2 1 1 6 ILE H . 6 . HN 1 1 46 1 1 1 1 3 PRO HD3 . 3 . HD1 1 1 46 1 2 1 1 6 ILE MD . 6 . HD1* 1 1 47 1 1 1 1 3 PRO HD3 . 3 . HD1 1 1 47 1 2 1 1 6 ILE MG . 6 . HG2* 1 1 48 1 1 1 1 5 LEU H . 5 . HN 1 1 48 1 2 1 1 5 LEU MD1 . 5 . HD1* 1 1 49 1 1 1 1 5 LEU H . 5 . HN 1 1 49 1 2 1 1 5 LEU MD2 . 5 . HD2* 1 1 50 1 1 1 1 5 LEU H . 5 . HN 1 1 50 1 2 1 1 5 LEU HG . 5 . HG 1 1 51 1 1 1 1 5 LEU H . 5 . HN 1 1 51 1 2 1 1 6 ILE H . 6 . HN 1 1 52 1 1 1 1 5 LEU H . 5 . HN 1 1 52 1 2 1 1 6 ILE MD . 6 . HD1* 1 1 53 1 1 1 1 5 LEU H . 5 . HN 1 1 53 1 2 1 1 6 ILE HG12 . 6 . HG12 1 1 54 1 1 1 1 5 LEU H . 5 . HN 1 1 54 1 2 1 1 8 GLY H . 8 . HN 1 1 55 1 1 1 1 5 LEU HA . 5 . HA 1 1 55 1 2 1 1 5 LEU MD1 . 5 . HD1* 1 1 56 1 1 1 1 5 LEU HA . 5 . HA 1 1 56 1 2 1 1 6 ILE H . 6 . HN 1 1 57 1 1 1 1 5 LEU QB . 5 . HB2 1 1 57 1 2 1 1 6 ILE H . 6 . HN 1 1 58 1 1 1 1 6 ILE H . 6 . HN 1 1 58 1 2 1 1 6 ILE HG12 . 6 . HG12 1 1 59 1 1 1 1 6 ILE H . 6 . HN 1 1 59 1 2 1 1 6 ILE HG13 . 6 . HG11 1 1 60 1 1 1 1 6 ILE H . 6 . HN 1 1 60 1 2 1 1 7 LEU H . 7 . HN 1 1 61 1 1 1 1 6 ILE H . 6 . HN 1 1 61 1 2 1 1 7 LEU QB . 7 . HB* 1 1 62 1 1 1 1 6 ILE HA . 6 . HA 1 1 62 1 2 1 1 7 LEU H . 7 . HN 1 1 63 1 1 1 1 6 ILE HA . 6 . HA 1 1 63 1 2 1 1 8 GLY H . 8 . HN 1 1 64 1 1 1 1 6 ILE HA . 6 . HA 1 1 64 1 2 1 1 9 SER H . 9 . HN 1 1 65 1 1 1 1 6 ILE HA . 6 . HA 1 1 65 1 2 1 1 10 LEU H . 10 . HN 1 1 66 1 1 1 1 6 ILE MD . 6 . HD1* 1 1 66 1 2 1 1 7 LEU H . 7 . HN 1 1 67 1 1 1 1 6 ILE HG13 . 6 . HG11 1 1 67 1 2 1 1 7 LEU H . 7 . HN 1 1 68 1 1 1 1 6 ILE MG . 6 . HG2* 1 1 68 1 2 1 1 7 LEU H . 7 . HN 1 1 69 1 1 1 1 6 ILE MG . 6 . HG2* 1 1 69 1 2 1 1 9 SER H . 9 . HN 1 1 70 1 1 1 1 7 LEU H . 7 . HN 1 1 70 1 2 1 1 7 LEU HA . 7 . HA 1 1 71 1 1 1 1 7 LEU H . 7 . HN 1 1 71 1 2 1 1 7 LEU QB . 7 . HB* 1 1 72 1 1 1 1 7 LEU H . 7 . HN 1 1 72 1 2 1 1 8 GLY H . 8 . HN 1 1 73 1 1 1 1 7 LEU H . 7 . HN 1 1 73 1 2 1 1 10 LEU HG . 10 . HG 1 1 74 1 1 1 1 7 LEU HA . 7 . HA 1 1 74 1 2 1 1 8 GLY H . 8 . HN 1 1 75 1 1 1 1 7 LEU QB . 7 . HB* 1 1 75 1 2 1 1 8 GLY H . 8 . HN 1 1 76 1 1 1 1 7 LEU QB . 7 . HB* 1 1 76 1 2 1 1 9 SER H . 9 . HN 1 1 77 1 1 1 1 7 LEU QB . 7 . HB* 1 1 77 1 2 1 1 10 LEU H . 10 . HN 1 1 78 1 1 1 1 7 LEU QD . 7 . HD* 1 1 78 1 2 1 1 8 GLY H . 8 . HN 1 1 79 1 1 1 1 8 GLY H . 8 . HN 1 1 79 1 2 1 1 8 GLY HA2 . 8 . HA2 1 1 80 1 1 1 1 8 GLY H . 8 . HN 1 1 80 1 2 1 1 8 GLY HA3 . 8 . HA1 1 1 81 1 1 1 1 8 GLY H . 8 . HN 1 1 81 1 2 1 1 9 SER H . 9 . HN 1 1 82 1 1 1 1 8 GLY H . 8 . HN 1 1 82 1 2 1 1 10 LEU H . 10 . HN 1 1 83 1 1 1 1 8 GLY HA2 . 8 . HA2 1 1 83 1 2 1 1 9 SER H . 9 . HN 1 1 84 1 1 1 1 8 GLY HA2 . 8 . HA2 1 1 84 1 2 1 1 10 LEU H . 10 . HN 1 1 85 1 1 1 1 8 GLY HA3 . 8 . HA1 1 1 85 1 2 1 1 9 SER H . 9 . HN 1 1 86 1 1 1 1 9 SER H . 9 . HN 1 1 86 1 2 1 1 9 SER HA . 9 . HA 1 1 87 1 1 1 1 9 SER H . 9 . HN 1 1 87 1 2 1 1 9 SER HB2 . 9 . HB2 1 1 88 1 1 1 1 9 SER H . 9 . HN 1 1 88 1 2 1 1 9 SER HB3 . 9 . HB1 1 1 89 1 1 1 1 9 SER H . 9 . HN 1 1 89 1 2 1 1 10 LEU HB2 . 10 . HB2 1 1 90 1 1 1 1 9 SER H . 9 . HN 1 1 90 1 2 1 1 10 LEU HB3 . 10 . HB1 1 1 91 1 1 1 1 9 SER HB3 . 9 . HB1 1 1 91 1 2 1 1 10 LEU H . 10 . HN 1 1 92 1 1 1 1 10 LEU HA . 10 . HA 1 1 92 1 2 1 1 13 THR H . 13 . HN 1 1 93 1 1 1 1 10 LEU HA . 10 . HA 1 1 93 1 2 1 1 15 PRO QD . 15 . HD* 1 1 94 1 1 1 1 10 LEU HB2 . 10 . HB2 1 1 94 1 2 1 1 10 LEU HG . 10 . HG 1 1 95 1 1 1 1 10 LEU HB3 . 10 . HB1 1 1 95 1 2 1 1 10 LEU HG . 10 . HG 1 1 96 1 1 1 1 11 LEU H . 11 . HN 1 1 96 1 2 1 1 12 MET H . 12 . HN 1 1 97 1 1 1 1 11 LEU HB2 . 11 . HB2 1 1 97 1 2 1 1 12 MET H . 12 . HN 1 1 98 1 1 1 1 11 LEU QD . 11 . HD* 1 1 98 1 2 1 1 12 MET HG2 . 12 . HG2 1 1 99 1 1 1 1 12 MET H . 12 . HN 1 1 99 1 2 1 1 12 MET QB . 12 . HB* 1 1 100 1 1 1 1 12 MET H . 12 . HN 1 1 100 1 2 1 1 12 MET HG2 . 12 . HG2 1 1 101 1 1 1 1 12 MET H . 12 . HN 1 1 101 1 2 1 1 12 MET HG3 . 12 . HG1 1 1 102 1 1 1 1 12 MET H . 12 . HN 1 1 102 1 2 1 1 13 THR H . 13 . HN 1 1 103 1 1 1 1 12 MET HA . 12 . HA 1 1 103 1 2 1 1 12 MET HG2 . 12 . HG2 1 1 104 1 1 1 1 12 MET HA . 12 . HA 1 1 104 1 2 1 1 12 MET HG3 . 12 . HG1 1 1 105 1 1 1 1 12 MET QB . 12 . HB* 1 1 105 1 2 1 1 13 THR H . 13 . HN 1 1 106 1 1 1 1 12 MET HG2 . 12 . HG2 1 1 106 1 2 1 1 13 THR H . 13 . HN 1 1 107 1 1 1 1 12 MET HG3 . 12 . HG1 1 1 107 1 2 1 1 13 THR H . 13 . HN 1 1 108 1 1 1 1 13 THR H . 13 . HN 1 1 108 1 2 1 1 13 THR HA . 13 . HA 1 1 109 1 1 1 1 13 THR H . 13 . HN 1 1 109 1 2 1 1 13 THR HB . 13 . HB 1 1 110 1 1 1 1 13 THR H . 13 . HN 1 1 110 1 2 1 1 13 THR MG . 13 . HG2* 1 1 111 1 1 1 1 13 THR H . 13 . HN 1 1 111 1 2 1 1 14 PRO HD3 . 14 . HD1 1 1 112 1 1 1 1 13 THR HA . 13 . HA 1 1 112 1 2 1 1 14 PRO HD2 . 14 . HD2 1 1 113 1 1 1 1 13 THR HA . 13 . HA 1 1 113 1 2 1 1 14 PRO HD3 . 14 . HD1 1 1 114 1 1 1 1 13 THR HA . 13 . HA 1 1 114 1 2 1 1 14 PRO HG2 . 14 . HG2 1 1 115 1 1 1 1 13 THR HA . 13 . HA 1 1 115 1 2 1 1 16 VAL MG1 . 16 . HG1* 1 1 116 1 1 1 1 13 THR HA . 13 . HA 1 1 116 1 2 1 1 16 VAL MG2 . 16 . HG2* 1 1 117 1 1 1 1 13 THR HB . 13 . HB 1 1 117 1 2 1 1 14 PRO HD2 . 14 . HD2 1 1 118 1 1 1 1 13 THR HB . 13 . HB 1 1 118 1 2 1 1 14 PRO HD3 . 14 . HD1 1 1 119 1 1 1 1 13 THR HB . 13 . HB 1 1 119 1 2 1 1 16 VAL MG1 . 16 . HG1* 1 1 120 1 1 1 1 13 THR MG . 13 . HG2* 1 1 120 1 2 1 1 14 PRO HA . 14 . HA 1 1 121 1 1 1 1 13 THR MG . 13 . HG2* 1 1 121 1 2 1 1 14 PRO HB2 . 14 . HB2 1 1 122 1 1 1 1 13 THR MG . 13 . HG2* 1 1 122 1 2 1 1 14 PRO HD2 . 14 . HD2 1 1 123 1 1 1 1 13 THR MG . 13 . HG2* 1 1 123 1 2 1 1 14 PRO HD3 . 14 . HD1 1 1 124 1 1 1 1 13 THR MG . 13 . HG2* 1 1 124 1 2 1 1 14 PRO HG3 . 14 . HG1 1 1 125 1 1 1 1 13 THR MG . 13 . HG2* 1 1 125 1 2 1 1 16 VAL H . 16 . HN 1 1 126 1 1 1 1 13 THR MG . 13 . HG2* 1 1 126 1 2 1 1 16 VAL HA . 16 . HA 1 1 127 1 1 1 1 13 THR MG . 13 . HG2* 1 1 127 1 2 1 1 16 VAL HB . 16 . HB 1 1 128 1 1 1 1 13 THR MG . 13 . HG2* 1 1 128 1 2 1 1 16 VAL MG1 . 16 . HG1* 1 1 129 1 1 1 1 13 THR MG . 13 . HG2* 1 1 129 1 2 1 1 17 ILE QG . 17 . HG1* 1 1 130 1 1 1 1 14 PRO HA . 14 . HA 1 1 130 1 2 1 1 15 PRO QD . 15 . HD* 1 1 131 1 1 1 1 14 PRO HA . 14 . HA 1 1 131 1 2 1 1 15 PRO HG2 . 15 . HG2 1 1 132 1 1 1 1 14 PRO HA . 14 . HA 1 1 132 1 2 1 1 16 VAL H . 16 . HN 1 1 133 1 1 1 1 14 PRO HB3 . 14 . HB1 1 1 133 1 2 1 1 15 PRO QD . 15 . HD* 1 1 134 1 1 1 1 14 PRO HB3 . 14 . HB1 1 1 134 1 2 1 1 16 VAL H . 16 . HN 1 1 135 1 1 1 1 14 PRO HD2 . 14 . HD2 1 1 135 1 2 1 1 15 PRO QD . 15 . HD* 1 1 136 1 1 1 1 14 PRO HG2 . 14 . HG2 1 1 136 1 2 1 1 15 PRO QD . 15 . HD* 1 1 137 1 1 1 1 15 PRO HA . 15 . HA 1 1 137 1 2 1 1 16 VAL H . 16 . HN 1 1 138 1 1 1 1 15 PRO HA . 15 . HA 1 1 138 1 2 1 1 18 GLN QB . 18 . HB* 1 1 139 1 1 1 1 15 PRO HB2 . 15 . HB2 1 1 139 1 2 1 1 16 VAL H . 16 . HN 1 1 140 1 1 1 1 15 PRO HB3 . 15 . HB1 1 1 140 1 2 1 1 16 VAL H . 16 . HN 1 1 141 1 1 1 1 15 PRO QD . 15 . HD* 1 1 141 1 2 1 1 16 VAL H . 16 . HN 1 1 142 1 1 1 1 15 PRO HG2 . 15 . HG2 1 1 142 1 2 1 1 16 VAL H . 16 . HN 1 1 143 1 1 1 1 16 VAL H . 16 . HN 1 1 143 1 2 1 1 16 VAL HA . 16 . HA 1 1 144 1 1 1 1 16 VAL H . 16 . HN 1 1 144 1 2 1 1 17 ILE H . 17 . HN 1 1 145 1 1 1 1 16 VAL H . 16 . HN 1 1 145 1 2 1 1 19 ALA H . 19 . HN 1 1 146 1 1 1 1 16 VAL H . 16 . HN 1 1 146 1 2 1 1 19 ALA MB . 19 . HB* 1 1 147 1 1 1 1 16 VAL HA . 16 . HA 1 1 147 1 2 1 1 16 VAL HB . 16 . HB 1 1 148 1 1 1 1 16 VAL HA . 16 . HA 1 1 148 1 2 1 1 17 ILE H . 17 . HN 1 1 149 1 1 1 1 16 VAL HA . 16 . HA 1 1 149 1 2 1 1 17 ILE QG . 17 . HG1* 1 1 150 1 1 1 1 16 VAL HA . 16 . HA 1 1 150 1 2 1 1 19 ALA H . 19 . HN 1 1 151 1 1 1 1 16 VAL HA . 16 . HA 1 1 151 1 2 1 1 19 ALA HA . 19 . HA 1 1 152 1 1 1 1 16 VAL HA . 16 . HA 1 1 152 1 2 1 1 19 ALA MB . 19 . HB* 1 1 153 1 1 1 1 16 VAL HA . 16 . HA 1 1 153 1 2 1 1 21 HIS H . 21 . HN 1 1 154 1 1 1 1 16 VAL HB . 16 . HB 1 1 154 1 2 1 1 17 ILE H . 17 . HN 1 1 155 1 1 1 1 16 VAL HB . 16 . HB 1 1 155 1 2 1 1 17 ILE QG . 17 . HG1* 1 1 156 1 1 1 1 16 VAL MG1 . 16 . HG1* 1 1 156 1 2 1 1 17 ILE H . 17 . HN 1 1 157 1 1 1 1 16 VAL MG1 . 16 . HG1* 1 1 157 1 2 1 1 17 ILE QG . 17 . HG1* 1 1 158 1 1 1 1 16 VAL MG1 . 16 . HG1* 1 1 158 1 2 1 1 19 ALA H . 19 . HN 1 1 159 1 1 1 1 16 VAL MG1 . 16 . HG1* 1 1 159 1 2 1 1 19 ALA MB . 19 . HB* 1 1 160 1 1 1 1 16 VAL MG2 . 16 . HG2* 1 1 160 1 2 1 1 17 ILE H . 17 . HN 1 1 161 1 1 1 1 16 VAL MG2 . 16 . HG2* 1 1 161 1 2 1 1 17 ILE HB . 17 . HB 1 1 162 1 1 1 1 16 VAL MG2 . 16 . HG2* 1 1 162 1 2 1 1 17 ILE QG . 17 . HG1* 1 1 163 1 1 1 1 16 VAL MG2 . 16 . HG2* 1 1 163 1 2 1 1 19 ALA H . 19 . HN 1 1 164 1 1 1 1 16 VAL MG2 . 16 . HG2* 1 1 164 1 2 1 1 19 ALA MB . 19 . HB* 1 1 165 1 1 1 1 17 ILE HA . 17 . HA 1 1 165 1 2 1 1 19 ALA H . 19 . HN 1 1 166 1 1 1 1 17 ILE HB . 17 . HB 1 1 166 1 2 1 1 18 GLN HE21 . 18 . HE21 1 1 167 1 1 1 1 17 ILE MD . 17 . HD1* 1 1 167 1 2 1 1 18 GLN QB . 18 . HB* 1 1 168 1 1 1 1 17 ILE MD . 17 . HD1* 1 1 168 1 2 1 1 18 GLN HE21 . 18 . HE21 1 1 169 1 1 1 1 18 GLN H . 18 . HN 1 1 169 1 2 1 1 18 GLN HG2 . 18 . HG2 1 1 170 1 1 1 1 18 GLN H . 18 . HN 1 1 170 1 2 1 1 18 GLN HG3 . 18 . HG1 1 1 171 1 1 1 1 18 GLN H . 18 . HN 1 1 171 1 2 1 1 22 ASP H . 22 . HN 1 1 172 1 1 1 1 18 GLN HA . 18 . HA 1 1 172 1 2 1 1 19 ALA H . 19 . HN 1 1 173 1 1 1 1 18 GLN HA . 18 . HA 1 1 173 1 2 1 1 20 ILE MD . 20 . HD1* 1 1 174 1 1 1 1 18 GLN HA . 18 . HA 1 1 174 1 2 1 1 21 HIS H . 21 . HN 1 1 175 1 1 1 1 18 GLN HA . 18 . HA 1 1 175 1 2 1 1 21 HIS HD2 . 21 . HD2 1 1 176 1 1 1 1 18 GLN HA . 18 . HA 1 1 176 1 2 1 1 22 ASP H . 22 . HN 1 1 177 1 1 1 1 18 GLN QB . 18 . HB* 1 1 177 1 2 1 1 19 ALA H . 19 . HN 1 1 178 1 1 1 1 18 GLN QB . 18 . HB* 1 1 178 1 2 1 1 19 ALA MB . 19 . HB* 1 1 179 1 1 1 1 18 GLN QB . 18 . HB* 1 1 179 1 2 1 1 21 HIS H . 21 . HN 1 1 180 1 1 1 1 18 GLN QB . 18 . HB* 1 1 180 1 2 1 1 22 ASP H . 22 . HN 1 1 181 1 1 1 1 18 GLN HG2 . 18 . HG2 1 1 181 1 2 1 1 19 ALA H . 19 . HN 1 1 182 1 1 1 1 18 GLN HG3 . 18 . HG1 1 1 182 1 2 1 1 19 ALA H . 19 . HN 1 1 183 1 1 1 1 19 ALA H . 19 . HN 1 1 183 1 2 1 1 19 ALA HA . 19 . HA 1 1 184 1 1 1 1 19 ALA H . 19 . HN 1 1 184 1 2 1 1 20 ILE H . 20 . HN 1 1 185 1 1 1 1 19 ALA HA . 19 . HA 1 1 185 1 2 1 1 20 ILE H . 20 . HN 1 1 186 1 1 1 1 19 ALA HA . 19 . HA 1 1 186 1 2 1 1 22 ASP H . 22 . HN 1 1 187 1 1 1 1 19 ALA HA . 19 . HA 1 1 187 1 2 1 1 22 ASP HB3 . 22 . HB1 1 1 188 1 1 1 1 19 ALA MB . 19 . HB* 1 1 188 1 2 1 1 20 ILE H . 20 . HN 1 1 189 1 1 1 1 19 ALA MB . 19 . HB* 1 1 189 1 2 1 1 22 ASP H . 22 . HN 1 1 190 1 1 1 1 20 ILE H . 20 . HN 1 1 190 1 2 1 1 20 ILE HA . 20 . HA 1 1 191 1 1 1 1 20 ILE H . 20 . HN 1 1 191 1 2 1 1 20 ILE MD . 20 . HD1* 1 1 192 1 1 1 1 20 ILE H . 20 . HN 1 1 192 1 2 1 1 20 ILE QG . 20 . HG1* 1 1 193 1 1 1 1 20 ILE H . 20 . HN 1 1 193 1 2 1 1 20 ILE MG . 20 . HG2* 1 1 194 1 1 1 1 20 ILE HA . 20 . HA 1 1 194 1 2 1 1 20 ILE QG . 20 . HG1* 1 1 195 1 1 1 1 20 ILE HA . 20 . HA 1 1 195 1 2 1 1 22 ASP H . 22 . HN 1 1 196 1 1 1 1 20 ILE HA . 20 . HA 1 1 196 1 2 1 1 23 ALA H . 23 . HN 1 1 197 1 1 1 1 20 ILE HA . 20 . HA 1 1 197 1 2 1 1 24 GLN H . 24 . HN 1 1 198 1 1 1 1 20 ILE MD . 20 . HD1* 1 1 198 1 2 1 1 22 ASP H . 22 . HN 1 1 199 1 1 1 1 20 ILE MD . 20 . HD1* 1 1 199 1 2 1 1 24 GLN QB . 24 . HB* 1 1 200 1 1 1 1 20 ILE MD . 20 . HD1* 1 1 200 1 2 1 1 24 GLN HE21 . 24 . HE21 1 1 201 1 1 1 1 20 ILE MD . 20 . HD1* 1 1 201 1 2 1 1 24 GLN HG2 . 24 . HG2 1 1 202 1 1 1 1 20 ILE MD . 20 . HD1* 1 1 202 1 2 1 1 24 GLN HG3 . 24 . HG1 1 1 203 1 1 1 1 20 ILE MG . 20 . HG2* 1 1 203 1 2 1 1 21 HIS HA . 21 . HA 1 1 204 1 1 1 1 21 HIS H . 21 . HN 1 1 204 1 2 1 1 21 HIS HA . 21 . HA 1 1 205 1 1 1 1 21 HIS H . 21 . HN 1 1 205 1 2 1 1 21 HIS HB2 . 21 . HB2 1 1 206 1 1 1 1 21 HIS H . 21 . HN 1 1 206 1 2 1 1 21 HIS HB3 . 21 . HB1 1 1 207 1 1 1 1 21 HIS H . 21 . HN 1 1 207 1 2 1 1 21 HIS HD2 . 21 . HD2 1 1 208 1 1 1 1 21 HIS H . 21 . HN 1 1 208 1 2 1 1 22 ASP H . 22 . HN 1 1 209 1 1 1 1 21 HIS H . 21 . HN 1 1 209 1 2 1 1 22 ASP HA . 22 . HA 1 1 210 1 1 1 1 21 HIS H . 21 . HN 1 1 210 1 2 1 1 23 ALA H . 23 . HN 1 1 211 1 1 1 1 21 HIS HA . 21 . HA 1 1 211 1 2 1 1 21 HIS HB2 . 21 . HB2 1 1 212 1 1 1 1 21 HIS HA . 21 . HA 1 1 212 1 2 1 1 21 HIS HB3 . 21 . HB1 1 1 213 1 1 1 1 21 HIS HA . 21 . HA 1 1 213 1 2 1 1 22 ASP H . 22 . HN 1 1 214 1 1 1 1 21 HIS HA . 21 . HA 1 1 214 1 2 1 1 23 ALA H . 23 . HN 1 1 215 1 1 1 1 21 HIS HA . 21 . HA 1 1 215 1 2 1 1 24 GLN H . 24 . HN 1 1 216 1 1 1 1 21 HIS HA . 21 . HA 1 1 216 1 2 1 1 24 GLN HE21 . 24 . HE21 1 1 217 1 1 1 1 21 HIS HB2 . 21 . HB2 1 1 217 1 2 1 1 21 HIS HD2 . 21 . HD2 1 1 218 1 1 1 1 21 HIS HB3 . 21 . HB1 1 1 218 1 2 1 1 21 HIS HD2 . 21 . HD2 1 1 219 1 1 1 1 21 HIS HB3 . 21 . HB1 1 1 219 1 2 1 1 22 ASP H . 22 . HN 1 1 220 1 1 1 1 21 HIS HD2 . 21 . HD2 1 1 220 1 2 1 1 22 ASP HA . 22 . HA 1 1 221 1 1 1 1 21 HIS HE1 . 21 . HE1 1 1 221 1 2 1 1 22 ASP HA . 22 . HA 1 1 222 1 1 1 1 21 HIS HE1 . 21 . HE1 1 1 222 1 2 1 1 25 ARG QD . 25 . HD* 1 1 223 1 1 1 1 22 ASP H . 22 . HN 1 1 223 1 2 1 1 22 ASP HA . 22 . HA 1 1 224 1 1 1 1 22 ASP H . 22 . HN 1 1 224 1 2 1 1 22 ASP HB2 . 22 . HB2 1 1 225 1 1 1 1 22 ASP H . 22 . HN 1 1 225 1 2 1 1 22 ASP HB3 . 22 . HB1 1 1 226 1 1 1 1 22 ASP H . 22 . HN 1 1 226 1 2 1 1 23 ALA H . 23 . HN 1 1 227 1 1 1 1 22 ASP H . 22 . HN 1 1 227 1 2 1 1 23 ALA MB . 23 . HB* 1 1 228 1 1 1 1 22 ASP HA . 22 . HA 1 1 228 1 2 1 1 22 ASP HB2 . 22 . HB2 1 1 229 1 1 1 1 22 ASP HA . 22 . HA 1 1 229 1 2 1 1 22 ASP HB3 . 22 . HB1 1 1 230 1 1 1 1 22 ASP HA . 22 . HA 1 1 230 1 2 1 1 23 ALA H . 23 . HN 1 1 231 1 1 1 1 22 ASP HA . 22 . HA 1 1 231 1 2 1 1 23 ALA MB . 23 . HB* 1 1 232 1 1 1 1 22 ASP HA . 22 . HA 1 1 232 1 2 1 1 24 GLN H . 24 . HN 1 1 233 1 1 1 1 22 ASP HA . 22 . HA 1 1 233 1 2 1 1 25 ARG H . 25 . HN 1 1 234 1 1 1 1 22 ASP HA . 22 . HA 1 1 234 1 2 1 1 25 ARG QD . 25 . HD* 1 1 235 1 1 1 1 22 ASP HA . 22 . HA 1 1 235 1 2 1 1 25 ARG HE . 25 . HE 1 1 236 1 1 1 1 22 ASP HA . 22 . HA 1 1 236 1 2 1 1 25 ARG HG2 . 25 . HG2 1 1 237 1 1 1 1 22 ASP HA . 22 . HA 1 1 237 1 2 1 1 25 ARG HG3 . 25 . HG1 1 1 238 1 1 1 1 22 ASP HB2 . 22 . HB2 1 1 238 1 2 1 1 23 ALA H . 23 . HN 1 1 239 1 1 1 1 22 ASP HB2 . 22 . HB2 1 1 239 1 2 1 1 23 ALA MB . 23 . HB* 1 1 240 1 1 1 1 22 ASP HB3 . 22 . HB1 1 1 240 1 2 1 1 23 ALA H . 23 . HN 1 1 241 1 1 1 1 22 ASP HB3 . 22 . HB1 1 1 241 1 2 1 1 23 ALA MB . 23 . HB* 1 1 242 1 1 1 1 23 ALA H . 23 . HN 1 1 242 1 2 1 1 23 ALA HA . 23 . HA 1 1 243 1 1 1 1 23 ALA H . 23 . HN 1 1 243 1 2 1 1 24 GLN H . 24 . HN 1 1 244 1 1 1 1 23 ALA HA . 23 . HA 1 1 244 1 2 1 1 24 GLN H . 24 . HN 1 1 245 1 1 1 1 23 ALA MB . 23 . HB* 1 1 245 1 2 1 1 24 GLN H . 24 . HN 1 1 246 1 1 1 1 23 ALA MB . 23 . HB* 1 1 246 1 2 1 1 24 GLN HG2 . 24 . HG2 1 1 247 1 1 1 1 23 ALA MB . 23 . HB* 1 1 247 1 2 1 1 25 ARG H . 25 . HN 1 1 248 1 1 1 1 23 ALA MB . 23 . HB* 1 1 248 1 2 1 1 25 ARG HE . 25 . HE 1 1 249 1 1 1 1 24 GLN H . 24 . HN 1 1 249 1 2 1 1 24 GLN QB . 24 . HB* 1 1 250 1 1 1 1 24 GLN H . 24 . HN 1 1 250 1 2 1 1 24 GLN HG2 . 24 . HG2 1 1 251 1 1 1 1 24 GLN H . 24 . HN 1 1 251 1 2 1 1 24 GLN HG3 . 24 . HG1 1 1 252 1 1 1 1 24 GLN H . 24 . HN 1 1 252 1 2 1 1 25 ARG H . 25 . HN 1 1 253 1 1 1 1 24 GLN H . 24 . HN 1 1 253 1 2 1 1 25 ARG HB2 . 25 . HB2 1 1 254 1 1 1 1 24 GLN HA . 24 . HA 1 1 254 1 2 1 1 24 GLN HE21 . 24 . HE21 1 1 255 1 1 1 1 24 GLN HA . 24 . HA 1 1 255 1 2 1 1 24 GLN HE22 . 24 . HE22 1 1 256 1 1 1 1 24 GLN HA . 24 . HA 1 1 256 1 2 1 1 24 GLN HG2 . 24 . HG2 1 1 257 1 1 1 1 24 GLN HA . 24 . HA 1 1 257 1 2 1 1 24 GLN HG3 . 24 . HG1 1 1 258 1 1 1 1 24 GLN HA . 24 . HA 1 1 258 1 2 1 1 25 ARG H . 25 . HN 1 1 259 1 1 1 1 24 GLN HA . 24 . HA 1 1 259 1 2 1 1 25 ARG HE . 25 . HE 1 1 260 1 1 1 1 25 ARG H . 25 . HN 1 1 260 1 2 1 1 25 ARG HG2 . 25 . HG2 1 1 261 1 1 1 1 25 ARG H . 25 . HN 1 1 261 1 2 1 1 25 ARG HG3 . 25 . HG1 1 1 262 1 1 1 1 25 ARG HA . 25 . HA 1 1 262 1 2 1 1 25 ARG HE . 25 . HE 1 1 263 1 1 1 1 25 ARG HB2 . 25 . HB2 1 1 263 1 2 1 1 25 ARG HE . 25 . HE 1 1 264 1 1 1 1 25 ARG HB3 . 25 . HB1 1 1 264 1 2 1 1 25 ARG HE . 25 . HE 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.9 1.8 2.9 1 1 2 1 . . . . . 5.6 1.8 5.6 1 1 3 1 . . . . . 5.5 1.8 5.5 1 1 4 1 . . . . . 6.4 1.8 6.4 1 1 5 1 . . . . . 5.5 1.8 5.5 1 1 6 1 . . . . . 5.2 1.8 5.2 1 1 7 1 . . . . . 7.2 1.7 7.2 1 1 8 1 . . . . . 6.4 1.8 6.4 1 1 9 1 . . . . . 7.4 1.8 7.4 1 1 10 1 . . . . . 5.9 1.8 5.9 1 1 11 1 . . . . . 7.6 1.8 7.6 1 1 12 1 . . . . . 7.6 1.8 7.6 1 1 13 1 . . . . . 7.6 1.8 7.6 1 1 14 1 . . . . . 7.6 1.8 7.6 1 1 15 1 . . . . . 8.5 1.8 8.5 1 1 16 1 . . . . . 7.6 1.8 7.6 1 1 17 1 . . . . . 8.7 1.8 8.7 1 1 18 1 . . . . . 7.0 1.8 7.0 1 1 19 1 . . . . . 7.6 1.8 7.6 1 1 20 1 . . . . . 7.6 1.8 7.6 1 1 21 1 . . . . . 7.6 1.8 7.6 1 1 22 1 . . . . . 7.6 1.8 7.6 1 1 23 1 . . . . . 8.5 1.8 8.5 1 1 24 1 . . . . . 7.6 1.8 7.6 1 1 25 1 . . . . . 3.1 1.8 3.1 1 1 26 1 . . . . . 4.5 1.8 4.5 1 1 27 1 . . . . . 4.3 1.8 4.3 1 1 28 1 . . . . . 5.5 1.8 5.5 1 1 29 1 . . . . . 4.1 1.8 4.1 1 1 30 1 . . . . . 4.0 1.8 4.0 1 1 31 1 . . . . . 5.5 1.8 5.5 1 1 32 1 . . . . . 3.2 1.8 3.2 1 1 33 1 . . . . . 6.5 1.8 6.5 1 1 34 1 . . . . . 6.4 1.8 6.4 1 1 35 1 . . . . . 6.4 1.8 6.4 1 1 36 1 . . . . . 6.5 1.8 6.5 1 1 37 1 . . . . . 5.5 1.8 5.5 1 1 38 1 . . . . . 4.4 1.8 4.4 1 1 39 1 . . . . . 5.5 1.8 5.5 1 1 40 1 . . . . . 6.5 1.8 6.5 1 1 41 1 . . . . . 6.5 1.8 6.5 1 1 42 1 . . . . . 6.5 1.8 6.5 1 1 43 1 . . . . . 6.5 1.8 6.5 1 1 44 1 . . . . . 6.5 1.8 6.5 1 1 45 1 . . . . . 5.5 1.8 5.5 1 1 46 1 . . . . . 6.5 1.8 6.5 1 1 47 1 . . . . . 6.5 1.8 6.5 1 1 48 1 . . . . . 5.4 1.8 5.4 1 1 49 1 . . . . . 5.0 1.8 5.0 1 1 50 1 . . . . . 5.5 1.8 5.5 1 1 51 1 . . . . . 3.5 1.8 3.5 1 1 52 1 . . . . . 6.5 1.8 6.5 1 1 53 1 . . . . . 5.5 1.8 5.5 1 1 54 1 . . . . . 5.5 1.8 5.5 1 1 55 1 . . . . . 3.7 1.8 3.7 1 1 56 1 . . . . . 5.5 1.8 5.5 1 1 57 1 . . . . . 5.5 1.8 5.5 1 1 58 1 . . . . . 4.0 1.8 4.0 1 1 59 1 . . . . . 5.5 1.8 5.5 1 1 60 1 . . . . . 3.3 1.8 3.3 1 1 61 1 . . . . . 6.4 1.8 6.4 1 1 62 1 . . . . . 3.8 1.8 3.8 1 1 63 1 . . . . . 5.5 1.8 5.5 1 1 64 1 . . . . . 3.7 1.8 3.7 1 1 65 1 . . . . . 5.5 1.8 5.5 1 1 66 1 . . . . . 6.5 1.8 6.5 1 1 67 1 . . . . . 5.5 1.8 5.5 1 1 68 1 . . . . . 6.5 1.8 6.5 1 1 69 1 . . . . . 6.5 1.8 6.5 1 1 70 1 . . . . . 3.0 1.8 3.0 1 1 71 1 . . . . . 3.7 1.8 3.7 1 1 72 1 . . . . . 3.4 1.8 3.4 1 1 73 1 . . . . . 5.5 1.8 5.5 1 1 74 1 . . . . . 3.6 1.8 3.6 1 1 75 1 . . . . . 4.0 1.8 4.0 1 1 76 1 . . . . . 6.4 1.8 6.4 1 1 77 1 . . . . . 6.4 1.8 6.4 1 1 78 1 . . . . . 7.6 1.8 7.6 1 1 79 1 . . . . . 2.6 1.8 2.6 1 1 80 1 . . . . . 2.8 1.8 2.8 1 1 81 1 . . . . . 3.4 1.8 3.4 1 1 82 1 . . . . . 5.5 1.8 5.5 1 1 83 1 . . . . . 3.4 1.8 3.4 1 1 84 1 . . . . . 5.5 1.8 5.5 1 1 85 1 . . . . . 3.6 1.8 3.6 1 1 86 1 . . . . . 3.0 1.8 3.0 1 1 87 1 . . . . . 3.1 1.8 3.1 1 1 88 1 . . . . . 3.2 1.8 3.2 1 1 89 1 . . . . . 5.5 1.8 5.5 1 1 90 1 . . . . . 5.5 1.8 5.5 1 1 91 1 . . . . . 3.9 1.8 3.9 1 1 92 1 . . . . . 5.5 1.8 5.5 1 1 93 1 . . . . . 6.4 1.8 6.4 1 1 94 1 . . . . . 2.4 1.8 2.4 1 1 95 1 . . . . . 2.6 1.8 2.6 1 1 96 1 . . . . . 3.2 1.8 3.2 1 1 97 1 . . . . . 5.5 1.8 5.5 1 1 98 1 . . . . . 7.6 1.8 7.6 1 1 99 1 . . . . . 3.8 1.8 3.8 1 1 100 1 . . . . . 4.3 1.8 4.3 1 1 101 1 . . . . . 3.8 1.8 3.8 1 1 102 1 . . . . . 3.5 1.8 3.5 1 1 103 1 . . . . . 4.1 1.8 4.1 1 1 104 1 . . . . . 3.9 1.8 3.9 1 1 105 1 . . . . . 4.7 1.8 4.7 1 1 106 1 . . . . . 5.5 1.8 5.5 1 1 107 1 . . . . . 5.5 1.8 5.5 1 1 108 1 . . . . . 2.7 1.8 2.7 1 1 109 1 . . . . . 3.1 1.8 3.1 1 1 110 1 . . . . . 4.7 1.8 4.7 1 1 111 1 . . . . . 4.5 1.8 4.5 1 1 112 1 . . . . . 3.6 1.8 3.6 1 1 113 1 . . . . . 3.6 1.8 3.6 1 1 114 1 . . . . . 5.5 1.8 5.5 1 1 115 1 . . . . . 6.5 1.8 6.5 1 1 116 1 . . . . . 6.5 1.8 6.5 1 1 117 1 . . . . . 4.1 1.8 4.1 1 1 118 1 . . . . . 5.5 1.8 5.5 1 1 119 1 . . . . . 6.1 1.8 6.1 1 1 120 1 . . . . . 6.5 1.8 6.5 1 1 121 1 . . . . . 6.3 1.8 6.3 1 1 122 1 . . . . . 4.7 1.8 4.7 1 1 123 1 . . . . . 4.7 1.8 4.7 1 1 124 1 . . . . . 6.5 1.8 6.5 1 1 125 1 . . . . . 6.5 1.8 6.5 1 1 126 1 . . . . . 6.5 1.8 6.5 1 1 127 1 . . . . . 5.6 1.8 5.6 1 1 128 1 . . . . . 7.6 1.8 7.6 1 1 129 1 . . . . . 7.4 1.8 7.4 1 1 130 1 . . . . . 5.2 1.8 5.2 1 1 131 1 . . . . . 5.5 1.8 5.5 1 1 132 1 . . . . . 5.5 1.8 5.5 1 1 133 1 . . . . . 6.4 1.8 6.4 1 1 134 1 . . . . . 5.5 1.8 5.5 1 1 135 1 . . . . . 6.4 1.8 6.4 1 1 136 1 . . . . . 6.3 1.8 6.3 1 1 137 1 . . . . . 3.5 1.8 3.5 1 1 138 1 . . . . . 6.4 1.8 6.4 1 1 139 1 . . . . . 4.3 1.8 4.3 1 1 140 1 . . . . . 5.5 1.8 5.5 1 1 141 1 . . . . . 5.8 1.8 5.8 1 1 142 1 . . . . . 5.5 1.8 5.5 1 1 143 1 . . . . . 3.1 1.8 3.1 1 1 144 1 . . . . . 4.5 1.8 4.5 1 1 145 1 . . . . . 4.7 1.8 4.7 1 1 146 1 . . . . . 6.5 1.8 6.5 1 1 147 1 . . . . . 3.0 1.8 3.0 1 1 148 1 . . . . . 4.3 1.8 4.3 1 1 149 1 . . . . . 6.4 1.8 6.4 1 1 150 1 . . . . . 3.4 1.8 3.4 1 1 151 1 . . . . . 5.5 1.8 5.5 1 1 152 1 . . . . . 6.5 1.8 6.5 1 1 153 1 . . . . . 5.5 1.8 5.5 1 1 154 1 . . . . . 3.3 1.8 3.3 1 1 155 1 . . . . . 6.4 1.8 6.4 1 1 156 1 . . . . . 5.9 1.8 5.9 1 1 157 1 . . . . . 7.4 1.8 7.4 1 1 158 1 . . . . . 6.5 1.8 6.5 1 1 159 1 . . . . . 6.4 1.8 6.4 1 1 160 1 . . . . . 6.5 1.8 6.5 1 1 161 1 . . . . . 6.5 1.8 6.5 1 1 162 1 . . . . . 7.4 1.8 7.4 1 1 163 1 . . . . . 6.5 1.8 6.5 1 1 164 1 . . . . . 7.6 1.8 7.6 1 1 165 1 . . . . . 5.5 1.8 5.5 1 1 166 1 . . . . . 5.5 1.8 5.5 1 1 167 1 . . . . . 7.4 1.8 7.4 1 1 168 1 . . . . . 6.5 1.8 6.5 1 1 169 1 . . . . . 3.5 1.8 3.5 1 1 170 1 . . . . . 5.5 1.8 5.5 1 1 171 1 . . . . . 5.5 1.8 5.5 1 1 172 1 . . . . . 4.2 1.8 4.2 1 1 173 1 . . . . . 5.3 1.8 5.3 1 1 174 1 . . . . . 3.6 1.8 3.6 1 1 175 1 . . . . . 5.5 1.8 5.5 1 1 176 1 . . . . . 3.8 1.8 3.8 1 1 177 1 . . . . . 4.1 1.8 4.1 1 1 178 1 . . . . . 6.9 1.8 6.9 1 1 179 1 . . . . . 6.4 1.8 6.4 1 1 180 1 . . . . . 6.4 1.8 6.4 1 1 181 1 . . . . . 5.5 1.8 5.5 1 1 182 1 . . . . . 5.5 1.8 5.5 1 1 183 1 . . . . . 3.0 1.8 3.0 1 1 184 1 . . . . . 3.7 1.8 3.7 1 1 185 1 . . . . . 3.7 1.8 3.7 1 1 186 1 . . . . . 3.5 1.8 3.5 1 1 187 1 . . . . . 5.5 1.8 5.5 1 1 188 1 . . . . . 4.5 1.8 4.5 1 1 189 1 . . . . . 6.5 1.8 6.5 1 1 190 1 . . . . . 2.9 1.8 2.9 1 1 191 1 . . . . . 4.5 1.8 4.5 1 1 192 1 . . . . . 5.1 1.8 5.1 1 1 193 1 . . . . . 4.8 1.8 4.8 1 1 194 1 . . . . . 4.0 1.8 4.0 1 1 195 1 . . . . . 5.5 1.8 5.5 1 1 196 1 . . . . . 3.5 1.8 3.5 1 1 197 1 . . . . . 4.3 1.8 4.3 1 1 198 1 . . . . . 6.5 1.8 6.5 1 1 199 1 . . . . . 7.4 1.8 7.4 1 1 200 1 . . . . . 6.5 1.8 6.5 1 1 201 1 . . . . . 5.3 1.8 5.3 1 1 202 1 . . . . . 6.5 1.8 6.5 1 1 203 1 . . . . . 6.5 1.8 6.5 1 1 204 1 . . . . . 3.0 1.8 3.0 1 1 205 1 . . . . . 3.0 1.8 3.0 1 1 206 1 . . . . . 2.9 1.8 2.9 1 1 207 1 . . . . . 5.5 1.8 5.5 1 1 208 1 . . . . . 3.3 1.8 3.3 1 1 209 1 . . . . . 5.5 1.8 5.5 1 1 210 1 . . . . . 5.5 1.8 5.5 1 1 211 1 . . . . . 3.1 1.8 3.1 1 1 212 1 . . . . . 3.0 1.8 3.0 1 1 213 1 . . . . . 3.9 1.8 3.9 1 1 214 1 . . . . . 5.5 1.8 5.5 1 1 215 1 . . . . . 4.0 1.8 4.0 1 1 216 1 . . . . . 5.5 1.8 5.5 1 1 217 1 . . . . . 4.0 1.8 4.0 1 1 218 1 . . . . . 3.9 1.8 3.9 1 1 219 1 . . . . . 3.3 1.8 3.3 1 1 220 1 . . . . . 5.5 1.8 5.5 1 1 221 1 . . . . . 5.5 1.8 5.5 1 1 222 1 . . . . . 6.4 1.8 6.4 1 1 223 1 . . . . . 3.0 1.8 3.0 1 1 224 1 . . . . . 2.9 1.8 2.9 1 1 225 1 . . . . . 3.1 1.8 3.1 1 1 226 1 . . . . . 3.3 1.8 3.3 1 1 227 1 . . . . . 6.5 1.8 6.5 1 1 228 1 . . . . . 3.1 1.8 3.1 1 1 229 1 . . . . . 2.8 1.8 2.8 1 1 230 1 . . . . . 3.4 1.8 3.4 1 1 231 1 . . . . . 6.5 1.8 6.5 1 1 232 1 . . . . . 4.7 1.8 4.7 1 1 233 1 . . . . . 3.8 1.8 3.8 1 1 234 1 . . . . . 6.4 1.8 6.4 1 1 235 1 . . . . . 5.5 1.8 5.5 1 1 236 1 . . . . . 5.2 1.7 5.2 1 1 237 1 . . . . . 5.5 1.8 5.5 1 1 238 1 . . . . . 3.3 1.8 3.3 1 1 239 1 . . . . . 6.5 1.8 6.5 1 1 240 1 . . . . . 3.5 1.8 3.5 1 1 241 1 . . . . . 6.5 1.8 6.5 1 1 242 1 . . . . . 2.8 1.8 2.8 1 1 243 1 . . . . . 3.2 1.8 3.2 1 1 244 1 . . . . . 5.5 1.8 5.5 1 1 245 1 . . . . . 6.5 1.8 6.5 1 1 246 1 . . . . . 6.5 1.8 6.5 1 1 247 1 . . . . . 6.5 1.8 6.5 1 1 248 1 . . . . . 6.5 1.8 6.5 1 1 249 1 . . . . . 3.9 1.8 3.9 1 1 250 1 . . . . . 3.5 1.8 3.5 1 1 251 1 . . . . . 3.8 1.8 3.8 1 1 252 1 . . . . . 3.3 1.8 3.3 1 1 253 1 . . . . . 5.5 1.8 5.5 1 1 254 1 . . . . . 5.5 1.8 5.5 1 1 255 1 . . . . . 5.5 1.8 5.5 1 1 256 1 . . . . . 3.8 1.8 3.8 1 1 257 1 . . . . . 3.3 1.8 3.3 1 1 258 1 . . . . . 3.5 1.8 3.5 1 1 259 1 . . . . . 5.5 1.8 5.5 1 1 260 1 . . . . . 5.5 1.8 5.5 1 1 261 1 . . . . . 5.5 1.8 5.5 1 1 262 1 . . . . . 5.5 1.8 5.5 1 1 263 1 . . . . . 5.5 1.8 5.5 1 1 264 1 . . . . . 5.5 1.8 5.5 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 PHE C C 1.131 0.000 -2.451 1.00 . A A . 1 PHE C 1 1 1 2 1 1 1 PHE CA C 2.073 0.000 -1.245 1.00 . A A . 1 PHE CA 1 1 1 3 1 1 1 PHE CB C 2.908 -1.282 -1.266 1.00 . A A . 1 PHE CB 1 1 1 4 1 1 1 PHE CD1 C 1.382 -2.967 -0.216 1.00 . A A . 1 PHE CD1 1 1 1 5 1 1 1 PHE CD2 C 2.033 -3.304 -2.455 1.00 . A A . 1 PHE CD2 1 1 1 6 1 1 1 PHE CE1 C 0.610 -4.158 -0.261 1.00 . A A . 1 PHE CE1 1 1 1 7 1 1 1 PHE CE2 C 1.261 -4.496 -2.500 1.00 . A A . 1 PHE CE2 1 1 1 8 1 1 1 PHE CG C 2.077 -2.565 -1.314 1.00 . A A . 1 PHE CG 1 1 1 9 1 1 1 PHE CZ C 0.566 -4.897 -1.402 1.00 . A A . 1 PHE CZ 1 1 1 10 1 1 1 PHE H1 H 1.884 0.000 0.829 1.00 . A A . 1 PHE H1 1 1 1 11 1 1 1 PHE HA H 2.678 0.907 -1.259 1.00 . A A . 1 PHE HA 1 1 1 12 1 1 1 PHE HB2 H 3.571 -1.258 -2.130 1.00 . A A . 1 PHE HB2 1 1 1 13 1 1 1 PHE HB3 H 3.542 -1.305 -0.379 1.00 . A A . 1 PHE HB3 1 1 1 14 1 1 1 PHE HD1 H 1.417 -2.375 0.698 1.00 . A A . 1 PHE HD1 1 1 1 15 1 1 1 PHE HD2 H 2.589 -2.982 -3.335 1.00 . A A . 1 PHE HD2 1 1 1 16 1 1 1 PHE HE1 H 0.053 -4.480 0.619 1.00 . A A . 1 PHE HE1 1 1 1 17 1 1 1 PHE HE2 H 1.225 -5.088 -3.414 1.00 . A A . 1 PHE HE2 1 1 1 18 1 1 1 PHE HZ H -0.026 -5.812 -1.436 1.00 . A A . 1 PHE HZ 1 1 1 19 1 1 1 PHE N N 1.325 0.000 0.000 1.00 . A A . 1 PHE N 1 1 1 20 1 1 1 PHE O O 0.013 0.506 -2.370 1.00 . A A . 1 PHE O 1 1 1 21 1 1 2 LEU C C -0.662 -0.549 -4.391 1.00 . A A . 2 LEU C 1 1 1 22 1 1 2 LEU CA C 0.819 -0.682 -4.750 1.00 . A A . 2 LEU CA 1 1 1 23 1 1 2 LEU CB C 1.155 -1.972 -5.501 1.00 . A A . 2 LEU CB 1 1 1 24 1 1 2 LEU CD1 C 0.993 -1.142 -7.877 1.00 . A A . 2 LEU CD1 1 1 1 25 1 1 2 LEU CD2 C 0.619 -3.596 -7.354 1.00 . A A . 2 LEU CD2 1 1 1 26 1 1 2 LEU CG C 0.471 -2.157 -6.857 1.00 . A A . 2 LEU CG 1 1 1 27 1 1 2 LEU H H 2.538 -0.959 -3.608 1.00 . A A . 2 LEU H 1 1 1 28 1 1 2 LEU HA H 1.093 0.149 -5.399 1.00 . A A . 2 LEU HA 1 1 1 29 1 1 2 LEU HB2 H 2.234 -2.010 -5.652 1.00 . A A . 2 LEU HB2 1 1 1 30 1 1 2 LEU HB3 H 0.892 -2.818 -4.866 1.00 . A A . 2 LEU HB3 1 1 1 31 1 1 2 LEU HD11 H 2.076 -1.064 -7.790 1.00 . A A . 2 LEU HD11 1 1 1 32 1 1 2 LEU HD12 H 0.732 -1.471 -8.883 1.00 . A A . 2 LEU HD12 1 1 1 33 1 1 2 LEU HD13 H 0.541 -0.169 -7.685 1.00 . A A . 2 LEU HD13 1 1 1 34 1 1 2 LEU HD21 H 0.407 -3.635 -8.423 1.00 . A A . 2 LEU HD21 1 1 1 35 1 1 2 LEU HD22 H 1.637 -3.941 -7.173 1.00 . A A . 2 LEU HD22 1 1 1 36 1 1 2 LEU HD23 H -0.083 -4.238 -6.821 1.00 . A A . 2 LEU HD23 1 1 1 37 1 1 2 LEU HG H -0.595 -1.967 -6.731 1.00 . A A . 2 LEU HG 1 1 1 38 1 1 2 LEU N N 1.618 -0.574 -3.542 1.00 . A A . 2 LEU N 1 1 1 39 1 1 2 LEU O O -1.351 0.336 -4.898 1.00 . A A . 2 LEU O 1 1 1 40 1 1 3 PRO C C -2.796 -0.322 -2.103 1.00 . A A . 3 PRO C 1 1 1 41 1 1 3 PRO CA C -2.513 -1.468 -3.076 1.00 . A A . 3 PRO CA 1 1 1 42 1 1 3 PRO CB C -2.733 -2.839 -2.459 1.00 . A A . 3 PRO CB 1 1 1 43 1 1 3 PRO CD C -0.331 -2.513 -2.860 1.00 . A A . 3 PRO CD 1 1 1 44 1 1 3 PRO CG C -1.349 -3.378 -2.134 1.00 . A A . 3 PRO CG 1 1 1 45 1 1 3 PRO HA H -3.112 -1.314 -3.862 1.00 . A A . 3 PRO HA 1 1 1 46 1 1 3 PRO HB2 H -3.346 -2.769 -1.561 1.00 . A A . 3 PRO HB2 1 1 1 47 1 1 3 PRO HB3 H -3.256 -3.500 -3.151 1.00 . A A . 3 PRO HB3 1 1 1 48 1 1 3 PRO HD2 H 0.399 -2.095 -2.167 1.00 . A A . 3 PRO HD2 1 1 1 49 1 1 3 PRO HD3 H 0.225 -3.092 -3.598 1.00 . A A . 3 PRO HD3 1 1 1 50 1 1 3 PRO HG2 H -1.173 -3.354 -1.059 1.00 . A A . 3 PRO HG2 1 1 1 51 1 1 3 PRO HG3 H -1.261 -4.418 -2.448 1.00 . A A . 3 PRO HG3 1 1 1 52 1 1 3 PRO N N -1.121 -1.463 -3.495 1.00 . A A . 3 PRO N 1 1 1 53 1 1 3 PRO O O -3.692 0.488 -2.337 1.00 . A A . 3 PRO O 1 1 1 54 1 1 4 LEU C C -2.000 2.105 -0.604 1.00 . A A . 4 LEU C 1 1 1 55 1 1 4 LEU CA C -2.204 0.714 0.000 1.00 . A A . 4 LEU CA 1 1 1 56 1 1 4 LEU CB C -1.298 0.425 1.199 1.00 . A A . 4 LEU CB 1 1 1 57 1 1 4 LEU CD1 C -1.825 -1.996 1.668 1.00 . A A . 4 LEU CD1 1 1 1 58 1 1 4 LEU CD2 C -1.079 -0.464 3.549 1.00 . A A . 4 LEU CD2 1 1 1 59 1 1 4 LEU CG C -1.841 -0.571 2.226 1.00 . A A . 4 LEU CG 1 1 1 60 1 1 4 LEU H H -1.270 -0.934 -0.866 1.00 . A A . 4 LEU H 1 1 1 61 1 1 4 LEU HA H -3.234 0.636 0.349 1.00 . A A . 4 LEU HA 1 1 1 62 1 1 4 LEU HB2 H -0.345 0.050 0.827 1.00 . A A . 4 LEU HB2 1 1 1 63 1 1 4 LEU HB3 H -1.092 1.367 1.709 1.00 . A A . 4 LEU HB3 1 1 1 64 1 1 4 LEU HD11 H -0.863 -2.189 1.194 1.00 . A A . 4 LEU HD11 1 1 1 65 1 1 4 LEU HD12 H -1.978 -2.705 2.481 1.00 . A A . 4 LEU HD12 1 1 1 66 1 1 4 LEU HD13 H -2.622 -2.107 0.933 1.00 . A A . 4 LEU HD13 1 1 1 67 1 1 4 LEU HD21 H -0.023 -0.669 3.377 1.00 . A A . 4 LEU HD21 1 1 1 68 1 1 4 LEU HD22 H -1.194 0.541 3.954 1.00 . A A . 4 LEU HD22 1 1 1 69 1 1 4 LEU HD23 H -1.480 -1.189 4.257 1.00 . A A . 4 LEU HD23 1 1 1 70 1 1 4 LEU HG H -2.880 -0.317 2.431 1.00 . A A . 4 LEU HG 1 1 1 71 1 1 4 LEU N N -2.017 -0.291 -1.033 1.00 . A A . 4 LEU N 1 1 1 72 1 1 4 LEU O O -2.676 3.058 -0.220 1.00 . A A . 4 LEU O 1 1 1 73 1 1 5 LEU C C -1.980 3.954 -2.927 1.00 . A A . 5 LEU C 1 1 1 74 1 1 5 LEU CA C -0.746 3.440 -2.183 1.00 . A A . 5 LEU CA 1 1 1 75 1 1 5 LEU CB C 0.490 3.292 -3.073 1.00 . A A . 5 LEU CB 1 1 1 76 1 1 5 LEU CD1 C 1.866 5.248 -2.273 1.00 . A A . 5 LEU CD1 1 1 1 77 1 1 5 LEU CD2 C 2.082 2.988 -1.141 1.00 . A A . 5 LEU CD2 1 1 1 78 1 1 5 LEU CG C 1.819 3.729 -2.453 1.00 . A A . 5 LEU CG 1 1 1 79 1 1 5 LEU H H -0.530 1.394 -1.858 1.00 . A A . 5 LEU H 1 1 1 80 1 1 5 LEU HA H -0.494 4.153 -1.398 1.00 . A A . 5 LEU HA 1 1 1 81 1 1 5 LEU HB2 H 0.577 2.246 -3.369 1.00 . A A . 5 LEU HB2 1 1 1 82 1 1 5 LEU HB3 H 0.329 3.868 -3.984 1.00 . A A . 5 LEU HB3 1 1 1 83 1 1 5 LEU HD11 H 1.538 5.505 -1.266 1.00 . A A . 5 LEU HD11 1 1 1 84 1 1 5 LEU HD12 H 2.887 5.599 -2.424 1.00 . A A . 5 LEU HD12 1 1 1 85 1 1 5 LEU HD13 H 1.208 5.720 -3.002 1.00 . A A . 5 LEU HD13 1 1 1 86 1 1 5 LEU HD21 H 1.829 1.935 -1.261 1.00 . A A . 5 LEU HD21 1 1 1 87 1 1 5 LEU HD22 H 3.135 3.080 -0.876 1.00 . A A . 5 LEU HD22 1 1 1 88 1 1 5 LEU HD23 H 1.469 3.421 -0.350 1.00 . A A . 5 LEU HD23 1 1 1 89 1 1 5 LEU HG H 2.621 3.461 -3.141 1.00 . A A . 5 LEU HG 1 1 1 90 1 1 5 LEU N N -1.065 2.177 -1.540 1.00 . A A . 5 LEU N 1 1 1 91 1 1 5 LEU O O -2.437 5.070 -2.682 1.00 . A A . 5 LEU O 1 1 1 92 1 1 6 ILE C C -4.851 3.668 -3.674 1.00 . A A . 6 ILE C 1 1 1 93 1 1 6 ILE CA C -3.653 3.475 -4.607 1.00 . A A . 6 ILE CA 1 1 1 94 1 1 6 ILE CB C -3.893 2.444 -5.711 1.00 . A A . 6 ILE CB 1 1 1 95 1 1 6 ILE CD1 C -4.353 0.018 -6.224 1.00 . A A . 6 ILE CD1 1 1 1 96 1 1 6 ILE CG1 C -4.150 1.056 -5.119 1.00 . A A . 6 ILE CG1 1 1 1 97 1 1 6 ILE CG2 C -2.737 2.435 -6.713 1.00 . A A . 6 ILE CG2 1 1 1 98 1 1 6 ILE H H -2.111 2.209 -4.010 1.00 . A A . 6 ILE H 1 1 1 99 1 1 6 ILE HA H -3.439 4.426 -5.095 1.00 . A A . 6 ILE HA 1 1 1 100 1 1 6 ILE HB H -4.791 2.732 -6.258 1.00 . A A . 6 ILE HB 1 1 1 101 1 1 6 ILE HD11 H -3.401 -0.176 -6.720 1.00 . A A . 6 ILE HD11 1 1 1 102 1 1 6 ILE HD12 H -4.730 -0.907 -5.788 1.00 . A A . 6 ILE HD12 1 1 1 103 1 1 6 ILE HD13 H -5.071 0.396 -6.951 1.00 . A A . 6 ILE HD13 1 1 1 104 1 1 6 ILE HG12 H -3.309 0.764 -4.490 1.00 . A A . 6 ILE HG12 1 1 1 105 1 1 6 ILE HG13 H -5.031 1.088 -4.478 1.00 . A A . 6 ILE HG13 1 1 1 106 1 1 6 ILE HG21 H -2.057 3.256 -6.490 1.00 . A A . 6 ILE HG21 1 1 1 107 1 1 6 ILE HG22 H -2.201 1.488 -6.641 1.00 . A A . 6 ILE HG22 1 1 1 108 1 1 6 ILE HG23 H -3.131 2.553 -7.723 1.00 . A A . 6 ILE HG23 1 1 1 109 1 1 6 ILE N N -2.485 3.116 -3.820 1.00 . A A . 6 ILE N 1 1 1 110 1 1 6 ILE O O -5.675 4.555 -3.891 1.00 . A A . 6 ILE O 1 1 1 111 1 1 7 LEU C C -5.964 4.232 -0.976 1.00 . A A . 7 LEU C 1 1 1 112 1 1 7 LEU CA C -5.998 2.882 -1.695 1.00 . A A . 7 LEU CA 1 1 1 113 1 1 7 LEU CB C -5.944 1.681 -0.749 1.00 . A A . 7 LEU CB 1 1 1 114 1 1 7 LEU CD1 C -8.414 1.445 -0.298 1.00 . A A . 7 LEU CD1 1 1 1 115 1 1 7 LEU CD2 C -6.722 0.541 1.362 1.00 . A A . 7 LEU CD2 1 1 1 116 1 1 7 LEU CG C -7.029 1.626 0.328 1.00 . A A . 7 LEU CG 1 1 1 117 1 1 7 LEU H H -4.232 2.107 -2.483 1.00 . A A . 7 LEU H 1 1 1 118 1 1 7 LEU HA H -6.931 2.811 -2.253 1.00 . A A . 7 LEU HA 1 1 1 119 1 1 7 LEU HB2 H -6.005 0.771 -1.345 1.00 . A A . 7 LEU HB2 1 1 1 120 1 1 7 LEU HB3 H -4.971 1.674 -0.257 1.00 . A A . 7 LEU HB3 1 1 1 121 1 1 7 LEU HD11 H -8.730 2.382 -0.758 1.00 . A A . 7 LEU HD11 1 1 1 122 1 1 7 LEU HD12 H -8.370 0.664 -1.057 1.00 . A A . 7 LEU HD12 1 1 1 123 1 1 7 LEU HD13 H -9.128 1.161 0.475 1.00 . A A . 7 LEU HD13 1 1 1 124 1 1 7 LEU HD21 H -5.701 0.663 1.724 1.00 . A A . 7 LEU HD21 1 1 1 125 1 1 7 LEU HD22 H -7.417 0.627 2.197 1.00 . A A . 7 LEU HD22 1 1 1 126 1 1 7 LEU HD23 H -6.828 -0.441 0.901 1.00 . A A . 7 LEU HD23 1 1 1 127 1 1 7 LEU HG H -7.036 2.580 0.855 1.00 . A A . 7 LEU HG 1 1 1 128 1 1 7 LEU N N -4.909 2.822 -2.656 1.00 . A A . 7 LEU N 1 1 1 129 1 1 7 LEU O O -6.971 4.936 -0.922 1.00 . A A . 7 LEU O 1 1 1 130 1 1 8 GLY C C -5.010 6.997 -0.615 1.00 . A A . 8 GLY C 1 1 1 131 1 1 8 GLY CA C -4.615 5.810 0.266 1.00 . A A . 8 GLY CA 1 1 1 132 1 1 8 GLY H H -3.981 3.974 -0.489 1.00 . A A . 8 GLY H 1 1 1 133 1 1 8 GLY HA2 H -5.218 5.809 1.173 1.00 . A A . 8 GLY HA2 1 1 1 134 1 1 8 GLY HA3 H -3.575 5.912 0.574 1.00 . A A . 8 GLY HA3 1 1 1 135 1 1 8 GLY N N -4.795 4.554 -0.443 1.00 . A A . 8 GLY N 1 1 1 136 1 1 8 GLY O O -5.647 7.939 -0.144 1.00 . A A . 8 GLY O 1 1 1 137 1 1 9 SER C C -6.228 7.651 -3.560 1.00 . A A . 9 SER C 1 1 1 138 1 1 9 SER CA C -4.923 7.969 -2.828 1.00 . A A . 9 SER CA 1 1 1 139 1 1 9 SER CB C -3.783 8.154 -3.831 1.00 . A A . 9 SER CB 1 1 1 140 1 1 9 SER H H -4.099 6.145 -2.252 1.00 . A A . 9 SER H 1 1 1 141 1 1 9 SER HA H -5.031 8.874 -2.230 1.00 . A A . 9 SER HA 1 1 1 142 1 1 9 SER HB2 H -2.838 8.239 -3.295 1.00 . A A . 9 SER HB2 1 1 1 143 1 1 9 SER HB3 H -3.711 7.271 -4.466 1.00 . A A . 9 SER HB3 1 1 1 144 1 1 9 SER HG H -4.623 9.109 -5.377 1.00 . A A . 9 SER HG 1 1 1 145 1 1 9 SER N N -4.617 6.914 -1.877 1.00 . A A . 9 SER N 1 1 1 146 1 1 9 SER O O -6.459 8.140 -4.665 1.00 . A A . 9 SER O 1 1 1 147 1 1 9 SER OG O -3.971 9.309 -4.645 1.00 . A A . 9 SER OG 1 1 1 148 1 1 10 LEU C C -9.438 7.288 -2.878 1.00 . A A . 10 LEU C 1 1 1 149 1 1 10 LEU CA C -8.322 6.442 -3.493 1.00 . A A . 10 LEU CA 1 1 1 150 1 1 10 LEU CB C -8.538 4.935 -3.340 1.00 . A A . 10 LEU CB 1 1 1 151 1 1 10 LEU CD1 C -10.624 4.731 -4.742 1.00 . A A . 10 LEU CD1 1 1 1 152 1 1 10 LEU CD2 C -8.343 4.367 -5.790 1.00 . A A . 10 LEU CD2 1 1 1 153 1 1 10 LEU CG C -9.196 4.228 -4.527 1.00 . A A . 10 LEU CG 1 1 1 154 1 1 10 LEU H H -6.854 6.443 -2.015 1.00 . A A . 10 LEU H 1 1 1 155 1 1 10 LEU HA H -8.275 6.654 -4.561 1.00 . A A . 10 LEU HA 1 1 1 156 1 1 10 LEU HB2 H -7.572 4.466 -3.154 1.00 . A A . 10 LEU HB2 1 1 1 157 1 1 10 LEU HB3 H -9.152 4.764 -2.456 1.00 . A A . 10 LEU HB3 1 1 1 158 1 1 10 LEU HD11 H -10.596 5.735 -5.166 1.00 . A A . 10 LEU HD11 1 1 1 159 1 1 10 LEU HD12 H -11.146 4.062 -5.426 1.00 . A A . 10 LEU HD12 1 1 1 160 1 1 10 LEU HD13 H -11.149 4.756 -3.787 1.00 . A A . 10 LEU HD13 1 1 1 161 1 1 10 LEU HD21 H -8.695 5.217 -6.374 1.00 . A A . 10 LEU HD21 1 1 1 162 1 1 10 LEU HD22 H -7.302 4.526 -5.509 1.00 . A A . 10 LEU HD22 1 1 1 163 1 1 10 LEU HD23 H -8.424 3.458 -6.385 1.00 . A A . 10 LEU HD23 1 1 1 164 1 1 10 LEU HG H -9.261 3.164 -4.298 1.00 . A A . 10 LEU HG 1 1 1 165 1 1 10 LEU N N -7.048 6.834 -2.915 1.00 . A A . 10 LEU N 1 1 1 166 1 1 10 LEU O O -10.313 6.764 -2.191 1.00 . A A . 10 LEU O 1 1 1 167 1 1 11 LEU C C -10.937 10.334 -3.787 1.00 . A A . 11 LEU C 1 1 1 168 1 1 11 LEU CA C -10.367 9.508 -2.632 1.00 . A A . 11 LEU CA 1 1 1 169 1 1 11 LEU CB C -9.777 10.356 -1.503 1.00 . A A . 11 LEU CB 1 1 1 170 1 1 11 LEU CD1 C -8.612 10.507 0.728 1.00 . A A . 11 LEU CD1 1 1 1 171 1 1 11 LEU CD2 C -10.608 8.970 0.433 1.00 . A A . 11 LEU CD2 1 1 1 172 1 1 11 LEU CG C -9.383 9.600 -0.233 1.00 . A A . 11 LEU CG 1 1 1 173 1 1 11 LEU H H -8.656 9.002 -3.707 1.00 . A A . 11 LEU H 1 1 1 174 1 1 11 LEU HA H -11.172 8.914 -2.201 1.00 . A A . 11 LEU HA 1 1 1 175 1 1 11 LEU HB2 H -8.894 10.870 -1.885 1.00 . A A . 11 LEU HB2 1 1 1 176 1 1 11 LEU HB3 H -10.502 11.124 -1.235 1.00 . A A . 11 LEU HB3 1 1 1 177 1 1 11 LEU HD11 H -7.640 10.750 0.298 1.00 . A A . 11 LEU HD11 1 1 1 178 1 1 11 LEU HD12 H -9.176 11.425 0.893 1.00 . A A . 11 LEU HD12 1 1 1 179 1 1 11 LEU HD13 H -8.470 9.993 1.679 1.00 . A A . 11 LEU HD13 1 1 1 180 1 1 11 LEU HD21 H -10.968 8.142 -0.179 1.00 . A A . 11 LEU HD21 1 1 1 181 1 1 11 LEU HD22 H -10.335 8.600 1.421 1.00 . A A . 11 LEU HD22 1 1 1 182 1 1 11 LEU HD23 H -11.394 9.719 0.530 1.00 . A A . 11 LEU HD23 1 1 1 183 1 1 11 LEU HG H -8.714 8.786 -0.513 1.00 . A A . 11 LEU HG 1 1 1 184 1 1 11 LEU N N -9.371 8.584 -3.148 1.00 . A A . 11 LEU N 1 1 1 185 1 1 11 LEU O O -12.101 10.175 -4.152 1.00 . A A . 11 LEU O 1 1 1 186 1 1 12 MET C C -9.456 12.033 -6.553 1.00 . A A . 12 MET C 1 1 1 187 1 1 12 MET CA C -10.498 12.050 -5.433 1.00 . A A . 12 MET CA 1 1 1 188 1 1 12 MET CB C -10.682 13.483 -4.929 1.00 . A A . 12 MET CB 1 1 1 189 1 1 12 MET CE C -11.073 15.084 -1.860 1.00 . A A . 12 MET CE 1 1 1 190 1 1 12 MET CG C -11.890 13.586 -3.996 1.00 . A A . 12 MET CG 1 1 1 191 1 1 12 MET H H -9.146 11.318 -4.028 1.00 . A A . 12 MET H 1 1 1 192 1 1 12 MET HA H -11.438 11.633 -5.795 1.00 . A A . 12 MET HA 1 1 1 193 1 1 12 MET HB2 H -9.784 13.806 -4.404 1.00 . A A . 12 MET HB2 1 1 1 194 1 1 12 MET HB3 H -10.815 14.156 -5.777 1.00 . A A . 12 MET HB3 1 1 1 195 1 1 12 MET HE1 H -11.512 14.310 -1.230 1.00 . A A . 12 MET HE1 1 1 1 196 1 1 12 MET HE2 H -10.048 14.811 -2.111 1.00 . A A . 12 MET HE2 1 1 1 197 1 1 12 MET HE3 H -11.074 16.033 -1.323 1.00 . A A . 12 MET HE3 1 1 1 198 1 1 12 MET HG2 H -12.799 13.316 -4.534 1.00 . A A . 12 MET HG2 1 1 1 199 1 1 12 MET HG3 H -11.785 12.878 -3.173 1.00 . A A . 12 MET HG3 1 1 1 200 1 1 12 MET N N -10.091 11.197 -4.330 1.00 . A A . 12 MET N 1 1 1 201 1 1 12 MET O O -9.337 12.995 -7.310 1.00 . A A . 12 MET O 1 1 1 202 1 1 12 MET SD S -12.030 15.247 -3.358 1.00 . A A . 12 MET SD 1 1 1 203 1 1 13 THR C C -7.498 9.302 -7.982 1.00 . A A . 13 THR C 1 1 1 204 1 1 13 THR CA C -7.690 10.778 -7.628 1.00 . A A . 13 THR CA 1 1 1 205 1 1 13 THR CB C -6.419 11.446 -7.098 1.00 . A A . 13 THR CB 1 1 1 206 1 1 13 THR CG2 C -5.344 11.598 -8.177 1.00 . A A . 13 THR CG2 1 1 1 207 1 1 13 THR H H -8.839 10.146 -6.010 1.00 . A A . 13 THR H 1 1 1 208 1 1 13 THR HA H -8.015 11.285 -8.537 1.00 . A A . 13 THR HA 1 1 1 209 1 1 13 THR HB H -6.030 10.910 -6.233 1.00 . A A . 13 THR HB 1 1 1 210 1 1 13 THR HG1 H -7.370 13.141 -7.573 1.00 . A A . 13 THR HG1 1 1 1 211 1 1 13 THR HG21 H -5.753 12.152 -9.021 1.00 . A A . 13 THR HG21 1 1 1 212 1 1 13 THR HG22 H -4.491 12.138 -7.766 1.00 . A A . 13 THR HG22 1 1 1 213 1 1 13 THR HG23 H -5.023 10.611 -8.511 1.00 . A A . 13 THR HG23 1 1 1 214 1 1 13 THR N N -8.728 10.928 -6.623 1.00 . A A . 13 THR N 1 1 1 215 1 1 13 THR O O -7.463 8.448 -7.097 1.00 . A A . 13 THR O 1 1 1 216 1 1 13 THR OG1 O -6.821 12.784 -6.818 1.00 . A A . 13 THR OG1 1 1 1 217 1 1 14 PRO C C -5.761 7.199 -9.531 1.00 . A A . 14 PRO C 1 1 1 218 1 1 14 PRO CA C -7.189 7.682 -9.792 1.00 . A A . 14 PRO CA 1 1 1 219 1 1 14 PRO CB C -7.536 7.738 -11.271 1.00 . A A . 14 PRO CB 1 1 1 220 1 1 14 PRO CD C -7.413 10.027 -10.386 1.00 . A A . 14 PRO CD 1 1 1 221 1 1 14 PRO CG C -7.454 9.204 -11.664 1.00 . A A . 14 PRO CG 1 1 1 222 1 1 14 PRO HA H -7.786 7.052 -9.295 1.00 . A A . 14 PRO HA 1 1 1 223 1 1 14 PRO HB2 H -6.841 7.137 -11.858 1.00 . A A . 14 PRO HB2 1 1 1 224 1 1 14 PRO HB3 H -8.534 7.340 -11.453 1.00 . A A . 14 PRO HB3 1 1 1 225 1 1 14 PRO HD2 H -6.536 10.674 -10.360 1.00 . A A . 14 PRO HD2 1 1 1 226 1 1 14 PRO HD3 H -8.287 10.672 -10.303 1.00 . A A . 14 PRO HD3 1 1 1 227 1 1 14 PRO HG2 H -6.564 9.388 -12.266 1.00 . A A . 14 PRO HG2 1 1 1 228 1 1 14 PRO HG3 H -8.314 9.485 -12.271 1.00 . A A . 14 PRO HG3 1 1 1 229 1 1 14 PRO N N -7.376 9.040 -9.311 1.00 . A A . 14 PRO N 1 1 1 230 1 1 14 PRO O O -4.918 7.965 -9.065 1.00 . A A . 14 PRO O 1 1 1 231 1 1 15 PRO C C -3.238 5.782 -10.739 1.00 . A A . 15 PRO C 1 1 1 232 1 1 15 PRO CA C -4.213 5.306 -9.661 1.00 . A A . 15 PRO CA 1 1 1 233 1 1 15 PRO CB C -4.449 3.805 -9.694 1.00 . A A . 15 PRO CB 1 1 1 234 1 1 15 PRO CD C -6.502 4.959 -10.395 1.00 . A A . 15 PRO CD 1 1 1 235 1 1 15 PRO CG C -5.802 3.611 -10.360 1.00 . A A . 15 PRO CG 1 1 1 236 1 1 15 PRO HA H -3.822 5.601 -8.789 1.00 . A A . 15 PRO HA 1 1 1 237 1 1 15 PRO HB2 H -3.662 3.298 -10.252 1.00 . A A . 15 PRO HB2 1 1 1 238 1 1 15 PRO HB3 H -4.446 3.387 -8.687 1.00 . A A . 15 PRO HB3 1 1 1 239 1 1 15 PRO HD2 H -6.788 5.231 -11.411 1.00 . A A . 15 PRO HD2 1 1 1 240 1 1 15 PRO HD3 H -7.416 4.947 -9.800 1.00 . A A . 15 PRO HD3 1 1 1 241 1 1 15 PRO HG2 H -5.677 3.219 -11.370 1.00 . A A . 15 PRO HG2 1 1 1 242 1 1 15 PRO HG3 H -6.399 2.885 -9.808 1.00 . A A . 15 PRO HG3 1 1 1 243 1 1 15 PRO N N -5.527 5.898 -9.849 1.00 . A A . 15 PRO N 1 1 1 244 1 1 15 PRO O O -2.760 4.985 -11.545 1.00 . A A . 15 PRO O 1 1 1 245 1 1 16 VAL C C -0.667 7.085 -11.506 1.00 . A A . 16 VAL C 1 1 1 246 1 1 16 VAL CA C -2.068 7.673 -11.692 1.00 . A A . 16 VAL CA 1 1 1 247 1 1 16 VAL CB C -2.098 9.198 -11.571 1.00 . A A . 16 VAL CB 1 1 1 248 1 1 16 VAL CG1 C -3.458 9.755 -11.995 1.00 . A A . 16 VAL CG1 1 1 1 249 1 1 16 VAL CG2 C -1.742 9.642 -10.151 1.00 . A A . 16 VAL CG2 1 1 1 250 1 1 16 VAL H H -3.358 7.720 -10.056 1.00 . A A . 16 VAL H 1 1 1 251 1 1 16 VAL HA H -2.432 7.406 -12.684 1.00 . A A . 16 VAL HA 1 1 1 252 1 1 16 VAL HB H -1.344 9.602 -12.247 1.00 . A A . 16 VAL HB 1 1 1 253 1 1 16 VAL HG11 H -3.696 9.405 -13.000 1.00 . A A . 16 VAL HG11 1 1 1 254 1 1 16 VAL HG12 H -4.224 9.412 -11.300 1.00 . A A . 16 VAL HG12 1 1 1 255 1 1 16 VAL HG13 H -3.422 10.844 -11.989 1.00 . A A . 16 VAL HG13 1 1 1 256 1 1 16 VAL HG21 H -1.204 10.590 -10.191 1.00 . A A . 16 VAL HG21 1 1 1 257 1 1 16 VAL HG22 H -2.655 9.767 -9.569 1.00 . A A . 16 VAL HG22 1 1 1 258 1 1 16 VAL HG23 H -1.112 8.887 -9.680 1.00 . A A . 16 VAL HG23 1 1 1 259 1 1 16 VAL N N -2.970 7.080 -10.719 1.00 . A A . 16 VAL N 1 1 1 260 1 1 16 VAL O O -0.446 6.270 -10.612 1.00 . A A . 16 VAL O 1 1 1 261 1 1 17 ILE C C 1.691 5.603 -12.732 1.00 . A A . 17 ILE C 1 1 1 262 1 1 17 ILE CA C 1.619 7.067 -12.293 1.00 . A A . 17 ILE CA 1 1 1 263 1 1 17 ILE CB C 2.196 7.319 -10.898 1.00 . A A . 17 ILE CB 1 1 1 264 1 1 17 ILE CD1 C 2.339 8.979 -9.005 1.00 . A A . 17 ILE CD1 1 1 1 265 1 1 17 ILE CG1 C 2.015 8.782 -10.487 1.00 . A A . 17 ILE CG1 1 1 1 266 1 1 17 ILE CG2 C 3.659 6.879 -10.822 1.00 . A A . 17 ILE CG2 1 1 1 267 1 1 17 ILE H H 0.050 8.176 -13.097 1.00 . A A . 17 ILE H 1 1 1 268 1 1 17 ILE HA H 2.199 7.666 -12.995 1.00 . A A . 17 ILE HA 1 1 1 269 1 1 17 ILE HB H 1.639 6.713 -10.184 1.00 . A A . 17 ILE HB 1 1 1 270 1 1 17 ILE HD11 H 3.398 8.785 -8.835 1.00 . A A . 17 ILE HD11 1 1 1 271 1 1 17 ILE HD12 H 2.106 10.003 -8.715 1.00 . A A . 17 ILE HD12 1 1 1 272 1 1 17 ILE HD13 H 1.743 8.288 -8.408 1.00 . A A . 17 ILE HD13 1 1 1 273 1 1 17 ILE HG12 H 2.664 9.416 -11.092 1.00 . A A . 17 ILE HG12 1 1 1 274 1 1 17 ILE HG13 H 0.990 9.095 -10.684 1.00 . A A . 17 ILE HG13 1 1 1 275 1 1 17 ILE HG21 H 3.743 5.840 -11.141 1.00 . A A . 17 ILE HG21 1 1 1 276 1 1 17 ILE HG22 H 4.263 7.509 -11.474 1.00 . A A . 17 ILE HG22 1 1 1 277 1 1 17 ILE HG23 H 4.013 6.973 -9.795 1.00 . A A . 17 ILE HG23 1 1 1 278 1 1 17 ILE N N 0.242 7.523 -12.364 1.00 . A A . 17 ILE N 1 1 1 279 1 1 17 ILE O O 2.480 5.251 -13.607 1.00 . A A . 17 ILE O 1 1 1 280 1 1 18 GLN C C -0.186 3.077 -13.512 1.00 . A A . 18 GLN C 1 1 1 281 1 1 18 GLN CA C 0.828 3.367 -12.404 1.00 . A A . 18 GLN CA 1 1 1 282 1 1 18 GLN CB C 0.519 2.548 -11.149 1.00 . A A . 18 GLN CB 1 1 1 283 1 1 18 GLN CD C 1.353 1.838 -8.877 1.00 . A A . 18 GLN CD 1 1 1 284 1 1 18 GLN CG C 1.601 2.744 -10.085 1.00 . A A . 18 GLN CG 1 1 1 285 1 1 18 GLN H H 0.206 5.085 -11.404 1.00 . A A . 18 GLN H 1 1 1 286 1 1 18 GLN HA H 1.833 3.125 -12.749 1.00 . A A . 18 GLN HA 1 1 1 287 1 1 18 GLN HB2 H -0.450 2.845 -10.746 1.00 . A A . 18 GLN HB2 1 1 1 288 1 1 18 GLN HB3 H 0.445 1.492 -11.409 1.00 . A A . 18 GLN HB3 1 1 1 289 1 1 18 GLN HE21 H 0.936 3.490 -7.784 1.00 . A A . 18 GLN HE21 1 1 1 290 1 1 18 GLN HE22 H 0.827 1.988 -6.928 1.00 . A A . 18 GLN HE22 1 1 1 291 1 1 18 GLN HG2 H 2.579 2.526 -10.513 1.00 . A A . 18 GLN HG2 1 1 1 292 1 1 18 GLN HG3 H 1.617 3.786 -9.766 1.00 . A A . 18 GLN HG3 1 1 1 293 1 1 18 GLN N N 0.855 4.789 -12.104 1.00 . A A . 18 GLN N 1 1 1 294 1 1 18 GLN NE2 N 1.010 2.493 -7.772 1.00 . A A . 18 GLN NE2 1 1 1 295 1 1 18 GLN O O 0.105 2.328 -14.444 1.00 . A A . 18 GLN O 1 1 1 296 1 1 18 GLN OE1 O 1.464 0.625 -8.945 1.00 . A A . 18 GLN OE1 1 1 1 297 1 1 19 ALA C C -1.907 3.859 -15.738 1.00 . A A . 19 ALA C 1 1 1 298 1 1 19 ALA CA C -2.419 3.489 -14.344 1.00 . A A . 19 ALA CA 1 1 1 299 1 1 19 ALA CB C -3.641 4.313 -13.935 1.00 . A A . 19 ALA CB 1 1 1 300 1 1 19 ALA H H -1.580 4.301 -12.619 1.00 . A A . 19 ALA H 1 1 1 301 1 1 19 ALA HA H -2.688 2.433 -14.333 1.00 . A A . 19 ALA HA 1 1 1 302 1 1 19 ALA HB1 H -3.338 5.343 -13.746 1.00 . A A . 19 ALA HB1 1 1 1 303 1 1 19 ALA HB2 H -4.379 4.293 -14.737 1.00 . A A . 19 ALA HB2 1 1 1 304 1 1 19 ALA HB3 H -4.077 3.891 -13.029 1.00 . A A . 19 ALA HB3 1 1 1 305 1 1 19 ALA N N -1.355 3.685 -13.374 1.00 . A A . 19 ALA N 1 1 1 306 1 1 19 ALA O O -2.003 3.061 -16.670 1.00 . A A . 19 ALA O 1 1 1 307 1 1 20 ILE C C 0.256 4.652 -17.594 1.00 . A A . 20 ILE C 1 1 1 308 1 1 20 ILE CA C -0.872 5.563 -17.107 1.00 . A A . 20 ILE CA 1 1 1 309 1 1 20 ILE CB C -0.467 7.033 -16.986 1.00 . A A . 20 ILE CB 1 1 1 310 1 1 20 ILE CD1 C 1.988 7.062 -16.407 1.00 . A A . 20 ILE CD1 1 1 1 311 1 1 20 ILE CG1 C 0.564 7.229 -15.872 1.00 . A A . 20 ILE CG1 1 1 1 312 1 1 20 ILE CG2 C -1.694 7.927 -16.795 1.00 . A A . 20 ILE CG2 1 1 1 313 1 1 20 ILE H H -1.284 5.703 -15.070 1.00 . A A . 20 ILE H 1 1 1 314 1 1 20 ILE HA H -1.691 5.512 -17.824 1.00 . A A . 20 ILE HA 1 1 1 315 1 1 20 ILE HB H 0.008 7.334 -17.920 1.00 . A A . 20 ILE HB 1 1 1 316 1 1 20 ILE HD11 H 2.490 6.265 -15.861 1.00 . A A . 20 ILE HD11 1 1 1 317 1 1 20 ILE HD12 H 1.950 6.809 -17.467 1.00 . A A . 20 ILE HD12 1 1 1 318 1 1 20 ILE HD13 H 2.536 7.995 -16.276 1.00 . A A . 20 ILE HD13 1 1 1 319 1 1 20 ILE HG12 H 0.449 8.221 -15.436 1.00 . A A . 20 ILE HG12 1 1 1 320 1 1 20 ILE HG13 H 0.384 6.507 -15.076 1.00 . A A . 20 ILE HG13 1 1 1 321 1 1 20 ILE HG21 H -2.450 7.669 -17.537 1.00 . A A . 20 ILE HG21 1 1 1 322 1 1 20 ILE HG22 H -2.101 7.776 -15.795 1.00 . A A . 20 ILE HG22 1 1 1 323 1 1 20 ILE HG23 H -1.406 8.971 -16.916 1.00 . A A . 20 ILE HG23 1 1 1 324 1 1 20 ILE N N -1.375 5.068 -15.837 1.00 . A A . 20 ILE N 1 1 1 325 1 1 20 ILE O O 0.402 4.425 -18.794 1.00 . A A . 20 ILE O 1 1 1 326 1 1 21 HIS C C 1.645 1.966 -17.516 1.00 . A A . 21 HIS C 1 1 1 327 1 1 21 HIS CA C 2.154 3.295 -16.956 1.00 . A A . 21 HIS CA 1 1 1 328 1 1 21 HIS CB C 3.062 3.116 -15.737 1.00 . A A . 21 HIS CB 1 1 1 329 1 1 21 HIS CD2 C 5.023 1.481 -16.297 1.00 . A A . 21 HIS CD2 1 1 1 330 1 1 21 HIS CE1 C 4.263 -0.285 -15.254 1.00 . A A . 21 HIS CE1 1 1 1 331 1 1 21 HIS CG C 3.829 1.816 -15.729 1.00 . A A . 21 HIS CG 1 1 1 332 1 1 21 HIS H H 0.890 4.328 -15.662 1.00 . A A . 21 HIS H 1 1 1 333 1 1 21 HIS HA H 2.730 3.808 -17.727 1.00 . A A . 21 HIS HA 1 1 1 334 1 1 21 HIS HB2 H 3.770 3.944 -15.700 1.00 . A A . 21 HIS HB2 1 1 1 335 1 1 21 HIS HB3 H 2.455 3.175 -14.834 1.00 . A A . 21 HIS HB3 1 1 1 336 1 1 21 HIS HD1 H 2.521 0.605 -14.563 1.00 . A A . 21 HIS HD1 1 1 1 337 1 1 21 HIS HD2 H 5.655 2.144 -16.889 1.00 . A A . 21 HIS HD2 1 1 1 338 1 1 21 HIS HE1 H 4.191 -1.300 -14.863 1.00 . A A . 21 HIS HE1 1 1 1 339 1 1 21 HIS HE2 H 6.067 -0.311 -16.345 1.00 . A A . 21 HIS HE2 1 1 1 340 1 1 21 HIS N N 1.026 4.154 -16.638 1.00 . A A . 21 HIS N 1 1 1 341 1 1 21 HIS ND1 N 3.375 0.682 -15.078 1.00 . A A . 21 HIS ND1 1 1 1 342 1 1 21 HIS NE2 N 5.284 0.212 -16.009 1.00 . A A . 21 HIS NE2 1 1 1 343 1 1 21 HIS O O 2.152 1.478 -18.525 1.00 . A A . 21 HIS O 1 1 1 344 1 1 22 ASP C C -0.604 0.331 -18.618 1.00 . A A . 22 ASP C 1 1 1 345 1 1 22 ASP CA C 0.065 0.153 -17.254 1.00 . A A . 22 ASP CA 1 1 1 346 1 1 22 ASP CB C -1.001 -0.315 -16.262 1.00 . A A . 22 ASP CB 1 1 1 347 1 1 22 ASP CG C -0.477 -1.165 -15.102 1.00 . A A . 22 ASP CG 1 1 1 348 1 1 22 ASP H H 0.242 1.820 -16.017 1.00 . A A . 22 ASP H 1 1 1 349 1 1 22 ASP HA H 0.898 -0.550 -17.286 1.00 . A A . 22 ASP HA 1 1 1 350 1 1 22 ASP HB2 H -1.505 0.560 -15.853 1.00 . A A . 22 ASP HB2 1 1 1 351 1 1 22 ASP HB3 H -1.752 -0.891 -16.803 1.00 . A A . 22 ASP HB3 1 1 1 352 1 1 22 ASP N N 0.649 1.417 -16.837 1.00 . A A . 22 ASP N 1 1 1 353 1 1 22 ASP O O -0.480 -0.527 -19.491 1.00 . A A . 22 ASP O 1 1 1 354 1 1 22 ASP OD1 O -0.027 -2.296 -15.385 1.00 . A A . 22 ASP OD1 1 1 1 355 1 1 22 ASP OD2 O -0.538 -0.663 -13.959 1.00 . A A . 22 ASP OD2 1 1 1 356 1 1 23 ALA C C -0.973 2.030 -21.100 1.00 . A A . 23 ALA C 1 1 1 357 1 1 23 ALA CA C -1.997 1.746 -19.999 1.00 . A A . 23 ALA CA 1 1 1 358 1 1 23 ALA CB C -2.956 2.918 -19.778 1.00 . A A . 23 ALA CB 1 1 1 359 1 1 23 ALA H H -1.389 2.146 -18.047 1.00 . A A . 23 ALA H 1 1 1 360 1 1 23 ALA HA H -2.577 0.865 -20.272 1.00 . A A . 23 ALA HA 1 1 1 361 1 1 23 ALA HB1 H -2.388 3.802 -19.488 1.00 . A A . 23 ALA HB1 1 1 1 362 1 1 23 ALA HB2 H -3.499 3.122 -20.700 1.00 . A A . 23 ALA HB2 1 1 1 363 1 1 23 ALA HB3 H -3.662 2.665 -18.988 1.00 . A A . 23 ALA HB3 1 1 1 364 1 1 23 ALA N N -1.299 1.450 -18.759 1.00 . A A . 23 ALA N 1 1 1 365 1 1 23 ALA O O -1.270 1.874 -22.284 1.00 . A A . 23 ALA O 1 1 1 366 1 1 24 GLN C C 1.715 1.464 -22.337 1.00 . A A . 24 GLN C 1 1 1 367 1 1 24 GLN CA C 1.284 2.737 -21.606 1.00 . A A . 24 GLN CA 1 1 1 368 1 1 24 GLN CB C 2.470 3.387 -20.891 1.00 . A A . 24 GLN CB 1 1 1 369 1 1 24 GLN CD C 3.158 5.330 -22.343 1.00 . A A . 24 GLN CD 1 1 1 370 1 1 24 GLN CG C 2.445 4.908 -21.057 1.00 . A A . 24 GLN CG 1 1 1 371 1 1 24 GLN H H 0.441 2.576 -19.707 1.00 . A A . 24 GLN H 1 1 1 372 1 1 24 GLN HA H 0.862 3.448 -22.317 1.00 . A A . 24 GLN HA 1 1 1 373 1 1 24 GLN HB2 H 2.444 3.133 -19.831 1.00 . A A . 24 GLN HB2 1 1 1 374 1 1 24 GLN HB3 H 3.403 2.989 -21.291 1.00 . A A . 24 GLN HB3 1 1 1 375 1 1 24 GLN HE21 H 4.578 6.221 -21.207 1.00 . A A . 24 GLN HE21 1 1 1 376 1 1 24 GLN HE22 H 4.814 6.344 -22.918 1.00 . A A . 24 GLN HE22 1 1 1 377 1 1 24 GLN HG2 H 1.413 5.258 -21.078 1.00 . A A . 24 GLN HG2 1 1 1 378 1 1 24 GLN HG3 H 2.924 5.379 -20.199 1.00 . A A . 24 GLN HG3 1 1 1 379 1 1 24 GLN N N 0.211 2.443 -20.671 1.00 . A A . 24 GLN N 1 1 1 380 1 1 24 GLN NE2 N 4.276 6.022 -22.139 1.00 . A A . 24 GLN NE2 1 1 1 381 1 1 24 GLN O O 2.088 1.513 -23.508 1.00 . A A . 24 GLN O 1 1 1 382 1 1 24 GLN OE1 O 2.723 5.047 -23.447 1.00 . A A . 24 GLN OE1 1 1 1 383 1 1 25 ARG C C 0.857 -1.507 -22.996 1.00 . A A . 25 ARG C 1 1 1 384 1 1 25 ARG CA C 2.019 -0.930 -22.184 1.00 . A A . 25 ARG CA 1 1 1 385 1 1 25 ARG CB C 2.410 -1.925 -21.090 1.00 . A A . 25 ARG CB 1 1 1 386 1 1 25 ARG CD C 3.240 -1.882 -18.708 1.00 . A A . 25 ARG CD 1 1 1 387 1 1 25 ARG CG C 3.410 -1.300 -20.113 1.00 . A A . 25 ARG CG 1 1 1 388 1 1 25 ARG CZ C 1.214 -2.894 -17.669 1.00 . A A . 25 ARG CZ 1 1 1 389 1 1 25 ARG H H 1.349 0.324 -20.662 1.00 . A A . 25 ARG H 1 1 1 390 1 1 25 ARG HA H 2.876 -0.716 -22.824 1.00 . A A . 25 ARG HA 1 1 1 391 1 1 25 ARG HB2 H 1.520 -2.245 -20.549 1.00 . A A . 25 ARG HB2 1 1 1 392 1 1 25 ARG HB3 H 2.846 -2.816 -21.541 1.00 . A A . 25 ARG HB3 1 1 1 393 1 1 25 ARG HD2 H 3.642 -2.894 -18.673 1.00 . A A . 25 ARG HD2 1 1 1 394 1 1 25 ARG HD3 H 3.805 -1.289 -17.990 1.00 . A A . 25 ARG HD3 1 1 1 395 1 1 25 ARG HE H 1.247 -1.109 -18.599 1.00 . A A . 25 ARG HE 1 1 1 396 1 1 25 ARG HG2 H 4.426 -1.479 -20.464 1.00 . A A . 25 ARG HG2 1 1 1 397 1 1 25 ARG HG3 H 3.268 -0.220 -20.083 1.00 . A A . 25 ARG HG3 1 1 1 398 1 1 25 ARG HH11 H 2.899 -4.022 -17.517 1.00 . A A . 25 ARG HH11 1 1 1 399 1 1 25 ARG HH12 H 1.482 -4.713 -16.799 1.00 . A A . 25 ARG HH12 1 1 1 400 1 1 25 ARG HH21 H -0.622 -2.020 -17.652 1.00 . A A . 25 ARG HH21 1 1 1 401 1 1 25 ARG HH22 H -0.534 -3.567 -16.876 1.00 . A A . 25 ARG HH22 1 1 1 402 1 1 25 ARG N N 1.649 0.355 -21.616 1.00 . A A . 25 ARG N 1 1 1 403 1 1 25 ARG NE N 1.807 -1.895 -18.336 1.00 . A A . 25 ARG NE 1 1 1 404 1 1 25 ARG NH1 N 1.925 -3.967 -17.297 1.00 . A A . 25 ARG NH1 1 1 1 405 1 1 25 ARG NH2 N -0.091 -2.821 -17.374 1.00 . A A . 25 ARG NH2 1 1 1 406 1 1 25 ARG O O 1.063 -2.061 -24.074 1.00 . A A . 25 ARG O 1 1 2 407 1 1 1 PHE C C 1.131 0.000 -2.451 1.00 . A A . 1 PHE C 1 1 2 408 1 1 1 PHE CA C 2.073 0.000 -1.245 1.00 . A A . 1 PHE CA 1 1 2 409 1 1 1 PHE CB C 2.908 -1.282 -1.266 1.00 . A A . 1 PHE CB 1 1 2 410 1 1 1 PHE CD1 C 1.648 -3.133 -2.387 1.00 . A A . 1 PHE CD1 1 1 2 411 1 1 1 PHE CD2 C 1.769 -3.141 -0.034 1.00 . A A . 1 PHE CD2 1 1 2 412 1 1 1 PHE CE1 C 0.877 -4.325 -2.352 1.00 . A A . 1 PHE CE1 1 1 2 413 1 1 1 PHE CE2 C 0.998 -4.333 0.001 1.00 . A A . 1 PHE CE2 1 1 2 414 1 1 1 PHE CG C 2.078 -2.566 -1.228 1.00 . A A . 1 PHE CG 1 1 2 415 1 1 1 PHE CZ C 0.568 -4.900 -1.159 1.00 . A A . 1 PHE CZ 1 1 2 416 1 1 1 PHE H1 H 1.884 0.000 0.829 1.00 . A A . 1 PHE H1 1 1 2 417 1 1 1 PHE HA H 2.678 0.907 -1.259 1.00 . A A . 1 PHE HA 1 1 2 418 1 1 1 PHE HB2 H 3.526 -1.287 -2.164 1.00 . A A . 1 PHE HB2 1 1 2 419 1 1 1 PHE HB3 H 3.587 -1.275 -0.412 1.00 . A A . 1 PHE HB3 1 1 2 420 1 1 1 PHE HD1 H 1.895 -2.672 -3.343 1.00 . A A . 1 PHE HD1 1 1 2 421 1 1 1 PHE HD2 H 2.113 -2.687 0.895 1.00 . A A . 1 PHE HD2 1 1 2 422 1 1 1 PHE HE1 H 0.533 -4.779 -3.281 1.00 . A A . 1 PHE HE1 1 1 2 423 1 1 1 PHE HE2 H 0.751 -4.795 0.957 1.00 . A A . 1 PHE HE2 1 1 2 424 1 1 1 PHE HZ H -0.023 -5.815 -1.132 1.00 . A A . 1 PHE HZ 1 1 2 425 1 1 1 PHE N N 1.325 0.000 0.000 1.00 . A A . 1 PHE N 1 1 2 426 1 1 1 PHE O O 1.504 -0.447 -3.535 1.00 . A A . 1 PHE O 1 1 2 427 1 1 2 LEU C C -2.421 0.959 -2.663 1.00 . A A . 2 LEU C 1 1 2 428 1 1 2 LEU CA C -1.078 0.547 -3.269 1.00 . A A . 2 LEU CA 1 1 2 429 1 1 2 LEU CB C -1.124 -0.785 -4.020 1.00 . A A . 2 LEU CB 1 1 2 430 1 1 2 LEU CD1 C -0.887 -2.102 -6.157 1.00 . A A . 2 LEU CD1 1 1 2 431 1 1 2 LEU CD2 C -2.086 0.134 -6.162 1.00 . A A . 2 LEU CD2 1 1 2 432 1 1 2 LEU CG C -0.968 -0.704 -5.540 1.00 . A A . 2 LEU CG 1 1 2 433 1 1 2 LEU H H -0.361 0.884 -1.342 1.00 . A A . 2 LEU H 1 1 2 434 1 1 2 LEU HA H -0.774 1.310 -3.985 1.00 . A A . 2 LEU HA 1 1 2 435 1 1 2 LEU HB2 H -0.337 -1.429 -3.627 1.00 . A A . 2 LEU HB2 1 1 2 436 1 1 2 LEU HB3 H -2.074 -1.272 -3.798 1.00 . A A . 2 LEU HB3 1 1 2 437 1 1 2 LEU HD11 H -0.957 -2.024 -7.242 1.00 . A A . 2 LEU HD11 1 1 2 438 1 1 2 LEU HD12 H 0.062 -2.564 -5.886 1.00 . A A . 2 LEU HD12 1 1 2 439 1 1 2 LEU HD13 H -1.709 -2.712 -5.784 1.00 . A A . 2 LEU HD13 1 1 2 440 1 1 2 LEU HD21 H -2.054 1.143 -5.752 1.00 . A A . 2 LEU HD21 1 1 2 441 1 1 2 LEU HD22 H -1.950 0.176 -7.243 1.00 . A A . 2 LEU HD22 1 1 2 442 1 1 2 LEU HD23 H -3.050 -0.321 -5.935 1.00 . A A . 2 LEU HD23 1 1 2 443 1 1 2 LEU HG H -0.027 -0.200 -5.760 1.00 . A A . 2 LEU HG 1 1 2 444 1 1 2 LEU N N -0.071 0.506 -2.222 1.00 . A A . 2 LEU N 1 1 2 445 1 1 2 LEU O O -3.075 1.875 -3.159 1.00 . A A . 2 LEU O 1 1 2 446 1 1 3 PRO C C -3.939 1.808 -0.053 1.00 . A A . 3 PRO C 1 1 2 447 1 1 3 PRO CA C -4.052 0.530 -0.887 1.00 . A A . 3 PRO CA 1 1 2 448 1 1 3 PRO CB C -4.333 -0.704 -0.047 1.00 . A A . 3 PRO CB 1 1 2 449 1 1 3 PRO CD C -2.058 -0.855 -0.962 1.00 . A A . 3 PRO CD 1 1 2 450 1 1 3 PRO CG C -3.009 -1.440 0.070 1.00 . A A . 3 PRO CG 1 1 2 451 1 1 3 PRO HA H -4.780 0.701 -1.551 1.00 . A A . 3 PRO HA 1 1 2 452 1 1 3 PRO HB2 H -4.715 -0.429 0.936 1.00 . A A . 3 PRO HB2 1 1 2 453 1 1 3 PRO HB3 H -5.089 -1.333 -0.517 1.00 . A A . 3 PRO HB3 1 1 2 454 1 1 3 PRO HD2 H -1.139 -0.499 -0.496 1.00 . A A . 3 PRO HD2 1 1 2 455 1 1 3 PRO HD3 H -1.772 -1.600 -1.704 1.00 . A A . 3 PRO HD3 1 1 2 456 1 1 3 PRO HG2 H -2.598 -1.330 1.073 1.00 . A A . 3 PRO HG2 1 1 2 457 1 1 3 PRO HG3 H -3.148 -2.508 -0.102 1.00 . A A . 3 PRO HG3 1 1 2 458 1 1 3 PRO N N -2.803 0.243 -1.571 1.00 . A A . 3 PRO N 1 1 2 459 1 1 3 PRO O O -4.840 2.645 -0.068 1.00 . A A . 3 PRO O 1 1 2 460 1 1 4 LEU C C -1.768 4.108 0.755 1.00 . A A . 4 LEU C 1 1 2 461 1 1 4 LEU CA C -2.593 3.066 1.514 1.00 . A A . 4 LEU CA 1 1 2 462 1 1 4 LEU CB C -1.962 2.628 2.837 1.00 . A A . 4 LEU CB 1 1 2 463 1 1 4 LEU CD1 C -3.460 0.724 3.540 1.00 . A A . 4 LEU CD1 1 1 2 464 1 1 4 LEU CD2 C -2.283 2.134 5.290 1.00 . A A . 4 LEU CD2 1 1 2 465 1 1 4 LEU CG C -2.931 2.113 3.904 1.00 . A A . 4 LEU CG 1 1 2 466 1 1 4 LEU H H -2.088 1.240 0.648 1.00 . A A . 4 LEU H 1 1 2 467 1 1 4 LEU HA H -3.565 3.500 1.749 1.00 . A A . 4 LEU HA 1 1 2 468 1 1 4 LEU HB2 H -1.234 1.844 2.628 1.00 . A A . 4 LEU HB2 1 1 2 469 1 1 4 LEU HB3 H -1.412 3.472 3.252 1.00 . A A . 4 LEU HB3 1 1 2 470 1 1 4 LEU HD11 H -4.209 0.815 2.753 1.00 . A A . 4 LEU HD11 1 1 2 471 1 1 4 LEU HD12 H -2.636 0.103 3.187 1.00 . A A . 4 LEU HD12 1 1 2 472 1 1 4 LEU HD13 H -3.911 0.265 4.419 1.00 . A A . 4 LEU HD13 1 1 2 473 1 1 4 LEU HD21 H -1.322 1.621 5.249 1.00 . A A . 4 LEU HD21 1 1 2 474 1 1 4 LEU HD22 H -2.130 3.167 5.603 1.00 . A A . 4 LEU HD22 1 1 2 475 1 1 4 LEU HD23 H -2.934 1.630 6.003 1.00 . A A . 4 LEU HD23 1 1 2 476 1 1 4 LEU HG H -3.789 2.785 3.939 1.00 . A A . 4 LEU HG 1 1 2 477 1 1 4 LEU N N -2.824 1.918 0.655 1.00 . A A . 4 LEU N 1 1 2 478 1 1 4 LEU O O -1.903 5.307 0.994 1.00 . A A . 4 LEU O 1 1 2 479 1 1 5 LEU C C -0.942 5.471 -1.715 1.00 . A A . 5 LEU C 1 1 2 480 1 1 5 LEU CA C -0.075 4.484 -0.931 1.00 . A A . 5 LEU CA 1 1 2 481 1 1 5 LEU CB C 0.866 3.659 -1.810 1.00 . A A . 5 LEU CB 1 1 2 482 1 1 5 LEU CD1 C 1.905 5.587 -3.059 1.00 . A A . 5 LEU CD1 1 1 2 483 1 1 5 LEU CD2 C 3.033 4.653 -0.988 1.00 . A A . 5 LEU CD2 1 1 2 484 1 1 5 LEU CG C 2.175 4.340 -2.215 1.00 . A A . 5 LEU CG 1 1 2 485 1 1 5 LEU H H -0.834 2.636 -0.339 1.00 . A A . 5 LEU H 1 1 2 486 1 1 5 LEU HA H 0.546 5.047 -0.234 1.00 . A A . 5 LEU HA 1 1 2 487 1 1 5 LEU HB2 H 1.109 2.736 -1.283 1.00 . A A . 5 LEU HB2 1 1 2 488 1 1 5 LEU HB3 H 0.331 3.377 -2.717 1.00 . A A . 5 LEU HB3 1 1 2 489 1 1 5 LEU HD11 H 1.055 5.404 -3.717 1.00 . A A . 5 LEU HD11 1 1 2 490 1 1 5 LEU HD12 H 1.682 6.429 -2.403 1.00 . A A . 5 LEU HD12 1 1 2 491 1 1 5 LEU HD13 H 2.786 5.818 -3.659 1.00 . A A . 5 LEU HD13 1 1 2 492 1 1 5 LEU HD21 H 4.063 4.827 -1.300 1.00 . A A . 5 LEU HD21 1 1 2 493 1 1 5 LEU HD22 H 2.648 5.545 -0.493 1.00 . A A . 5 LEU HD22 1 1 2 494 1 1 5 LEU HD23 H 3.000 3.811 -0.297 1.00 . A A . 5 LEU HD23 1 1 2 495 1 1 5 LEU HG H 2.743 3.648 -2.837 1.00 . A A . 5 LEU HG 1 1 2 496 1 1 5 LEU N N -0.931 3.612 -0.145 1.00 . A A . 5 LEU N 1 1 2 497 1 1 5 LEU O O -0.666 6.669 -1.730 1.00 . A A . 5 LEU O 1 1 2 498 1 1 6 ILE C C -3.540 6.789 -2.240 1.00 . A A . 6 ILE C 1 1 2 499 1 1 6 ILE CA C -2.875 5.747 -3.142 1.00 . A A . 6 ILE CA 1 1 2 500 1 1 6 ILE CB C -3.869 4.865 -3.900 1.00 . A A . 6 ILE CB 1 1 2 501 1 1 6 ILE CD1 C -5.616 3.057 -3.698 1.00 . A A . 6 ILE CD1 1 1 2 502 1 1 6 ILE CG1 C -4.663 3.980 -2.936 1.00 . A A . 6 ILE CG1 1 1 2 503 1 1 6 ILE CG2 C -3.162 4.045 -4.980 1.00 . A A . 6 ILE CG2 1 1 2 504 1 1 6 ILE H H -2.195 3.956 -2.325 1.00 . A A . 6 ILE H 1 1 2 505 1 1 6 ILE HA H -2.274 6.268 -3.887 1.00 . A A . 6 ILE HA 1 1 2 506 1 1 6 ILE HB H -4.585 5.514 -4.405 1.00 . A A . 6 ILE HB 1 1 2 507 1 1 6 ILE HD11 H -5.070 2.542 -4.487 1.00 . A A . 6 ILE HD11 1 1 2 508 1 1 6 ILE HD12 H -6.040 2.325 -3.011 1.00 . A A . 6 ILE HD12 1 1 2 509 1 1 6 ILE HD13 H -6.419 3.649 -4.138 1.00 . A A . 6 ILE HD13 1 1 2 510 1 1 6 ILE HG12 H -3.976 3.383 -2.336 1.00 . A A . 6 ILE HG12 1 1 2 511 1 1 6 ILE HG13 H -5.229 4.605 -2.246 1.00 . A A . 6 ILE HG13 1 1 2 512 1 1 6 ILE HG21 H -2.880 4.699 -5.806 1.00 . A A . 6 ILE HG21 1 1 2 513 1 1 6 ILE HG22 H -2.268 3.584 -4.560 1.00 . A A . 6 ILE HG22 1 1 2 514 1 1 6 ILE HG23 H -3.834 3.268 -5.345 1.00 . A A . 6 ILE HG23 1 1 2 515 1 1 6 ILE N N -1.973 4.930 -2.348 1.00 . A A . 6 ILE N 1 1 2 516 1 1 6 ILE O O -3.779 7.919 -2.662 1.00 . A A . 6 ILE O 1 1 2 517 1 1 7 LEU C C -3.572 8.471 0.189 1.00 . A A . 7 LEU C 1 1 2 518 1 1 7 LEU CA C -4.463 7.250 -0.052 1.00 . A A . 7 LEU CA 1 1 2 519 1 1 7 LEU CB C -4.813 6.483 1.224 1.00 . A A . 7 LEU CB 1 1 2 520 1 1 7 LEU CD1 C -7.029 7.555 1.776 1.00 . A A . 7 LEU CD1 1 1 2 521 1 1 7 LEU CD2 C -5.620 6.518 3.614 1.00 . A A . 7 LEU CD2 1 1 2 522 1 1 7 LEU CG C -5.613 7.258 2.274 1.00 . A A . 7 LEU CG 1 1 2 523 1 1 7 LEU H H -3.619 5.451 -0.677 1.00 . A A . 7 LEU H 1 1 2 524 1 1 7 LEU HA H -5.400 7.588 -0.493 1.00 . A A . 7 LEU HA 1 1 2 525 1 1 7 LEU HB2 H -5.381 5.595 0.947 1.00 . A A . 7 LEU HB2 1 1 2 526 1 1 7 LEU HB3 H -3.887 6.139 1.684 1.00 . A A . 7 LEU HB3 1 1 2 527 1 1 7 LEU HD11 H -6.996 8.372 1.055 1.00 . A A . 7 LEU HD11 1 1 2 528 1 1 7 LEU HD12 H -7.440 6.665 1.299 1.00 . A A . 7 LEU HD12 1 1 2 529 1 1 7 LEU HD13 H -7.658 7.839 2.619 1.00 . A A . 7 LEU HD13 1 1 2 530 1 1 7 LEU HD21 H -4.596 6.395 3.966 1.00 . A A . 7 LEU HD21 1 1 2 531 1 1 7 LEU HD22 H -6.188 7.095 4.344 1.00 . A A . 7 LEU HD22 1 1 2 532 1 1 7 LEU HD23 H -6.081 5.539 3.485 1.00 . A A . 7 LEU HD23 1 1 2 533 1 1 7 LEU HG H -5.122 8.217 2.438 1.00 . A A . 7 LEU HG 1 1 2 534 1 1 7 LEU N N -3.822 6.370 -1.014 1.00 . A A . 7 LEU N 1 1 2 535 1 1 7 LEU O O -4.055 9.602 0.205 1.00 . A A . 7 LEU O 1 1 2 536 1 1 8 GLY C C -1.425 10.337 -0.487 1.00 . A A . 8 GLY C 1 1 2 537 1 1 8 GLY CA C -1.324 9.263 0.597 1.00 . A A . 8 GLY CA 1 1 2 538 1 1 8 GLY H H -1.905 7.276 0.363 1.00 . A A . 8 GLY H 1 1 2 539 1 1 8 GLY HA2 H -1.496 9.711 1.576 1.00 . A A . 8 GLY HA2 1 1 2 540 1 1 8 GLY HA3 H -0.316 8.848 0.610 1.00 . A A . 8 GLY HA3 1 1 2 541 1 1 8 GLY N N -2.288 8.200 0.370 1.00 . A A . 8 GLY N 1 1 2 542 1 1 8 GLY O O -1.322 11.528 -0.198 1.00 . A A . 8 GLY O 1 1 2 543 1 1 9 SER C C -3.210 11.101 -3.116 1.00 . A A . 9 SER C 1 1 2 544 1 1 9 SER CA C -1.739 10.783 -2.844 1.00 . A A . 9 SER CA 1 1 2 545 1 1 9 SER CB C -1.084 10.189 -4.093 1.00 . A A . 9 SER CB 1 1 2 546 1 1 9 SER H H -1.713 8.907 -1.940 1.00 . A A . 9 SER H 1 1 2 547 1 1 9 SER HA H -1.202 11.684 -2.546 1.00 . A A . 9 SER HA 1 1 2 548 1 1 9 SER HB2 H -0.094 9.812 -3.838 1.00 . A A . 9 SER HB2 1 1 2 549 1 1 9 SER HB3 H -1.670 9.338 -4.439 1.00 . A A . 9 SER HB3 1 1 2 550 1 1 9 SER HG H -0.182 11.738 -4.983 1.00 . A A . 9 SER HG 1 1 2 551 1 1 9 SER N N -1.627 9.877 -1.714 1.00 . A A . 9 SER N 1 1 2 552 1 1 9 SER O O -3.556 11.585 -4.193 1.00 . A A . 9 SER O 1 1 2 553 1 1 9 SER OG O -0.972 11.146 -5.143 1.00 . A A . 9 SER OG 1 1 2 554 1 1 10 LEU C C -5.920 11.975 -1.102 1.00 . A A . 10 LEU C 1 1 2 555 1 1 10 LEU CA C -5.465 11.061 -2.242 1.00 . A A . 10 LEU CA 1 1 2 556 1 1 10 LEU CB C -6.231 9.738 -2.312 1.00 . A A . 10 LEU CB 1 1 2 557 1 1 10 LEU CD1 C -7.892 10.376 -4.099 1.00 . A A . 10 LEU CD1 1 1 2 558 1 1 10 LEU CD2 C -5.712 9.241 -4.729 1.00 . A A . 10 LEU CD2 1 1 2 559 1 1 10 LEU CG C -6.816 9.373 -3.678 1.00 . A A . 10 LEU CG 1 1 2 560 1 1 10 LEU H H -3.748 10.427 -1.247 1.00 . A A . 10 LEU H 1 1 2 561 1 1 10 LEU HA H -5.629 11.579 -3.187 1.00 . A A . 10 LEU HA 1 1 2 562 1 1 10 LEU HB2 H -5.562 8.937 -2.000 1.00 . A A . 10 LEU HB2 1 1 2 563 1 1 10 LEU HB3 H -7.045 9.774 -1.588 1.00 . A A . 10 LEU HB3 1 1 2 564 1 1 10 LEU HD11 H -7.712 11.331 -3.606 1.00 . A A . 10 LEU HD11 1 1 2 565 1 1 10 LEU HD12 H -7.857 10.514 -5.180 1.00 . A A . 10 LEU HD12 1 1 2 566 1 1 10 LEU HD13 H -8.873 9.998 -3.813 1.00 . A A . 10 LEU HD13 1 1 2 567 1 1 10 LEU HD21 H -6.025 8.534 -5.497 1.00 . A A . 10 LEU HD21 1 1 2 568 1 1 10 LEU HD22 H -5.526 10.213 -5.185 1.00 . A A . 10 LEU HD22 1 1 2 569 1 1 10 LEU HD23 H -4.799 8.882 -4.254 1.00 . A A . 10 LEU HD23 1 1 2 570 1 1 10 LEU HG H -7.299 8.400 -3.594 1.00 . A A . 10 LEU HG 1 1 2 571 1 1 10 LEU N N -4.038 10.817 -2.121 1.00 . A A . 10 LEU N 1 1 2 572 1 1 10 LEU O O -7.101 12.004 -0.758 1.00 . A A . 10 LEU O 1 1 2 573 1 1 11 LEU C C -5.487 15.012 -0.003 1.00 . A A . 11 LEU C 1 1 2 574 1 1 11 LEU CA C -5.245 13.606 0.551 1.00 . A A . 11 LEU CA 1 1 2 575 1 1 11 LEU CB C -4.134 13.542 1.601 1.00 . A A . 11 LEU CB 1 1 2 576 1 1 11 LEU CD1 C -5.094 15.319 3.110 1.00 . A A . 11 LEU CD1 1 1 2 577 1 1 11 LEU CD2 C -5.530 12.867 3.589 1.00 . A A . 11 LEU CD2 1 1 2 578 1 1 11 LEU CG C -4.543 13.894 3.032 1.00 . A A . 11 LEU CG 1 1 2 579 1 1 11 LEU H H -4.002 12.675 -0.838 1.00 . A A . 11 LEU H 1 1 2 580 1 1 11 LEU HA H -6.161 13.261 1.029 1.00 . A A . 11 LEU HA 1 1 2 581 1 1 11 LEU HB2 H -3.719 12.534 1.600 1.00 . A A . 11 LEU HB2 1 1 2 582 1 1 11 LEU HB3 H -3.334 14.217 1.296 1.00 . A A . 11 LEU HB3 1 1 2 583 1 1 11 LEU HD11 H -5.107 15.648 4.149 1.00 . A A . 11 LEU HD11 1 1 2 584 1 1 11 LEU HD12 H -4.461 15.987 2.526 1.00 . A A . 11 LEU HD12 1 1 2 585 1 1 11 LEU HD13 H -6.108 15.339 2.710 1.00 . A A . 11 LEU HD13 1 1 2 586 1 1 11 LEU HD21 H -6.535 13.100 3.237 1.00 . A A . 11 LEU HD21 1 1 2 587 1 1 11 LEU HD22 H -5.248 11.870 3.249 1.00 . A A . 11 LEU HD22 1 1 2 588 1 1 11 LEU HD23 H -5.511 12.897 4.679 1.00 . A A . 11 LEU HD23 1 1 2 589 1 1 11 LEU HG H -3.653 13.859 3.660 1.00 . A A . 11 LEU HG 1 1 2 590 1 1 11 LEU N N -4.959 12.700 -0.548 1.00 . A A . 11 LEU N 1 1 2 591 1 1 11 LEU O O -6.590 15.545 0.106 1.00 . A A . 11 LEU O 1 1 2 592 1 1 12 MET C C -4.793 16.867 -2.646 1.00 . A A . 12 MET C 1 1 2 593 1 1 12 MET CA C -4.517 16.913 -1.142 1.00 . A A . 12 MET CA 1 1 2 594 1 1 12 MET CB C -3.201 17.651 -0.885 1.00 . A A . 12 MET CB 1 1 2 595 1 1 12 MET CE C -2.113 20.481 0.882 1.00 . A A . 12 MET CE 1 1 2 596 1 1 12 MET CG C -2.999 17.908 0.609 1.00 . A A . 12 MET CG 1 1 2 597 1 1 12 MET H H -3.547 15.128 -0.681 1.00 . A A . 12 MET H 1 1 2 598 1 1 12 MET HA H -5.349 17.394 -0.627 1.00 . A A . 12 MET HA 1 1 2 599 1 1 12 MET HB2 H -2.369 17.063 -1.273 1.00 . A A . 12 MET HB2 1 1 2 600 1 1 12 MET HB3 H -3.201 18.598 -1.425 1.00 . A A . 12 MET HB3 1 1 2 601 1 1 12 MET HE1 H -1.316 21.169 1.166 1.00 . A A . 12 MET HE1 1 1 2 602 1 1 12 MET HE2 H -2.477 20.737 -0.113 1.00 . A A . 12 MET HE2 1 1 2 603 1 1 12 MET HE3 H -2.930 20.557 1.599 1.00 . A A . 12 MET HE3 1 1 2 604 1 1 12 MET HG2 H -3.842 18.473 1.007 1.00 . A A . 12 MET HG2 1 1 2 605 1 1 12 MET HG3 H -2.968 16.962 1.149 1.00 . A A . 12 MET HG3 1 1 2 606 1 1 12 MET N N -4.437 15.573 -0.586 1.00 . A A . 12 MET N 1 1 2 607 1 1 12 MET O O -5.737 17.491 -3.127 1.00 . A A . 12 MET O 1 1 2 608 1 1 12 MET SD S -1.482 18.811 0.873 1.00 . A A . 12 MET SD 1 1 2 609 1 1 13 THR C C -5.167 14.967 -5.132 1.00 . A A . 13 THR C 1 1 2 610 1 1 13 THR CA C -4.086 15.994 -4.788 1.00 . A A . 13 THR CA 1 1 2 611 1 1 13 THR CB C -2.712 15.646 -5.363 1.00 . A A . 13 THR CB 1 1 2 612 1 1 13 THR CG2 C -2.641 14.209 -5.882 1.00 . A A . 13 THR CG2 1 1 2 613 1 1 13 THR H H -3.188 15.613 -2.947 1.00 . A A . 13 THR H 1 1 2 614 1 1 13 THR HA H -4.417 16.952 -5.189 1.00 . A A . 13 THR HA 1 1 2 615 1 1 13 THR HB H -1.925 15.836 -4.633 1.00 . A A . 13 THR HB 1 1 2 616 1 1 13 THR HG1 H -1.914 17.147 -6.420 1.00 . A A . 13 THR HG1 1 1 2 617 1 1 13 THR HG21 H -1.598 13.900 -5.956 1.00 . A A . 13 THR HG21 1 1 2 618 1 1 13 THR HG22 H -3.168 13.548 -5.194 1.00 . A A . 13 THR HG22 1 1 2 619 1 1 13 THR HG23 H -3.106 14.154 -6.866 1.00 . A A . 13 THR HG23 1 1 2 620 1 1 13 THR N N -3.950 16.122 -3.347 1.00 . A A . 13 THR N 1 1 2 621 1 1 13 THR O O -5.619 14.222 -4.265 1.00 . A A . 13 THR O 1 1 2 622 1 1 13 THR OG1 O -2.616 16.445 -6.540 1.00 . A A . 13 THR OG1 1 1 2 623 1 1 14 PRO C C -6.031 12.622 -7.027 1.00 . A A . 14 PRO C 1 1 2 624 1 1 14 PRO CA C -6.584 14.043 -6.903 1.00 . A A . 14 PRO CA 1 1 2 625 1 1 14 PRO CB C -7.049 14.617 -8.231 1.00 . A A . 14 PRO CB 1 1 2 626 1 1 14 PRO CD C -5.040 15.824 -7.491 1.00 . A A . 14 PRO CD 1 1 2 627 1 1 14 PRO CG C -5.953 15.570 -8.680 1.00 . A A . 14 PRO CG 1 1 2 628 1 1 14 PRO HA H -7.331 13.989 -6.240 1.00 . A A . 14 PRO HA 1 1 2 629 1 1 14 PRO HB2 H -7.204 13.826 -8.966 1.00 . A A . 14 PRO HB2 1 1 2 630 1 1 14 PRO HB3 H -7.999 15.139 -8.120 1.00 . A A . 14 PRO HB3 1 1 2 631 1 1 14 PRO HD2 H -4.004 15.581 -7.728 1.00 . A A . 14 PRO HD2 1 1 2 632 1 1 14 PRO HD3 H -5.062 16.872 -7.193 1.00 . A A . 14 PRO HD3 1 1 2 633 1 1 14 PRO HG2 H -5.389 15.140 -9.509 1.00 . A A . 14 PRO HG2 1 1 2 634 1 1 14 PRO HG3 H -6.383 16.505 -9.038 1.00 . A A . 14 PRO HG3 1 1 2 635 1 1 14 PRO N N -5.559 14.961 -6.435 1.00 . A A . 14 PRO N 1 1 2 636 1 1 14 PRO O O -4.854 12.384 -6.759 1.00 . A A . 14 PRO O 1 1 2 637 1 1 15 PRO C C -5.708 10.111 -8.878 1.00 . A A . 15 PRO C 1 1 2 638 1 1 15 PRO CA C -6.543 10.299 -7.610 1.00 . A A . 15 PRO CA 1 1 2 639 1 1 15 PRO CB C -7.853 9.528 -7.641 1.00 . A A . 15 PRO CB 1 1 2 640 1 1 15 PRO CD C -8.333 11.934 -7.765 1.00 . A A . 15 PRO CD 1 1 2 641 1 1 15 PRO CG C -8.932 10.551 -7.957 1.00 . A A . 15 PRO CG 1 1 2 642 1 1 15 PRO HA H -5.959 10.008 -6.852 1.00 . A A . 15 PRO HA 1 1 2 643 1 1 15 PRO HB2 H -7.825 8.742 -8.396 1.00 . A A . 15 PRO HB2 1 1 2 644 1 1 15 PRO HB3 H -8.043 9.043 -6.683 1.00 . A A . 15 PRO HB3 1 1 2 645 1 1 15 PRO HD2 H -8.433 12.538 -8.667 1.00 . A A . 15 PRO HD2 1 1 2 646 1 1 15 PRO HD3 H -8.835 12.475 -6.963 1.00 . A A . 15 PRO HD3 1 1 2 647 1 1 15 PRO HG2 H -9.287 10.427 -8.980 1.00 . A A . 15 PRO HG2 1 1 2 648 1 1 15 PRO HG3 H -9.792 10.413 -7.302 1.00 . A A . 15 PRO HG3 1 1 2 649 1 1 15 PRO N N -6.930 11.690 -7.443 1.00 . A A . 15 PRO N 1 1 2 650 1 1 15 PRO O O -6.062 9.314 -9.746 1.00 . A A . 15 PRO O 1 1 2 651 1 1 16 VAL C C -3.188 9.360 -10.227 1.00 . A A . 16 VAL C 1 1 2 652 1 1 16 VAL CA C -3.729 10.785 -10.094 1.00 . A A . 16 VAL CA 1 1 2 653 1 1 16 VAL CB C -2.623 11.834 -9.968 1.00 . A A . 16 VAL CB 1 1 2 654 1 1 16 VAL CG1 C -3.180 13.244 -10.176 1.00 . A A . 16 VAL CG1 1 1 2 655 1 1 16 VAL CG2 C -1.909 11.720 -8.621 1.00 . A A . 16 VAL CG2 1 1 2 656 1 1 16 VAL H H -4.332 11.499 -8.233 1.00 . A A . 16 VAL H 1 1 2 657 1 1 16 VAL HA H -4.319 11.020 -10.979 1.00 . A A . 16 VAL HA 1 1 2 658 1 1 16 VAL HB H -1.891 11.645 -10.753 1.00 . A A . 16 VAL HB 1 1 2 659 1 1 16 VAL HG11 H -3.987 13.425 -9.466 1.00 . A A . 16 VAL HG11 1 1 2 660 1 1 16 VAL HG12 H -2.387 13.975 -10.017 1.00 . A A . 16 VAL HG12 1 1 2 661 1 1 16 VAL HG13 H -3.563 13.338 -11.192 1.00 . A A . 16 VAL HG13 1 1 2 662 1 1 16 VAL HG21 H -2.532 11.157 -7.926 1.00 . A A . 16 VAL HG21 1 1 2 663 1 1 16 VAL HG22 H -0.958 11.204 -8.756 1.00 . A A . 16 VAL HG22 1 1 2 664 1 1 16 VAL HG23 H -1.727 12.717 -8.220 1.00 . A A . 16 VAL HG23 1 1 2 665 1 1 16 VAL N N -4.615 10.856 -8.945 1.00 . A A . 16 VAL N 1 1 2 666 1 1 16 VAL O O -3.227 8.776 -11.309 1.00 . A A . 16 VAL O 1 1 2 667 1 1 17 ILE C C -3.155 6.528 -9.715 1.00 . A A . 17 ILE C 1 1 2 668 1 1 17 ILE CA C -2.147 7.496 -9.091 1.00 . A A . 17 ILE CA 1 1 2 669 1 1 17 ILE CB C -1.724 7.112 -7.672 1.00 . A A . 17 ILE CB 1 1 2 670 1 1 17 ILE CD1 C -2.512 6.780 -5.299 1.00 . A A . 17 ILE CD1 1 1 2 671 1 1 17 ILE CG1 C -2.865 7.340 -6.679 1.00 . A A . 17 ILE CG1 1 1 2 672 1 1 17 ILE CG2 C -0.449 7.852 -7.260 1.00 . A A . 17 ILE CG2 1 1 2 673 1 1 17 ILE H H -2.668 9.322 -8.236 1.00 . A A . 17 ILE H 1 1 2 674 1 1 17 ILE HA H -1.247 7.500 -9.706 1.00 . A A . 17 ILE HA 1 1 2 675 1 1 17 ILE HB H -1.495 6.046 -7.660 1.00 . A A . 17 ILE HB 1 1 2 676 1 1 17 ILE HD11 H -3.287 7.058 -4.585 1.00 . A A . 17 ILE HD11 1 1 2 677 1 1 17 ILE HD12 H -2.442 5.693 -5.355 1.00 . A A . 17 ILE HD12 1 1 2 678 1 1 17 ILE HD13 H -1.555 7.189 -4.975 1.00 . A A . 17 ILE HD13 1 1 2 679 1 1 17 ILE HG12 H -3.074 8.407 -6.599 1.00 . A A . 17 ILE HG12 1 1 2 680 1 1 17 ILE HG13 H -3.773 6.864 -7.047 1.00 . A A . 17 ILE HG13 1 1 2 681 1 1 17 ILE HG21 H -0.709 8.841 -6.885 1.00 . A A . 17 ILE HG21 1 1 2 682 1 1 17 ILE HG22 H 0.061 7.289 -6.479 1.00 . A A . 17 ILE HG22 1 1 2 683 1 1 17 ILE HG23 H 0.208 7.952 -8.124 1.00 . A A . 17 ILE HG23 1 1 2 684 1 1 17 ILE N N -2.696 8.841 -9.112 1.00 . A A . 17 ILE N 1 1 2 685 1 1 17 ILE O O -2.776 5.479 -10.232 1.00 . A A . 17 ILE O 1 1 2 686 1 1 18 GLN C C -5.967 6.668 -11.528 1.00 . A A . 18 GLN C 1 1 2 687 1 1 18 GLN CA C -5.486 6.095 -10.193 1.00 . A A . 18 GLN CA 1 1 2 688 1 1 18 GLN CB C -6.644 5.968 -9.202 1.00 . A A . 18 GLN CB 1 1 2 689 1 1 18 GLN CD C -7.301 4.888 -7.019 1.00 . A A . 18 GLN CD 1 1 2 690 1 1 18 GLN CG C -6.150 5.473 -7.841 1.00 . A A . 18 GLN CG 1 1 2 691 1 1 18 GLN H H -4.720 7.774 -9.227 1.00 . A A . 18 GLN H 1 1 2 692 1 1 18 GLN HA H -5.042 5.112 -10.351 1.00 . A A . 18 GLN HA 1 1 2 693 1 1 18 GLN HB2 H -7.135 6.934 -9.085 1.00 . A A . 18 GLN HB2 1 1 2 694 1 1 18 GLN HB3 H -7.390 5.277 -9.595 1.00 . A A . 18 GLN HB3 1 1 2 695 1 1 18 GLN HE21 H -6.230 3.181 -6.822 1.00 . A A . 18 GLN HE21 1 1 2 696 1 1 18 GLN HE22 H -7.781 3.178 -6.049 1.00 . A A . 18 GLN HE22 1 1 2 697 1 1 18 GLN HG2 H -5.379 4.715 -7.984 1.00 . A A . 18 GLN HG2 1 1 2 698 1 1 18 GLN HG3 H -5.690 6.296 -7.296 1.00 . A A . 18 GLN HG3 1 1 2 699 1 1 18 GLN N N -4.420 6.917 -9.646 1.00 . A A . 18 GLN N 1 1 2 700 1 1 18 GLN NE2 N -7.086 3.646 -6.595 1.00 . A A . 18 GLN NE2 1 1 2 701 1 1 18 GLN O O -6.275 5.920 -12.454 1.00 . A A . 18 GLN O 1 1 2 702 1 1 18 GLN OE1 O -8.316 5.524 -6.786 1.00 . A A . 18 GLN OE1 1 1 2 703 1 1 19 ALA C C -5.527 8.262 -13.952 1.00 . A A . 19 ALA C 1 1 2 704 1 1 19 ALA CA C -6.439 8.673 -12.795 1.00 . A A . 19 ALA CA 1 1 2 705 1 1 19 ALA CB C -6.433 10.185 -12.557 1.00 . A A . 19 ALA CB 1 1 2 706 1 1 19 ALA H H -5.772 8.592 -10.823 1.00 . A A . 19 ALA H 1 1 2 707 1 1 19 ALA HA H -7.458 8.356 -13.015 1.00 . A A . 19 ALA HA 1 1 2 708 1 1 19 ALA HB1 H -7.160 10.434 -11.784 1.00 . A A . 19 ALA HB1 1 1 2 709 1 1 19 ALA HB2 H -5.440 10.499 -12.237 1.00 . A A . 19 ALA HB2 1 1 2 710 1 1 19 ALA HB3 H -6.697 10.699 -13.482 1.00 . A A . 19 ALA HB3 1 1 2 711 1 1 19 ALA N N -6.015 7.991 -11.584 1.00 . A A . 19 ALA N 1 1 2 712 1 1 19 ALA O O -6.005 7.827 -14.999 1.00 . A A . 19 ALA O 1 1 2 713 1 1 20 ILE C C -3.230 6.579 -14.972 1.00 . A A . 20 ILE C 1 1 2 714 1 1 20 ILE CA C -3.250 8.092 -14.748 1.00 . A A . 20 ILE CA 1 1 2 715 1 1 20 ILE CB C -1.884 8.678 -14.383 1.00 . A A . 20 ILE CB 1 1 2 716 1 1 20 ILE CD1 C -1.547 7.330 -12.278 1.00 . A A . 20 ILE CD1 1 1 2 717 1 1 20 ILE CG1 C -1.012 7.637 -13.678 1.00 . A A . 20 ILE CG1 1 1 2 718 1 1 20 ILE CG2 C -2.039 9.953 -13.552 1.00 . A A . 20 ILE CG2 1 1 2 719 1 1 20 ILE H H -3.849 8.749 -12.864 1.00 . A A . 20 ILE H 1 1 2 720 1 1 20 ILE HA H -3.570 8.574 -15.672 1.00 . A A . 20 ILE HA 1 1 2 721 1 1 20 ILE HB H -1.373 8.954 -15.305 1.00 . A A . 20 ILE HB 1 1 2 722 1 1 20 ILE HD11 H -1.408 6.271 -12.060 1.00 . A A . 20 ILE HD11 1 1 2 723 1 1 20 ILE HD12 H -1.005 7.926 -11.544 1.00 . A A . 20 ILE HD12 1 1 2 724 1 1 20 ILE HD13 H -2.608 7.574 -12.233 1.00 . A A . 20 ILE HD13 1 1 2 725 1 1 20 ILE HG12 H -0.983 6.721 -14.269 1.00 . A A . 20 ILE HG12 1 1 2 726 1 1 20 ILE HG13 H 0.013 8.003 -13.608 1.00 . A A . 20 ILE HG13 1 1 2 727 1 1 20 ILE HG21 H -1.180 10.603 -13.720 1.00 . A A . 20 ILE HG21 1 1 2 728 1 1 20 ILE HG22 H -2.950 10.472 -13.848 1.00 . A A . 20 ILE HG22 1 1 2 729 1 1 20 ILE HG23 H -2.096 9.693 -12.495 1.00 . A A . 20 ILE HG23 1 1 2 730 1 1 20 ILE N N -4.231 8.414 -13.726 1.00 . A A . 20 ILE N 1 1 2 731 1 1 20 ILE O O -2.947 6.115 -16.075 1.00 . A A . 20 ILE O 1 1 2 732 1 1 21 HIS C C -4.598 3.900 -14.908 1.00 . A A . 21 HIS C 1 1 2 733 1 1 21 HIS CA C -3.506 4.399 -13.960 1.00 . A A . 21 HIS CA 1 1 2 734 1 1 21 HIS CB C -3.620 3.802 -12.556 1.00 . A A . 21 HIS CB 1 1 2 735 1 1 21 HIS CD2 C -4.828 1.681 -11.620 1.00 . A A . 21 HIS CD2 1 1 2 736 1 1 21 HIS CE1 C -4.327 0.297 -13.239 1.00 . A A . 21 HIS CE1 1 1 2 737 1 1 21 HIS CG C -4.084 2.365 -12.536 1.00 . A A . 21 HIS CG 1 1 2 738 1 1 21 HIS H H -3.794 6.237 -13.022 1.00 . A A . 21 HIS H 1 1 2 739 1 1 21 HIS HA H -2.532 4.119 -14.362 1.00 . A A . 21 HIS HA 1 1 2 740 1 1 21 HIS HB2 H -2.650 3.867 -12.065 1.00 . A A . 21 HIS HB2 1 1 2 741 1 1 21 HIS HB3 H -4.315 4.405 -11.971 1.00 . A A . 21 HIS HB3 1 1 2 742 1 1 21 HIS HD1 H -3.246 1.665 -14.364 1.00 . A A . 21 HIS HD1 1 1 2 743 1 1 21 HIS HD2 H -5.233 2.091 -10.694 1.00 . A A . 21 HIS HD2 1 1 2 744 1 1 21 HIS HE1 H -4.268 -0.613 -13.836 1.00 . A A . 21 HIS HE1 1 1 2 745 1 1 21 HIS HE2 H -5.429 -0.303 -11.544 1.00 . A A . 21 HIS HE2 1 1 2 746 1 1 21 HIS N N -3.534 5.851 -13.907 1.00 . A A . 21 HIS N 1 1 2 747 1 1 21 HIS ND1 N -3.783 1.466 -13.544 1.00 . A A . 21 HIS ND1 1 1 2 748 1 1 21 HIS NE2 N -4.975 0.433 -12.046 1.00 . A A . 21 HIS NE2 1 1 2 749 1 1 21 HIS O O -4.344 3.052 -15.762 1.00 . A A . 21 HIS O 1 1 2 750 1 1 22 ASP C C -6.551 4.224 -17.026 1.00 . A A . 22 ASP C 1 1 2 751 1 1 22 ASP CA C -6.924 4.064 -15.551 1.00 . A A . 22 ASP CA 1 1 2 752 1 1 22 ASP CB C -8.135 4.956 -15.271 1.00 . A A . 22 ASP CB 1 1 2 753 1 1 22 ASP CG C -9.486 4.238 -15.298 1.00 . A A . 22 ASP CG 1 1 2 754 1 1 22 ASP H H -5.989 5.137 -14.030 1.00 . A A . 22 ASP H 1 1 2 755 1 1 22 ASP HA H -7.136 3.029 -15.285 1.00 . A A . 22 ASP HA 1 1 2 756 1 1 22 ASP HB2 H -8.008 5.420 -14.293 1.00 . A A . 22 ASP HB2 1 1 2 757 1 1 22 ASP HB3 H -8.153 5.761 -16.005 1.00 . A A . 22 ASP HB3 1 1 2 758 1 1 22 ASP N N -5.791 4.446 -14.725 1.00 . A A . 22 ASP N 1 1 2 759 1 1 22 ASP O O -6.846 3.353 -17.843 1.00 . A A . 22 ASP O 1 1 2 760 1 1 22 ASP OD1 O -9.726 3.443 -14.364 1.00 . A A . 22 ASP OD1 1 1 2 761 1 1 22 ASP OD2 O -10.249 4.500 -16.254 1.00 . A A . 22 ASP OD2 1 1 2 762 1 1 23 ALA C C -4.438 4.606 -19.117 1.00 . A A . 23 ALA C 1 1 2 763 1 1 23 ALA CA C -5.491 5.629 -18.685 1.00 . A A . 23 ALA CA 1 1 2 764 1 1 23 ALA CB C -4.975 7.067 -18.771 1.00 . A A . 23 ALA CB 1 1 2 765 1 1 23 ALA H H -5.672 6.048 -16.653 1.00 . A A . 23 ALA H 1 1 2 766 1 1 23 ALA HA H -6.366 5.531 -19.328 1.00 . A A . 23 ALA HA 1 1 2 767 1 1 23 ALA HB1 H -5.809 7.760 -18.657 1.00 . A A . 23 ALA HB1 1 1 2 768 1 1 23 ALA HB2 H -4.248 7.240 -17.978 1.00 . A A . 23 ALA HB2 1 1 2 769 1 1 23 ALA HB3 H -4.501 7.226 -19.740 1.00 . A A . 23 ALA HB3 1 1 2 770 1 1 23 ALA N N -5.907 5.344 -17.323 1.00 . A A . 23 ALA N 1 1 2 771 1 1 23 ALA O O -4.492 4.086 -20.231 1.00 . A A . 23 ALA O 1 1 2 772 1 1 24 GLN C C -3.018 1.959 -18.457 1.00 . A A . 24 GLN C 1 1 2 773 1 1 24 GLN CA C -2.453 3.381 -18.479 1.00 . A A . 24 GLN CA 1 1 2 774 1 1 24 GLN CB C -1.306 3.530 -17.477 1.00 . A A . 24 GLN CB 1 1 2 775 1 1 24 GLN CD C -0.868 5.471 -19.027 1.00 . A A . 24 GLN CD 1 1 2 776 1 1 24 GLN CG C -0.610 4.884 -17.638 1.00 . A A . 24 GLN CG 1 1 2 777 1 1 24 GLN H H -3.462 4.782 -17.313 1.00 . A A . 24 GLN H 1 1 2 778 1 1 24 GLN HA H -2.087 3.619 -19.478 1.00 . A A . 24 GLN HA 1 1 2 779 1 1 24 GLN HB2 H -1.690 3.433 -16.462 1.00 . A A . 24 GLN HB2 1 1 2 780 1 1 24 GLN HB3 H -0.584 2.727 -17.623 1.00 . A A . 24 GLN HB3 1 1 2 781 1 1 24 GLN HE21 H -1.980 6.921 -18.155 1.00 . A A . 24 GLN HE21 1 1 2 782 1 1 24 GLN HE22 H -1.857 7.018 -19.880 1.00 . A A . 24 GLN HE22 1 1 2 783 1 1 24 GLN HG2 H -0.969 5.574 -16.875 1.00 . A A . 24 GLN HG2 1 1 2 784 1 1 24 GLN HG3 H 0.462 4.766 -17.483 1.00 . A A . 24 GLN HG3 1 1 2 785 1 1 24 GLN N N -3.506 4.346 -18.212 1.00 . A A . 24 GLN N 1 1 2 786 1 1 24 GLN NE2 N -1.632 6.560 -19.020 1.00 . A A . 24 GLN NE2 1 1 2 787 1 1 24 GLN O O -2.758 1.171 -19.365 1.00 . A A . 24 GLN O 1 1 2 788 1 1 24 GLN OE1 O -0.405 4.969 -20.038 1.00 . A A . 24 GLN OE1 1 1 2 789 1 1 25 ARG C C -3.336 -0.732 -17.435 1.00 . A A . 25 ARG C 1 1 2 790 1 1 25 ARG CA C -4.389 0.365 -17.263 1.00 . A A . 25 ARG CA 1 1 2 791 1 1 25 ARG CB C -5.505 0.156 -18.288 1.00 . A A . 25 ARG CB 1 1 2 792 1 1 25 ARG CD C -7.998 0.228 -18.660 1.00 . A A . 25 ARG CD 1 1 2 793 1 1 25 ARG CG C -6.879 0.187 -17.617 1.00 . A A . 25 ARG CG 1 1 2 794 1 1 25 ARG CZ C -8.003 1.502 -20.802 1.00 . A A . 25 ARG CZ 1 1 2 795 1 1 25 ARG H H -3.984 2.322 -16.676 1.00 . A A . 25 ARG H 1 1 2 796 1 1 25 ARG HA H -4.798 0.360 -16.253 1.00 . A A . 25 ARG HA 1 1 2 797 1 1 25 ARG HB2 H -5.452 0.932 -19.052 1.00 . A A . 25 ARG HB2 1 1 2 798 1 1 25 ARG HB3 H -5.365 -0.799 -18.794 1.00 . A A . 25 ARG HB3 1 1 2 799 1 1 25 ARG HD2 H -7.935 -0.645 -19.308 1.00 . A A . 25 ARG HD2 1 1 2 800 1 1 25 ARG HD3 H -8.969 0.189 -18.165 1.00 . A A . 25 ARG HD3 1 1 2 801 1 1 25 ARG HE H -7.729 2.326 -18.986 1.00 . A A . 25 ARG HE 1 1 2 802 1 1 25 ARG HG2 H -6.999 -0.692 -16.984 1.00 . A A . 25 ARG HG2 1 1 2 803 1 1 25 ARG HG3 H -6.951 1.059 -16.967 1.00 . A A . 25 ARG HG3 1 1 2 804 1 1 25 ARG HH11 H -8.305 -0.499 -21.003 1.00 . A A . 25 ARG HH11 1 1 2 805 1 1 25 ARG HH12 H -8.305 0.400 -22.484 1.00 . A A . 25 ARG HH12 1 1 2 806 1 1 25 ARG HH21 H -7.730 3.512 -20.939 1.00 . A A . 25 ARG HH21 1 1 2 807 1 1 25 ARG HH22 H -7.976 2.697 -22.447 1.00 . A A . 25 ARG HH22 1 1 2 808 1 1 25 ARG N N -3.780 1.676 -17.412 1.00 . A A . 25 ARG N 1 1 2 809 1 1 25 ARG NE N -7.893 1.465 -19.467 1.00 . A A . 25 ARG NE 1 1 2 810 1 1 25 ARG NH1 N -8.223 0.372 -21.488 1.00 . A A . 25 ARG NH1 1 1 2 811 1 1 25 ARG NH2 N -7.894 2.669 -21.451 1.00 . A A . 25 ARG NH2 1 1 2 812 1 1 25 ARG O O -3.581 -1.732 -18.108 1.00 . A A . 25 ARG O 1 1 3 813 1 1 1 PHE C C 1.131 0.000 -2.451 1.00 . A A . 1 PHE C 1 1 3 814 1 1 1 PHE CA C 2.073 0.000 -1.245 1.00 . A A . 1 PHE CA 1 1 3 815 1 1 1 PHE CB C 2.908 -1.282 -1.266 1.00 . A A . 1 PHE CB 1 1 3 816 1 1 1 PHE CD1 C 1.445 -3.040 -0.247 1.00 . A A . 1 PHE CD1 1 1 3 817 1 1 1 PHE CD2 C 1.972 -3.227 -2.535 1.00 . A A . 1 PHE CD2 1 1 3 818 1 1 1 PHE CE1 C 0.674 -4.230 -0.327 1.00 . A A . 1 PHE CE1 1 1 3 819 1 1 1 PHE CE2 C 1.202 -4.417 -2.615 1.00 . A A . 1 PHE CE2 1 1 3 820 1 1 1 PHE CG C 2.078 -2.564 -1.352 1.00 . A A . 1 PHE CG 1 1 3 821 1 1 1 PHE CZ C 0.569 -4.894 -1.510 1.00 . A A . 1 PHE CZ 1 1 3 822 1 1 1 PHE H1 H 1.884 0.000 0.829 1.00 . A A . 1 PHE H1 1 1 3 823 1 1 1 PHE HA H 2.678 0.907 -1.259 1.00 . A A . 1 PHE HA 1 1 3 824 1 1 1 PHE HB2 H 3.591 -1.245 -2.114 1.00 . A A . 1 PHE HB2 1 1 3 825 1 1 1 PHE HB3 H 3.521 -1.318 -0.365 1.00 . A A . 1 PHE HB3 1 1 3 826 1 1 1 PHE HD1 H 1.530 -2.509 0.701 1.00 . A A . 1 PHE HD1 1 1 3 827 1 1 1 PHE HD2 H 2.480 -2.846 -3.421 1.00 . A A . 1 PHE HD2 1 1 3 828 1 1 1 PHE HE1 H 0.167 -4.612 0.559 1.00 . A A . 1 PHE HE1 1 1 3 829 1 1 1 PHE HE2 H 1.117 -4.949 -3.563 1.00 . A A . 1 PHE HE2 1 1 3 830 1 1 1 PHE HZ H -0.023 -5.807 -1.571 1.00 . A A . 1 PHE HZ 1 1 3 831 1 1 1 PHE N N 1.325 0.000 0.000 1.00 . A A . 1 PHE N 1 1 3 832 1 1 1 PHE O O 0.005 0.487 -2.364 1.00 . A A . 1 PHE O 1 1 3 833 1 1 2 LEU C C -0.505 0.062 -4.549 1.00 . A A . 2 LEU C 1 1 3 834 1 1 2 LEU CA C 0.832 -0.653 -4.761 1.00 . A A . 2 LEU CA 1 1 3 835 1 1 2 LEU CB C 0.687 -2.115 -5.186 1.00 . A A . 2 LEU CB 1 1 3 836 1 1 2 LEU CD1 C -1.416 -2.135 -6.578 1.00 . A A . 2 LEU CD1 1 1 3 837 1 1 2 LEU CD2 C 0.801 -1.489 -7.626 1.00 . A A . 2 LEU CD2 1 1 3 838 1 1 2 LEU CG C 0.098 -2.353 -6.578 1.00 . A A . 2 LEU CG 1 1 3 839 1 1 2 LEU H H 2.552 -0.925 -3.619 1.00 . A A . 2 LEU H 1 1 3 840 1 1 2 LEU HA H 1.376 -0.139 -5.553 1.00 . A A . 2 LEU HA 1 1 3 841 1 1 2 LEU HB2 H 1.670 -2.584 -5.144 1.00 . A A . 2 LEU HB2 1 1 3 842 1 1 2 LEU HB3 H 0.059 -2.625 -4.456 1.00 . A A . 2 LEU HB3 1 1 3 843 1 1 2 LEU HD11 H -1.630 -1.069 -6.660 1.00 . A A . 2 LEU HD11 1 1 3 844 1 1 2 LEU HD12 H -1.860 -2.661 -7.423 1.00 . A A . 2 LEU HD12 1 1 3 845 1 1 2 LEU HD13 H -1.839 -2.520 -5.649 1.00 . A A . 2 LEU HD13 1 1 3 846 1 1 2 LEU HD21 H 1.876 -1.504 -7.448 1.00 . A A . 2 LEU HD21 1 1 3 847 1 1 2 LEU HD22 H 0.592 -1.882 -8.621 1.00 . A A . 2 LEU HD22 1 1 3 848 1 1 2 LEU HD23 H 0.436 -0.464 -7.557 1.00 . A A . 2 LEU HD23 1 1 3 849 1 1 2 LEU HG H 0.273 -3.394 -6.849 1.00 . A A . 2 LEU HG 1 1 3 850 1 1 2 LEU N N 1.627 -0.552 -3.549 1.00 . A A . 2 LEU N 1 1 3 851 1 1 2 LEU O O -0.733 1.136 -5.103 1.00 . A A . 2 LEU O 1 1 3 852 1 1 3 PRO C C -2.613 1.157 -2.501 1.00 . A A . 3 PRO C 1 1 3 853 1 1 3 PRO CA C -2.695 -0.034 -3.459 1.00 . A A . 3 PRO CA 1 1 3 854 1 1 3 PRO CB C -3.495 -1.196 -2.893 1.00 . A A . 3 PRO CB 1 1 3 855 1 1 3 PRO CD C -1.127 -1.838 -3.027 1.00 . A A . 3 PRO CD 1 1 3 856 1 1 3 PRO CG C -2.472 -2.221 -2.431 1.00 . A A . 3 PRO CG 1 1 3 857 1 1 3 PRO HA H -3.101 0.320 -4.301 1.00 . A A . 3 PRO HA 1 1 3 858 1 1 3 PRO HB2 H -4.125 -0.871 -2.065 1.00 . A A . 3 PRO HB2 1 1 3 859 1 1 3 PRO HB3 H -4.157 -1.619 -3.649 1.00 . A A . 3 PRO HB3 1 1 3 860 1 1 3 PRO HD2 H -0.370 -1.719 -2.252 1.00 . A A . 3 PRO HD2 1 1 3 861 1 1 3 PRO HD3 H -0.765 -2.606 -3.711 1.00 . A A . 3 PRO HD3 1 1 3 862 1 1 3 PRO HG2 H -2.416 -2.240 -1.343 1.00 . A A . 3 PRO HG2 1 1 3 863 1 1 3 PRO HG3 H -2.762 -3.221 -2.752 1.00 . A A . 3 PRO HG3 1 1 3 864 1 1 3 PRO N N -1.375 -0.580 -3.725 1.00 . A A . 3 PRO N 1 1 3 865 1 1 3 PRO O O -2.948 2.280 -2.872 1.00 . A A . 3 PRO O 1 1 3 866 1 1 4 LEU C C -0.987 2.906 -0.667 1.00 . A A . 4 LEU C 1 1 3 867 1 1 4 LEU CA C -2.064 1.897 -0.265 1.00 . A A . 4 LEU CA 1 1 3 868 1 1 4 LEU CB C -1.832 1.264 1.109 1.00 . A A . 4 LEU CB 1 1 3 869 1 1 4 LEU CD1 C -3.685 -0.445 1.193 1.00 . A A . 4 LEU CD1 1 1 3 870 1 1 4 LEU CD2 C -2.790 0.573 3.337 1.00 . A A . 4 LEU CD2 1 1 3 871 1 1 4 LEU CG C -3.086 0.798 1.853 1.00 . A A . 4 LEU CG 1 1 3 872 1 1 4 LEU H H -1.874 -0.043 -1.000 1.00 . A A . 4 LEU H 1 1 3 873 1 1 4 LEU HA H -3.023 2.413 -0.224 1.00 . A A . 4 LEU HA 1 1 3 874 1 1 4 LEU HB2 H -1.168 0.408 0.985 1.00 . A A . 4 LEU HB2 1 1 3 875 1 1 4 LEU HB3 H -1.309 1.986 1.735 1.00 . A A . 4 LEU HB3 1 1 3 876 1 1 4 LEU HD11 H -2.889 -1.151 0.957 1.00 . A A . 4 LEU HD11 1 1 3 877 1 1 4 LEU HD12 H -4.395 -0.912 1.875 1.00 . A A . 4 LEU HD12 1 1 3 878 1 1 4 LEU HD13 H -4.199 -0.157 0.275 1.00 . A A . 4 LEU HD13 1 1 3 879 1 1 4 LEU HD21 H -2.404 1.494 3.774 1.00 . A A . 4 LEU HD21 1 1 3 880 1 1 4 LEU HD22 H -3.707 0.284 3.850 1.00 . A A . 4 LEU HD22 1 1 3 881 1 1 4 LEU HD23 H -2.049 -0.219 3.444 1.00 . A A . 4 LEU HD23 1 1 3 882 1 1 4 LEU HG H -3.834 1.589 1.790 1.00 . A A . 4 LEU HG 1 1 3 883 1 1 4 LEU N N -2.165 0.870 -1.288 1.00 . A A . 4 LEU N 1 1 3 884 1 1 4 LEU O O -1.077 4.084 -0.324 1.00 . A A . 4 LEU O 1 1 3 885 1 1 5 LEU C C 0.575 4.303 -2.805 1.00 . A A . 5 LEU C 1 1 3 886 1 1 5 LEU CA C 1.106 3.249 -1.830 1.00 . A A . 5 LEU CA 1 1 3 887 1 1 5 LEU CB C 2.238 2.395 -2.404 1.00 . A A . 5 LEU CB 1 1 3 888 1 1 5 LEU CD1 C 3.859 4.234 -1.815 1.00 . A A . 5 LEU CD1 1 1 3 889 1 1 5 LEU CD2 C 4.658 2.185 -3.080 1.00 . A A . 5 LEU CD2 1 1 3 890 1 1 5 LEU CG C 3.497 3.150 -2.833 1.00 . A A . 5 LEU CG 1 1 3 891 1 1 5 LEU H H 0.069 1.450 -1.668 1.00 . A A . 5 LEU H 1 1 3 892 1 1 5 LEU HA H 1.501 3.759 -0.951 1.00 . A A . 5 LEU HA 1 1 3 893 1 1 5 LEU HB2 H 2.520 1.652 -1.658 1.00 . A A . 5 LEU HB2 1 1 3 894 1 1 5 LEU HB3 H 1.853 1.850 -3.266 1.00 . A A . 5 LEU HB3 1 1 3 895 1 1 5 LEU HD11 H 3.722 3.845 -0.806 1.00 . A A . 5 LEU HD11 1 1 3 896 1 1 5 LEU HD12 H 4.900 4.528 -1.953 1.00 . A A . 5 LEU HD12 1 1 3 897 1 1 5 LEU HD13 H 3.214 5.100 -1.962 1.00 . A A . 5 LEU HD13 1 1 3 898 1 1 5 LEU HD21 H 4.397 1.501 -3.888 1.00 . A A . 5 LEU HD21 1 1 3 899 1 1 5 LEU HD22 H 5.548 2.750 -3.355 1.00 . A A . 5 LEU HD22 1 1 3 900 1 1 5 LEU HD23 H 4.856 1.615 -2.172 1.00 . A A . 5 LEU HD23 1 1 3 901 1 1 5 LEU HG H 3.289 3.652 -3.778 1.00 . A A . 5 LEU HG 1 1 3 902 1 1 5 LEU N N 0.007 2.408 -1.387 1.00 . A A . 5 LEU N 1 1 3 903 1 1 5 LEU O O 0.835 5.493 -2.639 1.00 . A A . 5 LEU O 1 1 3 904 1 1 6 ILE C C -1.770 5.610 -4.171 1.00 . A A . 6 ILE C 1 1 3 905 1 1 6 ILE CA C -0.712 4.709 -4.811 1.00 . A A . 6 ILE CA 1 1 3 906 1 1 6 ILE CB C -1.232 3.901 -6.002 1.00 . A A . 6 ILE CB 1 1 3 907 1 1 6 ILE CD1 C -2.776 2.042 -6.720 1.00 . A A . 6 ILE CD1 1 1 3 908 1 1 6 ILE CG1 C -2.388 2.991 -5.585 1.00 . A A . 6 ILE CG1 1 1 3 909 1 1 6 ILE CG2 C -0.099 3.120 -6.670 1.00 . A A . 6 ILE CG2 1 1 3 910 1 1 6 ILE H H -0.375 2.857 -3.920 1.00 . A A . 6 ILE H 1 1 3 911 1 1 6 ILE HA H 0.100 5.337 -5.177 1.00 . A A . 6 ILE HA 1 1 3 912 1 1 6 ILE HB H -1.622 4.598 -6.743 1.00 . A A . 6 ILE HB 1 1 3 913 1 1 6 ILE HD11 H -2.062 1.220 -6.767 1.00 . A A . 6 ILE HD11 1 1 3 914 1 1 6 ILE HD12 H -3.775 1.645 -6.537 1.00 . A A . 6 ILE HD12 1 1 3 915 1 1 6 ILE HD13 H -2.769 2.584 -7.666 1.00 . A A . 6 ILE HD13 1 1 3 916 1 1 6 ILE HG12 H -2.101 2.413 -4.705 1.00 . A A . 6 ILE HG12 1 1 3 917 1 1 6 ILE HG13 H -3.249 3.596 -5.302 1.00 . A A . 6 ILE HG13 1 1 3 918 1 1 6 ILE HG21 H 0.763 3.089 -6.004 1.00 . A A . 6 ILE HG21 1 1 3 919 1 1 6 ILE HG22 H -0.433 2.103 -6.880 1.00 . A A . 6 ILE HG22 1 1 3 920 1 1 6 ILE HG23 H 0.180 3.610 -7.603 1.00 . A A . 6 ILE HG23 1 1 3 921 1 1 6 ILE N N -0.158 3.826 -3.800 1.00 . A A . 6 ILE N 1 1 3 922 1 1 6 ILE O O -1.907 6.775 -4.543 1.00 . A A . 6 ILE O 1 1 3 923 1 1 7 LEU C C -2.944 7.027 -1.894 1.00 . A A . 7 LEU C 1 1 3 924 1 1 7 LEU CA C -3.541 5.771 -2.531 1.00 . A A . 7 LEU CA 1 1 3 925 1 1 7 LEU CB C -4.266 4.862 -1.537 1.00 . A A . 7 LEU CB 1 1 3 926 1 1 7 LEU CD1 C -5.453 6.590 -0.135 1.00 . A A . 7 LEU CD1 1 1 3 927 1 1 7 LEU CD2 C -6.572 5.636 -2.202 1.00 . A A . 7 LEU CD2 1 1 3 928 1 1 7 LEU CG C -5.622 5.364 -1.035 1.00 . A A . 7 LEU CG 1 1 3 929 1 1 7 LEU H H -2.370 4.091 -2.918 1.00 . A A . 7 LEU H 1 1 3 930 1 1 7 LEU HA H -4.271 6.076 -3.280 1.00 . A A . 7 LEU HA 1 1 3 931 1 1 7 LEU HB2 H -4.412 3.888 -2.004 1.00 . A A . 7 LEU HB2 1 1 3 932 1 1 7 LEU HB3 H -3.617 4.708 -0.675 1.00 . A A . 7 LEU HB3 1 1 3 933 1 1 7 LEU HD11 H -4.521 6.506 0.424 1.00 . A A . 7 LEU HD11 1 1 3 934 1 1 7 LEU HD12 H -5.428 7.491 -0.749 1.00 . A A . 7 LEU HD12 1 1 3 935 1 1 7 LEU HD13 H -6.290 6.648 0.561 1.00 . A A . 7 LEU HD13 1 1 3 936 1 1 7 LEU HD21 H -7.603 5.592 -1.849 1.00 . A A . 7 LEU HD21 1 1 3 937 1 1 7 LEU HD22 H -6.370 6.625 -2.612 1.00 . A A . 7 LEU HD22 1 1 3 938 1 1 7 LEU HD23 H -6.421 4.884 -2.976 1.00 . A A . 7 LEU HD23 1 1 3 939 1 1 7 LEU HG H -6.073 4.579 -0.428 1.00 . A A . 7 LEU HG 1 1 3 940 1 1 7 LEU N N -2.492 5.037 -3.219 1.00 . A A . 7 LEU N 1 1 3 941 1 1 7 LEU O O -3.450 8.130 -2.096 1.00 . A A . 7 LEU O 1 1 3 942 1 1 8 GLY C C -0.785 8.995 -1.475 1.00 . A A . 8 GLY C 1 1 3 943 1 1 8 GLY CA C -1.206 7.921 -0.470 1.00 . A A . 8 GLY CA 1 1 3 944 1 1 8 GLY H H -1.473 5.918 -0.976 1.00 . A A . 8 GLY H 1 1 3 945 1 1 8 GLY HA2 H -1.868 8.357 0.278 1.00 . A A . 8 GLY HA2 1 1 3 946 1 1 8 GLY HA3 H -0.328 7.550 0.060 1.00 . A A . 8 GLY HA3 1 1 3 947 1 1 8 GLY N N -1.877 6.819 -1.137 1.00 . A A . 8 GLY N 1 1 3 948 1 1 8 GLY O O -0.831 10.186 -1.171 1.00 . A A . 8 GLY O 1 1 3 949 1 1 9 SER C C -1.128 9.792 -4.612 1.00 . A A . 9 SER C 1 1 3 950 1 1 9 SER CA C 0.050 9.442 -3.700 1.00 . A A . 9 SER CA 1 1 3 951 1 1 9 SER CB C 1.190 8.832 -4.518 1.00 . A A . 9 SER CB 1 1 3 952 1 1 9 SER H H -0.355 7.566 -2.892 1.00 . A A . 9 SER H 1 1 3 953 1 1 9 SER HA H 0.410 10.331 -3.183 1.00 . A A . 9 SER HA 1 1 3 954 1 1 9 SER HB2 H 1.970 8.477 -3.844 1.00 . A A . 9 SER HB2 1 1 3 955 1 1 9 SER HB3 H 0.821 7.963 -5.063 1.00 . A A . 9 SER HB3 1 1 3 956 1 1 9 SER HG H 2.317 10.428 -4.950 1.00 . A A . 9 SER HG 1 1 3 957 1 1 9 SER N N -0.385 8.536 -2.651 1.00 . A A . 9 SER N 1 1 3 958 1 1 9 SER O O -0.933 10.229 -5.745 1.00 . A A . 9 SER O 1 1 3 959 1 1 9 SER OG O 1.747 9.767 -5.438 1.00 . A A . 9 SER OG 1 1 3 960 1 1 10 LEU C C -4.331 10.965 -4.129 1.00 . A A . 10 LEU C 1 1 3 961 1 1 10 LEU CA C -3.535 9.867 -4.837 1.00 . A A . 10 LEU CA 1 1 3 962 1 1 10 LEU CB C -4.332 8.581 -5.067 1.00 . A A . 10 LEU CB 1 1 3 963 1 1 10 LEU CD1 C -5.257 9.140 -7.345 1.00 . A A . 10 LEU CD1 1 1 3 964 1 1 10 LEU CD2 C -3.091 7.837 -7.132 1.00 . A A . 10 LEU CD2 1 1 3 965 1 1 10 LEU CG C -4.464 8.124 -6.521 1.00 . A A . 10 LEU CG 1 1 3 966 1 1 10 LEU H H -2.476 9.238 -3.157 1.00 . A A . 10 LEU H 1 1 3 967 1 1 10 LEU HA H -3.231 10.236 -5.816 1.00 . A A . 10 LEU HA 1 1 3 968 1 1 10 LEU HB2 H -3.864 7.780 -4.496 1.00 . A A . 10 LEU HB2 1 1 3 969 1 1 10 LEU HB3 H -5.333 8.720 -4.658 1.00 . A A . 10 LEU HB3 1 1 3 970 1 1 10 LEU HD11 H -5.566 8.684 -8.285 1.00 . A A . 10 LEU HD11 1 1 3 971 1 1 10 LEU HD12 H -6.139 9.453 -6.786 1.00 . A A . 10 LEU HD12 1 1 3 972 1 1 10 LEU HD13 H -4.631 10.008 -7.552 1.00 . A A . 10 LEU HD13 1 1 3 973 1 1 10 LEU HD21 H -2.331 7.877 -6.352 1.00 . A A . 10 LEU HD21 1 1 3 974 1 1 10 LEU HD22 H -3.095 6.845 -7.585 1.00 . A A . 10 LEU HD22 1 1 3 975 1 1 10 LEU HD23 H -2.869 8.583 -7.894 1.00 . A A . 10 LEU HD23 1 1 3 976 1 1 10 LEU HG H -5.025 7.190 -6.536 1.00 . A A . 10 LEU HG 1 1 3 977 1 1 10 LEU N N -2.326 9.587 -4.082 1.00 . A A . 10 LEU N 1 1 3 978 1 1 10 LEU O O -4.179 11.169 -2.926 1.00 . A A . 10 LEU O 1 1 3 979 1 1 11 LEU C C -5.090 13.775 -3.732 1.00 . A A . 11 LEU C 1 1 3 980 1 1 11 LEU CA C -5.988 12.711 -4.368 1.00 . A A . 11 LEU CA 1 1 3 981 1 1 11 LEU CB C -7.039 12.143 -3.412 1.00 . A A . 11 LEU CB 1 1 3 982 1 1 11 LEU CD1 C -9.001 12.691 -4.898 1.00 . A A . 11 LEU CD1 1 1 3 983 1 1 11 LEU CD2 C -8.029 10.348 -4.880 1.00 . A A . 11 LEU CD2 1 1 3 984 1 1 11 LEU CG C -8.317 11.608 -4.062 1.00 . A A . 11 LEU CG 1 1 3 985 1 1 11 LEU H H -5.274 11.477 -5.886 1.00 . A A . 11 LEU H 1 1 3 986 1 1 11 LEU HA H -6.522 13.164 -5.203 1.00 . A A . 11 LEU HA 1 1 3 987 1 1 11 LEU HB2 H -6.582 11.337 -2.838 1.00 . A A . 11 LEU HB2 1 1 3 988 1 1 11 LEU HB3 H -7.315 12.923 -2.702 1.00 . A A . 11 LEU HB3 1 1 3 989 1 1 11 LEU HD11 H -8.543 12.730 -5.886 1.00 . A A . 11 LEU HD11 1 1 3 990 1 1 11 LEU HD12 H -10.061 12.457 -4.998 1.00 . A A . 11 LEU HD12 1 1 3 991 1 1 11 LEU HD13 H -8.887 13.657 -4.406 1.00 . A A . 11 LEU HD13 1 1 3 992 1 1 11 LEU HD21 H -7.327 9.715 -4.338 1.00 . A A . 11 LEU HD21 1 1 3 993 1 1 11 LEU HD22 H -8.958 9.802 -5.045 1.00 . A A . 11 LEU HD22 1 1 3 994 1 1 11 LEU HD23 H -7.598 10.629 -5.841 1.00 . A A . 11 LEU HD23 1 1 3 995 1 1 11 LEU HG H -9.010 11.326 -3.270 1.00 . A A . 11 LEU HG 1 1 3 996 1 1 11 LEU N N -5.161 11.645 -4.907 1.00 . A A . 11 LEU N 1 1 3 997 1 1 11 LEU O O -5.563 14.619 -2.974 1.00 . A A . 11 LEU O 1 1 3 998 1 1 12 MET C C -1.717 14.903 -4.531 1.00 . A A . 12 MET C 1 1 3 999 1 1 12 MET CA C -2.839 14.635 -3.526 1.00 . A A . 12 MET CA 1 1 3 1000 1 1 12 MET CB C -2.244 14.067 -2.236 1.00 . A A . 12 MET CB 1 1 3 1001 1 1 12 MET CE C -1.825 15.099 1.061 1.00 . A A . 12 MET CE 1 1 3 1002 1 1 12 MET CG C -3.244 14.164 -1.082 1.00 . A A . 12 MET CG 1 1 3 1003 1 1 12 MET H H -3.434 13.015 -4.692 1.00 . A A . 12 MET H 1 1 3 1004 1 1 12 MET HA H -3.393 15.554 -3.336 1.00 . A A . 12 MET HA 1 1 3 1005 1 1 12 MET HB2 H -1.961 13.026 -2.390 1.00 . A A . 12 MET HB2 1 1 3 1006 1 1 12 MET HB3 H -1.334 14.610 -1.980 1.00 . A A . 12 MET HB3 1 1 3 1007 1 1 12 MET HE1 H -1.312 14.907 2.004 1.00 . A A . 12 MET HE1 1 1 3 1008 1 1 12 MET HE2 H -1.119 15.513 0.341 1.00 . A A . 12 MET HE2 1 1 3 1009 1 1 12 MET HE3 H -2.635 15.810 1.226 1.00 . A A . 12 MET HE3 1 1 3 1010 1 1 12 MET HG2 H -3.567 15.197 -0.955 1.00 . A A . 12 MET HG2 1 1 3 1011 1 1 12 MET HG3 H -4.134 13.577 -1.310 1.00 . A A . 12 MET HG3 1 1 3 1012 1 1 12 MET N N -3.810 13.699 -4.066 1.00 . A A . 12 MET N 1 1 3 1013 1 1 12 MET O O -1.674 15.965 -5.151 1.00 . A A . 12 MET O 1 1 3 1014 1 1 12 MET SD S -2.495 13.571 0.426 1.00 . A A . 12 MET SD 1 1 3 1015 1 1 13 THR C C 0.753 12.671 -6.043 1.00 . A A . 13 THR C 1 1 3 1016 1 1 13 THR CA C 0.298 14.049 -5.560 1.00 . A A . 13 THR CA 1 1 3 1017 1 1 13 THR CB C 1.394 14.829 -4.830 1.00 . A A . 13 THR CB 1 1 3 1018 1 1 13 THR CG2 C 2.513 15.285 -5.769 1.00 . A A . 13 THR CG2 1 1 3 1019 1 1 13 THR H H -0.889 13.054 -4.168 1.00 . A A . 13 THR H 1 1 3 1020 1 1 13 THR HA H -0.021 14.607 -6.440 1.00 . A A . 13 THR HA 1 1 3 1021 1 1 13 THR HB H 1.795 14.251 -3.998 1.00 . A A . 13 THR HB 1 1 3 1022 1 1 13 THR HG1 H 0.556 16.021 -3.458 1.00 . A A . 13 THR HG1 1 1 3 1023 1 1 13 THR HG21 H 2.087 15.875 -6.582 1.00 . A A . 13 THR HG21 1 1 3 1024 1 1 13 THR HG22 H 3.227 15.893 -5.215 1.00 . A A . 13 THR HG22 1 1 3 1025 1 1 13 THR HG23 H 3.020 14.412 -6.181 1.00 . A A . 13 THR HG23 1 1 3 1026 1 1 13 THR N N -0.836 13.922 -4.661 1.00 . A A . 13 THR N 1 1 3 1027 1 1 13 THR O O 0.887 11.743 -5.247 1.00 . A A . 13 THR O 1 1 3 1028 1 1 13 THR OG1 O 0.755 16.041 -4.438 1.00 . A A . 13 THR OG1 1 1 3 1029 1 1 14 PRO C C 2.891 11.052 -7.671 1.00 . A A . 14 PRO C 1 1 3 1030 1 1 14 PRO CA C 1.418 11.328 -7.980 1.00 . A A . 14 PRO CA 1 1 3 1031 1 1 14 PRO CB C 1.143 11.488 -9.466 1.00 . A A . 14 PRO CB 1 1 3 1032 1 1 14 PRO CD C 0.841 13.658 -8.353 1.00 . A A . 14 PRO CD 1 1 3 1033 1 1 14 PRO CG C 1.002 12.983 -9.705 1.00 . A A . 14 PRO CG 1 1 3 1034 1 1 14 PRO HA H 0.908 10.561 -7.590 1.00 . A A . 14 PRO HA 1 1 3 1035 1 1 14 PRO HB2 H 1.956 11.073 -10.061 1.00 . A A . 14 PRO HB2 1 1 3 1036 1 1 14 PRO HB3 H 0.235 10.959 -9.755 1.00 . A A . 14 PRO HB3 1 1 3 1037 1 1 14 PRO HD2 H 1.597 14.429 -8.203 1.00 . A A . 14 PRO HD2 1 1 3 1038 1 1 14 PRO HD3 H -0.131 14.143 -8.265 1.00 . A A . 14 PRO HD3 1 1 3 1039 1 1 14 PRO HG2 H 1.879 13.371 -10.224 1.00 . A A . 14 PRO HG2 1 1 3 1040 1 1 14 PRO HG3 H 0.140 13.188 -10.339 1.00 . A A . 14 PRO HG3 1 1 3 1041 1 1 14 PRO N N 0.985 12.578 -7.380 1.00 . A A . 14 PRO N 1 1 3 1042 1 1 14 PRO O O 3.575 11.894 -7.092 1.00 . A A . 14 PRO O 1 1 3 1043 1 1 15 PRO C C 5.667 10.163 -8.828 1.00 . A A . 15 PRO C 1 1 3 1044 1 1 15 PRO CA C 4.727 9.443 -7.859 1.00 . A A . 15 PRO CA 1 1 3 1045 1 1 15 PRO CB C 4.737 7.933 -8.033 1.00 . A A . 15 PRO CB 1 1 3 1046 1 1 15 PRO CD C 2.564 8.814 -8.766 1.00 . A A . 15 PRO CD 1 1 3 1047 1 1 15 PRO CG C 3.469 7.594 -8.799 1.00 . A A . 15 PRO CG 1 1 3 1048 1 1 15 PRO HA H 5.022 9.713 -6.942 1.00 . A A . 15 PRO HA 1 1 3 1049 1 1 15 PRO HB2 H 5.623 7.609 -8.579 1.00 . A A . 15 PRO HB2 1 1 3 1050 1 1 15 PRO HB3 H 4.757 7.429 -7.066 1.00 . A A . 15 PRO HB3 1 1 3 1051 1 1 15 PRO HD2 H 2.290 9.131 -9.772 1.00 . A A . 15 PRO HD2 1 1 3 1052 1 1 15 PRO HD3 H 1.635 8.604 -8.234 1.00 . A A . 15 PRO HD3 1 1 3 1053 1 1 15 PRO HG2 H 3.706 7.322 -9.827 1.00 . A A . 15 PRO HG2 1 1 3 1054 1 1 15 PRO HG3 H 2.970 6.736 -8.349 1.00 . A A . 15 PRO HG3 1 1 3 1055 1 1 15 PRO N N 3.347 9.839 -8.081 1.00 . A A . 15 PRO N 1 1 3 1056 1 1 15 PRO O O 6.350 9.523 -9.627 1.00 . A A . 15 PRO O 1 1 3 1057 1 1 16 VAL C C 7.979 11.879 -9.392 1.00 . A A . 16 VAL C 1 1 3 1058 1 1 16 VAL CA C 6.520 12.297 -9.581 1.00 . A A . 16 VAL CA 1 1 3 1059 1 1 16 VAL CB C 6.281 13.781 -9.295 1.00 . A A . 16 VAL CB 1 1 3 1060 1 1 16 VAL CG1 C 4.881 14.207 -9.740 1.00 . A A . 16 VAL CG1 1 1 3 1061 1 1 16 VAL CG2 C 6.507 14.098 -7.815 1.00 . A A . 16 VAL CG2 1 1 3 1062 1 1 16 VAL H H 5.111 11.997 -8.076 1.00 . A A . 16 VAL H 1 1 3 1063 1 1 16 VAL HA H 6.230 12.102 -10.614 1.00 . A A . 16 VAL HA 1 1 3 1064 1 1 16 VAL HB H 7.006 14.355 -9.874 1.00 . A A . 16 VAL HB 1 1 3 1065 1 1 16 VAL HG11 H 4.788 15.291 -9.662 1.00 . A A . 16 VAL HG11 1 1 3 1066 1 1 16 VAL HG12 H 4.720 13.903 -10.775 1.00 . A A . 16 VAL HG12 1 1 3 1067 1 1 16 VAL HG13 H 4.136 13.732 -9.102 1.00 . A A . 16 VAL HG13 1 1 3 1068 1 1 16 VAL HG21 H 6.243 13.228 -7.214 1.00 . A A . 16 VAL HG21 1 1 3 1069 1 1 16 VAL HG22 H 7.555 14.347 -7.653 1.00 . A A . 16 VAL HG22 1 1 3 1070 1 1 16 VAL HG23 H 5.882 14.943 -7.525 1.00 . A A . 16 VAL HG23 1 1 3 1071 1 1 16 VAL N N 5.672 11.484 -8.727 1.00 . A A . 16 VAL N 1 1 3 1072 1 1 16 VAL O O 8.692 11.640 -10.365 1.00 . A A . 16 VAL O 1 1 3 1073 1 1 17 ILE C C 10.111 10.149 -8.567 1.00 . A A . 17 ILE C 1 1 3 1074 1 1 17 ILE CA C 9.743 11.422 -7.801 1.00 . A A . 17 ILE CA 1 1 3 1075 1 1 17 ILE CB C 9.913 11.299 -6.286 1.00 . A A . 17 ILE CB 1 1 3 1076 1 1 17 ILE CD1 C 9.176 10.029 -4.236 1.00 . A A . 17 ILE CD1 1 1 3 1077 1 1 17 ILE CG1 C 8.844 10.384 -5.686 1.00 . A A . 17 ILE CG1 1 1 3 1078 1 1 17 ILE CG2 C 9.926 12.677 -5.622 1.00 . A A . 17 ILE CG2 1 1 3 1079 1 1 17 ILE H H 7.793 11.996 -7.345 1.00 . A A . 17 ILE H 1 1 3 1080 1 1 17 ILE HA H 10.397 12.227 -8.135 1.00 . A A . 17 ILE HA 1 1 3 1081 1 1 17 ILE HB H 10.880 10.837 -6.087 1.00 . A A . 17 ILE HB 1 1 3 1082 1 1 17 ILE HD11 H 8.528 9.219 -3.902 1.00 . A A . 17 ILE HD11 1 1 3 1083 1 1 17 ILE HD12 H 10.217 9.713 -4.168 1.00 . A A . 17 ILE HD12 1 1 3 1084 1 1 17 ILE HD13 H 9.020 10.903 -3.603 1.00 . A A . 17 ILE HD13 1 1 3 1085 1 1 17 ILE HG12 H 7.872 10.877 -5.730 1.00 . A A . 17 ILE HG12 1 1 3 1086 1 1 17 ILE HG13 H 8.766 9.473 -6.279 1.00 . A A . 17 ILE HG13 1 1 3 1087 1 1 17 ILE HG21 H 10.412 13.395 -6.284 1.00 . A A . 17 ILE HG21 1 1 3 1088 1 1 17 ILE HG22 H 8.902 12.997 -5.429 1.00 . A A . 17 ILE HG22 1 1 3 1089 1 1 17 ILE HG23 H 10.474 12.623 -4.681 1.00 . A A . 17 ILE HG23 1 1 3 1090 1 1 17 ILE N N 8.380 11.803 -8.131 1.00 . A A . 17 ILE N 1 1 3 1091 1 1 17 ILE O O 11.280 9.925 -8.881 1.00 . A A . 17 ILE O 1 1 3 1092 1 1 18 GLN C C 9.068 8.282 -11.049 1.00 . A A . 18 GLN C 1 1 3 1093 1 1 18 GLN CA C 9.298 8.094 -9.548 1.00 . A A . 18 GLN CA 1 1 3 1094 1 1 18 GLN CB C 8.391 6.996 -8.988 1.00 . A A . 18 GLN CB 1 1 3 1095 1 1 18 GLN CD C 7.758 5.668 -6.940 1.00 . A A . 18 GLN CD 1 1 3 1096 1 1 18 GLN CG C 8.654 6.776 -7.497 1.00 . A A . 18 GLN CG 1 1 3 1097 1 1 18 GLN H H 8.144 9.545 -8.598 1.00 . A A . 18 GLN H 1 1 3 1098 1 1 18 GLN HA H 10.339 7.825 -9.364 1.00 . A A . 18 GLN HA 1 1 3 1099 1 1 18 GLN HB2 H 7.347 7.270 -9.140 1.00 . A A . 18 GLN HB2 1 1 3 1100 1 1 18 GLN HB3 H 8.559 6.067 -9.532 1.00 . A A . 18 GLN HB3 1 1 3 1101 1 1 18 GLN HE21 H 6.825 7.059 -5.802 1.00 . A A . 18 GLN HE21 1 1 3 1102 1 1 18 GLN HE22 H 6.232 5.441 -5.629 1.00 . A A . 18 GLN HE22 1 1 3 1103 1 1 18 GLN HG2 H 9.701 6.513 -7.344 1.00 . A A . 18 GLN HG2 1 1 3 1104 1 1 18 GLN HG3 H 8.475 7.702 -6.951 1.00 . A A . 18 GLN HG3 1 1 3 1105 1 1 18 GLN N N 9.093 9.348 -8.845 1.00 . A A . 18 GLN N 1 1 3 1106 1 1 18 GLN NE2 N 6.864 6.091 -6.050 1.00 . A A . 18 GLN NE2 1 1 3 1107 1 1 18 GLN O O 9.836 7.779 -11.867 1.00 . A A . 18 GLN O 1 1 3 1108 1 1 18 GLN OE1 O 7.869 4.506 -7.295 1.00 . A A . 18 GLN OE1 1 1 3 1109 1 1 19 ALA C C 8.857 9.905 -13.461 1.00 . A A . 19 ALA C 1 1 3 1110 1 1 19 ALA CA C 7.661 9.266 -12.753 1.00 . A A . 19 ALA CA 1 1 3 1111 1 1 19 ALA CB C 6.409 10.143 -12.815 1.00 . A A . 19 ALA CB 1 1 3 1112 1 1 19 ALA H H 7.388 9.418 -10.694 1.00 . A A . 19 ALA H 1 1 3 1113 1 1 19 ALA HA H 7.441 8.307 -13.223 1.00 . A A . 19 ALA HA 1 1 3 1114 1 1 19 ALA HB1 H 5.590 9.644 -12.296 1.00 . A A . 19 ALA HB1 1 1 3 1115 1 1 19 ALA HB2 H 6.613 11.101 -12.336 1.00 . A A . 19 ALA HB2 1 1 3 1116 1 1 19 ALA HB3 H 6.133 10.309 -13.856 1.00 . A A . 19 ALA HB3 1 1 3 1117 1 1 19 ALA N N 8.006 9.009 -11.365 1.00 . A A . 19 ALA N 1 1 3 1118 1 1 19 ALA O O 9.262 9.456 -14.532 1.00 . A A . 19 ALA O 1 1 3 1119 1 1 20 ILE C C 11.722 10.754 -13.497 1.00 . A A . 20 ILE C 1 1 3 1120 1 1 20 ILE CA C 10.504 11.676 -13.411 1.00 . A A . 20 ILE CA 1 1 3 1121 1 1 20 ILE CB C 10.762 12.965 -12.628 1.00 . A A . 20 ILE CB 1 1 3 1122 1 1 20 ILE CD1 C 12.575 12.442 -10.954 1.00 . A A . 20 ILE CD1 1 1 3 1123 1 1 20 ILE CG1 C 11.075 12.662 -11.161 1.00 . A A . 20 ILE CG1 1 1 3 1124 1 1 20 ILE CG2 C 9.592 13.939 -12.775 1.00 . A A . 20 ILE CG2 1 1 3 1125 1 1 20 ILE H H 9.070 11.288 -11.951 1.00 . A A . 20 ILE H 1 1 3 1126 1 1 20 ILE HA H 10.217 11.965 -14.422 1.00 . A A . 20 ILE HA 1 1 3 1127 1 1 20 ILE HB H 11.641 13.451 -13.051 1.00 . A A . 20 ILE HB 1 1 3 1128 1 1 20 ILE HD11 H 13.077 12.430 -11.922 1.00 . A A . 20 ILE HD11 1 1 3 1129 1 1 20 ILE HD12 H 12.979 13.250 -10.345 1.00 . A A . 20 ILE HD12 1 1 3 1130 1 1 20 ILE HD13 H 12.736 11.490 -10.449 1.00 . A A . 20 ILE HD13 1 1 3 1131 1 1 20 ILE HG12 H 10.734 13.487 -10.535 1.00 . A A . 20 ILE HG12 1 1 3 1132 1 1 20 ILE HG13 H 10.526 11.775 -10.845 1.00 . A A . 20 ILE HG13 1 1 3 1133 1 1 20 ILE HG21 H 9.222 13.911 -13.800 1.00 . A A . 20 ILE HG21 1 1 3 1134 1 1 20 ILE HG22 H 8.792 13.652 -12.093 1.00 . A A . 20 ILE HG22 1 1 3 1135 1 1 20 ILE HG23 H 9.927 14.949 -12.538 1.00 . A A . 20 ILE HG23 1 1 3 1136 1 1 20 ILE N N 9.388 10.945 -12.835 1.00 . A A . 20 ILE N 1 1 3 1137 1 1 20 ILE O O 12.506 10.841 -14.441 1.00 . A A . 20 ILE O 1 1 3 1138 1 1 21 HIS C C 12.886 7.975 -13.586 1.00 . A A . 21 HIS C 1 1 3 1139 1 1 21 HIS CA C 12.970 8.977 -12.432 1.00 . A A . 21 HIS CA 1 1 3 1140 1 1 21 HIS CB C 13.040 8.299 -11.063 1.00 . A A . 21 HIS CB 1 1 3 1141 1 1 21 HIS CD2 C 13.824 5.886 -10.434 1.00 . A A . 21 HIS CD2 1 1 3 1142 1 1 21 HIS CE1 C 15.795 5.941 -11.383 1.00 . A A . 21 HIS CE1 1 1 3 1143 1 1 21 HIS CG C 13.973 7.113 -11.011 1.00 . A A . 21 HIS CG 1 1 3 1144 1 1 21 HIS H H 11.191 9.813 -11.745 1.00 . A A . 21 HIS H 1 1 3 1145 1 1 21 HIS HA H 13.870 9.580 -12.551 1.00 . A A . 21 HIS HA 1 1 3 1146 1 1 21 HIS HB2 H 13.360 9.032 -10.322 1.00 . A A . 21 HIS HB2 1 1 3 1147 1 1 21 HIS HB3 H 12.040 7.974 -10.778 1.00 . A A . 21 HIS HB3 1 1 3 1148 1 1 21 HIS HD1 H 15.631 7.879 -12.106 1.00 . A A . 21 HIS HD1 1 1 3 1149 1 1 21 HIS HD2 H 12.949 5.544 -9.881 1.00 . A A . 21 HIS HD2 1 1 3 1150 1 1 21 HIS HE1 H 16.785 5.636 -11.722 1.00 . A A . 21 HIS HE1 1 1 3 1151 1 1 21 HIS HE2 H 15.111 4.264 -10.304 1.00 . A A . 21 HIS HE2 1 1 3 1152 1 1 21 HIS N N 11.844 9.892 -12.498 1.00 . A A . 21 HIS N 1 1 3 1153 1 1 21 HIS ND1 N 15.225 7.118 -11.601 1.00 . A A . 21 HIS ND1 1 1 3 1154 1 1 21 HIS NE2 N 14.925 5.179 -10.660 1.00 . A A . 21 HIS NE2 1 1 3 1155 1 1 21 HIS O O 13.876 7.729 -14.273 1.00 . A A . 21 HIS O 1 1 3 1156 1 1 22 ASP C C 11.782 7.072 -16.169 1.00 . A A . 22 ASP C 1 1 3 1157 1 1 22 ASP CA C 11.472 6.442 -14.810 1.00 . A A . 22 ASP CA 1 1 3 1158 1 1 22 ASP CB C 10.015 5.975 -14.827 1.00 . A A . 22 ASP CB 1 1 3 1159 1 1 22 ASP CG C 9.803 4.535 -15.299 1.00 . A A . 22 ASP CG 1 1 3 1160 1 1 22 ASP H H 10.891 7.639 -13.207 1.00 . A A . 22 ASP H 1 1 3 1161 1 1 22 ASP HA H 12.139 5.614 -14.572 1.00 . A A . 22 ASP HA 1 1 3 1162 1 1 22 ASP HB2 H 9.605 6.075 -13.822 1.00 . A A . 22 ASP HB2 1 1 3 1163 1 1 22 ASP HB3 H 9.443 6.641 -15.472 1.00 . A A . 22 ASP HB3 1 1 3 1164 1 1 22 ASP N N 11.694 7.424 -13.763 1.00 . A A . 22 ASP N 1 1 3 1165 1 1 22 ASP O O 12.499 6.487 -16.979 1.00 . A A . 22 ASP O 1 1 3 1166 1 1 22 ASP OD1 O 10.107 3.624 -14.499 1.00 . A A . 22 ASP OD1 1 1 3 1167 1 1 22 ASP OD2 O 9.341 4.378 -16.450 1.00 . A A . 22 ASP OD2 1 1 3 1168 1 1 23 ALA C C 12.925 9.082 -17.911 1.00 . A A . 23 ALA C 1 1 3 1169 1 1 23 ALA CA C 11.426 8.967 -17.628 1.00 . A A . 23 ALA CA 1 1 3 1170 1 1 23 ALA CB C 10.741 10.333 -17.554 1.00 . A A . 23 ALA CB 1 1 3 1171 1 1 23 ALA H H 10.650 8.729 -15.710 1.00 . A A . 23 ALA H 1 1 3 1172 1 1 23 ALA HA H 10.958 8.383 -18.420 1.00 . A A . 23 ALA HA 1 1 3 1173 1 1 23 ALA HB1 H 11.071 10.858 -16.658 1.00 . A A . 23 ALA HB1 1 1 3 1174 1 1 23 ALA HB2 H 11.003 10.920 -18.435 1.00 . A A . 23 ALA HB2 1 1 3 1175 1 1 23 ALA HB3 H 9.660 10.196 -17.518 1.00 . A A . 23 ALA HB3 1 1 3 1176 1 1 23 ALA N N 11.226 8.257 -16.377 1.00 . A A . 23 ALA N 1 1 3 1177 1 1 23 ALA O O 13.347 9.043 -19.066 1.00 . A A . 23 ALA O 1 1 3 1178 1 1 24 GLN C C 15.773 7.942 -16.721 1.00 . A A . 24 GLN C 1 1 3 1179 1 1 24 GLN CA C 15.134 9.312 -16.954 1.00 . A A . 24 GLN CA 1 1 3 1180 1 1 24 GLN CB C 15.698 10.352 -15.984 1.00 . A A . 24 GLN CB 1 1 3 1181 1 1 24 GLN CD C 14.740 11.911 -17.719 1.00 . A A . 24 GLN CD 1 1 3 1182 1 1 24 GLN CG C 15.083 11.730 -16.239 1.00 . A A . 24 GLN CG 1 1 3 1183 1 1 24 GLN H H 13.336 9.270 -15.903 1.00 . A A . 24 GLN H 1 1 3 1184 1 1 24 GLN HA H 15.322 9.639 -17.977 1.00 . A A . 24 GLN HA 1 1 3 1185 1 1 24 GLN HB2 H 15.496 10.045 -14.958 1.00 . A A . 24 GLN HB2 1 1 3 1186 1 1 24 GLN HB3 H 16.781 10.407 -16.093 1.00 . A A . 24 GLN HB3 1 1 3 1187 1 1 24 GLN HE21 H 12.807 12.193 -17.187 1.00 . A A . 24 GLN HE21 1 1 3 1188 1 1 24 GLN HE22 H 13.128 12.280 -18.887 1.00 . A A . 24 GLN HE22 1 1 3 1189 1 1 24 GLN HG2 H 14.183 11.848 -15.636 1.00 . A A . 24 GLN HG2 1 1 3 1190 1 1 24 GLN HG3 H 15.781 12.507 -15.927 1.00 . A A . 24 GLN HG3 1 1 3 1191 1 1 24 GLN N N 13.689 9.221 -16.838 1.00 . A A . 24 GLN N 1 1 3 1192 1 1 24 GLN NE2 N 13.451 12.148 -17.950 1.00 . A A . 24 GLN NE2 1 1 3 1193 1 1 24 GLN O O 16.931 7.854 -16.316 1.00 . A A . 24 GLN O 1 1 3 1194 1 1 24 GLN OE1 O 15.588 11.841 -18.593 1.00 . A A . 24 GLN OE1 1 1 3 1195 1 1 25 ARG C C 16.644 5.264 -17.739 1.00 . A A . 25 ARG C 1 1 3 1196 1 1 25 ARG CA C 15.464 5.545 -16.806 1.00 . A A . 25 ARG CA 1 1 3 1197 1 1 25 ARG CB C 14.351 4.533 -17.085 1.00 . A A . 25 ARG CB 1 1 3 1198 1 1 25 ARG CD C 12.159 3.605 -16.253 1.00 . A A . 25 ARG CD 1 1 3 1199 1 1 25 ARG CG C 13.403 4.417 -15.889 1.00 . A A . 25 ARG CG 1 1 3 1200 1 1 25 ARG CZ C 10.736 3.514 -18.297 1.00 . A A . 25 ARG CZ 1 1 3 1201 1 1 25 ARG H H 14.051 6.987 -17.321 1.00 . A A . 25 ARG H 1 1 3 1202 1 1 25 ARG HA H 15.769 5.492 -15.761 1.00 . A A . 25 ARG HA 1 1 3 1203 1 1 25 ARG HB2 H 13.791 4.838 -17.969 1.00 . A A . 25 ARG HB2 1 1 3 1204 1 1 25 ARG HB3 H 14.787 3.558 -17.305 1.00 . A A . 25 ARG HB3 1 1 3 1205 1 1 25 ARG HD2 H 12.437 2.573 -16.468 1.00 . A A . 25 ARG HD2 1 1 3 1206 1 1 25 ARG HD3 H 11.471 3.579 -15.408 1.00 . A A . 25 ARG HD3 1 1 3 1207 1 1 25 ARG HE H 11.608 5.184 -17.588 1.00 . A A . 25 ARG HE 1 1 3 1208 1 1 25 ARG HG2 H 13.921 3.942 -15.056 1.00 . A A . 25 ARG HG2 1 1 3 1209 1 1 25 ARG HG3 H 13.108 5.412 -15.557 1.00 . A A . 25 ARG HG3 1 1 3 1210 1 1 25 ARG HH11 H 10.975 1.730 -17.349 1.00 . A A . 25 ARG HH11 1 1 3 1211 1 1 25 ARG HH12 H 9.988 1.683 -18.772 1.00 . A A . 25 ARG HH12 1 1 3 1212 1 1 25 ARG HH21 H 10.306 5.122 -19.465 1.00 . A A . 25 ARG HH21 1 1 3 1213 1 1 25 ARG HH22 H 9.606 3.626 -19.984 1.00 . A A . 25 ARG HH22 1 1 3 1214 1 1 25 ARG N N 14.991 6.906 -16.987 1.00 . A A . 25 ARG N 1 1 3 1215 1 1 25 ARG NE N 11.490 4.203 -17.430 1.00 . A A . 25 ARG NE 1 1 3 1216 1 1 25 ARG NH1 N 10.551 2.198 -18.125 1.00 . A A . 25 ARG NH1 1 1 3 1217 1 1 25 ARG NH2 N 10.168 4.140 -19.336 1.00 . A A . 25 ARG NH2 1 1 3 1218 1 1 25 ARG O O 16.651 5.707 -18.887 1.00 . A A . 25 ARG O 1 1 4 1219 1 1 1 PHE C C 1.131 0.000 -2.451 1.00 . A A . 1 PHE C 1 1 4 1220 1 1 1 PHE CA C 2.073 0.000 -1.245 1.00 . A A . 1 PHE CA 1 1 4 1221 1 1 1 PHE CB C 2.908 -1.282 -1.266 1.00 . A A . 1 PHE CB 1 1 4 1222 1 1 1 PHE CD1 C 5.277 -0.485 -1.110 1.00 . A A . 1 PHE CD1 1 1 4 1223 1 1 1 PHE CD2 C 4.597 -1.555 -3.095 1.00 . A A . 1 PHE CD2 1 1 4 1224 1 1 1 PHE CE1 C 6.581 -0.317 -1.648 1.00 . A A . 1 PHE CE1 1 1 4 1225 1 1 1 PHE CE2 C 5.900 -1.387 -3.633 1.00 . A A . 1 PHE CE2 1 1 4 1226 1 1 1 PHE CG C 4.313 -1.101 -1.845 1.00 . A A . 1 PHE CG 1 1 4 1227 1 1 1 PHE CZ C 6.865 -0.771 -2.898 1.00 . A A . 1 PHE CZ 1 1 4 1228 1 1 1 PHE H1 H 1.884 0.000 0.829 1.00 . A A . 1 PHE H1 1 1 4 1229 1 1 1 PHE HA H 2.678 0.907 -1.259 1.00 . A A . 1 PHE HA 1 1 4 1230 1 1 1 PHE HB2 H 2.993 -1.665 -0.249 1.00 . A A . 1 PHE HB2 1 1 4 1231 1 1 1 PHE HB3 H 2.381 -2.038 -1.848 1.00 . A A . 1 PHE HB3 1 1 4 1232 1 1 1 PHE HD1 H 5.050 -0.120 -0.108 1.00 . A A . 1 PHE HD1 1 1 4 1233 1 1 1 PHE HD2 H 3.824 -2.049 -3.684 1.00 . A A . 1 PHE HD2 1 1 4 1234 1 1 1 PHE HE1 H 7.354 0.177 -1.059 1.00 . A A . 1 PHE HE1 1 1 4 1235 1 1 1 PHE HE2 H 6.128 -1.752 -4.634 1.00 . A A . 1 PHE HE2 1 1 4 1236 1 1 1 PHE HZ H 7.865 -0.642 -3.311 1.00 . A A . 1 PHE HZ 1 1 4 1237 1 1 1 PHE N N 1.325 0.000 0.000 1.00 . A A . 1 PHE N 1 1 4 1238 1 1 1 PHE O O -0.088 -0.021 -2.291 1.00 . A A . 1 PHE O 1 1 4 1239 1 1 2 LEU C C 1.184 -1.319 -5.585 1.00 . A A . 2 LEU C 1 1 4 1240 1 1 2 LEU CA C 0.963 0.012 -4.864 1.00 . A A . 2 LEU CA 1 1 4 1241 1 1 2 LEU CB C 1.299 1.237 -5.717 1.00 . A A . 2 LEU CB 1 1 4 1242 1 1 2 LEU CD1 C -0.847 1.403 -7.031 1.00 . A A . 2 LEU CD1 1 1 4 1243 1 1 2 LEU CD2 C 1.300 2.380 -7.965 1.00 . A A . 2 LEU CD2 1 1 4 1244 1 1 2 LEU CG C 0.675 1.273 -7.114 1.00 . A A . 2 LEU CG 1 1 4 1245 1 1 2 LEU H H 2.725 0.051 -3.753 1.00 . A A . 2 LEU H 1 1 4 1246 1 1 2 LEU HA H -0.090 0.087 -4.592 1.00 . A A . 2 LEU HA 1 1 4 1247 1 1 2 LEU HB2 H 0.983 2.129 -5.176 1.00 . A A . 2 LEU HB2 1 1 4 1248 1 1 2 LEU HB3 H 2.382 1.295 -5.823 1.00 . A A . 2 LEU HB3 1 1 4 1249 1 1 2 LEU HD11 H -1.105 2.291 -6.454 1.00 . A A . 2 LEU HD11 1 1 4 1250 1 1 2 LEU HD12 H -1.259 1.491 -8.036 1.00 . A A . 2 LEU HD12 1 1 4 1251 1 1 2 LEU HD13 H -1.262 0.520 -6.545 1.00 . A A . 2 LEU HD13 1 1 4 1252 1 1 2 LEU HD21 H 2.353 2.156 -8.136 1.00 . A A . 2 LEU HD21 1 1 4 1253 1 1 2 LEU HD22 H 0.781 2.440 -8.921 1.00 . A A . 2 LEU HD22 1 1 4 1254 1 1 2 LEU HD23 H 1.211 3.333 -7.443 1.00 . A A . 2 LEU HD23 1 1 4 1255 1 1 2 LEU HG H 0.890 0.326 -7.609 1.00 . A A . 2 LEU HG 1 1 4 1256 1 1 2 LEU N N 1.733 0.024 -3.632 1.00 . A A . 2 LEU N 1 1 4 1257 1 1 2 LEU O O 0.259 -2.120 -5.715 1.00 . A A . 2 LEU O 1 1 4 1258 1 1 3 PRO C C 2.922 -3.920 -5.813 1.00 . A A . 3 PRO C 1 1 4 1259 1 1 3 PRO CA C 2.797 -2.732 -6.768 1.00 . A A . 3 PRO CA 1 1 4 1260 1 1 3 PRO CB C 4.098 -2.404 -7.482 1.00 . A A . 3 PRO CB 1 1 4 1261 1 1 3 PRO CD C 3.571 -0.600 -5.899 1.00 . A A . 3 PRO CD 1 1 4 1262 1 1 3 PRO CG C 4.669 -1.188 -6.770 1.00 . A A . 3 PRO CG 1 1 4 1263 1 1 3 PRO HA H 2.071 -2.974 -7.413 1.00 . A A . 3 PRO HA 1 1 4 1264 1 1 3 PRO HB2 H 4.791 -3.244 -7.437 1.00 . A A . 3 PRO HB2 1 1 4 1265 1 1 3 PRO HB3 H 3.922 -2.193 -8.537 1.00 . A A . 3 PRO HB3 1 1 4 1266 1 1 3 PRO HD2 H 3.887 -0.526 -4.859 1.00 . A A . 3 PRO HD2 1 1 4 1267 1 1 3 PRO HD3 H 3.305 0.406 -6.223 1.00 . A A . 3 PRO HD3 1 1 4 1268 1 1 3 PRO HG2 H 5.529 -1.471 -6.162 1.00 . A A . 3 PRO HG2 1 1 4 1269 1 1 3 PRO HG3 H 5.019 -0.452 -7.494 1.00 . A A . 3 PRO HG3 1 1 4 1270 1 1 3 PRO N N 2.447 -1.519 -6.048 1.00 . A A . 3 PRO N 1 1 4 1271 1 1 3 PRO O O 2.269 -4.946 -6.003 1.00 . A A . 3 PRO O 1 1 4 1272 1 1 4 LEU C C 2.683 -5.197 -3.182 1.00 . A A . 4 LEU C 1 1 4 1273 1 1 4 LEU CA C 4.006 -4.798 -3.837 1.00 . A A . 4 LEU CA 1 1 4 1274 1 1 4 LEU CB C 5.084 -4.372 -2.838 1.00 . A A . 4 LEU CB 1 1 4 1275 1 1 4 LEU CD1 C 7.446 -3.639 -2.344 1.00 . A A . 4 LEU CD1 1 1 4 1276 1 1 4 LEU CD2 C 7.008 -5.483 -4.031 1.00 . A A . 4 LEU CD2 1 1 4 1277 1 1 4 LEU CG C 6.491 -4.184 -3.408 1.00 . A A . 4 LEU CG 1 1 4 1278 1 1 4 LEU H H 4.276 -2.898 -4.647 1.00 . A A . 4 LEU H 1 1 4 1279 1 1 4 LEU HA H 4.395 -5.659 -4.382 1.00 . A A . 4 LEU HA 1 1 4 1280 1 1 4 LEU HB2 H 4.772 -3.435 -2.376 1.00 . A A . 4 LEU HB2 1 1 4 1281 1 1 4 LEU HB3 H 5.131 -5.118 -2.045 1.00 . A A . 4 LEU HB3 1 1 4 1282 1 1 4 LEU HD11 H 8.400 -3.388 -2.807 1.00 . A A . 4 LEU HD11 1 1 4 1283 1 1 4 LEU HD12 H 7.014 -2.746 -1.892 1.00 . A A . 4 LEU HD12 1 1 4 1284 1 1 4 LEU HD13 H 7.602 -4.395 -1.575 1.00 . A A . 4 LEU HD13 1 1 4 1285 1 1 4 LEU HD21 H 6.498 -5.660 -4.978 1.00 . A A . 4 LEU HD21 1 1 4 1286 1 1 4 LEU HD22 H 8.081 -5.400 -4.206 1.00 . A A . 4 LEU HD22 1 1 4 1287 1 1 4 LEU HD23 H 6.813 -6.314 -3.352 1.00 . A A . 4 LEU HD23 1 1 4 1288 1 1 4 LEU HG H 6.441 -3.443 -4.205 1.00 . A A . 4 LEU HG 1 1 4 1289 1 1 4 LEU N N 3.764 -3.742 -4.806 1.00 . A A . 4 LEU N 1 1 4 1290 1 1 4 LEU O O 2.481 -6.360 -2.838 1.00 . A A . 4 LEU O 1 1 4 1291 1 1 5 LEU C C -0.355 -5.265 -3.340 1.00 . A A . 5 LEU C 1 1 4 1292 1 1 5 LEU CA C 0.523 -4.436 -2.401 1.00 . A A . 5 LEU CA 1 1 4 1293 1 1 5 LEU CB C -0.110 -3.109 -1.979 1.00 . A A . 5 LEU CB 1 1 4 1294 1 1 5 LEU CD1 C -2.390 -3.984 -1.352 1.00 . A A . 5 LEU CD1 1 1 4 1295 1 1 5 LEU CD2 C -0.579 -3.764 0.410 1.00 . A A . 5 LEU CD2 1 1 4 1296 1 1 5 LEU CG C -1.170 -3.191 -0.879 1.00 . A A . 5 LEU CG 1 1 4 1297 1 1 5 LEU H H 1.980 -3.267 -3.323 1.00 . A A . 5 LEU H 1 1 4 1298 1 1 5 LEU HA H 0.699 -5.013 -1.493 1.00 . A A . 5 LEU HA 1 1 4 1299 1 1 5 LEU HB2 H 0.684 -2.442 -1.642 1.00 . A A . 5 LEU HB2 1 1 4 1300 1 1 5 LEU HB3 H -0.561 -2.649 -2.858 1.00 . A A . 5 LEU HB3 1 1 4 1301 1 1 5 LEU HD11 H -2.209 -5.050 -1.208 1.00 . A A . 5 LEU HD11 1 1 4 1302 1 1 5 LEU HD12 H -3.265 -3.684 -0.775 1.00 . A A . 5 LEU HD12 1 1 4 1303 1 1 5 LEU HD13 H -2.566 -3.785 -2.409 1.00 . A A . 5 LEU HD13 1 1 4 1304 1 1 5 LEU HD21 H 0.442 -3.401 0.535 1.00 . A A . 5 LEU HD21 1 1 4 1305 1 1 5 LEU HD22 H -1.183 -3.446 1.260 1.00 . A A . 5 LEU HD22 1 1 4 1306 1 1 5 LEU HD23 H -0.574 -4.852 0.356 1.00 . A A . 5 LEU HD23 1 1 4 1307 1 1 5 LEU HG H -1.510 -2.180 -0.656 1.00 . A A . 5 LEU HG 1 1 4 1308 1 1 5 LEU N N 1.814 -4.208 -3.028 1.00 . A A . 5 LEU N 1 1 4 1309 1 1 5 LEU O O -0.871 -6.312 -2.951 1.00 . A A . 5 LEU O 1 1 4 1310 1 1 6 ILE C C -0.733 -6.846 -5.801 1.00 . A A . 6 ILE C 1 1 4 1311 1 1 6 ILE CA C -1.306 -5.448 -5.557 1.00 . A A . 6 ILE CA 1 1 4 1312 1 1 6 ILE CB C -1.419 -4.600 -6.825 1.00 . A A . 6 ILE CB 1 1 4 1313 1 1 6 ILE CD1 C -0.159 -3.541 -8.736 1.00 . A A . 6 ILE CD1 1 1 4 1314 1 1 6 ILE CG1 C -0.041 -4.342 -7.437 1.00 . A A . 6 ILE CG1 1 1 4 1315 1 1 6 ILE CG2 C -2.177 -3.300 -6.549 1.00 . A A . 6 ILE CG2 1 1 4 1316 1 1 6 ILE H H -0.077 -3.914 -4.868 1.00 . A A . 6 ILE H 1 1 4 1317 1 1 6 ILE HA H -2.311 -5.553 -5.148 1.00 . A A . 6 ILE HA 1 1 4 1318 1 1 6 ILE HB H -1.998 -5.160 -7.560 1.00 . A A . 6 ILE HB 1 1 4 1319 1 1 6 ILE HD11 H -0.917 -3.994 -9.375 1.00 . A A . 6 ILE HD11 1 1 4 1320 1 1 6 ILE HD12 H -0.445 -2.515 -8.505 1.00 . A A . 6 ILE HD12 1 1 4 1321 1 1 6 ILE HD13 H 0.800 -3.543 -9.253 1.00 . A A . 6 ILE HD13 1 1 4 1322 1 1 6 ILE HG12 H 0.581 -3.798 -6.726 1.00 . A A . 6 ILE HG12 1 1 4 1323 1 1 6 ILE HG13 H 0.456 -5.291 -7.636 1.00 . A A . 6 ILE HG13 1 1 4 1324 1 1 6 ILE HG21 H -1.559 -2.450 -6.840 1.00 . A A . 6 ILE HG21 1 1 4 1325 1 1 6 ILE HG22 H -3.102 -3.289 -7.125 1.00 . A A . 6 ILE HG22 1 1 4 1326 1 1 6 ILE HG23 H -2.409 -3.233 -5.486 1.00 . A A . 6 ILE HG23 1 1 4 1327 1 1 6 ILE N N -0.499 -4.766 -4.559 1.00 . A A . 6 ILE N 1 1 4 1328 1 1 6 ILE O O -1.482 -7.803 -5.992 1.00 . A A . 6 ILE O 1 1 4 1329 1 1 7 LEU C C 0.858 -9.184 -4.939 1.00 . A A . 7 LEU C 1 1 4 1330 1 1 7 LEU CA C 1.272 -8.181 -6.018 1.00 . A A . 7 LEU CA 1 1 4 1331 1 1 7 LEU CB C 2.784 -7.964 -6.108 1.00 . A A . 7 LEU CB 1 1 4 1332 1 1 7 LEU CD1 C 3.376 -9.760 -7.777 1.00 . A A . 7 LEU CD1 1 1 4 1333 1 1 7 LEU CD2 C 5.110 -8.938 -6.117 1.00 . A A . 7 LEU CD2 1 1 4 1334 1 1 7 LEU CG C 3.627 -9.214 -6.369 1.00 . A A . 7 LEU CG 1 1 4 1335 1 1 7 LEU H H 1.192 -6.137 -5.623 1.00 . A A . 7 LEU H 1 1 4 1336 1 1 7 LEU HA H 0.942 -8.559 -6.986 1.00 . A A . 7 LEU HA 1 1 4 1337 1 1 7 LEU HB2 H 2.981 -7.245 -6.903 1.00 . A A . 7 LEU HB2 1 1 4 1338 1 1 7 LEU HB3 H 3.122 -7.510 -5.177 1.00 . A A . 7 LEU HB3 1 1 4 1339 1 1 7 LEU HD11 H 4.219 -10.381 -8.081 1.00 . A A . 7 LEU HD11 1 1 4 1340 1 1 7 LEU HD12 H 2.465 -10.359 -7.777 1.00 . A A . 7 LEU HD12 1 1 4 1341 1 1 7 LEU HD13 H 3.266 -8.930 -8.474 1.00 . A A . 7 LEU HD13 1 1 4 1342 1 1 7 LEU HD21 H 5.686 -9.844 -6.308 1.00 . A A . 7 LEU HD21 1 1 4 1343 1 1 7 LEU HD22 H 5.450 -8.145 -6.783 1.00 . A A . 7 LEU HD22 1 1 4 1344 1 1 7 LEU HD23 H 5.251 -8.629 -5.082 1.00 . A A . 7 LEU HD23 1 1 4 1345 1 1 7 LEU HG H 3.319 -9.987 -5.665 1.00 . A A . 7 LEU HG 1 1 4 1346 1 1 7 LEU N N 0.590 -6.919 -5.788 1.00 . A A . 7 LEU N 1 1 4 1347 1 1 7 LEU O O 0.396 -10.280 -5.250 1.00 . A A . 7 LEU O 1 1 4 1348 1 1 8 GLY C C -0.777 -10.045 -2.631 1.00 . A A . 8 GLY C 1 1 4 1349 1 1 8 GLY CA C 0.692 -9.621 -2.566 1.00 . A A . 8 GLY CA 1 1 4 1350 1 1 8 GLY H H 1.414 -7.878 -3.448 1.00 . A A . 8 GLY H 1 1 4 1351 1 1 8 GLY HA2 H 1.329 -10.506 -2.563 1.00 . A A . 8 GLY HA2 1 1 4 1352 1 1 8 GLY HA3 H 0.880 -9.089 -1.634 1.00 . A A . 8 GLY HA3 1 1 4 1353 1 1 8 GLY N N 1.039 -8.772 -3.693 1.00 . A A . 8 GLY N 1 1 4 1354 1 1 8 GLY O O -1.112 -11.188 -2.323 1.00 . A A . 8 GLY O 1 1 4 1355 1 1 9 SER C C -3.375 -9.910 -4.523 1.00 . A A . 9 SER C 1 1 4 1356 1 1 9 SER CA C -3.041 -9.359 -3.136 1.00 . A A . 9 SER CA 1 1 4 1357 1 1 9 SER CB C -3.852 -8.092 -2.858 1.00 . A A . 9 SER CB 1 1 4 1358 1 1 9 SER H H -1.334 -8.174 -3.286 1.00 . A A . 9 SER H 1 1 4 1359 1 1 9 SER HA H -3.256 -10.102 -2.367 1.00 . A A . 9 SER HA 1 1 4 1360 1 1 9 SER HB2 H -3.554 -7.673 -1.897 1.00 . A A . 9 SER HB2 1 1 4 1361 1 1 9 SER HB3 H -3.625 -7.343 -3.616 1.00 . A A . 9 SER HB3 1 1 4 1362 1 1 9 SER HG H -5.427 -9.301 -2.606 1.00 . A A . 9 SER HG 1 1 4 1363 1 1 9 SER N N -1.615 -9.100 -3.033 1.00 . A A . 9 SER N 1 1 4 1364 1 1 9 SER O O -4.519 -9.831 -4.968 1.00 . A A . 9 SER O 1 1 4 1365 1 1 9 SER OG O -5.254 -8.347 -2.850 1.00 . A A . 9 SER OG 1 1 4 1366 1 1 10 LEU C C -2.460 -12.542 -6.416 1.00 . A A . 10 LEU C 1 1 4 1367 1 1 10 LEU CA C -2.524 -11.015 -6.499 1.00 . A A . 10 LEU CA 1 1 4 1368 1 1 10 LEU CB C -1.509 -10.409 -7.470 1.00 . A A . 10 LEU CB 1 1 4 1369 1 1 10 LEU CD1 C -2.662 -11.106 -9.602 1.00 . A A . 10 LEU CD1 1 1 4 1370 1 1 10 LEU CD2 C -3.073 -8.802 -8.623 1.00 . A A . 10 LEU CD2 1 1 4 1371 1 1 10 LEU CG C -2.065 -9.937 -8.815 1.00 . A A . 10 LEU CG 1 1 4 1372 1 1 10 LEU H H -1.427 -10.516 -4.800 1.00 . A A . 10 LEU H 1 1 4 1373 1 1 10 LEU HA H -3.516 -10.730 -6.850 1.00 . A A . 10 LEU HA 1 1 4 1374 1 1 10 LEU HB2 H -1.028 -9.562 -6.980 1.00 . A A . 10 LEU HB2 1 1 4 1375 1 1 10 LEU HB3 H -0.732 -11.150 -7.661 1.00 . A A . 10 LEU HB3 1 1 4 1376 1 1 10 LEU HD11 H -1.970 -11.948 -9.582 1.00 . A A . 10 LEU HD11 1 1 4 1377 1 1 10 LEU HD12 H -3.608 -11.403 -9.150 1.00 . A A . 10 LEU HD12 1 1 4 1378 1 1 10 LEU HD13 H -2.832 -10.799 -10.634 1.00 . A A . 10 LEU HD13 1 1 4 1379 1 1 10 LEU HD21 H -3.168 -8.576 -7.561 1.00 . A A . 10 LEU HD21 1 1 4 1380 1 1 10 LEU HD22 H -2.726 -7.915 -9.153 1.00 . A A . 10 LEU HD22 1 1 4 1381 1 1 10 LEU HD23 H -4.042 -9.106 -9.018 1.00 . A A . 10 LEU HD23 1 1 4 1382 1 1 10 LEU HG H -1.240 -9.539 -9.405 1.00 . A A . 10 LEU HG 1 1 4 1383 1 1 10 LEU N N -2.354 -10.455 -5.170 1.00 . A A . 10 LEU N 1 1 4 1384 1 1 10 LEU O O -3.274 -13.235 -7.026 1.00 . A A . 10 LEU O 1 1 4 1385 1 1 11 LEU C C -1.621 -14.822 -4.026 1.00 . A A . 11 LEU C 1 1 4 1386 1 1 11 LEU CA C -1.312 -14.453 -5.478 1.00 . A A . 11 LEU CA 1 1 4 1387 1 1 11 LEU CB C 0.081 -14.885 -5.939 1.00 . A A . 11 LEU CB 1 1 4 1388 1 1 11 LEU CD1 C 2.327 -15.319 -4.877 1.00 . A A . 11 LEU CD1 1 1 4 1389 1 1 11 LEU CD2 C 1.835 -13.072 -5.947 1.00 . A A . 11 LEU CD2 1 1 4 1390 1 1 11 LEU CG C 1.260 -14.267 -5.183 1.00 . A A . 11 LEU CG 1 1 4 1391 1 1 11 LEU H H -0.825 -12.451 -5.170 1.00 . A A . 11 LEU H 1 1 4 1392 1 1 11 LEU HA H -2.034 -14.953 -6.123 1.00 . A A . 11 LEU HA 1 1 4 1393 1 1 11 LEU HB2 H 0.150 -15.969 -5.855 1.00 . A A . 11 LEU HB2 1 1 4 1394 1 1 11 LEU HB3 H 0.185 -14.640 -6.996 1.00 . A A . 11 LEU HB3 1 1 4 1395 1 1 11 LEU HD11 H 2.677 -15.763 -5.809 1.00 . A A . 11 LEU HD11 1 1 4 1396 1 1 11 LEU HD12 H 3.164 -14.848 -4.361 1.00 . A A . 11 LEU HD12 1 1 4 1397 1 1 11 LEU HD13 H 1.900 -16.096 -4.242 1.00 . A A . 11 LEU HD13 1 1 4 1398 1 1 11 LEU HD21 H 1.041 -12.588 -6.515 1.00 . A A . 11 LEU HD21 1 1 4 1399 1 1 11 LEU HD22 H 2.262 -12.361 -5.240 1.00 . A A . 11 LEU HD22 1 1 4 1400 1 1 11 LEU HD23 H 2.612 -13.417 -6.629 1.00 . A A . 11 LEU HD23 1 1 4 1401 1 1 11 LEU HG H 0.893 -13.892 -4.227 1.00 . A A . 11 LEU HG 1 1 4 1402 1 1 11 LEU N N -1.486 -13.021 -5.657 1.00 . A A . 11 LEU N 1 1 4 1403 1 1 11 LEU O O -1.101 -15.809 -3.508 1.00 . A A . 11 LEU O 1 1 4 1404 1 1 12 MET C C -4.324 -13.919 -1.801 1.00 . A A . 12 MET C 1 1 4 1405 1 1 12 MET CA C -2.843 -14.232 -2.024 1.00 . A A . 12 MET CA 1 1 4 1406 1 1 12 MET CB C -1.991 -13.346 -1.113 1.00 . A A . 12 MET CB 1 1 4 1407 1 1 12 MET CE C 0.243 -13.865 1.498 1.00 . A A . 12 MET CE 1 1 4 1408 1 1 12 MET CG C -0.528 -13.795 -1.124 1.00 . A A . 12 MET CG 1 1 4 1409 1 1 12 MET H H -2.890 -13.212 -3.839 1.00 . A A . 12 MET H 1 1 4 1410 1 1 12 MET HA H -2.657 -15.290 -1.836 1.00 . A A . 12 MET HA 1 1 4 1411 1 1 12 MET HB2 H -2.059 -12.309 -1.442 1.00 . A A . 12 MET HB2 1 1 4 1412 1 1 12 MET HB3 H -2.379 -13.384 -0.095 1.00 . A A . 12 MET HB3 1 1 4 1413 1 1 12 MET HE1 H 0.654 -14.854 1.292 1.00 . A A . 12 MET HE1 1 1 4 1414 1 1 12 MET HE2 H 0.783 -13.414 2.331 1.00 . A A . 12 MET HE2 1 1 4 1415 1 1 12 MET HE3 H -0.812 -13.957 1.757 1.00 . A A . 12 MET HE3 1 1 4 1416 1 1 12 MET HG2 H -0.462 -14.854 -0.877 1.00 . A A . 12 MET HG2 1 1 4 1417 1 1 12 MET HG3 H -0.110 -13.674 -2.124 1.00 . A A . 12 MET HG3 1 1 4 1418 1 1 12 MET N N -2.467 -14.009 -3.409 1.00 . A A . 12 MET N 1 1 4 1419 1 1 12 MET O O -5.097 -14.794 -1.414 1.00 . A A . 12 MET O 1 1 4 1420 1 1 12 MET SD S 0.413 -12.836 0.050 1.00 . A A . 12 MET SD 1 1 4 1421 1 1 13 THR C C -6.390 -11.121 -2.875 1.00 . A A . 13 THR C 1 1 4 1422 1 1 13 THR CA C -6.047 -12.222 -1.870 1.00 . A A . 13 THR CA 1 1 4 1423 1 1 13 THR CB C -6.211 -11.787 -0.412 1.00 . A A . 13 THR CB 1 1 4 1424 1 1 13 THR CG2 C -7.678 -11.619 -0.013 1.00 . A A . 13 THR CG2 1 1 4 1425 1 1 13 THR H H -4.043 -11.963 -2.379 1.00 . A A . 13 THR H 1 1 4 1426 1 1 13 THR HA H -6.711 -13.061 -2.076 1.00 . A A . 13 THR HA 1 1 4 1427 1 1 13 THR HB H -5.646 -10.876 -0.212 1.00 . A A . 13 THR HB 1 1 4 1428 1 1 13 THR HG1 H -4.810 -12.812 0.583 1.00 . A A . 13 THR HG1 1 1 4 1429 1 1 13 THR HG21 H -7.739 -11.346 1.040 1.00 . A A . 13 THR HG21 1 1 4 1430 1 1 13 THR HG22 H -8.133 -10.836 -0.619 1.00 . A A . 13 THR HG22 1 1 4 1431 1 1 13 THR HG23 H -8.209 -12.558 -0.176 1.00 . A A . 13 THR HG23 1 1 4 1432 1 1 13 THR N N -4.676 -12.666 -2.054 1.00 . A A . 13 THR N 1 1 4 1433 1 1 13 THR O O -5.607 -10.193 -3.077 1.00 . A A . 13 THR O 1 1 4 1434 1 1 13 THR OG1 O -5.774 -12.916 0.338 1.00 . A A . 13 THR OG1 1 1 4 1435 1 1 14 PRO C C -8.504 -9.002 -3.812 1.00 . A A . 14 PRO C 1 1 4 1436 1 1 14 PRO CA C -8.043 -10.298 -4.483 1.00 . A A . 14 PRO CA 1 1 4 1437 1 1 14 PRO CB C -9.157 -11.002 -5.241 1.00 . A A . 14 PRO CB 1 1 4 1438 1 1 14 PRO CD C -8.549 -12.343 -3.274 1.00 . A A . 14 PRO CD 1 1 4 1439 1 1 14 PRO CG C -9.601 -12.154 -4.355 1.00 . A A . 14 PRO CG 1 1 4 1440 1 1 14 PRO HA H -7.289 -10.040 -5.087 1.00 . A A . 14 PRO HA 1 1 4 1441 1 1 14 PRO HB2 H -9.984 -10.321 -5.442 1.00 . A A . 14 PRO HB2 1 1 4 1442 1 1 14 PRO HB3 H -8.802 -11.366 -6.206 1.00 . A A . 14 PRO HB3 1 1 4 1443 1 1 14 PRO HD2 H -8.989 -12.284 -2.278 1.00 . A A . 14 PRO HD2 1 1 4 1444 1 1 14 PRO HD3 H -8.071 -13.319 -3.353 1.00 . A A . 14 PRO HD3 1 1 4 1445 1 1 14 PRO HG2 H -10.572 -11.939 -3.909 1.00 . A A . 14 PRO HG2 1 1 4 1446 1 1 14 PRO HG3 H -9.714 -13.065 -4.941 1.00 . A A . 14 PRO HG3 1 1 4 1447 1 1 14 PRO N N -7.592 -11.263 -3.495 1.00 . A A . 14 PRO N 1 1 4 1448 1 1 14 PRO O O -8.672 -8.954 -2.595 1.00 . A A . 14 PRO O 1 1 4 1449 1 1 15 PRO C C -10.623 -6.690 -3.795 1.00 . A A . 15 PRO C 1 1 4 1450 1 1 15 PRO CA C -9.138 -6.662 -4.160 1.00 . A A . 15 PRO CA 1 1 4 1451 1 1 15 PRO CB C -8.819 -5.682 -5.277 1.00 . A A . 15 PRO CB 1 1 4 1452 1 1 15 PRO CD C -8.511 -7.975 -6.106 1.00 . A A . 15 PRO CD 1 1 4 1453 1 1 15 PRO CG C -8.646 -6.522 -6.532 1.00 . A A . 15 PRO CG 1 1 4 1454 1 1 15 PRO HA H -8.653 -6.433 -3.316 1.00 . A A . 15 PRO HA 1 1 4 1455 1 1 15 PRO HB2 H -9.623 -4.956 -5.401 1.00 . A A . 15 PRO HB2 1 1 4 1456 1 1 15 PRO HB3 H -7.913 -5.119 -5.056 1.00 . A A . 15 PRO HB3 1 1 4 1457 1 1 15 PRO HD2 H -9.257 -8.602 -6.594 1.00 . A A . 15 PRO HD2 1 1 4 1458 1 1 15 PRO HD3 H -7.533 -8.376 -6.372 1.00 . A A . 15 PRO HD3 1 1 4 1459 1 1 15 PRO HG2 H -9.501 -6.397 -7.196 1.00 . A A . 15 PRO HG2 1 1 4 1460 1 1 15 PRO HG3 H -7.763 -6.203 -7.086 1.00 . A A . 15 PRO HG3 1 1 4 1461 1 1 15 PRO N N -8.700 -7.955 -4.658 1.00 . A A . 15 PRO N 1 1 4 1462 1 1 15 PRO O O -11.421 -5.947 -4.365 1.00 . A A . 15 PRO O 1 1 4 1463 1 1 16 VAL C C -12.832 -6.333 -1.903 1.00 . A A . 16 VAL C 1 1 4 1464 1 1 16 VAL CA C -12.326 -7.690 -2.398 1.00 . A A . 16 VAL CA 1 1 4 1465 1 1 16 VAL CB C -12.426 -8.788 -1.337 1.00 . A A . 16 VAL CB 1 1 4 1466 1 1 16 VAL CG1 C -12.191 -10.168 -1.953 1.00 . A A . 16 VAL CG1 1 1 4 1467 1 1 16 VAL CG2 C -11.453 -8.528 -0.186 1.00 . A A . 16 VAL CG2 1 1 4 1468 1 1 16 VAL H H -10.296 -8.156 -2.387 1.00 . A A . 16 VAL H 1 1 4 1469 1 1 16 VAL HA H -12.923 -7.995 -3.257 1.00 . A A . 16 VAL HA 1 1 4 1470 1 1 16 VAL HB H -13.437 -8.770 -0.931 1.00 . A A . 16 VAL HB 1 1 4 1471 1 1 16 VAL HG11 H -11.129 -10.295 -2.166 1.00 . A A . 16 VAL HG11 1 1 4 1472 1 1 16 VAL HG12 H -12.516 -10.939 -1.254 1.00 . A A . 16 VAL HG12 1 1 4 1473 1 1 16 VAL HG13 H -12.759 -10.254 -2.880 1.00 . A A . 16 VAL HG13 1 1 4 1474 1 1 16 VAL HG21 H -11.104 -9.479 0.217 1.00 . A A . 16 VAL HG21 1 1 4 1475 1 1 16 VAL HG22 H -10.601 -7.955 -0.552 1.00 . A A . 16 VAL HG22 1 1 4 1476 1 1 16 VAL HG23 H -11.959 -7.965 0.598 1.00 . A A . 16 VAL HG23 1 1 4 1477 1 1 16 VAL N N -10.951 -7.555 -2.846 1.00 . A A . 16 VAL N 1 1 4 1478 1 1 16 VAL O O -13.915 -5.893 -2.286 1.00 . A A . 16 VAL O 1 1 4 1479 1 1 17 ILE C C -12.709 -3.446 -1.642 1.00 . A A . 17 ILE C 1 1 4 1480 1 1 17 ILE CA C -12.380 -4.414 -0.503 1.00 . A A . 17 ILE CA 1 1 4 1481 1 1 17 ILE CB C -11.277 -3.911 0.431 1.00 . A A . 17 ILE CB 1 1 4 1482 1 1 17 ILE CD1 C -8.891 -3.100 0.507 1.00 . A A . 17 ILE CD1 1 1 4 1483 1 1 17 ILE CG1 C -9.916 -3.932 -0.266 1.00 . A A . 17 ILE CG1 1 1 4 1484 1 1 17 ILE CG2 C -11.263 -4.704 1.739 1.00 . A A . 17 ILE CG2 1 1 4 1485 1 1 17 ILE H H -11.142 -6.070 -0.758 1.00 . A A . 17 ILE H 1 1 4 1486 1 1 17 ILE HA H -13.276 -4.553 0.102 1.00 . A A . 17 ILE HA 1 1 4 1487 1 1 17 ILE HB H -11.493 -2.873 0.686 1.00 . A A . 17 ILE HB 1 1 4 1488 1 1 17 ILE HD11 H -9.306 -2.113 0.715 1.00 . A A . 17 ILE HD11 1 1 4 1489 1 1 17 ILE HD12 H -8.652 -3.599 1.446 1.00 . A A . 17 ILE HD12 1 1 4 1490 1 1 17 ILE HD13 H -7.984 -2.994 -0.089 1.00 . A A . 17 ILE HD13 1 1 4 1491 1 1 17 ILE HG12 H -9.563 -4.959 -0.354 1.00 . A A . 17 ILE HG12 1 1 4 1492 1 1 17 ILE HG13 H -10.016 -3.542 -1.279 1.00 . A A . 17 ILE HG13 1 1 4 1493 1 1 17 ILE HG21 H -10.797 -5.675 1.571 1.00 . A A . 17 ILE HG21 1 1 4 1494 1 1 17 ILE HG22 H -10.697 -4.155 2.491 1.00 . A A . 17 ILE HG22 1 1 4 1495 1 1 17 ILE HG23 H -12.286 -4.849 2.088 1.00 . A A . 17 ILE HG23 1 1 4 1496 1 1 17 ILE N N -12.024 -5.708 -1.060 1.00 . A A . 17 ILE N 1 1 4 1497 1 1 17 ILE O O -13.443 -2.479 -1.446 1.00 . A A . 17 ILE O 1 1 4 1498 1 1 18 GLN C C -13.446 -3.510 -4.871 1.00 . A A . 18 GLN C 1 1 4 1499 1 1 18 GLN CA C -12.366 -2.903 -3.973 1.00 . A A . 18 GLN CA 1 1 4 1500 1 1 18 GLN CB C -11.062 -2.696 -4.748 1.00 . A A . 18 GLN CB 1 1 4 1501 1 1 18 GLN CD C -8.744 -1.706 -4.678 1.00 . A A . 18 GLN CD 1 1 4 1502 1 1 18 GLN CG C -10.004 -2.025 -3.870 1.00 . A A . 18 GLN CG 1 1 4 1503 1 1 18 GLN H H -11.560 -4.534 -2.959 1.00 . A A . 18 GLN H 1 1 4 1504 1 1 18 GLN HA H -12.705 -1.944 -3.582 1.00 . A A . 18 GLN HA 1 1 4 1505 1 1 18 GLN HB2 H -10.690 -3.656 -5.103 1.00 . A A . 18 GLN HB2 1 1 4 1506 1 1 18 GLN HB3 H -11.252 -2.082 -5.628 1.00 . A A . 18 GLN HB3 1 1 4 1507 1 1 18 GLN HE21 H -7.690 -2.880 -3.410 1.00 . A A . 18 GLN HE21 1 1 4 1508 1 1 18 GLN HE22 H -6.768 -2.144 -4.678 1.00 . A A . 18 GLN HE22 1 1 4 1509 1 1 18 GLN HG2 H -10.408 -1.107 -3.443 1.00 . A A . 18 GLN HG2 1 1 4 1510 1 1 18 GLN HG3 H -9.749 -2.679 -3.037 1.00 . A A . 18 GLN HG3 1 1 4 1511 1 1 18 GLN N N -12.150 -3.741 -2.806 1.00 . A A . 18 GLN N 1 1 4 1512 1 1 18 GLN NE2 N -7.643 -2.292 -4.217 1.00 . A A . 18 GLN NE2 1 1 4 1513 1 1 18 GLN O O -14.268 -2.788 -5.433 1.00 . A A . 18 GLN O 1 1 4 1514 1 1 18 GLN OE1 O -8.770 -0.975 -5.655 1.00 . A A . 18 GLN OE1 1 1 4 1515 1 1 19 ALA C C -15.789 -5.262 -5.249 1.00 . A A . 19 ALA C 1 1 4 1516 1 1 19 ALA CA C -14.383 -5.543 -5.785 1.00 . A A . 19 ALA CA 1 1 4 1517 1 1 19 ALA CB C -14.049 -7.036 -5.788 1.00 . A A . 19 ALA CB 1 1 4 1518 1 1 19 ALA H H -12.731 -5.409 -4.523 1.00 . A A . 19 ALA H 1 1 4 1519 1 1 19 ALA HA H -14.310 -5.165 -6.804 1.00 . A A . 19 ALA HA 1 1 4 1520 1 1 19 ALA HB1 H -13.083 -7.191 -6.269 1.00 . A A . 19 ALA HB1 1 1 4 1521 1 1 19 ALA HB2 H -14.007 -7.401 -4.762 1.00 . A A . 19 ALA HB2 1 1 4 1522 1 1 19 ALA HB3 H -14.819 -7.580 -6.336 1.00 . A A . 19 ALA HB3 1 1 4 1523 1 1 19 ALA N N -13.409 -4.830 -4.977 1.00 . A A . 19 ALA N 1 1 4 1524 1 1 19 ALA O O -16.675 -4.859 -6.002 1.00 . A A . 19 ALA O 1 1 4 1525 1 1 20 ILE C C -17.556 -3.795 -3.255 1.00 . A A . 20 ILE C 1 1 4 1526 1 1 20 ILE CA C -17.239 -5.291 -3.314 1.00 . A A . 20 ILE CA 1 1 4 1527 1 1 20 ILE CB C -17.270 -5.980 -1.948 1.00 . A A . 20 ILE CB 1 1 4 1528 1 1 20 ILE CD1 C -15.528 -4.476 -0.916 1.00 . A A . 20 ILE CD1 1 1 4 1529 1 1 20 ILE CG1 C -16.968 -4.985 -0.826 1.00 . A A . 20 ILE CG1 1 1 4 1530 1 1 20 ILE CG2 C -16.323 -7.181 -1.919 1.00 . A A . 20 ILE CG2 1 1 4 1531 1 1 20 ILE H H -15.217 -5.790 -3.344 1.00 . A A . 20 ILE H 1 1 4 1532 1 1 20 ILE HA H -17.989 -5.778 -3.938 1.00 . A A . 20 ILE HA 1 1 4 1533 1 1 20 ILE HB H -18.277 -6.360 -1.780 1.00 . A A . 20 ILE HB 1 1 4 1534 1 1 20 ILE HD11 H -14.924 -4.959 -0.148 1.00 . A A . 20 ILE HD11 1 1 4 1535 1 1 20 ILE HD12 H -15.121 -4.710 -1.900 1.00 . A A . 20 ILE HD12 1 1 4 1536 1 1 20 ILE HD13 H -15.514 -3.397 -0.764 1.00 . A A . 20 ILE HD13 1 1 4 1537 1 1 20 ILE HG12 H -17.659 -4.144 -0.885 1.00 . A A . 20 ILE HG12 1 1 4 1538 1 1 20 ILE HG13 H -17.129 -5.463 0.141 1.00 . A A . 20 ILE HG13 1 1 4 1539 1 1 20 ILE HG21 H -15.346 -6.865 -1.553 1.00 . A A . 20 ILE HG21 1 1 4 1540 1 1 20 ILE HG22 H -16.728 -7.947 -1.258 1.00 . A A . 20 ILE HG22 1 1 4 1541 1 1 20 ILE HG23 H -16.220 -7.587 -2.926 1.00 . A A . 20 ILE HG23 1 1 4 1542 1 1 20 ILE N N -15.949 -5.484 -3.953 1.00 . A A . 20 ILE N 1 1 4 1543 1 1 20 ILE O O -18.721 -3.404 -3.224 1.00 . A A . 20 ILE O 1 1 4 1544 1 1 21 HIS C C -17.226 -1.014 -4.456 1.00 . A A . 21 HIS C 1 1 4 1545 1 1 21 HIS CA C -16.646 -1.556 -3.148 1.00 . A A . 21 HIS CA 1 1 4 1546 1 1 21 HIS CB C -15.318 -0.897 -2.770 1.00 . A A . 21 HIS CB 1 1 4 1547 1 1 21 HIS CD2 C -14.330 1.452 -3.353 1.00 . A A . 21 HIS CD2 1 1 4 1548 1 1 21 HIS CE1 C -16.091 2.659 -2.876 1.00 . A A . 21 HIS CE1 1 1 4 1549 1 1 21 HIS CG C -15.311 0.605 -2.929 1.00 . A A . 21 HIS CG 1 1 4 1550 1 1 21 HIS H H -15.552 -3.323 -3.296 1.00 . A A . 21 HIS H 1 1 4 1551 1 1 21 HIS HA H -17.353 -1.367 -2.341 1.00 . A A . 21 HIS HA 1 1 4 1552 1 1 21 HIS HB2 H -15.084 -1.143 -1.734 1.00 . A A . 21 HIS HB2 1 1 4 1553 1 1 21 HIS HB3 H -14.525 -1.321 -3.385 1.00 . A A . 21 HIS HB3 1 1 4 1554 1 1 21 HIS HD1 H -17.292 1.068 -2.298 1.00 . A A . 21 HIS HD1 1 1 4 1555 1 1 21 HIS HD2 H -13.327 1.159 -3.665 1.00 . A A . 21 HIS HD2 1 1 4 1556 1 1 21 HIS HE1 H -16.745 3.520 -2.742 1.00 . A A . 21 HIS HE1 1 1 4 1557 1 1 21 HIS HE2 H -14.280 3.519 -3.527 1.00 . A A . 21 HIS HE2 1 1 4 1558 1 1 21 HIS N N -16.497 -2.999 -3.243 1.00 . A A . 21 HIS N 1 1 4 1559 1 1 21 HIS ND1 N -16.409 1.395 -2.635 1.00 . A A . 21 HIS ND1 1 1 4 1560 1 1 21 HIS NE2 N -14.803 2.692 -3.321 1.00 . A A . 21 HIS NE2 1 1 4 1561 1 1 21 HIS O O -18.143 -0.194 -4.439 1.00 . A A . 21 HIS O 1 1 4 1562 1 1 22 ASP C C -18.606 -1.402 -7.027 1.00 . A A . 22 ASP C 1 1 4 1563 1 1 22 ASP CA C -17.120 -1.069 -6.872 1.00 . A A . 22 ASP CA 1 1 4 1564 1 1 22 ASP CB C -16.355 -1.796 -7.979 1.00 . A A . 22 ASP CB 1 1 4 1565 1 1 22 ASP CG C -15.827 -0.896 -9.098 1.00 . A A . 22 ASP CG 1 1 4 1566 1 1 22 ASP H H -15.921 -2.158 -5.562 1.00 . A A . 22 ASP H 1 1 4 1567 1 1 22 ASP HA H -16.927 0.003 -6.909 1.00 . A A . 22 ASP HA 1 1 4 1568 1 1 22 ASP HB2 H -15.514 -2.325 -7.532 1.00 . A A . 22 ASP HB2 1 1 4 1569 1 1 22 ASP HB3 H -17.009 -2.549 -8.418 1.00 . A A . 22 ASP HB3 1 1 4 1570 1 1 22 ASP N N -16.668 -1.493 -5.558 1.00 . A A . 22 ASP N 1 1 4 1571 1 1 22 ASP O O -19.344 -0.671 -7.686 1.00 . A A . 22 ASP O 1 1 4 1572 1 1 22 ASP OD1 O -14.907 -0.103 -8.802 1.00 . A A . 22 ASP OD1 1 1 4 1573 1 1 22 ASP OD2 O -16.355 -1.021 -10.224 1.00 . A A . 22 ASP OD2 1 1 4 1574 1 1 23 ALA C C -21.226 -2.035 -5.546 1.00 . A A . 23 ALA C 1 1 4 1575 1 1 23 ALA CA C -20.387 -2.935 -6.456 1.00 . A A . 23 ALA CA 1 1 4 1576 1 1 23 ALA CB C -20.478 -4.410 -6.061 1.00 . A A . 23 ALA CB 1 1 4 1577 1 1 23 ALA H H -18.391 -3.099 -5.883 1.00 . A A . 23 ALA H 1 1 4 1578 1 1 23 ALA HA H -20.734 -2.824 -7.483 1.00 . A A . 23 ALA HA 1 1 4 1579 1 1 23 ALA HB1 H -21.505 -4.755 -6.181 1.00 . A A . 23 ALA HB1 1 1 4 1580 1 1 23 ALA HB2 H -19.820 -4.998 -6.700 1.00 . A A . 23 ALA HB2 1 1 4 1581 1 1 23 ALA HB3 H -20.176 -4.527 -5.020 1.00 . A A . 23 ALA HB3 1 1 4 1582 1 1 23 ALA N N -19.000 -2.505 -6.408 1.00 . A A . 23 ALA N 1 1 4 1583 1 1 23 ALA O O -22.335 -1.642 -5.908 1.00 . A A . 23 ALA O 1 1 4 1584 1 1 24 GLN C C -20.806 0.569 -3.565 1.00 . A A . 24 GLN C 1 1 4 1585 1 1 24 GLN CA C -21.335 -0.861 -3.434 1.00 . A A . 24 GLN CA 1 1 4 1586 1 1 24 GLN CB C -21.170 -1.378 -2.004 1.00 . A A . 24 GLN CB 1 1 4 1587 1 1 24 GLN CD C -19.717 -1.191 0.049 1.00 . A A . 24 GLN CD 1 1 4 1588 1 1 24 GLN CG C -19.761 -1.094 -1.477 1.00 . A A . 24 GLN CG 1 1 4 1589 1 1 24 GLN H H -19.774 -2.077 -4.088 1.00 . A A . 24 GLN H 1 1 4 1590 1 1 24 GLN HA H -22.390 -0.892 -3.706 1.00 . A A . 24 GLN HA 1 1 4 1591 1 1 24 GLN HB2 H -21.907 -0.904 -1.355 1.00 . A A . 24 GLN HB2 1 1 4 1592 1 1 24 GLN HB3 H -21.363 -2.450 -1.976 1.00 . A A . 24 GLN HB3 1 1 4 1593 1 1 24 GLN HE21 H -21.210 -2.555 -0.041 1.00 . A A . 24 GLN HE21 1 1 4 1594 1 1 24 GLN HE22 H -20.645 -2.180 1.553 1.00 . A A . 24 GLN HE22 1 1 4 1595 1 1 24 GLN HG2 H -19.057 -1.804 -1.911 1.00 . A A . 24 GLN HG2 1 1 4 1596 1 1 24 GLN HG3 H -19.445 -0.099 -1.792 1.00 . A A . 24 GLN HG3 1 1 4 1597 1 1 24 GLN N N -20.666 -1.735 -4.384 1.00 . A A . 24 GLN N 1 1 4 1598 1 1 24 GLN NE2 N -20.597 -2.046 0.563 1.00 . A A . 24 GLN NE2 1 1 4 1599 1 1 24 GLN O O -21.518 1.527 -3.271 1.00 . A A . 24 GLN O 1 1 4 1600 1 1 24 GLN OE1 O -18.935 -0.533 0.716 1.00 . A A . 24 GLN OE1 1 1 4 1601 1 1 25 ARG C C -19.059 2.791 -2.898 1.00 . A A . 25 ARG C 1 1 4 1602 1 1 25 ARG CA C -18.927 1.963 -4.178 1.00 . A A . 25 ARG CA 1 1 4 1603 1 1 25 ARG CB C -19.553 2.734 -5.342 1.00 . A A . 25 ARG CB 1 1 4 1604 1 1 25 ARG CD C -20.212 2.557 -7.770 1.00 . A A . 25 ARG CD 1 1 4 1605 1 1 25 ARG CG C -19.284 2.030 -6.674 1.00 . A A . 25 ARG CG 1 1 4 1606 1 1 25 ARG CZ C -20.112 2.085 -10.215 1.00 . A A . 25 ARG CZ 1 1 4 1607 1 1 25 ARG H H -18.989 -0.118 -4.248 1.00 . A A . 25 ARG H 1 1 4 1608 1 1 25 ARG HA H -17.883 1.737 -4.393 1.00 . A A . 25 ARG HA 1 1 4 1609 1 1 25 ARG HB2 H -20.628 2.826 -5.186 1.00 . A A . 25 ARG HB2 1 1 4 1610 1 1 25 ARG HB3 H -19.148 3.746 -5.373 1.00 . A A . 25 ARG HB3 1 1 4 1611 1 1 25 ARG HD2 H -21.232 2.625 -7.392 1.00 . A A . 25 ARG HD2 1 1 4 1612 1 1 25 ARG HD3 H -19.912 3.564 -8.060 1.00 . A A . 25 ARG HD3 1 1 4 1613 1 1 25 ARG HE H -20.181 0.672 -8.782 1.00 . A A . 25 ARG HE 1 1 4 1614 1 1 25 ARG HG2 H -18.245 2.184 -6.967 1.00 . A A . 25 ARG HG2 1 1 4 1615 1 1 25 ARG HG3 H -19.426 0.956 -6.557 1.00 . A A . 25 ARG HG3 1 1 4 1616 1 1 25 ARG HH11 H -20.121 4.060 -9.731 1.00 . A A . 25 ARG HH11 1 1 4 1617 1 1 25 ARG HH12 H -20.051 3.716 -11.428 1.00 . A A . 25 ARG HH12 1 1 4 1618 1 1 25 ARG HH21 H -20.089 0.217 -11.020 1.00 . A A . 25 ARG HH21 1 1 4 1619 1 1 25 ARG HH22 H -20.033 1.515 -12.165 1.00 . A A . 25 ARG HH22 1 1 4 1620 1 1 25 ARG N N -19.561 0.667 -4.008 1.00 . A A . 25 ARG N 1 1 4 1621 1 1 25 ARG NE N -20.168 1.659 -8.945 1.00 . A A . 25 ARG NE 1 1 4 1622 1 1 25 ARG NH1 N -20.093 3.398 -10.480 1.00 . A A . 25 ARG NH1 1 1 4 1623 1 1 25 ARG NH2 N -20.074 1.197 -11.218 1.00 . A A . 25 ARG NH2 1 1 4 1624 1 1 25 ARG O O -19.173 2.237 -1.806 1.00 . A A . 25 ARG O 1 1 5 1625 1 1 1 PHE C C 1.131 0.000 -2.451 1.00 . A A . 1 PHE C 1 1 5 1626 1 1 1 PHE CA C 2.073 0.000 -1.245 1.00 . A A . 1 PHE CA 1 1 5 1627 1 1 1 PHE CB C 2.908 -1.282 -1.266 1.00 . A A . 1 PHE CB 1 1 5 1628 1 1 1 PHE CD1 C 1.360 -2.974 -0.260 1.00 . A A . 1 PHE CD1 1 1 5 1629 1 1 1 PHE CD2 C 2.056 -3.295 -2.488 1.00 . A A . 1 PHE CD2 1 1 5 1630 1 1 1 PHE CE1 C 0.589 -4.165 -0.330 1.00 . A A . 1 PHE CE1 1 1 5 1631 1 1 1 PHE CE2 C 1.285 -4.485 -2.558 1.00 . A A . 1 PHE CE2 1 1 5 1632 1 1 1 PHE CG C 2.077 -2.565 -1.341 1.00 . A A . 1 PHE CG 1 1 5 1633 1 1 1 PHE CZ C 0.568 -4.895 -1.477 1.00 . A A . 1 PHE CZ 1 1 5 1634 1 1 1 PHE H1 H 1.884 0.000 0.829 1.00 . A A . 1 PHE H1 1 1 5 1635 1 1 1 PHE HA H 2.678 0.907 -1.259 1.00 . A A . 1 PHE HA 1 1 5 1636 1 1 1 PHE HB2 H 3.585 -1.249 -2.119 1.00 . A A . 1 PHE HB2 1 1 5 1637 1 1 1 PHE HB3 H 3.527 -1.314 -0.369 1.00 . A A . 1 PHE HB3 1 1 5 1638 1 1 1 PHE HD1 H 1.377 -2.389 0.659 1.00 . A A . 1 PHE HD1 1 1 5 1639 1 1 1 PHE HD2 H 2.631 -2.966 -3.354 1.00 . A A . 1 PHE HD2 1 1 5 1640 1 1 1 PHE HE1 H 0.014 -4.493 0.536 1.00 . A A . 1 PHE HE1 1 1 5 1641 1 1 1 PHE HE2 H 1.268 -5.070 -3.477 1.00 . A A . 1 PHE HE2 1 1 5 1642 1 1 1 PHE HZ H -0.024 -5.809 -1.531 1.00 . A A . 1 PHE HZ 1 1 5 1643 1 1 1 PHE N N 1.325 0.000 0.000 1.00 . A A . 1 PHE N 1 1 5 1644 1 1 1 PHE O O 0.010 0.499 -2.368 1.00 . A A . 1 PHE O 1 1 5 1645 1 1 2 LEU C C -0.655 -0.490 -4.402 1.00 . A A . 2 LEU C 1 1 5 1646 1 1 2 LEU CA C 0.823 -0.672 -4.754 1.00 . A A . 2 LEU CA 1 1 5 1647 1 1 2 LEU CB C 1.125 -1.984 -5.481 1.00 . A A . 2 LEU CB 1 1 5 1648 1 1 2 LEU CD1 C 2.187 -3.216 -7.408 1.00 . A A . 2 LEU CD1 1 1 5 1649 1 1 2 LEU CD2 C 0.806 -1.131 -7.833 1.00 . A A . 2 LEU CD2 1 1 5 1650 1 1 2 LEU CG C 1.752 -1.851 -6.871 1.00 . A A . 2 LEU CG 1 1 5 1651 1 1 2 LEU H H 2.543 -0.947 -3.612 1.00 . A A . 2 LEU H 1 1 5 1652 1 1 2 LEU HA H 1.124 0.140 -5.416 1.00 . A A . 2 LEU HA 1 1 5 1653 1 1 2 LEU HB2 H 1.794 -2.577 -4.858 1.00 . A A . 2 LEU HB2 1 1 5 1654 1 1 2 LEU HB3 H 0.196 -2.546 -5.576 1.00 . A A . 2 LEU HB3 1 1 5 1655 1 1 2 LEU HD11 H 1.328 -3.886 -7.436 1.00 . A A . 2 LEU HD11 1 1 5 1656 1 1 2 LEU HD12 H 2.589 -3.099 -8.415 1.00 . A A . 2 LEU HD12 1 1 5 1657 1 1 2 LEU HD13 H 2.954 -3.635 -6.758 1.00 . A A . 2 LEU HD13 1 1 5 1658 1 1 2 LEU HD21 H -0.156 -1.643 -7.848 1.00 . A A . 2 LEU HD21 1 1 5 1659 1 1 2 LEU HD22 H 0.664 -0.102 -7.502 1.00 . A A . 2 LEU HD22 1 1 5 1660 1 1 2 LEU HD23 H 1.235 -1.134 -8.835 1.00 . A A . 2 LEU HD23 1 1 5 1661 1 1 2 LEU HG H 2.650 -1.239 -6.783 1.00 . A A . 2 LEU HG 1 1 5 1662 1 1 2 LEU N N 1.621 -0.566 -3.544 1.00 . A A . 2 LEU N 1 1 5 1663 1 1 2 LEU O O -1.305 0.430 -4.896 1.00 . A A . 2 LEU O 1 1 5 1664 1 1 3 PRO C C -2.800 -0.230 -2.129 1.00 . A A . 3 PRO C 1 1 5 1665 1 1 3 PRO CA C -2.549 -1.366 -3.122 1.00 . A A . 3 PRO CA 1 1 5 1666 1 1 3 PRO CB C -2.825 -2.740 -2.534 1.00 . A A . 3 PRO CB 1 1 5 1667 1 1 3 PRO CD C -0.409 -2.495 -2.908 1.00 . A A . 3 PRO CD 1 1 5 1668 1 1 3 PRO CG C -1.465 -3.335 -2.208 1.00 . A A . 3 PRO CG 1 1 5 1669 1 1 3 PRO HA H -3.135 -1.175 -3.909 1.00 . A A . 3 PRO HA 1 1 5 1670 1 1 3 PRO HB2 H -3.443 -2.666 -1.639 1.00 . A A . 3 PRO HB2 1 1 5 1671 1 1 3 PRO HB3 H -3.366 -3.367 -3.243 1.00 . A A . 3 PRO HB3 1 1 5 1672 1 1 3 PRO HD2 H 0.330 -2.117 -2.201 1.00 . A A . 3 PRO HD2 1 1 5 1673 1 1 3 PRO HD3 H 0.132 -3.079 -3.652 1.00 . A A . 3 PRO HD3 1 1 5 1674 1 1 3 PRO HG2 H -1.298 -3.339 -1.131 1.00 . A A . 3 PRO HG2 1 1 5 1675 1 1 3 PRO HG3 H -1.411 -4.371 -2.542 1.00 . A A . 3 PRO HG3 1 1 5 1676 1 1 3 PRO N N -1.155 -1.404 -3.529 1.00 . A A . 3 PRO N 1 1 5 1677 1 1 3 PRO O O -3.667 0.614 -2.351 1.00 . A A . 3 PRO O 1 1 5 1678 1 1 4 LEU C C -1.895 2.137 -0.572 1.00 . A A . 4 LEU C 1 1 5 1679 1 1 4 LEU CA C -2.184 0.747 -0.003 1.00 . A A . 4 LEU CA 1 1 5 1680 1 1 4 LEU CB C -1.321 0.386 1.208 1.00 . A A . 4 LEU CB 1 1 5 1681 1 1 4 LEU CD1 C -3.249 0.041 2.796 1.00 . A A . 4 LEU CD1 1 1 5 1682 1 1 4 LEU CD2 C -2.189 -1.945 1.626 1.00 . A A . 4 LEU CD2 1 1 5 1683 1 1 4 LEU CG C -1.960 -0.557 2.229 1.00 . A A . 4 LEU CG 1 1 5 1684 1 1 4 LEU H H -1.300 -0.915 -0.896 1.00 . A A . 4 LEU H 1 1 5 1685 1 1 4 LEU HA H -3.224 0.715 0.321 1.00 . A A . 4 LEU HA 1 1 5 1686 1 1 4 LEU HB2 H -0.398 -0.070 0.849 1.00 . A A . 4 LEU HB2 1 1 5 1687 1 1 4 LEU HB3 H -1.043 1.308 1.718 1.00 . A A . 4 LEU HB3 1 1 5 1688 1 1 4 LEU HD11 H -3.144 1.123 2.874 1.00 . A A . 4 LEU HD11 1 1 5 1689 1 1 4 LEU HD12 H -4.082 -0.197 2.135 1.00 . A A . 4 LEU HD12 1 1 5 1690 1 1 4 LEU HD13 H -3.439 -0.377 3.785 1.00 . A A . 4 LEU HD13 1 1 5 1691 1 1 4 LEU HD21 H -2.487 -2.638 2.413 1.00 . A A . 4 LEU HD21 1 1 5 1692 1 1 4 LEU HD22 H -2.975 -1.889 0.873 1.00 . A A . 4 LEU HD22 1 1 5 1693 1 1 4 LEU HD23 H -1.266 -2.296 1.163 1.00 . A A . 4 LEU HD23 1 1 5 1694 1 1 4 LEU HG H -1.267 -0.678 3.062 1.00 . A A . 4 LEU HG 1 1 5 1695 1 1 4 LEU N N -2.025 -0.244 -1.054 1.00 . A A . 4 LEU N 1 1 5 1696 1 1 4 LEU O O -2.522 3.118 -0.173 1.00 . A A . 4 LEU O 1 1 5 1697 1 1 5 LEU C C -1.736 4.017 -2.880 1.00 . A A . 5 LEU C 1 1 5 1698 1 1 5 LEU CA C -0.551 3.436 -2.107 1.00 . A A . 5 LEU CA 1 1 5 1699 1 1 5 LEU CB C 0.706 3.247 -2.959 1.00 . A A . 5 LEU CB 1 1 5 1700 1 1 5 LEU CD1 C 2.080 5.167 -2.075 1.00 . A A . 5 LEU CD1 1 1 5 1701 1 1 5 LEU CD2 C 2.268 2.869 -1.016 1.00 . A A . 5 LEU CD2 1 1 5 1702 1 1 5 LEU CG C 2.027 3.656 -2.306 1.00 . A A . 5 LEU CG 1 1 5 1703 1 1 5 LEU H H -0.450 1.375 -1.825 1.00 . A A . 5 LEU H 1 1 5 1704 1 1 5 LEU HA H -0.293 4.125 -1.302 1.00 . A A . 5 LEU HA 1 1 5 1705 1 1 5 LEU HB2 H 0.773 2.196 -3.243 1.00 . A A . 5 LEU HB2 1 1 5 1706 1 1 5 LEU HB3 H 0.586 3.818 -3.880 1.00 . A A . 5 LEU HB3 1 1 5 1707 1 1 5 LEU HD11 H 1.710 5.683 -2.961 1.00 . A A . 5 LEU HD11 1 1 5 1708 1 1 5 LEU HD12 H 1.458 5.425 -1.218 1.00 . A A . 5 LEU HD12 1 1 5 1709 1 1 5 LEU HD13 H 3.109 5.469 -1.881 1.00 . A A . 5 LEU HD13 1 1 5 1710 1 1 5 LEU HD21 H 1.916 1.846 -1.143 1.00 . A A . 5 LEU HD21 1 1 5 1711 1 1 5 LEU HD22 H 3.334 2.861 -0.789 1.00 . A A . 5 LEU HD22 1 1 5 1712 1 1 5 LEU HD23 H 1.725 3.341 -0.197 1.00 . A A . 5 LEU HD23 1 1 5 1713 1 1 5 LEU HG H 2.838 3.406 -2.991 1.00 . A A . 5 LEU HG 1 1 5 1714 1 1 5 LEU N N -0.945 2.179 -1.495 1.00 . A A . 5 LEU N 1 1 5 1715 1 1 5 LEU O O -2.147 5.150 -2.634 1.00 . A A . 5 LEU O 1 1 5 1716 1 1 6 ILE C C -4.568 3.957 -3.705 1.00 . A A . 6 ILE C 1 1 5 1717 1 1 6 ILE CA C -3.380 3.636 -4.613 1.00 . A A . 6 ILE CA 1 1 5 1718 1 1 6 ILE CB C -3.689 2.588 -5.684 1.00 . A A . 6 ILE CB 1 1 5 1719 1 1 6 ILE CD1 C -4.361 0.197 -6.119 1.00 . A A . 6 ILE CD1 1 1 5 1720 1 1 6 ILE CG1 C -4.056 1.246 -5.048 1.00 . A A . 6 ILE CG1 1 1 5 1721 1 1 6 ILE CG2 C -2.529 2.456 -6.673 1.00 . A A . 6 ILE CG2 1 1 5 1722 1 1 6 ILE H H -1.915 2.292 -3.989 1.00 . A A . 6 ILE H 1 1 5 1723 1 1 6 ILE HA H -3.084 4.549 -5.131 1.00 . A A . 6 ILE HA 1 1 5 1724 1 1 6 ILE HB H -4.558 2.924 -6.250 1.00 . A A . 6 ILE HB 1 1 5 1725 1 1 6 ILE HD11 H -4.990 0.638 -6.891 1.00 . A A . 6 ILE HD11 1 1 5 1726 1 1 6 ILE HD12 H -3.428 -0.150 -6.564 1.00 . A A . 6 ILE HD12 1 1 5 1727 1 1 6 ILE HD13 H -4.881 -0.646 -5.664 1.00 . A A . 6 ILE HD13 1 1 5 1728 1 1 6 ILE HG12 H -3.235 0.901 -4.419 1.00 . A A . 6 ILE HG12 1 1 5 1729 1 1 6 ILE HG13 H -4.923 1.372 -4.399 1.00 . A A . 6 ILE HG13 1 1 5 1730 1 1 6 ILE HG21 H -2.192 1.420 -6.701 1.00 . A A . 6 ILE HG21 1 1 5 1731 1 1 6 ILE HG22 H -2.863 2.756 -7.667 1.00 . A A . 6 ILE HG22 1 1 5 1732 1 1 6 ILE HG23 H -1.707 3.098 -6.357 1.00 . A A . 6 ILE HG23 1 1 5 1733 1 1 6 ILE N N -2.253 3.214 -3.799 1.00 . A A . 6 ILE N 1 1 5 1734 1 1 6 ILE O O -5.298 4.917 -3.948 1.00 . A A . 6 ILE O 1 1 5 1735 1 1 7 LEU C C -5.699 4.681 -1.070 1.00 . A A . 7 LEU C 1 1 5 1736 1 1 7 LEU CA C -5.822 3.311 -1.740 1.00 . A A . 7 LEU CA 1 1 5 1737 1 1 7 LEU CB C -5.873 2.145 -0.751 1.00 . A A . 7 LEU CB 1 1 5 1738 1 1 7 LEU CD1 C -8.371 2.020 -0.428 1.00 . A A . 7 LEU CD1 1 1 5 1739 1 1 7 LEU CD2 C -6.807 1.128 1.359 1.00 . A A . 7 LEU CD2 1 1 5 1740 1 1 7 LEU CG C -7.017 2.177 0.265 1.00 . A A . 7 LEU CG 1 1 5 1741 1 1 7 LEU H H -4.123 2.362 -2.483 1.00 . A A . 7 LEU H 1 1 5 1742 1 1 7 LEU HA H -6.749 3.289 -2.313 1.00 . A A . 7 LEU HA 1 1 5 1743 1 1 7 LEU HB2 H -5.943 1.217 -1.318 1.00 . A A . 7 LEU HB2 1 1 5 1744 1 1 7 LEU HB3 H -4.930 2.115 -0.206 1.00 . A A . 7 LEU HB3 1 1 5 1745 1 1 7 LEU HD11 H -9.129 1.755 0.309 1.00 . A A . 7 LEU HD11 1 1 5 1746 1 1 7 LEU HD12 H -8.645 2.959 -0.909 1.00 . A A . 7 LEU HD12 1 1 5 1747 1 1 7 LEU HD13 H -8.305 1.233 -1.180 1.00 . A A . 7 LEU HD13 1 1 5 1748 1 1 7 LEU HD21 H -7.656 1.143 2.043 1.00 . A A . 7 LEU HD21 1 1 5 1749 1 1 7 LEU HD22 H -6.723 0.141 0.905 1.00 . A A . 7 LEU HD22 1 1 5 1750 1 1 7 LEU HD23 H -5.894 1.354 1.909 1.00 . A A . 7 LEU HD23 1 1 5 1751 1 1 7 LEU HG H -7.015 3.153 0.750 1.00 . A A . 7 LEU HG 1 1 5 1752 1 1 7 LEU N N -4.726 3.135 -2.678 1.00 . A A . 7 LEU N 1 1 5 1753 1 1 7 LEU O O -6.644 5.468 -1.081 1.00 . A A . 7 LEU O 1 1 5 1754 1 1 8 GLY C C -4.501 7.368 -0.775 1.00 . A A . 8 GLY C 1 1 5 1755 1 1 8 GLY CA C -4.267 6.186 0.168 1.00 . A A . 8 GLY CA 1 1 5 1756 1 1 8 GLY H H -3.763 4.278 -0.499 1.00 . A A . 8 GLY H 1 1 5 1757 1 1 8 GLY HA2 H -4.916 6.278 1.040 1.00 . A A . 8 GLY HA2 1 1 5 1758 1 1 8 GLY HA3 H -3.240 6.204 0.532 1.00 . A A . 8 GLY HA3 1 1 5 1759 1 1 8 GLY N N -4.526 4.924 -0.504 1.00 . A A . 8 GLY N 1 1 5 1760 1 1 8 GLY O O -5.030 8.399 -0.364 1.00 . A A . 8 GLY O 1 1 5 1761 1 1 9 SER C C -5.586 8.045 -3.752 1.00 . A A . 9 SER C 1 1 5 1762 1 1 9 SER CA C -4.250 8.216 -3.026 1.00 . A A . 9 SER CA 1 1 5 1763 1 1 9 SER CB C -3.094 8.191 -4.028 1.00 . A A . 9 SER CB 1 1 5 1764 1 1 9 SER H H -3.666 6.335 -2.348 1.00 . A A . 9 SER H 1 1 5 1765 1 1 9 SER HA H -4.232 9.156 -2.474 1.00 . A A . 9 SER HA 1 1 5 1766 1 1 9 SER HB2 H -2.153 8.062 -3.493 1.00 . A A . 9 SER HB2 1 1 5 1767 1 1 9 SER HB3 H -3.206 7.332 -4.689 1.00 . A A . 9 SER HB3 1 1 5 1768 1 1 9 SER HG H -3.784 9.396 -5.469 1.00 . A A . 9 SER HG 1 1 5 1769 1 1 9 SER N N -4.094 7.178 -2.021 1.00 . A A . 9 SER N 1 1 5 1770 1 1 9 SER O O -5.713 8.412 -4.919 1.00 . A A . 9 SER O 1 1 5 1771 1 1 9 SER OG O -3.036 9.384 -4.806 1.00 . A A . 9 SER OG 1 1 5 1772 1 1 10 LEU C C -8.910 7.986 -2.726 1.00 . A A . 10 LEU C 1 1 5 1773 1 1 10 LEU CA C -7.871 7.270 -3.590 1.00 . A A . 10 LEU CA 1 1 5 1774 1 1 10 LEU CB C -8.140 5.774 -3.762 1.00 . A A . 10 LEU CB 1 1 5 1775 1 1 10 LEU CD1 C -9.861 6.023 -5.588 1.00 . A A . 10 LEU CD1 1 1 5 1776 1 1 10 LEU CD2 C -7.441 5.536 -6.174 1.00 . A A . 10 LEU CD2 1 1 5 1777 1 1 10 LEU CG C -8.568 5.325 -5.161 1.00 . A A . 10 LEU CG 1 1 5 1778 1 1 10 LEU H H -6.435 7.190 -2.083 1.00 . A A . 10 LEU H 1 1 5 1779 1 1 10 LEU HA H -7.883 7.716 -4.585 1.00 . A A . 10 LEU HA 1 1 5 1780 1 1 10 LEU HB2 H -7.236 5.229 -3.489 1.00 . A A . 10 LEU HB2 1 1 5 1781 1 1 10 LEU HB3 H -8.915 5.480 -3.055 1.00 . A A . 10 LEU HB3 1 1 5 1782 1 1 10 LEU HD11 H -10.368 5.420 -6.342 1.00 . A A . 10 LEU HD11 1 1 5 1783 1 1 10 LEU HD12 H -10.512 6.144 -4.722 1.00 . A A . 10 LEU HD12 1 1 5 1784 1 1 10 LEU HD13 H -9.625 7.002 -6.005 1.00 . A A . 10 LEU HD13 1 1 5 1785 1 1 10 LEU HD21 H -6.933 6.477 -5.961 1.00 . A A . 10 LEU HD21 1 1 5 1786 1 1 10 LEU HD22 H -6.729 4.714 -6.102 1.00 . A A . 10 LEU HD22 1 1 5 1787 1 1 10 LEU HD23 H -7.859 5.568 -7.180 1.00 . A A . 10 LEU HD23 1 1 5 1788 1 1 10 LEU HG H -8.776 4.256 -5.128 1.00 . A A . 10 LEU HG 1 1 5 1789 1 1 10 LEU N N -6.548 7.489 -3.031 1.00 . A A . 10 LEU N 1 1 5 1790 1 1 10 LEU O O -9.794 8.666 -3.246 1.00 . A A . 10 LEU O 1 1 5 1791 1 1 11 LEU C C -9.732 9.945 -0.762 1.00 . A A . 11 LEU C 1 1 5 1792 1 1 11 LEU CA C -9.676 8.443 -0.477 1.00 . A A . 11 LEU CA 1 1 5 1793 1 1 11 LEU CB C -9.277 8.104 0.960 1.00 . A A . 11 LEU CB 1 1 5 1794 1 1 11 LEU CD1 C -11.461 7.020 1.605 1.00 . A A . 11 LEU CD1 1 1 5 1795 1 1 11 LEU CD2 C -9.512 5.596 0.824 1.00 . A A . 11 LEU CD2 1 1 5 1796 1 1 11 LEU CG C -9.940 6.865 1.566 1.00 . A A . 11 LEU CG 1 1 5 1797 1 1 11 LEU H H -8.055 7.246 -1.006 1.00 . A A . 11 LEU H 1 1 5 1798 1 1 11 LEU HA H -10.668 8.023 -0.644 1.00 . A A . 11 LEU HA 1 1 5 1799 1 1 11 LEU HB2 H -8.196 7.966 0.993 1.00 . A A . 11 LEU HB2 1 1 5 1800 1 1 11 LEU HB3 H -9.509 8.961 1.593 1.00 . A A . 11 LEU HB3 1 1 5 1801 1 1 11 LEU HD11 H -11.879 6.747 0.636 1.00 . A A . 11 LEU HD11 1 1 5 1802 1 1 11 LEU HD12 H -11.873 6.369 2.375 1.00 . A A . 11 LEU HD12 1 1 5 1803 1 1 11 LEU HD13 H -11.715 8.056 1.830 1.00 . A A . 11 LEU HD13 1 1 5 1804 1 1 11 LEU HD21 H -8.424 5.552 0.777 1.00 . A A . 11 LEU HD21 1 1 5 1805 1 1 11 LEU HD22 H -9.889 4.721 1.354 1.00 . A A . 11 LEU HD22 1 1 5 1806 1 1 11 LEU HD23 H -9.919 5.612 -0.187 1.00 . A A . 11 LEU HD23 1 1 5 1807 1 1 11 LEU HG H -9.600 6.765 2.597 1.00 . A A . 11 LEU HG 1 1 5 1808 1 1 11 LEU N N -8.770 7.809 -1.420 1.00 . A A . 11 LEU N 1 1 5 1809 1 1 11 LEU O O -10.794 10.483 -1.072 1.00 . A A . 11 LEU O 1 1 5 1810 1 1 12 MET C C -7.479 12.312 -2.005 1.00 . A A . 12 MET C 1 1 5 1811 1 1 12 MET CA C -8.479 12.010 -0.887 1.00 . A A . 12 MET CA 1 1 5 1812 1 1 12 MET CB C -8.036 12.715 0.397 1.00 . A A . 12 MET CB 1 1 5 1813 1 1 12 MET CE C -7.969 12.234 3.864 1.00 . A A . 12 MET CE 1 1 5 1814 1 1 12 MET CG C -9.153 12.701 1.443 1.00 . A A . 12 MET CG 1 1 5 1815 1 1 12 MET H H -7.716 10.136 -0.393 1.00 . A A . 12 MET H 1 1 5 1816 1 1 12 MET HA H -9.478 12.324 -1.188 1.00 . A A . 12 MET HA 1 1 5 1817 1 1 12 MET HB2 H -7.150 12.225 0.799 1.00 . A A . 12 MET HB2 1 1 5 1818 1 1 12 MET HB3 H -7.757 13.745 0.173 1.00 . A A . 12 MET HB3 1 1 5 1819 1 1 12 MET HE1 H -7.134 11.783 3.329 1.00 . A A . 12 MET HE1 1 1 5 1820 1 1 12 MET HE2 H -7.623 12.609 4.828 1.00 . A A . 12 MET HE2 1 1 5 1821 1 1 12 MET HE3 H -8.745 11.486 4.023 1.00 . A A . 12 MET HE3 1 1 5 1822 1 1 12 MET HG2 H -10.053 13.158 1.033 1.00 . A A . 12 MET HG2 1 1 5 1823 1 1 12 MET HG3 H -9.407 11.672 1.702 1.00 . A A . 12 MET HG3 1 1 5 1824 1 1 12 MET N N -8.575 10.580 -0.646 1.00 . A A . 12 MET N 1 1 5 1825 1 1 12 MET O O -6.773 13.318 -1.957 1.00 . A A . 12 MET O 1 1 5 1826 1 1 12 MET SD S -8.632 13.585 2.904 1.00 . A A . 12 MET SD 1 1 5 1827 1 1 13 THR C C -7.096 10.871 -5.347 1.00 . A A . 13 THR C 1 1 5 1828 1 1 13 THR CA C -6.537 11.570 -4.106 1.00 . A A . 13 THR CA 1 1 5 1829 1 1 13 THR CB C -5.170 11.038 -3.673 1.00 . A A . 13 THR CB 1 1 5 1830 1 1 13 THR CG2 C -4.051 11.452 -4.631 1.00 . A A . 13 THR CG2 1 1 5 1831 1 1 13 THR H H -8.038 10.612 -3.024 1.00 . A A . 13 THR H 1 1 5 1832 1 1 13 THR HA H -6.457 12.630 -4.345 1.00 . A A . 13 THR HA 1 1 5 1833 1 1 13 THR HB H -5.195 9.956 -3.548 1.00 . A A . 13 THR HB 1 1 5 1834 1 1 13 THR HG1 H -5.042 11.168 -1.680 1.00 . A A . 13 THR HG1 1 1 5 1835 1 1 13 THR HG21 H -4.277 11.087 -5.633 1.00 . A A . 13 THR HG21 1 1 5 1836 1 1 13 THR HG22 H -3.972 12.539 -4.650 1.00 . A A . 13 THR HG22 1 1 5 1837 1 1 13 THR HG23 H -3.107 11.025 -4.293 1.00 . A A . 13 THR HG23 1 1 5 1838 1 1 13 THR N N -7.452 11.422 -2.986 1.00 . A A . 13 THR N 1 1 5 1839 1 1 13 THR O O -7.712 9.812 -5.242 1.00 . A A . 13 THR O 1 1 5 1840 1 1 13 THR OG1 O -4.882 11.754 -2.475 1.00 . A A . 13 THR OG1 1 1 5 1841 1 1 14 PRO C C -6.443 9.766 -8.209 1.00 . A A . 14 PRO C 1 1 5 1842 1 1 14 PRO CA C -7.313 10.952 -7.785 1.00 . A A . 14 PRO CA 1 1 5 1843 1 1 14 PRO CB C -7.259 12.109 -8.768 1.00 . A A . 14 PRO CB 1 1 5 1844 1 1 14 PRO CD C -6.140 12.772 -6.684 1.00 . A A . 14 PRO CD 1 1 5 1845 1 1 14 PRO CG C -6.339 13.145 -8.144 1.00 . A A . 14 PRO CG 1 1 5 1846 1 1 14 PRO HA H -8.240 10.590 -7.688 1.00 . A A . 14 PRO HA 1 1 5 1847 1 1 14 PRO HB2 H -6.879 11.782 -9.736 1.00 . A A . 14 PRO HB2 1 1 5 1848 1 1 14 PRO HB3 H -8.253 12.523 -8.940 1.00 . A A . 14 PRO HB3 1 1 5 1849 1 1 14 PRO HD2 H -5.083 12.663 -6.443 1.00 . A A . 14 PRO HD2 1 1 5 1850 1 1 14 PRO HD3 H -6.540 13.540 -6.021 1.00 . A A . 14 PRO HD3 1 1 5 1851 1 1 14 PRO HG2 H -5.382 13.169 -8.665 1.00 . A A . 14 PRO HG2 1 1 5 1852 1 1 14 PRO HG3 H -6.773 14.142 -8.228 1.00 . A A . 14 PRO HG3 1 1 5 1853 1 1 14 PRO N N -6.854 11.509 -6.523 1.00 . A A . 14 PRO N 1 1 5 1854 1 1 14 PRO O O -5.453 9.451 -7.551 1.00 . A A . 14 PRO O 1 1 5 1855 1 1 15 PRO C C -4.831 8.437 -10.547 1.00 . A A . 15 PRO C 1 1 5 1856 1 1 15 PRO CA C -6.121 7.987 -9.860 1.00 . A A . 15 PRO CA 1 1 5 1857 1 1 15 PRO CB C -7.089 7.296 -10.807 1.00 . A A . 15 PRO CB 1 1 5 1858 1 1 15 PRO CD C -8.029 9.465 -10.135 1.00 . A A . 15 PRO CD 1 1 5 1859 1 1 15 PRO CG C -8.159 8.326 -11.133 1.00 . A A . 15 PRO CG 1 1 5 1860 1 1 15 PRO HA H -5.837 7.383 -9.114 1.00 . A A . 15 PRO HA 1 1 5 1861 1 1 15 PRO HB2 H -6.580 6.962 -11.711 1.00 . A A . 15 PRO HB2 1 1 5 1862 1 1 15 PRO HB3 H -7.526 6.412 -10.342 1.00 . A A . 15 PRO HB3 1 1 5 1863 1 1 15 PRO HD2 H -7.898 10.422 -10.642 1.00 . A A . 15 PRO HD2 1 1 5 1864 1 1 15 PRO HD3 H -8.920 9.552 -9.514 1.00 . A A . 15 PRO HD3 1 1 5 1865 1 1 15 PRO HG2 H -8.037 8.694 -12.151 1.00 . A A . 15 PRO HG2 1 1 5 1866 1 1 15 PRO HG3 H -9.151 7.877 -11.073 1.00 . A A . 15 PRO HG3 1 1 5 1867 1 1 15 PRO N N -6.856 9.125 -9.335 1.00 . A A . 15 PRO N 1 1 5 1868 1 1 15 PRO O O -4.619 8.153 -11.725 1.00 . A A . 15 PRO O 1 1 5 1869 1 1 16 VAL C C -1.915 8.438 -10.825 1.00 . A A . 16 VAL C 1 1 5 1870 1 1 16 VAL CA C -2.735 9.619 -10.301 1.00 . A A . 16 VAL CA 1 1 5 1871 1 1 16 VAL CB C -2.004 10.424 -9.225 1.00 . A A . 16 VAL CB 1 1 5 1872 1 1 16 VAL CG1 C -2.745 11.726 -8.916 1.00 . A A . 16 VAL CG1 1 1 5 1873 1 1 16 VAL CG2 C -1.805 9.592 -7.957 1.00 . A A . 16 VAL CG2 1 1 5 1874 1 1 16 VAL H H -4.183 9.361 -8.826 1.00 . A A . 16 VAL H 1 1 5 1875 1 1 16 VAL HA H -2.956 10.289 -11.132 1.00 . A A . 16 VAL HA 1 1 5 1876 1 1 16 VAL HB H -1.018 10.684 -9.613 1.00 . A A . 16 VAL HB 1 1 5 1877 1 1 16 VAL HG11 H -3.004 12.227 -9.849 1.00 . A A . 16 VAL HG11 1 1 5 1878 1 1 16 VAL HG12 H -3.655 11.503 -8.360 1.00 . A A . 16 VAL HG12 1 1 5 1879 1 1 16 VAL HG13 H -2.105 12.376 -8.320 1.00 . A A . 16 VAL HG13 1 1 5 1880 1 1 16 VAL HG21 H -1.723 10.255 -7.096 1.00 . A A . 16 VAL HG21 1 1 5 1881 1 1 16 VAL HG22 H -2.658 8.926 -7.822 1.00 . A A . 16 VAL HG22 1 1 5 1882 1 1 16 VAL HG23 H -0.894 9.001 -8.049 1.00 . A A . 16 VAL HG23 1 1 5 1883 1 1 16 VAL N N -4.001 9.131 -9.782 1.00 . A A . 16 VAL N 1 1 5 1884 1 1 16 VAL O O -1.400 8.482 -11.941 1.00 . A A . 16 VAL O 1 1 5 1885 1 1 17 ILE C C -1.554 5.727 -11.732 1.00 . A A . 17 ILE C 1 1 5 1886 1 1 17 ILE CA C -1.077 6.217 -10.363 1.00 . A A . 17 ILE CA 1 1 5 1887 1 1 17 ILE CB C -1.181 5.160 -9.261 1.00 . A A . 17 ILE CB 1 1 5 1888 1 1 17 ILE CD1 C -2.760 3.686 -7.959 1.00 . A A . 17 ILE CD1 1 1 5 1889 1 1 17 ILE CG1 C -2.643 4.887 -8.899 1.00 . A A . 17 ILE CG1 1 1 5 1890 1 1 17 ILE CG2 C -0.352 5.559 -8.039 1.00 . A A . 17 ILE CG2 1 1 5 1891 1 1 17 ILE H H -2.237 7.385 -9.086 1.00 . A A . 17 ILE H 1 1 5 1892 1 1 17 ILE HA H -0.027 6.497 -10.443 1.00 . A A . 17 ILE HA 1 1 5 1893 1 1 17 ILE HB H -0.765 4.228 -9.642 1.00 . A A . 17 ILE HB 1 1 5 1894 1 1 17 ILE HD11 H -2.220 3.894 -7.034 1.00 . A A . 17 ILE HD11 1 1 5 1895 1 1 17 ILE HD12 H -3.810 3.502 -7.733 1.00 . A A . 17 ILE HD12 1 1 5 1896 1 1 17 ILE HD13 H -2.332 2.806 -8.439 1.00 . A A . 17 ILE HD13 1 1 5 1897 1 1 17 ILE HG12 H -3.074 5.769 -8.424 1.00 . A A . 17 ILE HG12 1 1 5 1898 1 1 17 ILE HG13 H -3.217 4.701 -9.806 1.00 . A A . 17 ILE HG13 1 1 5 1899 1 1 17 ILE HG21 H 0.639 5.877 -8.360 1.00 . A A . 17 ILE HG21 1 1 5 1900 1 1 17 ILE HG22 H -0.846 6.379 -7.517 1.00 . A A . 17 ILE HG22 1 1 5 1901 1 1 17 ILE HG23 H -0.260 4.705 -7.368 1.00 . A A . 17 ILE HG23 1 1 5 1902 1 1 17 ILE N N -1.819 7.411 -9.994 1.00 . A A . 17 ILE N 1 1 5 1903 1 1 17 ILE O O -0.795 5.104 -12.471 1.00 . A A . 17 ILE O 1 1 5 1904 1 1 18 GLN C C -3.437 6.800 -14.265 1.00 . A A . 18 GLN C 1 1 5 1905 1 1 18 GLN CA C -3.400 5.620 -13.291 1.00 . A A . 18 GLN CA 1 1 5 1906 1 1 18 GLN CB C -4.799 5.039 -13.081 1.00 . A A . 18 GLN CB 1 1 5 1907 1 1 18 GLN CD C -6.072 3.016 -12.276 1.00 . A A . 18 GLN CD 1 1 5 1908 1 1 18 GLN CG C -4.744 3.774 -12.222 1.00 . A A . 18 GLN CG 1 1 5 1909 1 1 18 GLN H H -3.420 6.540 -11.422 1.00 . A A . 18 GLN H 1 1 5 1910 1 1 18 GLN HA H -2.744 4.841 -13.679 1.00 . A A . 18 GLN HA 1 1 5 1911 1 1 18 GLN HB2 H -5.437 5.781 -12.601 1.00 . A A . 18 GLN HB2 1 1 5 1912 1 1 18 GLN HB3 H -5.250 4.808 -14.046 1.00 . A A . 18 GLN HB3 1 1 5 1913 1 1 18 GLN HE21 H -6.243 3.268 -10.275 1.00 . A A . 18 GLN HE21 1 1 5 1914 1 1 18 GLN HE22 H -7.543 2.404 -11.026 1.00 . A A . 18 GLN HE22 1 1 5 1915 1 1 18 GLN HG2 H -3.938 3.128 -12.571 1.00 . A A . 18 GLN HG2 1 1 5 1916 1 1 18 GLN HG3 H -4.515 4.040 -11.190 1.00 . A A . 18 GLN HG3 1 1 5 1917 1 1 18 GLN N N -2.810 6.028 -12.027 1.00 . A A . 18 GLN N 1 1 5 1918 1 1 18 GLN NE2 N -6.669 2.885 -11.095 1.00 . A A . 18 GLN NE2 1 1 5 1919 1 1 18 GLN O O -3.252 6.623 -15.468 1.00 . A A . 18 GLN O 1 1 5 1920 1 1 18 GLN OE1 O -6.525 2.578 -13.321 1.00 . A A . 18 GLN OE1 1 1 5 1921 1 1 19 ALA C C -2.401 9.354 -15.257 1.00 . A A . 19 ALA C 1 1 5 1922 1 1 19 ALA CA C -3.726 9.189 -14.510 1.00 . A A . 19 ALA CA 1 1 5 1923 1 1 19 ALA CB C -4.041 10.385 -13.609 1.00 . A A . 19 ALA CB 1 1 5 1924 1 1 19 ALA H H -3.838 8.112 -12.730 1.00 . A A . 19 ALA H 1 1 5 1925 1 1 19 ALA HA H -4.531 9.075 -15.236 1.00 . A A . 19 ALA HA 1 1 5 1926 1 1 19 ALA HB1 H -3.376 10.375 -12.746 1.00 . A A . 19 ALA HB1 1 1 5 1927 1 1 19 ALA HB2 H -3.895 11.309 -14.169 1.00 . A A . 19 ALA HB2 1 1 5 1928 1 1 19 ALA HB3 H -5.075 10.324 -13.272 1.00 . A A . 19 ALA HB3 1 1 5 1929 1 1 19 ALA N N -3.678 7.978 -13.708 1.00 . A A . 19 ALA N 1 1 5 1930 1 1 19 ALA O O -2.386 9.485 -16.480 1.00 . A A . 19 ALA O 1 1 5 1931 1 1 20 ILE C C 0.364 8.290 -15.897 1.00 . A A . 20 ILE C 1 1 5 1932 1 1 20 ILE CA C 0.004 9.520 -15.061 1.00 . A A . 20 ILE CA 1 1 5 1933 1 1 20 ILE CB C 1.021 9.837 -13.963 1.00 . A A . 20 ILE CB 1 1 5 1934 1 1 20 ILE CD1 C 0.762 7.691 -12.665 1.00 . A A . 20 ILE CD1 1 1 5 1935 1 1 20 ILE CG1 C 1.719 8.565 -13.478 1.00 . A A . 20 ILE CG1 1 1 5 1936 1 1 20 ILE CG2 C 0.366 10.606 -12.814 1.00 . A A . 20 ILE CG2 1 1 5 1937 1 1 20 ILE H H -1.340 9.213 -13.499 1.00 . A A . 20 ILE H 1 1 5 1938 1 1 20 ILE HA H -0.039 10.386 -15.721 1.00 . A A . 20 ILE HA 1 1 5 1939 1 1 20 ILE HB H 1.790 10.484 -14.386 1.00 . A A . 20 ILE HB 1 1 5 1940 1 1 20 ILE HD11 H -0.261 7.863 -13.000 1.00 . A A . 20 ILE HD11 1 1 5 1941 1 1 20 ILE HD12 H 1.019 6.641 -12.807 1.00 . A A . 20 ILE HD12 1 1 5 1942 1 1 20 ILE HD13 H 0.846 7.945 -11.608 1.00 . A A . 20 ILE HD13 1 1 5 1943 1 1 20 ILE HG12 H 2.093 8.003 -14.333 1.00 . A A . 20 ILE HG12 1 1 5 1944 1 1 20 ILE HG13 H 2.582 8.830 -12.867 1.00 . A A . 20 ILE HG13 1 1 5 1945 1 1 20 ILE HG21 H -0.431 11.237 -13.206 1.00 . A A . 20 ILE HG21 1 1 5 1946 1 1 20 ILE HG22 H -0.050 9.900 -12.095 1.00 . A A . 20 ILE HG22 1 1 5 1947 1 1 20 ILE HG23 H 1.113 11.228 -12.321 1.00 . A A . 20 ILE HG23 1 1 5 1948 1 1 20 ILE N N -1.321 9.341 -14.490 1.00 . A A . 20 ILE N 1 1 5 1949 1 1 20 ILE O O 1.113 8.393 -16.867 1.00 . A A . 20 ILE O 1 1 5 1950 1 1 21 HIS C C -0.450 5.939 -17.585 1.00 . A A . 21 HIS C 1 1 5 1951 1 1 21 HIS CA C 0.106 5.900 -16.160 1.00 . A A . 21 HIS CA 1 1 5 1952 1 1 21 HIS CB C -0.424 4.715 -15.350 1.00 . A A . 21 HIS CB 1 1 5 1953 1 1 21 HIS CD2 C -1.460 2.419 -16.047 1.00 . A A . 21 HIS CD2 1 1 5 1954 1 1 21 HIS CE1 C -0.081 1.935 -17.675 1.00 . A A . 21 HIS CE1 1 1 5 1955 1 1 21 HIS CG C -0.560 3.439 -16.145 1.00 . A A . 21 HIS CG 1 1 5 1956 1 1 21 HIS H H -0.817 7.086 -14.717 1.00 . A A . 21 HIS H 1 1 5 1957 1 1 21 HIS HA H 1.191 5.813 -16.205 1.00 . A A . 21 HIS HA 1 1 5 1958 1 1 21 HIS HB2 H 0.244 4.537 -14.508 1.00 . A A . 21 HIS HB2 1 1 5 1959 1 1 21 HIS HB3 H -1.397 4.978 -14.935 1.00 . A A . 21 HIS HB3 1 1 5 1960 1 1 21 HIS HD1 H 1.070 3.653 -17.499 1.00 . A A . 21 HIS HD1 1 1 5 1961 1 1 21 HIS HD2 H -2.279 2.359 -15.330 1.00 . A A . 21 HIS HD2 1 1 5 1962 1 1 21 HIS HE1 H 0.396 1.405 -18.499 1.00 . A A . 21 HIS HE1 1 1 5 1963 1 1 21 HIS HE2 H -1.633 0.634 -17.090 1.00 . A A . 21 HIS HE2 1 1 5 1964 1 1 21 HIS N N -0.185 7.155 -15.489 1.00 . A A . 21 HIS N 1 1 5 1965 1 1 21 HIS ND1 N 0.297 3.105 -17.180 1.00 . A A . 21 HIS ND1 1 1 5 1966 1 1 21 HIS NE2 N -1.170 1.512 -16.972 1.00 . A A . 21 HIS NE2 1 1 5 1967 1 1 21 HIS O O 0.228 5.541 -18.531 1.00 . A A . 21 HIS O 1 1 5 1968 1 1 22 ASP C C -1.425 7.279 -19.958 1.00 . A A . 22 ASP C 1 1 5 1969 1 1 22 ASP CA C -2.333 6.521 -18.988 1.00 . A A . 22 ASP CA 1 1 5 1970 1 1 22 ASP CB C -3.654 7.285 -18.881 1.00 . A A . 22 ASP CB 1 1 5 1971 1 1 22 ASP CG C -4.799 6.718 -19.722 1.00 . A A . 22 ASP CG 1 1 5 1972 1 1 22 ASP H H -2.223 6.746 -16.920 1.00 . A A . 22 ASP H 1 1 5 1973 1 1 22 ASP HA H -2.507 5.491 -19.299 1.00 . A A . 22 ASP HA 1 1 5 1974 1 1 22 ASP HB2 H -3.963 7.301 -17.836 1.00 . A A . 22 ASP HB2 1 1 5 1975 1 1 22 ASP HB3 H -3.482 8.320 -19.178 1.00 . A A . 22 ASP HB3 1 1 5 1976 1 1 22 ASP N N -1.678 6.424 -17.694 1.00 . A A . 22 ASP N 1 1 5 1977 1 1 22 ASP O O -1.278 6.884 -21.114 1.00 . A A . 22 ASP O 1 1 5 1978 1 1 22 ASP OD1 O -4.672 6.774 -20.964 1.00 . A A . 22 ASP OD1 1 1 5 1979 1 1 22 ASP OD2 O -5.775 6.242 -19.103 1.00 . A A . 22 ASP OD2 1 1 5 1980 1 1 23 ALA C C 1.315 8.385 -20.585 1.00 . A A . 23 ALA C 1 1 5 1981 1 1 23 ALA CA C 0.045 9.176 -20.262 1.00 . A A . 23 ALA CA 1 1 5 1982 1 1 23 ALA CB C 0.344 10.483 -19.526 1.00 . A A . 23 ALA CB 1 1 5 1983 1 1 23 ALA H H -0.960 8.666 -18.510 1.00 . A A . 23 ALA H 1 1 5 1984 1 1 23 ALA HA H -0.475 9.407 -21.192 1.00 . A A . 23 ALA HA 1 1 5 1985 1 1 23 ALA HB1 H 1.169 10.997 -20.019 1.00 . A A . 23 ALA HB1 1 1 5 1986 1 1 23 ALA HB2 H -0.541 11.119 -19.541 1.00 . A A . 23 ALA HB2 1 1 5 1987 1 1 23 ALA HB3 H 0.617 10.265 -18.494 1.00 . A A . 23 ALA HB3 1 1 5 1988 1 1 23 ALA N N -0.839 8.354 -19.453 1.00 . A A . 23 ALA N 1 1 5 1989 1 1 23 ALA O O 1.817 8.441 -21.707 1.00 . A A . 23 ALA O 1 1 5 1990 1 1 24 GLN C C 2.661 5.598 -20.568 1.00 . A A . 24 GLN C 1 1 5 1991 1 1 24 GLN CA C 2.987 6.850 -19.751 1.00 . A A . 24 GLN CA 1 1 5 1992 1 1 24 GLN CB C 3.594 6.478 -18.397 1.00 . A A . 24 GLN CB 1 1 5 1993 1 1 24 GLN CD C 4.314 8.884 -18.625 1.00 . A A . 24 GLN CD 1 1 5 1994 1 1 24 GLN CG C 4.085 7.723 -17.655 1.00 . A A . 24 GLN CG 1 1 5 1995 1 1 24 GLN H H 1.390 7.636 -18.669 1.00 . A A . 24 GLN H 1 1 5 1996 1 1 24 GLN HA H 3.693 7.476 -20.298 1.00 . A A . 24 GLN HA 1 1 5 1997 1 1 24 GLN HB2 H 2.850 5.959 -17.791 1.00 . A A . 24 GLN HB2 1 1 5 1998 1 1 24 GLN HB3 H 4.423 5.786 -18.543 1.00 . A A . 24 GLN HB3 1 1 5 1999 1 1 24 GLN HE21 H 2.750 9.844 -17.771 1.00 . A A . 24 GLN HE21 1 1 5 2000 1 1 24 GLN HE22 H 3.529 10.698 -19.061 1.00 . A A . 24 GLN HE22 1 1 5 2001 1 1 24 GLN HG2 H 3.354 8.013 -16.901 1.00 . A A . 24 GLN HG2 1 1 5 2002 1 1 24 GLN HG3 H 5.012 7.495 -17.129 1.00 . A A . 24 GLN HG3 1 1 5 2003 1 1 24 GLN N N 1.797 7.666 -19.582 1.00 . A A . 24 GLN N 1 1 5 2004 1 1 24 GLN NE2 N 3.460 9.892 -18.473 1.00 . A A . 24 GLN NE2 1 1 5 2005 1 1 24 GLN O O 3.373 5.268 -21.516 1.00 . A A . 24 GLN O 1 1 5 2006 1 1 24 GLN OE1 O 5.207 8.865 -19.456 1.00 . A A . 24 GLN OE1 1 1 5 2007 1 1 25 ARG C C 2.318 2.759 -21.021 1.00 . A A . 25 ARG C 1 1 5 2008 1 1 25 ARG CA C 1.149 3.734 -20.863 1.00 . A A . 25 ARG CA 1 1 5 2009 1 1 25 ARG CB C 0.582 4.068 -22.245 1.00 . A A . 25 ARG CB 1 1 5 2010 1 1 25 ARG CD C -1.500 4.671 -23.533 1.00 . A A . 25 ARG CD 1 1 5 2011 1 1 25 ARG CG C -0.945 4.151 -22.206 1.00 . A A . 25 ARG CG 1 1 5 2012 1 1 25 ARG CZ C -0.484 6.509 -24.873 1.00 . A A . 25 ARG CZ 1 1 5 2013 1 1 25 ARG H H 1.015 5.207 -19.396 1.00 . A A . 25 ARG H 1 1 5 2014 1 1 25 ARG HA H 0.370 3.313 -20.227 1.00 . A A . 25 ARG HA 1 1 5 2015 1 1 25 ARG HB2 H 0.993 5.016 -22.591 1.00 . A A . 25 ARG HB2 1 1 5 2016 1 1 25 ARG HB3 H 0.891 3.307 -22.962 1.00 . A A . 25 ARG HB3 1 1 5 2017 1 1 25 ARG HD2 H -1.153 4.042 -24.353 1.00 . A A . 25 ARG HD2 1 1 5 2018 1 1 25 ARG HD3 H -2.589 4.616 -23.528 1.00 . A A . 25 ARG HD3 1 1 5 2019 1 1 25 ARG HE H -1.218 6.727 -23.012 1.00 . A A . 25 ARG HE 1 1 5 2020 1 1 25 ARG HG2 H -1.361 3.165 -21.994 1.00 . A A . 25 ARG HG2 1 1 5 2021 1 1 25 ARG HG3 H -1.256 4.809 -21.394 1.00 . A A . 25 ARG HG3 1 1 5 2022 1 1 25 ARG HH11 H -0.530 4.704 -25.808 1.00 . A A . 25 ARG HH11 1 1 5 2023 1 1 25 ARG HH12 H 0.174 5.992 -26.727 1.00 . A A . 25 ARG HH12 1 1 5 2024 1 1 25 ARG HH21 H -0.289 8.427 -24.224 1.00 . A A . 25 ARG HH21 1 1 5 2025 1 1 25 ARG HH22 H 0.312 8.124 -25.820 1.00 . A A . 25 ARG HH22 1 1 5 2026 1 1 25 ARG N N 1.584 4.936 -20.172 1.00 . A A . 25 ARG N 1 1 5 2027 1 1 25 ARG NE N -1.066 6.069 -23.750 1.00 . A A . 25 ARG NE 1 1 5 2028 1 1 25 ARG NH1 N -0.261 5.663 -25.889 1.00 . A A . 25 ARG NH1 1 1 5 2029 1 1 25 ARG NH2 N -0.123 7.795 -24.982 1.00 . A A . 25 ARG NH2 1 1 5 2030 1 1 25 ARG O O 2.544 2.226 -22.106 1.00 . A A . 25 ARG O 1 1 6 2031 1 1 1 PHE C C 1.131 0.000 -2.451 1.00 . A A . 1 PHE C 1 1 6 2032 1 1 1 PHE CA C 2.073 0.000 -1.245 1.00 . A A . 1 PHE CA 1 1 6 2033 1 1 1 PHE CB C 2.908 -1.282 -1.266 1.00 . A A . 1 PHE CB 1 1 6 2034 1 1 1 PHE CD1 C 5.199 -0.274 -1.172 1.00 . A A . 1 PHE CD1 1 1 6 2035 1 1 1 PHE CD2 C 4.707 -1.746 -2.945 1.00 . A A . 1 PHE CD2 1 1 6 2036 1 1 1 PHE CE1 C 6.513 -0.100 -1.682 1.00 . A A . 1 PHE CE1 1 1 6 2037 1 1 1 PHE CE2 C 6.021 -1.572 -3.454 1.00 . A A . 1 PHE CE2 1 1 6 2038 1 1 1 PHE CG C 4.324 -1.094 -1.814 1.00 . A A . 1 PHE CG 1 1 6 2039 1 1 1 PHE CZ C 6.896 -0.752 -2.812 1.00 . A A . 1 PHE CZ 1 1 6 2040 1 1 1 PHE H1 H 1.884 0.000 0.829 1.00 . A A . 1 PHE H1 1 1 6 2041 1 1 1 PHE HA H 2.678 0.907 -1.259 1.00 . A A . 1 PHE HA 1 1 6 2042 1 1 1 PHE HB2 H 2.972 -1.678 -0.252 1.00 . A A . 1 PHE HB2 1 1 6 2043 1 1 1 PHE HB3 H 2.393 -2.030 -1.868 1.00 . A A . 1 PHE HB3 1 1 6 2044 1 1 1 PHE HD1 H 4.892 0.248 -0.266 1.00 . A A . 1 PHE HD1 1 1 6 2045 1 1 1 PHE HD2 H 4.006 -2.403 -3.459 1.00 . A A . 1 PHE HD2 1 1 6 2046 1 1 1 PHE HE1 H 7.214 0.557 -1.167 1.00 . A A . 1 PHE HE1 1 1 6 2047 1 1 1 PHE HE2 H 6.329 -2.095 -4.360 1.00 . A A . 1 PHE HE2 1 1 6 2048 1 1 1 PHE HZ H 7.905 -0.618 -3.203 1.00 . A A . 1 PHE HZ 1 1 6 2049 1 1 1 PHE N N 1.325 0.000 0.000 1.00 . A A . 1 PHE N 1 1 6 2050 1 1 1 PHE O O -0.087 -0.050 -2.291 1.00 . A A . 1 PHE O 1 1 6 2051 1 1 2 LEU C C 0.958 -1.310 -5.489 1.00 . A A . 2 LEU C 1 1 6 2052 1 1 2 LEU CA C 0.961 0.086 -4.862 1.00 . A A . 2 LEU CA 1 1 6 2053 1 1 2 LEU CB C 1.484 1.178 -5.797 1.00 . A A . 2 LEU CB 1 1 6 2054 1 1 2 LEU CD1 C 0.641 3.344 -4.819 1.00 . A A . 2 LEU CD1 1 1 6 2055 1 1 2 LEU CD2 C 0.863 3.080 -7.332 1.00 . A A . 2 LEU CD2 1 1 6 2056 1 1 2 LEU CG C 0.562 2.381 -6.005 1.00 . A A . 2 LEU CG 1 1 6 2057 1 1 2 LEU H H 2.724 0.083 -3.753 1.00 . A A . 2 LEU H 1 1 6 2058 1 1 2 LEU HA H -0.064 0.349 -4.600 1.00 . A A . 2 LEU HA 1 1 6 2059 1 1 2 LEU HB2 H 2.436 1.539 -5.405 1.00 . A A . 2 LEU HB2 1 1 6 2060 1 1 2 LEU HB3 H 1.689 0.730 -6.769 1.00 . A A . 2 LEU HB3 1 1 6 2061 1 1 2 LEU HD11 H 0.222 2.866 -3.934 1.00 . A A . 2 LEU HD11 1 1 6 2062 1 1 2 LEU HD12 H 1.682 3.607 -4.633 1.00 . A A . 2 LEU HD12 1 1 6 2063 1 1 2 LEU HD13 H 0.074 4.247 -5.046 1.00 . A A . 2 LEU HD13 1 1 6 2064 1 1 2 LEU HD21 H 0.606 2.417 -8.158 1.00 . A A . 2 LEU HD21 1 1 6 2065 1 1 2 LEU HD22 H 0.275 3.994 -7.403 1.00 . A A . 2 LEU HD22 1 1 6 2066 1 1 2 LEU HD23 H 1.924 3.326 -7.381 1.00 . A A . 2 LEU HD23 1 1 6 2067 1 1 2 LEU HG H -0.465 2.019 -6.058 1.00 . A A . 2 LEU HG 1 1 6 2068 1 1 2 LEU N N 1.732 0.057 -3.631 1.00 . A A . 2 LEU N 1 1 6 2069 1 1 2 LEU O O -0.082 -1.964 -5.551 1.00 . A A . 2 LEU O 1 1 6 2070 1 1 3 PRO C C 2.271 -4.158 -5.541 1.00 . A A . 3 PRO C 1 1 6 2071 1 1 3 PRO CA C 2.308 -3.037 -6.582 1.00 . A A . 3 PRO CA 1 1 6 2072 1 1 3 PRO CB C 3.627 -2.966 -7.333 1.00 . A A . 3 PRO CB 1 1 6 2073 1 1 3 PRO CD C 3.419 -0.993 -5.884 1.00 . A A . 3 PRO CD 1 1 6 2074 1 1 3 PRO CG C 4.394 -1.805 -6.721 1.00 . A A . 3 PRO CG 1 1 6 2075 1 1 3 PRO HA H 1.539 -3.210 -7.198 1.00 . A A . 3 PRO HA 1 1 6 2076 1 1 3 PRO HB2 H 4.184 -3.898 -7.233 1.00 . A A . 3 PRO HB2 1 1 6 2077 1 1 3 PRO HB3 H 3.462 -2.807 -8.398 1.00 . A A . 3 PRO HB3 1 1 6 2078 1 1 3 PRO HD2 H 3.767 -0.894 -4.855 1.00 . A A . 3 PRO HD2 1 1 6 2079 1 1 3 PRO HD3 H 3.304 0.016 -6.279 1.00 . A A . 3 PRO HD3 1 1 6 2080 1 1 3 PRO HG2 H 5.214 -2.173 -6.103 1.00 . A A . 3 PRO HG2 1 1 6 2081 1 1 3 PRO HG3 H 4.836 -1.186 -7.501 1.00 . A A . 3 PRO HG3 1 1 6 2082 1 1 3 PRO N N 2.164 -1.736 -5.951 1.00 . A A . 3 PRO N 1 1 6 2083 1 1 3 PRO O O 3.094 -4.189 -4.628 1.00 . A A . 3 PRO O 1 1 6 2084 1 1 4 LEU C C 0.390 -5.844 -3.605 1.00 . A A . 4 LEU C 1 1 6 2085 1 1 4 LEU CA C 1.200 -6.213 -4.849 1.00 . A A . 4 LEU CA 1 1 6 2086 1 1 4 LEU CB C 2.587 -6.778 -4.535 1.00 . A A . 4 LEU CB 1 1 6 2087 1 1 4 LEU CD1 C 2.250 -9.190 -5.190 1.00 . A A . 4 LEU CD1 1 1 6 2088 1 1 4 LEU CD2 C 3.990 -8.571 -3.450 1.00 . A A . 4 LEU CD2 1 1 6 2089 1 1 4 LEU CG C 2.628 -8.231 -4.059 1.00 . A A . 4 LEU CG 1 1 6 2090 1 1 4 LEU H H 0.610 -4.990 -6.429 1.00 . A A . 4 LEU H 1 1 6 2091 1 1 4 LEU HA H 0.657 -6.981 -5.400 1.00 . A A . 4 LEU HA 1 1 6 2092 1 1 4 LEU HB2 H 3.203 -6.692 -5.430 1.00 . A A . 4 LEU HB2 1 1 6 2093 1 1 4 LEU HB3 H 3.047 -6.152 -3.771 1.00 . A A . 4 LEU HB3 1 1 6 2094 1 1 4 LEU HD11 H 1.166 -9.296 -5.230 1.00 . A A . 4 LEU HD11 1 1 6 2095 1 1 4 LEU HD12 H 2.612 -8.792 -6.139 1.00 . A A . 4 LEU HD12 1 1 6 2096 1 1 4 LEU HD13 H 2.704 -10.164 -5.007 1.00 . A A . 4 LEU HD13 1 1 6 2097 1 1 4 LEU HD21 H 3.971 -9.589 -3.062 1.00 . A A . 4 LEU HD21 1 1 6 2098 1 1 4 LEU HD22 H 4.761 -8.488 -4.216 1.00 . A A . 4 LEU HD22 1 1 6 2099 1 1 4 LEU HD23 H 4.208 -7.877 -2.639 1.00 . A A . 4 LEU HD23 1 1 6 2100 1 1 4 LEU HG H 1.884 -8.353 -3.272 1.00 . A A . 4 LEU HG 1 1 6 2101 1 1 4 LEU N N 1.308 -5.051 -5.715 1.00 . A A . 4 LEU N 1 1 6 2102 1 1 4 LEU O O 0.597 -6.413 -2.534 1.00 . A A . 4 LEU O 1 1 6 2103 1 1 5 LEU C C -2.605 -3.766 -3.260 1.00 . A A . 5 LEU C 1 1 6 2104 1 1 5 LEU CA C -1.355 -4.440 -2.692 1.00 . A A . 5 LEU CA 1 1 6 2105 1 1 5 LEU CB C -0.558 -3.551 -1.736 1.00 . A A . 5 LEU CB 1 1 6 2106 1 1 5 LEU CD1 C -2.441 -3.131 -0.112 1.00 . A A . 5 LEU CD1 1 1 6 2107 1 1 5 LEU CD2 C -0.756 -4.973 0.337 1.00 . A A . 5 LEU CD2 1 1 6 2108 1 1 5 LEU CG C -0.989 -3.588 -0.268 1.00 . A A . 5 LEU CG 1 1 6 2109 1 1 5 LEU H H -0.675 -4.435 -4.661 1.00 . A A . 5 LEU H 1 1 6 2110 1 1 5 LEU HA H -1.663 -5.322 -2.131 1.00 . A A . 5 LEU HA 1 1 6 2111 1 1 5 LEU HB2 H 0.492 -3.840 -1.792 1.00 . A A . 5 LEU HB2 1 1 6 2112 1 1 5 LEU HB3 H -0.624 -2.522 -2.088 1.00 . A A . 5 LEU HB3 1 1 6 2113 1 1 5 LEU HD11 H -2.623 -2.846 0.924 1.00 . A A . 5 LEU HD11 1 1 6 2114 1 1 5 LEU HD12 H -2.624 -2.275 -0.762 1.00 . A A . 5 LEU HD12 1 1 6 2115 1 1 5 LEU HD13 H -3.110 -3.946 -0.388 1.00 . A A . 5 LEU HD13 1 1 6 2116 1 1 5 LEU HD21 H -0.730 -4.895 1.424 1.00 . A A . 5 LEU HD21 1 1 6 2117 1 1 5 LEU HD22 H -1.566 -5.640 0.041 1.00 . A A . 5 LEU HD22 1 1 6 2118 1 1 5 LEU HD23 H 0.193 -5.372 -0.022 1.00 . A A . 5 LEU HD23 1 1 6 2119 1 1 5 LEU HG H -0.369 -2.885 0.288 1.00 . A A . 5 LEU HG 1 1 6 2120 1 1 5 LEU N N -0.514 -4.893 -3.787 1.00 . A A . 5 LEU N 1 1 6 2121 1 1 5 LEU O O -3.723 -4.081 -2.855 1.00 . A A . 5 LEU O 1 1 6 2122 1 1 6 ILE C C -4.399 -3.121 -5.513 1.00 . A A . 6 ILE C 1 1 6 2123 1 1 6 ILE CA C -3.468 -2.127 -4.816 1.00 . A A . 6 ILE CA 1 1 6 2124 1 1 6 ILE CB C -2.928 -1.036 -5.742 1.00 . A A . 6 ILE CB 1 1 6 2125 1 1 6 ILE CD1 C -1.469 -0.544 -7.739 1.00 . A A . 6 ILE CD1 1 1 6 2126 1 1 6 ILE CG1 C -2.079 -1.640 -6.863 1.00 . A A . 6 ILE CG1 1 1 6 2127 1 1 6 ILE CG2 C -2.162 0.026 -4.951 1.00 . A A . 6 ILE CG2 1 1 6 2128 1 1 6 ILE H H -1.462 -2.602 -4.516 1.00 . A A . 6 ILE H 1 1 6 2129 1 1 6 ILE HA H -4.026 -1.629 -4.023 1.00 . A A . 6 ILE HA 1 1 6 2130 1 1 6 ILE HB H -3.775 -0.538 -6.213 1.00 . A A . 6 ILE HB 1 1 6 2131 1 1 6 ILE HD11 H -0.657 -0.057 -7.199 1.00 . A A . 6 ILE HD11 1 1 6 2132 1 1 6 ILE HD12 H -1.080 -0.987 -8.657 1.00 . A A . 6 ILE HD12 1 1 6 2133 1 1 6 ILE HD13 H -2.234 0.192 -7.987 1.00 . A A . 6 ILE HD13 1 1 6 2134 1 1 6 ILE HG12 H -1.285 -2.251 -6.434 1.00 . A A . 6 ILE HG12 1 1 6 2135 1 1 6 ILE HG13 H -2.694 -2.299 -7.475 1.00 . A A . 6 ILE HG13 1 1 6 2136 1 1 6 ILE HG21 H -2.057 -0.298 -3.916 1.00 . A A . 6 ILE HG21 1 1 6 2137 1 1 6 ILE HG22 H -1.174 0.164 -5.391 1.00 . A A . 6 ILE HG22 1 1 6 2138 1 1 6 ILE HG23 H -2.709 0.968 -4.983 1.00 . A A . 6 ILE HG23 1 1 6 2139 1 1 6 ILE N N -2.374 -2.851 -4.190 1.00 . A A . 6 ILE N 1 1 6 2140 1 1 6 ILE O O -5.606 -2.898 -5.590 1.00 . A A . 6 ILE O 1 1 6 2141 1 1 7 LEU C C -5.662 -5.749 -5.772 1.00 . A A . 7 LEU C 1 1 6 2142 1 1 7 LEU CA C -4.561 -5.225 -6.696 1.00 . A A . 7 LEU CA 1 1 6 2143 1 1 7 LEU CB C -3.629 -6.317 -7.223 1.00 . A A . 7 LEU CB 1 1 6 2144 1 1 7 LEU CD1 C -1.865 -5.059 -8.513 1.00 . A A . 7 LEU CD1 1 1 6 2145 1 1 7 LEU CD2 C -2.576 -7.379 -9.254 1.00 . A A . 7 LEU CD2 1 1 6 2146 1 1 7 LEU CG C -3.013 -6.066 -8.601 1.00 . A A . 7 LEU CG 1 1 6 2147 1 1 7 LEU H H -2.820 -4.374 -5.933 1.00 . A A . 7 LEU H 1 1 6 2148 1 1 7 LEU HA H -5.031 -4.756 -7.561 1.00 . A A . 7 LEU HA 1 1 6 2149 1 1 7 LEU HB2 H -2.820 -6.454 -6.506 1.00 . A A . 7 LEU HB2 1 1 6 2150 1 1 7 LEU HB3 H -4.184 -7.254 -7.261 1.00 . A A . 7 LEU HB3 1 1 6 2151 1 1 7 LEU HD11 H -2.253 -4.051 -8.663 1.00 . A A . 7 LEU HD11 1 1 6 2152 1 1 7 LEU HD12 H -1.397 -5.126 -7.531 1.00 . A A . 7 LEU HD12 1 1 6 2153 1 1 7 LEU HD13 H -1.126 -5.282 -9.284 1.00 . A A . 7 LEU HD13 1 1 6 2154 1 1 7 LEU HD21 H -2.100 -7.167 -10.212 1.00 . A A . 7 LEU HD21 1 1 6 2155 1 1 7 LEU HD22 H -1.868 -7.891 -8.602 1.00 . A A . 7 LEU HD22 1 1 6 2156 1 1 7 LEU HD23 H -3.448 -8.013 -9.414 1.00 . A A . 7 LEU HD23 1 1 6 2157 1 1 7 LEU HG H -3.778 -5.627 -9.242 1.00 . A A . 7 LEU HG 1 1 6 2158 1 1 7 LEU N N -3.802 -4.198 -6.003 1.00 . A A . 7 LEU N 1 1 6 2159 1 1 7 LEU O O -6.828 -5.808 -6.160 1.00 . A A . 7 LEU O 1 1 6 2160 1 1 8 GLY C C -7.331 -5.635 -3.343 1.00 . A A . 8 GLY C 1 1 6 2161 1 1 8 GLY CA C -6.192 -6.628 -3.582 1.00 . A A . 8 GLY CA 1 1 6 2162 1 1 8 GLY H H -4.303 -6.071 -4.260 1.00 . A A . 8 GLY H 1 1 6 2163 1 1 8 GLY HA2 H -6.600 -7.580 -3.922 1.00 . A A . 8 GLY HA2 1 1 6 2164 1 1 8 GLY HA3 H -5.671 -6.821 -2.644 1.00 . A A . 8 GLY HA3 1 1 6 2165 1 1 8 GLY N N -5.253 -6.117 -4.567 1.00 . A A . 8 GLY N 1 1 6 2166 1 1 8 GLY O O -8.483 -6.033 -3.183 1.00 . A A . 8 GLY O 1 1 6 2167 1 1 9 SER C C -8.429 -2.762 -4.460 1.00 . A A . 9 SER C 1 1 6 2168 1 1 9 SER CA C -7.946 -3.307 -3.114 1.00 . A A . 9 SER CA 1 1 6 2169 1 1 9 SER CB C -7.363 -2.178 -2.262 1.00 . A A . 9 SER CB 1 1 6 2170 1 1 9 SER H H -6.028 -4.045 -3.455 1.00 . A A . 9 SER H 1 1 6 2171 1 1 9 SER HA H -8.768 -3.780 -2.576 1.00 . A A . 9 SER HA 1 1 6 2172 1 1 9 SER HB2 H -6.878 -2.601 -1.382 1.00 . A A . 9 SER HB2 1 1 6 2173 1 1 9 SER HB3 H -6.593 -1.655 -2.830 1.00 . A A . 9 SER HB3 1 1 6 2174 1 1 9 SER HG H -8.697 -0.735 -2.642 1.00 . A A . 9 SER HG 1 1 6 2175 1 1 9 SER N N -6.968 -4.360 -3.326 1.00 . A A . 9 SER N 1 1 6 2176 1 1 9 SER O O -8.917 -1.636 -4.538 1.00 . A A . 9 SER O 1 1 6 2177 1 1 9 SER OG O -8.362 -1.248 -1.852 1.00 . A A . 9 SER OG 1 1 6 2178 1 1 10 LEU C C -9.919 -3.998 -7.232 1.00 . A A . 10 LEU C 1 1 6 2179 1 1 10 LEU CA C -8.681 -3.197 -6.825 1.00 . A A . 10 LEU CA 1 1 6 2180 1 1 10 LEU CB C -7.510 -3.337 -7.801 1.00 . A A . 10 LEU CB 1 1 6 2181 1 1 10 LEU CD1 C -8.320 -1.606 -9.446 1.00 . A A . 10 LEU CD1 1 1 6 2182 1 1 10 LEU CD2 C -6.626 -0.980 -7.664 1.00 . A A . 10 LEU CD2 1 1 6 2183 1 1 10 LEU CG C -7.142 -2.081 -8.592 1.00 . A A . 10 LEU CG 1 1 6 2184 1 1 10 LEU H H -7.884 -4.503 -5.412 1.00 . A A . 10 LEU H 1 1 6 2185 1 1 10 LEU HA H -8.947 -2.141 -6.792 1.00 . A A . 10 LEU HA 1 1 6 2186 1 1 10 LEU HB2 H -6.633 -3.660 -7.240 1.00 . A A . 10 LEU HB2 1 1 6 2187 1 1 10 LEU HB3 H -7.746 -4.132 -8.508 1.00 . A A . 10 LEU HB3 1 1 6 2188 1 1 10 LEU HD11 H -7.973 -0.861 -10.162 1.00 . A A . 10 LEU HD11 1 1 6 2189 1 1 10 LEU HD12 H -8.746 -2.454 -9.981 1.00 . A A . 10 LEU HD12 1 1 6 2190 1 1 10 LEU HD13 H -9.080 -1.164 -8.802 1.00 . A A . 10 LEU HD13 1 1 6 2191 1 1 10 LEU HD21 H -6.647 -0.024 -8.187 1.00 . A A . 10 LEU HD21 1 1 6 2192 1 1 10 LEU HD22 H -7.261 -0.923 -6.779 1.00 . A A . 10 LEU HD22 1 1 6 2193 1 1 10 LEU HD23 H -5.603 -1.207 -7.363 1.00 . A A . 10 LEU HD23 1 1 6 2194 1 1 10 LEU HG H -6.331 -2.332 -9.275 1.00 . A A . 10 LEU HG 1 1 6 2195 1 1 10 LEU N N -8.276 -3.586 -5.485 1.00 . A A . 10 LEU N 1 1 6 2196 1 1 10 LEU O O -10.054 -4.394 -8.388 1.00 . A A . 10 LEU O 1 1 6 2197 1 1 11 LEU C C -13.205 -4.006 -6.500 1.00 . A A . 11 LEU C 1 1 6 2198 1 1 11 LEU CA C -12.012 -4.964 -6.499 1.00 . A A . 11 LEU CA 1 1 6 2199 1 1 11 LEU CB C -12.143 -6.108 -5.492 1.00 . A A . 11 LEU CB 1 1 6 2200 1 1 11 LEU CD1 C -11.203 -8.176 -4.396 1.00 . A A . 11 LEU CD1 1 1 6 2201 1 1 11 LEU CD2 C -11.024 -7.870 -6.908 1.00 . A A . 11 LEU CD2 1 1 6 2202 1 1 11 LEU CG C -11.049 -7.176 -5.544 1.00 . A A . 11 LEU CG 1 1 6 2203 1 1 11 LEU H H -10.677 -3.882 -5.321 1.00 . A A . 11 LEU H 1 1 6 2204 1 1 11 LEU HA H -11.929 -5.413 -7.488 1.00 . A A . 11 LEU HA 1 1 6 2205 1 1 11 LEU HB2 H -12.160 -5.683 -4.488 1.00 . A A . 11 LEU HB2 1 1 6 2206 1 1 11 LEU HB3 H -13.106 -6.595 -5.648 1.00 . A A . 11 LEU HB3 1 1 6 2207 1 1 11 LEU HD11 H -12.206 -8.602 -4.417 1.00 . A A . 11 LEU HD11 1 1 6 2208 1 1 11 LEU HD12 H -10.467 -8.972 -4.506 1.00 . A A . 11 LEU HD12 1 1 6 2209 1 1 11 LEU HD13 H -11.045 -7.665 -3.446 1.00 . A A . 11 LEU HD13 1 1 6 2210 1 1 11 LEU HD21 H -10.521 -7.229 -7.632 1.00 . A A . 11 LEU HD21 1 1 6 2211 1 1 11 LEU HD22 H -10.489 -8.815 -6.825 1.00 . A A . 11 LEU HD22 1 1 6 2212 1 1 11 LEU HD23 H -12.046 -8.058 -7.238 1.00 . A A . 11 LEU HD23 1 1 6 2213 1 1 11 LEU HG H -10.085 -6.685 -5.416 1.00 . A A . 11 LEU HG 1 1 6 2214 1 1 11 LEU N N -10.792 -4.212 -6.258 1.00 . A A . 11 LEU N 1 1 6 2215 1 1 11 LEU O O -14.011 -4.014 -7.428 1.00 . A A . 11 LEU O 1 1 6 2216 1 1 12 MET C C -13.827 -0.815 -5.246 1.00 . A A . 12 MET C 1 1 6 2217 1 1 12 MET CA C -14.364 -2.246 -5.313 1.00 . A A . 12 MET CA 1 1 6 2218 1 1 12 MET CB C -15.160 -2.553 -4.042 1.00 . A A . 12 MET CB 1 1 6 2219 1 1 12 MET CE C -15.677 -5.151 -1.768 1.00 . A A . 12 MET CE 1 1 6 2220 1 1 12 MET CG C -15.916 -3.876 -4.176 1.00 . A A . 12 MET CG 1 1 6 2221 1 1 12 MET H H -12.616 -3.199 -4.700 1.00 . A A . 12 MET H 1 1 6 2222 1 1 12 MET HA H -14.977 -2.370 -6.205 1.00 . A A . 12 MET HA 1 1 6 2223 1 1 12 MET HB2 H -14.484 -2.601 -3.188 1.00 . A A . 12 MET HB2 1 1 6 2224 1 1 12 MET HB3 H -15.865 -1.745 -3.846 1.00 . A A . 12 MET HB3 1 1 6 2225 1 1 12 MET HE1 H -16.090 -5.390 -0.788 1.00 . A A . 12 MET HE1 1 1 6 2226 1 1 12 MET HE2 H -15.458 -6.074 -2.305 1.00 . A A . 12 MET HE2 1 1 6 2227 1 1 12 MET HE3 H -14.760 -4.576 -1.645 1.00 . A A . 12 MET HE3 1 1 6 2228 1 1 12 MET HG2 H -16.580 -3.840 -5.040 1.00 . A A . 12 MET HG2 1 1 6 2229 1 1 12 MET HG3 H -15.213 -4.691 -4.348 1.00 . A A . 12 MET HG3 1 1 6 2230 1 1 12 MET N N -13.279 -3.203 -5.448 1.00 . A A . 12 MET N 1 1 6 2231 1 1 12 MET O O -14.168 0.019 -6.083 1.00 . A A . 12 MET O 1 1 6 2232 1 1 12 MET SD S -16.862 -4.191 -2.695 1.00 . A A . 12 MET SD 1 1 6 2233 1 1 13 THR C C -11.480 1.074 -5.232 1.00 . A A . 13 THR C 1 1 6 2234 1 1 13 THR CA C -12.404 0.739 -4.059 1.00 . A A . 13 THR CA 1 1 6 2235 1 1 13 THR CB C -11.694 0.754 -2.703 1.00 . A A . 13 THR CB 1 1 6 2236 1 1 13 THR CG2 C -11.381 2.172 -2.222 1.00 . A A . 13 THR CG2 1 1 6 2237 1 1 13 THR H H -12.731 -1.257 -3.560 1.00 . A A . 13 THR H 1 1 6 2238 1 1 13 THR HA H -13.203 1.481 -4.060 1.00 . A A . 13 THR HA 1 1 6 2239 1 1 13 THR HB H -10.792 0.143 -2.730 1.00 . A A . 13 THR HB 1 1 6 2240 1 1 13 THR HG1 H -12.329 -0.490 -1.270 1.00 . A A . 13 THR HG1 1 1 6 2241 1 1 13 THR HG21 H -10.948 2.128 -1.222 1.00 . A A . 13 THR HG21 1 1 6 2242 1 1 13 THR HG22 H -10.671 2.639 -2.905 1.00 . A A . 13 THR HG22 1 1 6 2243 1 1 13 THR HG23 H -12.299 2.758 -2.195 1.00 . A A . 13 THR HG23 1 1 6 2244 1 1 13 THR N N -12.998 -0.574 -4.241 1.00 . A A . 13 THR N 1 1 6 2245 1 1 13 THR O O -10.663 0.249 -5.638 1.00 . A A . 13 THR O 1 1 6 2246 1 1 13 THR OG1 O -12.683 0.287 -1.789 1.00 . A A . 13 THR OG1 1 1 6 2247 1 1 14 PRO C C -9.415 3.113 -6.420 1.00 . A A . 14 PRO C 1 1 6 2248 1 1 14 PRO CA C -10.835 2.771 -6.875 1.00 . A A . 14 PRO CA 1 1 6 2249 1 1 14 PRO CB C -11.582 3.968 -7.441 1.00 . A A . 14 PRO CB 1 1 6 2250 1 1 14 PRO CD C -12.602 3.321 -5.301 1.00 . A A . 14 PRO CD 1 1 6 2251 1 1 14 PRO CG C -12.530 4.424 -6.344 1.00 . A A . 14 PRO CG 1 1 6 2252 1 1 14 PRO HA H -10.737 2.041 -7.551 1.00 . A A . 14 PRO HA 1 1 6 2253 1 1 14 PRO HB2 H -10.891 4.765 -7.716 1.00 . A A . 14 PRO HB2 1 1 6 2254 1 1 14 PRO HB3 H -12.130 3.696 -8.343 1.00 . A A . 14 PRO HB3 1 1 6 2255 1 1 14 PRO HD2 H -12.342 3.695 -4.310 1.00 . A A . 14 PRO HD2 1 1 6 2256 1 1 14 PRO HD3 H -13.607 2.906 -5.231 1.00 . A A . 14 PRO HD3 1 1 6 2257 1 1 14 PRO HG2 H -12.177 5.352 -5.895 1.00 . A A . 14 PRO HG2 1 1 6 2258 1 1 14 PRO HG3 H -13.520 4.626 -6.755 1.00 . A A . 14 PRO HG3 1 1 6 2259 1 1 14 PRO N N -11.644 2.318 -5.756 1.00 . A A . 14 PRO N 1 1 6 2260 1 1 14 PRO O O -9.108 3.053 -5.230 1.00 . A A . 14 PRO O 1 1 6 2261 1 1 15 PRO C C -7.098 5.226 -6.506 1.00 . A A . 15 PRO C 1 1 6 2262 1 1 15 PRO CA C -7.184 3.832 -7.132 1.00 . A A . 15 PRO CA 1 1 6 2263 1 1 15 PRO CB C -6.468 3.735 -8.468 1.00 . A A . 15 PRO CB 1 1 6 2264 1 1 15 PRO CD C -8.890 3.551 -8.838 1.00 . A A . 15 PRO CD 1 1 6 2265 1 1 15 PRO CG C -7.556 3.782 -9.529 1.00 . A A . 15 PRO CG 1 1 6 2266 1 1 15 PRO HA H -6.796 3.205 -6.457 1.00 . A A . 15 PRO HA 1 1 6 2267 1 1 15 PRO HB2 H -5.764 4.558 -8.595 1.00 . A A . 15 PRO HB2 1 1 6 2268 1 1 15 PRO HB3 H -5.894 2.811 -8.538 1.00 . A A . 15 PRO HB3 1 1 6 2269 1 1 15 PRO HD2 H -9.586 4.365 -9.041 1.00 . A A . 15 PRO HD2 1 1 6 2270 1 1 15 PRO HD3 H -9.363 2.633 -9.186 1.00 . A A . 15 PRO HD3 1 1 6 2271 1 1 15 PRO HG2 H -7.551 4.745 -10.039 1.00 . A A . 15 PRO HG2 1 1 6 2272 1 1 15 PRO HG3 H -7.382 3.019 -10.288 1.00 . A A . 15 PRO HG3 1 1 6 2273 1 1 15 PRO N N -8.563 3.474 -7.417 1.00 . A A . 15 PRO N 1 1 6 2274 1 1 15 PRO O O -6.447 6.115 -7.052 1.00 . A A . 15 PRO O 1 1 6 2275 1 1 16 VAL C C -6.326 7.058 -4.364 1.00 . A A . 16 VAL C 1 1 6 2276 1 1 16 VAL CA C -7.767 6.641 -4.663 1.00 . A A . 16 VAL CA 1 1 6 2277 1 1 16 VAL CB C -8.632 6.537 -3.405 1.00 . A A . 16 VAL CB 1 1 6 2278 1 1 16 VAL CG1 C -10.109 6.370 -3.768 1.00 . A A . 16 VAL CG1 1 1 6 2279 1 1 16 VAL CG2 C -8.156 5.395 -2.505 1.00 . A A . 16 VAL CG2 1 1 6 2280 1 1 16 VAL H H -8.292 4.643 -4.934 1.00 . A A . 16 VAL H 1 1 6 2281 1 1 16 VAL HA H -8.217 7.383 -5.322 1.00 . A A . 16 VAL HA 1 1 6 2282 1 1 16 VAL HB H -8.527 7.468 -2.848 1.00 . A A . 16 VAL HB 1 1 6 2283 1 1 16 VAL HG11 H -10.698 6.270 -2.856 1.00 . A A . 16 VAL HG11 1 1 6 2284 1 1 16 VAL HG12 H -10.447 7.244 -4.325 1.00 . A A . 16 VAL HG12 1 1 6 2285 1 1 16 VAL HG13 H -10.234 5.477 -4.381 1.00 . A A . 16 VAL HG13 1 1 6 2286 1 1 16 VAL HG21 H -8.988 5.044 -1.894 1.00 . A A . 16 VAL HG21 1 1 6 2287 1 1 16 VAL HG22 H -7.788 4.575 -3.122 1.00 . A A . 16 VAL HG22 1 1 6 2288 1 1 16 VAL HG23 H -7.355 5.751 -1.859 1.00 . A A . 16 VAL HG23 1 1 6 2289 1 1 16 VAL N N -7.763 5.372 -5.370 1.00 . A A . 16 VAL N 1 1 6 2290 1 1 16 VAL O O -5.947 8.205 -4.593 1.00 . A A . 16 VAL O 1 1 6 2291 1 1 17 ILE C C -3.499 7.063 -4.722 1.00 . A A . 17 ILE C 1 1 6 2292 1 1 17 ILE CA C -4.163 6.350 -3.542 1.00 . A A . 17 ILE CA 1 1 6 2293 1 1 17 ILE CB C -3.466 5.050 -3.138 1.00 . A A . 17 ILE CB 1 1 6 2294 1 1 17 ILE CD1 C -2.840 2.728 -3.900 1.00 . A A . 17 ILE CD1 1 1 6 2295 1 1 17 ILE CG1 C -3.730 3.945 -4.164 1.00 . A A . 17 ILE CG1 1 1 6 2296 1 1 17 ILE CG2 C -3.870 4.627 -1.724 1.00 . A A . 17 ILE CG2 1 1 6 2297 1 1 17 ILE H H -5.880 5.175 -3.660 1.00 . A A . 17 ILE H 1 1 6 2298 1 1 17 ILE HA H -4.135 7.013 -2.678 1.00 . A A . 17 ILE HA 1 1 6 2299 1 1 17 ILE HB H -2.391 5.228 -3.127 1.00 . A A . 17 ILE HB 1 1 6 2300 1 1 17 ILE HD11 H -3.049 2.335 -2.905 1.00 . A A . 17 ILE HD11 1 1 6 2301 1 1 17 ILE HD12 H -3.046 1.959 -4.645 1.00 . A A . 17 ILE HD12 1 1 6 2302 1 1 17 ILE HD13 H -1.793 3.024 -3.962 1.00 . A A . 17 ILE HD13 1 1 6 2303 1 1 17 ILE HG12 H -4.778 3.649 -4.123 1.00 . A A . 17 ILE HG12 1 1 6 2304 1 1 17 ILE HG13 H -3.544 4.324 -5.168 1.00 . A A . 17 ILE HG13 1 1 6 2305 1 1 17 ILE HG21 H -3.210 3.831 -1.381 1.00 . A A . 17 ILE HG21 1 1 6 2306 1 1 17 ILE HG22 H -3.788 5.482 -1.053 1.00 . A A . 17 ILE HG22 1 1 6 2307 1 1 17 ILE HG23 H -4.899 4.269 -1.732 1.00 . A A . 17 ILE HG23 1 1 6 2308 1 1 17 ILE N N -5.560 6.103 -3.856 1.00 . A A . 17 ILE N 1 1 6 2309 1 1 17 ILE O O -2.555 7.830 -4.536 1.00 . A A . 17 ILE O 1 1 6 2310 1 1 18 GLN C C -4.511 8.325 -7.748 1.00 . A A . 18 GLN C 1 1 6 2311 1 1 18 GLN CA C -3.481 7.384 -7.119 1.00 . A A . 18 GLN CA 1 1 6 2312 1 1 18 GLN CB C -3.042 6.308 -8.114 1.00 . A A . 18 GLN CB 1 1 6 2313 1 1 18 GLN CD C -3.773 4.316 -9.477 1.00 . A A . 18 GLN CD 1 1 6 2314 1 1 18 GLN CG C -4.224 5.428 -8.528 1.00 . A A . 18 GLN CG 1 1 6 2315 1 1 18 GLN H H -4.790 6.165 -6.050 1.00 . A A . 18 GLN H 1 1 6 2316 1 1 18 GLN HA H -2.608 7.952 -6.799 1.00 . A A . 18 GLN HA 1 1 6 2317 1 1 18 GLN HB2 H -2.608 6.779 -8.996 1.00 . A A . 18 GLN HB2 1 1 6 2318 1 1 18 GLN HB3 H -2.263 5.690 -7.667 1.00 . A A . 18 GLN HB3 1 1 6 2319 1 1 18 GLN HE21 H -4.067 2.985 -7.981 1.00 . A A . 18 GLN HE21 1 1 6 2320 1 1 18 GLN HE22 H -3.504 2.310 -9.473 1.00 . A A . 18 GLN HE22 1 1 6 2321 1 1 18 GLN HG2 H -4.684 4.991 -7.642 1.00 . A A . 18 GLN HG2 1 1 6 2322 1 1 18 GLN HG3 H -4.984 6.040 -9.014 1.00 . A A . 18 GLN HG3 1 1 6 2323 1 1 18 GLN N N -4.018 6.785 -5.909 1.00 . A A . 18 GLN N 1 1 6 2324 1 1 18 GLN NE2 N -3.782 3.103 -8.932 1.00 . A A . 18 GLN NE2 1 1 6 2325 1 1 18 GLN O O -4.147 9.288 -8.420 1.00 . A A . 18 GLN O 1 1 6 2326 1 1 18 GLN OE1 O -3.440 4.544 -10.628 1.00 . A A . 18 GLN OE1 1 1 6 2327 1 1 19 ALA C C -6.722 10.254 -7.515 1.00 . A A . 19 ALA C 1 1 6 2328 1 1 19 ALA CA C -6.861 8.822 -8.035 1.00 . A A . 19 ALA CA 1 1 6 2329 1 1 19 ALA CB C -8.201 8.191 -7.654 1.00 . A A . 19 ALA CB 1 1 6 2330 1 1 19 ALA H H -6.063 7.224 -6.962 1.00 . A A . 19 ALA H 1 1 6 2331 1 1 19 ALA HA H -6.771 8.828 -9.121 1.00 . A A . 19 ALA HA 1 1 6 2332 1 1 19 ALA HB1 H -9.015 8.817 -8.020 1.00 . A A . 19 ALA HB1 1 1 6 2333 1 1 19 ALA HB2 H -8.276 7.200 -8.102 1.00 . A A . 19 ALA HB2 1 1 6 2334 1 1 19 ALA HB3 H -8.268 8.105 -6.570 1.00 . A A . 19 ALA HB3 1 1 6 2335 1 1 19 ALA N N -5.776 8.012 -7.507 1.00 . A A . 19 ALA N 1 1 6 2336 1 1 19 ALA O O -6.762 11.207 -8.292 1.00 . A A . 19 ALA O 1 1 6 2337 1 1 20 ILE C C -5.099 12.282 -5.902 1.00 . A A . 20 ILE C 1 1 6 2338 1 1 20 ILE CA C -6.458 11.662 -5.566 1.00 . A A . 20 ILE CA 1 1 6 2339 1 1 20 ILE CB C -6.727 11.547 -4.065 1.00 . A A . 20 ILE CB 1 1 6 2340 1 1 20 ILE CD1 C -4.696 10.140 -3.559 1.00 . A A . 20 ILE CD1 1 1 6 2341 1 1 20 ILE CG1 C -5.417 11.460 -3.278 1.00 . A A . 20 ILE CG1 1 1 6 2342 1 1 20 ILE CG2 C -7.656 10.369 -3.763 1.00 . A A . 20 ILE CG2 1 1 6 2343 1 1 20 ILE H H -6.505 9.580 -5.582 1.00 . A A . 20 ILE H 1 1 6 2344 1 1 20 ILE HA H -7.239 12.296 -5.986 1.00 . A A . 20 ILE HA 1 1 6 2345 1 1 20 ILE HB H -7.239 12.452 -3.739 1.00 . A A . 20 ILE HB 1 1 6 2346 1 1 20 ILE HD11 H -4.783 9.487 -2.691 1.00 . A A . 20 ILE HD11 1 1 6 2347 1 1 20 ILE HD12 H -5.147 9.656 -4.425 1.00 . A A . 20 ILE HD12 1 1 6 2348 1 1 20 ILE HD13 H -3.643 10.337 -3.760 1.00 . A A . 20 ILE HD13 1 1 6 2349 1 1 20 ILE HG12 H -4.772 12.296 -3.547 1.00 . A A . 20 ILE HG12 1 1 6 2350 1 1 20 ILE HG13 H -5.623 11.546 -2.211 1.00 . A A . 20 ILE HG13 1 1 6 2351 1 1 20 ILE HG21 H -7.069 9.454 -3.685 1.00 . A A . 20 ILE HG21 1 1 6 2352 1 1 20 ILE HG22 H -8.176 10.548 -2.823 1.00 . A A . 20 ILE HG22 1 1 6 2353 1 1 20 ILE HG23 H -8.384 10.266 -4.568 1.00 . A A . 20 ILE HG23 1 1 6 2354 1 1 20 ILE N N -6.562 10.361 -6.204 1.00 . A A . 20 ILE N 1 1 6 2355 1 1 20 ILE O O -4.962 13.504 -5.937 1.00 . A A . 20 ILE O 1 1 6 2356 1 1 21 HIS C C -2.753 12.558 -7.792 1.00 . A A . 21 HIS C 1 1 6 2357 1 1 21 HIS CA C -2.778 11.857 -6.433 1.00 . A A . 21 HIS CA 1 1 6 2358 1 1 21 HIS CB C -1.791 10.691 -6.349 1.00 . A A . 21 HIS CB 1 1 6 2359 1 1 21 HIS CD2 C 0.424 10.254 -7.666 1.00 . A A . 21 HIS CD2 1 1 6 2360 1 1 21 HIS CE1 C 1.391 12.181 -7.296 1.00 . A A . 21 HIS CE1 1 1 6 2361 1 1 21 HIS CG C -0.422 11.004 -6.903 1.00 . A A . 21 HIS CG 1 1 6 2362 1 1 21 HIS H H -4.256 10.419 -6.133 1.00 . A A . 21 HIS H 1 1 6 2363 1 1 21 HIS HA H -2.511 12.575 -5.658 1.00 . A A . 21 HIS HA 1 1 6 2364 1 1 21 HIS HB2 H -1.690 10.388 -5.307 1.00 . A A . 21 HIS HB2 1 1 6 2365 1 1 21 HIS HB3 H -2.205 9.839 -6.889 1.00 . A A . 21 HIS HB3 1 1 6 2366 1 1 21 HIS HD1 H -0.149 12.980 -6.158 1.00 . A A . 21 HIS HD1 1 1 6 2367 1 1 21 HIS HD2 H 0.233 9.241 -8.021 1.00 . A A . 21 HIS HD2 1 1 6 2368 1 1 21 HIS HE1 H 2.128 12.984 -7.310 1.00 . A A . 21 HIS HE1 1 1 6 2369 1 1 21 HIS HE2 H 2.329 10.642 -8.391 1.00 . A A . 21 HIS HE2 1 1 6 2370 1 1 21 HIS N N -4.130 11.411 -6.139 1.00 . A A . 21 HIS N 1 1 6 2371 1 1 21 HIS ND1 N 0.216 12.213 -6.686 1.00 . A A . 21 HIS ND1 1 1 6 2372 1 1 21 HIS NE2 N 1.518 10.966 -7.904 1.00 . A A . 21 HIS NE2 1 1 6 2373 1 1 21 HIS O O -2.124 13.604 -7.943 1.00 . A A . 21 HIS O 1 1 6 2374 1 1 22 ASP C C -4.128 13.900 -10.039 1.00 . A A . 22 ASP C 1 1 6 2375 1 1 22 ASP CA C -3.504 12.504 -10.090 1.00 . A A . 22 ASP CA 1 1 6 2376 1 1 22 ASP CB C -4.369 11.633 -11.004 1.00 . A A . 22 ASP CB 1 1 6 2377 1 1 22 ASP CG C -3.868 11.512 -12.445 1.00 . A A . 22 ASP CG 1 1 6 2378 1 1 22 ASP H H -3.959 11.106 -8.614 1.00 . A A . 22 ASP H 1 1 6 2379 1 1 22 ASP HA H -2.471 12.521 -10.438 1.00 . A A . 22 ASP HA 1 1 6 2380 1 1 22 ASP HB2 H -4.436 10.634 -10.573 1.00 . A A . 22 ASP HB2 1 1 6 2381 1 1 22 ASP HB3 H -5.380 12.041 -11.020 1.00 . A A . 22 ASP HB3 1 1 6 2382 1 1 22 ASP N N -3.446 11.954 -8.747 1.00 . A A . 22 ASP N 1 1 6 2383 1 1 22 ASP O O -3.604 14.840 -10.634 1.00 . A A . 22 ASP O 1 1 6 2384 1 1 22 ASP OD1 O -2.800 10.888 -12.624 1.00 . A A . 22 ASP OD1 1 1 6 2385 1 1 22 ASP OD2 O -4.565 12.045 -13.335 1.00 . A A . 22 ASP OD2 1 1 6 2386 1 1 23 ALA C C -5.107 16.231 -8.379 1.00 . A A . 23 ALA C 1 1 6 2387 1 1 23 ALA CA C -5.949 15.253 -9.201 1.00 . A A . 23 ALA CA 1 1 6 2388 1 1 23 ALA CB C -7.326 15.005 -8.581 1.00 . A A . 23 ALA CB 1 1 6 2389 1 1 23 ALA H H -5.651 13.224 -8.830 1.00 . A A . 23 ALA H 1 1 6 2390 1 1 23 ALA HA H -6.084 15.656 -10.205 1.00 . A A . 23 ALA HA 1 1 6 2391 1 1 23 ALA HB1 H -7.205 14.660 -7.554 1.00 . A A . 23 ALA HB1 1 1 6 2392 1 1 23 ALA HB2 H -7.899 15.932 -8.587 1.00 . A A . 23 ALA HB2 1 1 6 2393 1 1 23 ALA HB3 H -7.854 14.247 -9.159 1.00 . A A . 23 ALA HB3 1 1 6 2394 1 1 23 ALA N N -5.238 13.991 -9.322 1.00 . A A . 23 ALA N 1 1 6 2395 1 1 23 ALA O O -5.241 17.445 -8.525 1.00 . A A . 23 ALA O 1 1 6 2396 1 1 24 GLN C C -2.443 17.309 -7.568 1.00 . A A . 24 GLN C 1 1 6 2397 1 1 24 GLN CA C -3.385 16.473 -6.699 1.00 . A A . 24 GLN CA 1 1 6 2398 1 1 24 GLN CB C -2.598 15.597 -5.722 1.00 . A A . 24 GLN CB 1 1 6 2399 1 1 24 GLN CD C -3.319 16.740 -3.592 1.00 . A A . 24 GLN CD 1 1 6 2400 1 1 24 GLN CG C -3.349 15.440 -4.399 1.00 . A A . 24 GLN CG 1 1 6 2401 1 1 24 GLN H H -4.161 14.678 -7.415 1.00 . A A . 24 GLN H 1 1 6 2402 1 1 24 GLN HA H -4.048 17.129 -6.135 1.00 . A A . 24 GLN HA 1 1 6 2403 1 1 24 GLN HB2 H -2.424 14.617 -6.165 1.00 . A A . 24 GLN HB2 1 1 6 2404 1 1 24 GLN HB3 H -1.619 16.041 -5.538 1.00 . A A . 24 GLN HB3 1 1 6 2405 1 1 24 GLN HE21 H -2.053 15.846 -2.289 1.00 . A A . 24 GLN HE21 1 1 6 2406 1 1 24 GLN HE22 H -2.462 17.487 -1.917 1.00 . A A . 24 GLN HE22 1 1 6 2407 1 1 24 GLN HG2 H -4.383 15.154 -4.595 1.00 . A A . 24 GLN HG2 1 1 6 2408 1 1 24 GLN HG3 H -2.901 14.635 -3.815 1.00 . A A . 24 GLN HG3 1 1 6 2409 1 1 24 GLN N N -4.258 15.666 -7.534 1.00 . A A . 24 GLN N 1 1 6 2410 1 1 24 GLN NE2 N -2.548 16.686 -2.510 1.00 . A A . 24 GLN NE2 1 1 6 2411 1 1 24 GLN O O -2.135 18.452 -7.233 1.00 . A A . 24 GLN O 1 1 6 2412 1 1 24 GLN OE1 O -3.953 17.725 -3.930 1.00 . A A . 24 GLN OE1 1 1 6 2413 1 1 25 ARG C C -1.917 18.331 -10.495 1.00 . A A . 25 ARG C 1 1 6 2414 1 1 25 ARG CA C -1.122 17.385 -9.592 1.00 . A A . 25 ARG CA 1 1 6 2415 1 1 25 ARG CB C -0.361 16.382 -10.461 1.00 . A A . 25 ARG CB 1 1 6 2416 1 1 25 ARG CD C 0.313 13.953 -10.390 1.00 . A A . 25 ARG CD 1 1 6 2417 1 1 25 ARG CG C 0.243 15.265 -9.607 1.00 . A A . 25 ARG CG 1 1 6 2418 1 1 25 ARG CZ C -1.094 13.260 -12.327 1.00 . A A . 25 ARG CZ 1 1 6 2419 1 1 25 ARG H H -2.260 15.773 -8.926 1.00 . A A . 25 ARG H 1 1 6 2420 1 1 25 ARG HA H -0.429 17.939 -8.958 1.00 . A A . 25 ARG HA 1 1 6 2421 1 1 25 ARG HB2 H -1.034 15.953 -11.203 1.00 . A A . 25 ARG HB2 1 1 6 2422 1 1 25 ARG HB3 H 0.430 16.895 -11.007 1.00 . A A . 25 ARG HB3 1 1 6 2423 1 1 25 ARG HD2 H 1.114 14.001 -11.127 1.00 . A A . 25 ARG HD2 1 1 6 2424 1 1 25 ARG HD3 H 0.549 13.129 -9.716 1.00 . A A . 25 ARG HD3 1 1 6 2425 1 1 25 ARG HE H -1.819 13.862 -10.548 1.00 . A A . 25 ARG HE 1 1 6 2426 1 1 25 ARG HG2 H 1.243 15.552 -9.282 1.00 . A A . 25 ARG HG2 1 1 6 2427 1 1 25 ARG HG3 H -0.357 15.125 -8.708 1.00 . A A . 25 ARG HG3 1 1 6 2428 1 1 25 ARG HH11 H 0.910 13.179 -12.662 1.00 . A A . 25 ARG HH11 1 1 6 2429 1 1 25 ARG HH12 H -0.081 12.701 -14.000 1.00 . A A . 25 ARG HH12 1 1 6 2430 1 1 25 ARG HH21 H -3.128 13.231 -12.313 1.00 . A A . 25 ARG HH21 1 1 6 2431 1 1 25 ARG HH22 H -2.393 12.731 -13.799 1.00 . A A . 25 ARG HH22 1 1 6 2432 1 1 25 ARG N N -2.012 16.706 -8.666 1.00 . A A . 25 ARG N 1 1 6 2433 1 1 25 ARG NE N -0.979 13.698 -11.066 1.00 . A A . 25 ARG NE 1 1 6 2434 1 1 25 ARG NH1 N 0.004 13.027 -13.058 1.00 . A A . 25 ARG NH1 1 1 6 2435 1 1 25 ARG NH2 N -2.308 13.057 -12.858 1.00 . A A . 25 ARG NH2 1 1 6 2436 1 1 25 ARG O O -1.506 19.468 -10.724 1.00 . A A . 25 ARG O 1 1 7 2437 1 1 1 PHE C C 1.131 0.000 -2.451 1.00 . A A . 1 PHE C 1 1 7 2438 1 1 1 PHE CA C 2.073 0.000 -1.245 1.00 . A A . 1 PHE CA 1 1 7 2439 1 1 1 PHE CB C 2.908 -1.282 -1.266 1.00 . A A . 1 PHE CB 1 1 7 2440 1 1 1 PHE CD1 C 1.581 -3.155 -0.265 1.00 . A A . 1 PHE CD1 1 1 7 2441 1 1 1 PHE CD2 C 1.841 -3.109 -2.605 1.00 . A A . 1 PHE CD2 1 1 7 2442 1 1 1 PHE CE1 C 0.812 -4.343 -0.373 1.00 . A A . 1 PHE CE1 1 1 7 2443 1 1 1 PHE CE2 C 1.072 -4.298 -2.714 1.00 . A A . 1 PHE CE2 1 1 7 2444 1 1 1 PHE CG C 2.079 -2.563 -1.383 1.00 . A A . 1 PHE CG 1 1 7 2445 1 1 1 PHE CZ C 0.574 -4.890 -1.596 1.00 . A A . 1 PHE CZ 1 1 7 2446 1 1 1 PHE H1 H 1.884 0.000 0.829 1.00 . A A . 1 PHE H1 1 1 7 2447 1 1 1 PHE HA H 2.678 0.907 -1.259 1.00 . A A . 1 PHE HA 1 1 7 2448 1 1 1 PHE HB2 H 3.607 -1.236 -2.101 1.00 . A A . 1 PHE HB2 1 1 7 2449 1 1 1 PHE HB3 H 3.504 -1.329 -0.354 1.00 . A A . 1 PHE HB3 1 1 7 2450 1 1 1 PHE HD1 H 1.772 -2.717 0.715 1.00 . A A . 1 PHE HD1 1 1 7 2451 1 1 1 PHE HD2 H 2.241 -2.635 -3.502 1.00 . A A . 1 PHE HD2 1 1 7 2452 1 1 1 PHE HE1 H 0.412 -4.818 0.523 1.00 . A A . 1 PHE HE1 1 1 7 2453 1 1 1 PHE HE2 H 0.881 -4.736 -3.694 1.00 . A A . 1 PHE HE2 1 1 7 2454 1 1 1 PHE HZ H -0.017 -5.802 -1.680 1.00 . A A . 1 PHE HZ 1 1 7 2455 1 1 1 PHE N N 1.325 0.000 0.000 1.00 . A A . 1 PHE N 1 1 7 2456 1 1 1 PHE O O 1.531 -0.363 -3.556 1.00 . A A . 1 PHE O 1 1 7 2457 1 1 2 LEU C C -2.448 0.882 -2.644 1.00 . A A . 2 LEU C 1 1 7 2458 1 1 2 LEU CA C -1.110 0.445 -3.244 1.00 . A A . 2 LEU CA 1 1 7 2459 1 1 2 LEU CB C -1.172 -0.900 -3.971 1.00 . A A . 2 LEU CB 1 1 7 2460 1 1 2 LEU CD1 C -0.775 -2.278 -6.046 1.00 . A A . 2 LEU CD1 1 1 7 2461 1 1 2 LEU CD2 C -1.953 -0.037 -6.208 1.00 . A A . 2 LEU CD2 1 1 7 2462 1 1 2 LEU CG C -0.894 -0.863 -5.475 1.00 . A A . 2 LEU CG 1 1 7 2463 1 1 2 LEU H H -0.416 0.718 -1.299 1.00 . A A . 2 LEU H 1 1 7 2464 1 1 2 LEU HA H -0.798 1.192 -3.974 1.00 . A A . 2 LEU HA 1 1 7 2465 1 1 2 LEU HB2 H -0.454 -1.576 -3.506 1.00 . A A . 2 LEU HB2 1 1 7 2466 1 1 2 LEU HB3 H -2.161 -1.330 -3.815 1.00 . A A . 2 LEU HB3 1 1 7 2467 1 1 2 LEU HD11 H -0.607 -2.223 -7.121 1.00 . A A . 2 LEU HD11 1 1 7 2468 1 1 2 LEU HD12 H 0.063 -2.791 -5.573 1.00 . A A . 2 LEU HD12 1 1 7 2469 1 1 2 LEU HD13 H -1.696 -2.827 -5.849 1.00 . A A . 2 LEU HD13 1 1 7 2470 1 1 2 LEU HD21 H -1.730 1.024 -6.093 1.00 . A A . 2 LEU HD21 1 1 7 2471 1 1 2 LEU HD22 H -1.948 -0.296 -7.267 1.00 . A A . 2 LEU HD22 1 1 7 2472 1 1 2 LEU HD23 H -2.935 -0.249 -5.786 1.00 . A A . 2 LEU HD23 1 1 7 2473 1 1 2 LEU HG H 0.065 -0.370 -5.634 1.00 . A A . 2 LEU HG 1 1 7 2474 1 1 2 LEU N N -0.102 0.412 -2.198 1.00 . A A . 2 LEU N 1 1 7 2475 1 1 2 LEU O O -3.023 1.884 -3.065 1.00 . A A . 2 LEU O 1 1 7 2476 1 1 3 PRO C C -4.048 1.559 -0.033 1.00 . A A . 3 PRO C 1 1 7 2477 1 1 3 PRO CA C -4.182 0.374 -0.992 1.00 . A A . 3 PRO CA 1 1 7 2478 1 1 3 PRO CB C -4.564 -0.918 -0.289 1.00 . A A . 3 PRO CB 1 1 7 2479 1 1 3 PRO CD C -2.256 -1.102 -1.113 1.00 . A A . 3 PRO CD 1 1 7 2480 1 1 3 PRO CG C -3.284 -1.731 -0.186 1.00 . A A . 3 PRO CG 1 1 7 2481 1 1 3 PRO HA H -4.868 0.645 -1.668 1.00 . A A . 3 PRO HA 1 1 7 2482 1 1 3 PRO HB2 H -4.980 -0.718 0.699 1.00 . A A . 3 PRO HB2 1 1 7 2483 1 1 3 PRO HB3 H -5.326 -1.459 -0.851 1.00 . A A . 3 PRO HB3 1 1 7 2484 1 1 3 PRO HD2 H -1.345 -0.841 -0.575 1.00 . A A . 3 PRO HD2 1 1 7 2485 1 1 3 PRO HD3 H -1.971 -1.787 -1.911 1.00 . A A . 3 PRO HD3 1 1 7 2486 1 1 3 PRO HG2 H -2.918 -1.739 0.841 1.00 . A A . 3 PRO HG2 1 1 7 2487 1 1 3 PRO HG3 H -3.466 -2.768 -0.467 1.00 . A A . 3 PRO HG3 1 1 7 2488 1 1 3 PRO N N -2.917 0.087 -1.645 1.00 . A A . 3 PRO N 1 1 7 2489 1 1 3 PRO O O -4.900 2.446 -0.014 1.00 . A A . 3 PRO O 1 1 7 2490 1 1 4 LEU C C -2.341 3.865 1.050 1.00 . A A . 4 LEU C 1 1 7 2491 1 1 4 LEU CA C -2.748 2.563 1.742 1.00 . A A . 4 LEU CA 1 1 7 2492 1 1 4 LEU CB C -1.740 2.080 2.787 1.00 . A A . 4 LEU CB 1 1 7 2493 1 1 4 LEU CD1 C -1.621 4.214 4.126 1.00 . A A . 4 LEU CD1 1 1 7 2494 1 1 4 LEU CD2 C -3.215 2.364 4.812 1.00 . A A . 4 LEU CD2 1 1 7 2495 1 1 4 LEU CG C -1.865 2.705 4.178 1.00 . A A . 4 LEU CG 1 1 7 2496 1 1 4 LEU H H -2.262 0.833 0.687 1.00 . A A . 4 LEU H 1 1 7 2497 1 1 4 LEU HA H -3.694 2.726 2.258 1.00 . A A . 4 LEU HA 1 1 7 2498 1 1 4 LEU HB2 H -1.838 0.999 2.885 1.00 . A A . 4 LEU HB2 1 1 7 2499 1 1 4 LEU HB3 H -0.736 2.277 2.411 1.00 . A A . 4 LEU HB3 1 1 7 2500 1 1 4 LEU HD11 H -1.321 4.568 5.112 1.00 . A A . 4 LEU HD11 1 1 7 2501 1 1 4 LEU HD12 H -0.831 4.430 3.406 1.00 . A A . 4 LEU HD12 1 1 7 2502 1 1 4 LEU HD13 H -2.537 4.720 3.821 1.00 . A A . 4 LEU HD13 1 1 7 2503 1 1 4 LEU HD21 H -3.108 2.323 5.896 1.00 . A A . 4 LEU HD21 1 1 7 2504 1 1 4 LEU HD22 H -3.944 3.130 4.548 1.00 . A A . 4 LEU HD22 1 1 7 2505 1 1 4 LEU HD23 H -3.556 1.396 4.444 1.00 . A A . 4 LEU HD23 1 1 7 2506 1 1 4 LEU HG H -1.092 2.275 4.816 1.00 . A A . 4 LEU HG 1 1 7 2507 1 1 4 LEU N N -2.972 1.536 0.739 1.00 . A A . 4 LEU N 1 1 7 2508 1 1 4 LEU O O -2.716 4.950 1.493 1.00 . A A . 4 LEU O 1 1 7 2509 1 1 5 LEU C C -2.279 5.681 -1.275 1.00 . A A . 5 LEU C 1 1 7 2510 1 1 5 LEU CA C -1.090 4.867 -0.761 1.00 . A A . 5 LEU CA 1 1 7 2511 1 1 5 LEU CB C -0.124 4.427 -1.863 1.00 . A A . 5 LEU CB 1 1 7 2512 1 1 5 LEU CD1 C 1.833 5.863 -1.178 1.00 . A A . 5 LEU CD1 1 1 7 2513 1 1 5 LEU CD2 C 1.655 3.470 -0.353 1.00 . A A . 5 LEU CD2 1 1 7 2514 1 1 5 LEU CG C 1.362 4.443 -1.497 1.00 . A A . 5 LEU CG 1 1 7 2515 1 1 5 LEU H H -1.299 2.828 -0.390 1.00 . A A . 5 LEU H 1 1 7 2516 1 1 5 LEU HA H -0.524 5.485 -0.064 1.00 . A A . 5 LEU HA 1 1 7 2517 1 1 5 LEU HB2 H -0.391 3.416 -2.171 1.00 . A A . 5 LEU HB2 1 1 7 2518 1 1 5 LEU HB3 H -0.272 5.074 -2.728 1.00 . A A . 5 LEU HB3 1 1 7 2519 1 1 5 LEU HD11 H 1.647 6.079 -0.126 1.00 . A A . 5 LEU HD11 1 1 7 2520 1 1 5 LEU HD12 H 2.900 5.946 -1.383 1.00 . A A . 5 LEU HD12 1 1 7 2521 1 1 5 LEU HD13 H 1.287 6.575 -1.797 1.00 . A A . 5 LEU HD13 1 1 7 2522 1 1 5 LEU HD21 H 1.295 3.894 0.585 1.00 . A A . 5 LEU HD21 1 1 7 2523 1 1 5 LEU HD22 H 1.149 2.523 -0.542 1.00 . A A . 5 LEU HD22 1 1 7 2524 1 1 5 LEU HD23 H 2.730 3.301 -0.287 1.00 . A A . 5 LEU HD23 1 1 7 2525 1 1 5 LEU HG H 1.930 4.102 -2.363 1.00 . A A . 5 LEU HG 1 1 7 2526 1 1 5 LEU N N -1.580 3.715 -0.024 1.00 . A A . 5 LEU N 1 1 7 2527 1 1 5 LEU O O -2.371 6.881 -1.020 1.00 . A A . 5 LEU O 1 1 7 2528 1 1 6 ILE C C -5.221 6.155 -1.415 1.00 . A A . 6 ILE C 1 1 7 2529 1 1 6 ILE CA C -4.333 5.644 -2.552 1.00 . A A . 6 ILE CA 1 1 7 2530 1 1 6 ILE CB C -5.054 4.702 -3.519 1.00 . A A . 6 ILE CB 1 1 7 2531 1 1 6 ILE CD1 C -6.171 2.456 -3.781 1.00 . A A . 6 ILE CD1 1 1 7 2532 1 1 6 ILE CG1 C -5.545 3.446 -2.796 1.00 . A A . 6 ILE CG1 1 1 7 2533 1 1 6 ILE CG2 C -4.166 4.363 -4.718 1.00 . A A . 6 ILE CG2 1 1 7 2534 1 1 6 ILE H H -3.081 4.020 -2.188 1.00 . A A . 6 ILE H 1 1 7 2535 1 1 6 ILE HA H -3.988 6.499 -3.132 1.00 . A A . 6 ILE HA 1 1 7 2536 1 1 6 ILE HB H -5.934 5.216 -3.904 1.00 . A A . 6 ILE HB 1 1 7 2537 1 1 6 ILE HD11 H -6.804 2.996 -4.486 1.00 . A A . 6 ILE HD11 1 1 7 2538 1 1 6 ILE HD12 H -5.382 1.937 -4.325 1.00 . A A . 6 ILE HD12 1 1 7 2539 1 1 6 ILE HD13 H -6.773 1.731 -3.234 1.00 . A A . 6 ILE HD13 1 1 7 2540 1 1 6 ILE HG12 H -4.712 2.971 -2.278 1.00 . A A . 6 ILE HG12 1 1 7 2541 1 1 6 ILE HG13 H -6.277 3.721 -2.037 1.00 . A A . 6 ILE HG13 1 1 7 2542 1 1 6 ILE HG21 H -4.008 3.286 -4.760 1.00 . A A . 6 ILE HG21 1 1 7 2543 1 1 6 ILE HG22 H -4.653 4.695 -5.635 1.00 . A A . 6 ILE HG22 1 1 7 2544 1 1 6 ILE HG23 H -3.206 4.867 -4.613 1.00 . A A . 6 ILE HG23 1 1 7 2545 1 1 6 ILE N N -3.160 4.997 -1.991 1.00 . A A . 6 ILE N 1 1 7 2546 1 1 6 ILE O O -5.818 7.225 -1.522 1.00 . A A . 6 ILE O 1 1 7 2547 1 1 7 LEU C C -5.586 7.037 1.389 1.00 . A A . 7 LEU C 1 1 7 2548 1 1 7 LEU CA C -6.093 5.720 0.799 1.00 . A A . 7 LEU CA 1 1 7 2549 1 1 7 LEU CB C -6.128 4.568 1.805 1.00 . A A . 7 LEU CB 1 1 7 2550 1 1 7 LEU CD1 C -7.429 3.344 3.584 1.00 . A A . 7 LEU CD1 1 1 7 2551 1 1 7 LEU CD2 C -6.675 5.734 3.973 1.00 . A A . 7 LEU CD2 1 1 7 2552 1 1 7 LEU CG C -7.141 4.703 2.943 1.00 . A A . 7 LEU CG 1 1 7 2553 1 1 7 LEU H H -4.786 4.500 -0.271 1.00 . A A . 7 LEU H 1 1 7 2554 1 1 7 LEU HA H -7.113 5.870 0.444 1.00 . A A . 7 LEU HA 1 1 7 2555 1 1 7 LEU HB2 H -6.339 3.646 1.264 1.00 . A A . 7 LEU HB2 1 1 7 2556 1 1 7 LEU HB3 H -5.134 4.462 2.240 1.00 . A A . 7 LEU HB3 1 1 7 2557 1 1 7 LEU HD11 H -8.189 3.460 4.357 1.00 . A A . 7 LEU HD11 1 1 7 2558 1 1 7 LEU HD12 H -7.789 2.652 2.822 1.00 . A A . 7 LEU HD12 1 1 7 2559 1 1 7 LEU HD13 H -6.515 2.950 4.029 1.00 . A A . 7 LEU HD13 1 1 7 2560 1 1 7 LEU HD21 H -7.043 5.455 4.960 1.00 . A A . 7 LEU HD21 1 1 7 2561 1 1 7 LEU HD22 H -5.585 5.766 3.987 1.00 . A A . 7 LEU HD22 1 1 7 2562 1 1 7 LEU HD23 H -7.063 6.717 3.705 1.00 . A A . 7 LEU HD23 1 1 7 2563 1 1 7 LEU HG H -8.079 5.067 2.525 1.00 . A A . 7 LEU HG 1 1 7 2564 1 1 7 LEU N N -5.280 5.366 -0.353 1.00 . A A . 7 LEU N 1 1 7 2565 1 1 7 LEU O O -6.361 7.972 1.587 1.00 . A A . 7 LEU O 1 1 7 2566 1 1 8 GLY C C -3.972 9.490 1.355 1.00 . A A . 8 GLY C 1 1 7 2567 1 1 8 GLY CA C -3.668 8.259 2.212 1.00 . A A . 8 GLY CA 1 1 7 2568 1 1 8 GLY H H -3.666 6.304 1.495 1.00 . A A . 8 GLY H 1 1 7 2569 1 1 8 GLY HA2 H -4.030 8.420 3.228 1.00 . A A . 8 GLY HA2 1 1 7 2570 1 1 8 GLY HA3 H -2.589 8.115 2.277 1.00 . A A . 8 GLY HA3 1 1 7 2571 1 1 8 GLY N N -4.288 7.070 1.654 1.00 . A A . 8 GLY N 1 1 7 2572 1 1 8 GLY O O -4.200 10.577 1.883 1.00 . A A . 8 GLY O 1 1 7 2573 1 1 9 SER C C -5.725 10.346 -1.271 1.00 . A A . 9 SER C 1 1 7 2574 1 1 9 SER CA C -4.244 10.354 -0.887 1.00 . A A . 9 SER CA 1 1 7 2575 1 1 9 SER CB C -3.371 10.235 -2.138 1.00 . A A . 9 SER CB 1 1 7 2576 1 1 9 SER H H -3.779 8.389 -0.374 1.00 . A A . 9 SER H 1 1 7 2577 1 1 9 SER HA H -3.991 11.270 -0.354 1.00 . A A . 9 SER HA 1 1 7 2578 1 1 9 SER HB2 H -2.333 10.085 -1.843 1.00 . A A . 9 SER HB2 1 1 7 2579 1 1 9 SER HB3 H -3.671 9.355 -2.707 1.00 . A A . 9 SER HB3 1 1 7 2580 1 1 9 SER HG H -2.697 12.004 -2.787 1.00 . A A . 9 SER HG 1 1 7 2581 1 1 9 SER N N -3.967 9.277 0.048 1.00 . A A . 9 SER N 1 1 7 2582 1 1 9 SER O O -6.099 10.852 -2.328 1.00 . A A . 9 SER O 1 1 7 2583 1 1 9 SER OG O -3.466 11.390 -2.967 1.00 . A A . 9 SER OG 1 1 7 2584 1 1 10 LEU C C -8.690 10.588 0.368 1.00 . A A . 10 LEU C 1 1 7 2585 1 1 10 LEU CA C -7.960 9.683 -0.626 1.00 . A A . 10 LEU CA 1 1 7 2586 1 1 10 LEU CB C -8.424 8.225 -0.586 1.00 . A A . 10 LEU CB 1 1 7 2587 1 1 10 LEU CD1 C -10.488 8.571 -1.994 1.00 . A A . 10 LEU CD1 1 1 7 2588 1 1 10 LEU CD2 C -8.344 7.731 -3.058 1.00 . A A . 10 LEU CD2 1 1 7 2589 1 1 10 LEU CG C -9.217 7.741 -1.802 1.00 . A A . 10 LEU CG 1 1 7 2590 1 1 10 LEU H H -6.217 9.362 0.469 1.00 . A A . 10 LEU H 1 1 7 2591 1 1 10 LEU HA H -8.148 10.054 -1.634 1.00 . A A . 10 LEU HA 1 1 7 2592 1 1 10 LEU HB2 H -7.547 7.588 -0.473 1.00 . A A . 10 LEU HB2 1 1 7 2593 1 1 10 LEU HB3 H -9.038 8.085 0.303 1.00 . A A . 10 LEU HB3 1 1 7 2594 1 1 10 LEU HD11 H -11.168 8.045 -2.663 1.00 . A A . 10 LEU HD11 1 1 7 2595 1 1 10 LEU HD12 H -10.972 8.723 -1.029 1.00 . A A . 10 LEU HD12 1 1 7 2596 1 1 10 LEU HD13 H -10.229 9.538 -2.425 1.00 . A A . 10 LEU HD13 1 1 7 2597 1 1 10 LEU HD21 H -7.775 8.659 -3.112 1.00 . A A . 10 LEU HD21 1 1 7 2598 1 1 10 LEU HD22 H -7.658 6.885 -3.017 1.00 . A A . 10 LEU HD22 1 1 7 2599 1 1 10 LEU HD23 H -8.978 7.642 -3.940 1.00 . A A . 10 LEU HD23 1 1 7 2600 1 1 10 LEU HG H -9.530 6.713 -1.618 1.00 . A A . 10 LEU HG 1 1 7 2601 1 1 10 LEU N N -6.529 9.767 -0.390 1.00 . A A . 10 LEU N 1 1 7 2602 1 1 10 LEU O O -9.281 10.107 1.333 1.00 . A A . 10 LEU O 1 1 7 2603 1 1 11 LEU C C -10.460 13.479 0.217 1.00 . A A . 11 LEU C 1 1 7 2604 1 1 11 LEU CA C -9.271 12.861 0.957 1.00 . A A . 11 LEU CA 1 1 7 2605 1 1 11 LEU CB C -8.255 13.890 1.456 1.00 . A A . 11 LEU CB 1 1 7 2606 1 1 11 LEU CD1 C -6.107 14.441 2.656 1.00 . A A . 11 LEU CD1 1 1 7 2607 1 1 11 LEU CD2 C -7.680 12.687 3.596 1.00 . A A . 11 LEU CD2 1 1 7 2608 1 1 11 LEU CG C -7.125 13.346 2.332 1.00 . A A . 11 LEU CG 1 1 7 2609 1 1 11 LEU H H -8.145 12.267 -0.691 1.00 . A A . 11 LEU H 1 1 7 2610 1 1 11 LEU HA H -9.647 12.329 1.831 1.00 . A A . 11 LEU HA 1 1 7 2611 1 1 11 LEU HB2 H -7.812 14.383 0.591 1.00 . A A . 11 LEU HB2 1 1 7 2612 1 1 11 LEU HB3 H -8.789 14.655 2.020 1.00 . A A . 11 LEU HB3 1 1 7 2613 1 1 11 LEU HD11 H -5.762 14.902 1.731 1.00 . A A . 11 LEU HD11 1 1 7 2614 1 1 11 LEU HD12 H -6.575 15.197 3.286 1.00 . A A . 11 LEU HD12 1 1 7 2615 1 1 11 LEU HD13 H -5.258 14.004 3.183 1.00 . A A . 11 LEU HD13 1 1 7 2616 1 1 11 LEU HD21 H -8.455 13.321 4.026 1.00 . A A . 11 LEU HD21 1 1 7 2617 1 1 11 LEU HD22 H -8.104 11.715 3.343 1.00 . A A . 11 LEU HD22 1 1 7 2618 1 1 11 LEU HD23 H -6.876 12.555 4.321 1.00 . A A . 11 LEU HD23 1 1 7 2619 1 1 11 LEU HG H -6.599 12.574 1.771 1.00 . A A . 11 LEU HG 1 1 7 2620 1 1 11 LEU N N -8.626 11.883 0.097 1.00 . A A . 11 LEU N 1 1 7 2621 1 1 11 LEU O O -11.598 13.379 0.672 1.00 . A A . 11 LEU O 1 1 7 2622 1 1 12 MET C C -11.081 14.319 -3.177 1.00 . A A . 12 MET C 1 1 7 2623 1 1 12 MET CA C -11.181 14.747 -1.711 1.00 . A A . 12 MET CA 1 1 7 2624 1 1 12 MET CB C -11.029 16.266 -1.611 1.00 . A A . 12 MET CB 1 1 7 2625 1 1 12 MET CE C -12.843 19.064 -0.842 1.00 . A A . 12 MET CE 1 1 7 2626 1 1 12 MET CG C -11.476 16.773 -0.238 1.00 . A A . 12 MET CG 1 1 7 2627 1 1 12 MET H H -9.226 14.174 -1.277 1.00 . A A . 12 MET H 1 1 7 2628 1 1 12 MET HA H -12.130 14.415 -1.292 1.00 . A A . 12 MET HA 1 1 7 2629 1 1 12 MET HB2 H -9.989 16.544 -1.784 1.00 . A A . 12 MET HB2 1 1 7 2630 1 1 12 MET HB3 H -11.621 16.747 -2.390 1.00 . A A . 12 MET HB3 1 1 7 2631 1 1 12 MET HE1 H -12.918 20.150 -0.794 1.00 . A A . 12 MET HE1 1 1 7 2632 1 1 12 MET HE2 H -12.904 18.740 -1.881 1.00 . A A . 12 MET HE2 1 1 7 2633 1 1 12 MET HE3 H -13.659 18.618 -0.273 1.00 . A A . 12 MET HE3 1 1 7 2634 1 1 12 MET HG2 H -12.518 16.504 -0.064 1.00 . A A . 12 MET HG2 1 1 7 2635 1 1 12 MET HG3 H -10.888 16.294 0.544 1.00 . A A . 12 MET HG3 1 1 7 2636 1 1 12 MET N N -10.154 14.104 -0.910 1.00 . A A . 12 MET N 1 1 7 2637 1 1 12 MET O O -12.052 13.829 -3.752 1.00 . A A . 12 MET O 1 1 7 2638 1 1 12 MET SD S -11.282 18.545 -0.148 1.00 . A A . 12 MET SD 1 1 7 2639 1 1 13 THR C C -8.233 13.681 -5.328 1.00 . A A . 13 THR C 1 1 7 2640 1 1 13 THR CA C -9.666 14.181 -5.133 1.00 . A A . 13 THR CA 1 1 7 2641 1 1 13 THR CB C -10.001 15.409 -5.982 1.00 . A A . 13 THR CB 1 1 7 2642 1 1 13 THR CG2 C -10.134 15.075 -7.469 1.00 . A A . 13 THR CG2 1 1 7 2643 1 1 13 THR H H -9.110 14.907 -3.262 1.00 . A A . 13 THR H 1 1 7 2644 1 1 13 THR HA H -10.331 13.360 -5.403 1.00 . A A . 13 THR HA 1 1 7 2645 1 1 13 THR HB H -9.270 16.202 -5.824 1.00 . A A . 13 THR HB 1 1 7 2646 1 1 13 THR HG1 H -11.305 16.557 -4.988 1.00 . A A . 13 THR HG1 1 1 7 2647 1 1 13 THR HG21 H -10.891 14.303 -7.602 1.00 . A A . 13 THR HG21 1 1 7 2648 1 1 13 THR HG22 H -10.428 15.970 -8.017 1.00 . A A . 13 THR HG22 1 1 7 2649 1 1 13 THR HG23 H -9.177 14.715 -7.847 1.00 . A A . 13 THR HG23 1 1 7 2650 1 1 13 THR N N -9.899 14.521 -3.740 1.00 . A A . 13 THR N 1 1 7 2651 1 1 13 THR O O -7.287 14.286 -4.827 1.00 . A A . 13 THR O 1 1 7 2652 1 1 13 THR OG1 O -11.325 15.755 -5.584 1.00 . A A . 13 THR OG1 1 1 7 2653 1 1 14 PRO C C -6.044 12.773 -7.383 1.00 . A A . 14 PRO C 1 1 7 2654 1 1 14 PRO CA C -6.815 11.960 -6.340 1.00 . A A . 14 PRO CA 1 1 7 2655 1 1 14 PRO CB C -7.113 10.541 -6.796 1.00 . A A . 14 PRO CB 1 1 7 2656 1 1 14 PRO CD C -9.214 11.810 -6.690 1.00 . A A . 14 PRO CD 1 1 7 2657 1 1 14 PRO CG C -8.574 10.536 -7.215 1.00 . A A . 14 PRO CG 1 1 7 2658 1 1 14 PRO HA H -6.253 11.974 -5.513 1.00 . A A . 14 PRO HA 1 1 7 2659 1 1 14 PRO HB2 H -6.467 10.253 -7.625 1.00 . A A . 14 PRO HB2 1 1 7 2660 1 1 14 PRO HB3 H -6.935 9.827 -5.991 1.00 . A A . 14 PRO HB3 1 1 7 2661 1 1 14 PRO HD2 H -9.677 12.382 -7.495 1.00 . A A . 14 PRO HD2 1 1 7 2662 1 1 14 PRO HD3 H -9.997 11.590 -5.964 1.00 . A A . 14 PRO HD3 1 1 7 2663 1 1 14 PRO HG2 H -8.659 10.484 -8.300 1.00 . A A . 14 PRO HG2 1 1 7 2664 1 1 14 PRO HG3 H -9.083 9.659 -6.814 1.00 . A A . 14 PRO HG3 1 1 7 2665 1 1 14 PRO N N -8.116 12.551 -6.077 1.00 . A A . 14 PRO N 1 1 7 2666 1 1 14 PRO O O -6.586 13.708 -7.970 1.00 . A A . 14 PRO O 1 1 7 2667 1 1 15 PRO C C -4.290 12.673 -9.981 1.00 . A A . 15 PRO C 1 1 7 2668 1 1 15 PRO CA C -3.910 13.056 -8.549 1.00 . A A . 15 PRO CA 1 1 7 2669 1 1 15 PRO CB C -2.493 12.647 -8.182 1.00 . A A . 15 PRO CB 1 1 7 2670 1 1 15 PRO CD C -4.084 11.276 -6.905 1.00 . A A . 15 PRO CD 1 1 7 2671 1 1 15 PRO CG C -2.628 11.397 -7.328 1.00 . A A . 15 PRO CG 1 1 7 2672 1 1 15 PRO HA H -4.038 14.046 -8.488 1.00 . A A . 15 PRO HA 1 1 7 2673 1 1 15 PRO HB2 H -1.900 12.448 -9.074 1.00 . A A . 15 PRO HB2 1 1 7 2674 1 1 15 PRO HB3 H -1.987 13.441 -7.634 1.00 . A A . 15 PRO HB3 1 1 7 2675 1 1 15 PRO HD2 H -4.502 10.313 -7.198 1.00 . A A . 15 PRO HD2 1 1 7 2676 1 1 15 PRO HD3 H -4.190 11.354 -5.824 1.00 . A A . 15 PRO HD3 1 1 7 2677 1 1 15 PRO HG2 H -2.319 10.515 -7.889 1.00 . A A . 15 PRO HG2 1 1 7 2678 1 1 15 PRO HG3 H -1.981 11.460 -6.453 1.00 . A A . 15 PRO HG3 1 1 7 2679 1 1 15 PRO N N -4.759 12.377 -7.586 1.00 . A A . 15 PRO N 1 1 7 2680 1 1 15 PRO O O -3.469 12.138 -10.724 1.00 . A A . 15 PRO O 1 1 7 2681 1 1 16 VAL C C -5.138 13.326 -12.698 1.00 . A A . 16 VAL C 1 1 7 2682 1 1 16 VAL CA C -6.036 12.657 -11.655 1.00 . A A . 16 VAL CA 1 1 7 2683 1 1 16 VAL CB C -7.503 13.075 -11.773 1.00 . A A . 16 VAL CB 1 1 7 2684 1 1 16 VAL CG1 C -8.399 12.177 -10.917 1.00 . A A . 16 VAL CG1 1 1 7 2685 1 1 16 VAL CG2 C -7.685 14.547 -11.399 1.00 . A A . 16 VAL CG2 1 1 7 2686 1 1 16 VAL H H -6.199 13.396 -9.715 1.00 . A A . 16 VAL H 1 1 7 2687 1 1 16 VAL HA H -5.981 11.576 -11.787 1.00 . A A . 16 VAL HA 1 1 7 2688 1 1 16 VAL HB H -7.803 12.954 -12.814 1.00 . A A . 16 VAL HB 1 1 7 2689 1 1 16 VAL HG11 H -8.225 11.133 -11.181 1.00 . A A . 16 VAL HG11 1 1 7 2690 1 1 16 VAL HG12 H -8.165 12.329 -9.864 1.00 . A A . 16 VAL HG12 1 1 7 2691 1 1 16 VAL HG13 H -9.444 12.428 -11.098 1.00 . A A . 16 VAL HG13 1 1 7 2692 1 1 16 VAL HG21 H -7.601 15.163 -12.295 1.00 . A A . 16 VAL HG21 1 1 7 2693 1 1 16 VAL HG22 H -8.669 14.689 -10.952 1.00 . A A . 16 VAL HG22 1 1 7 2694 1 1 16 VAL HG23 H -6.916 14.838 -10.684 1.00 . A A . 16 VAL HG23 1 1 7 2695 1 1 16 VAL N N -5.537 12.962 -10.325 1.00 . A A . 16 VAL N 1 1 7 2696 1 1 16 VAL O O -4.739 12.695 -13.676 1.00 . A A . 16 VAL O 1 1 7 2697 1 1 17 ILE C C -2.757 14.536 -13.699 1.00 . A A . 17 ILE C 1 1 7 2698 1 1 17 ILE CA C -4.002 15.357 -13.359 1.00 . A A . 17 ILE CA 1 1 7 2699 1 1 17 ILE CB C -3.690 16.734 -12.770 1.00 . A A . 17 ILE CB 1 1 7 2700 1 1 17 ILE CD1 C -4.773 18.656 -11.548 1.00 . A A . 17 ILE CD1 1 1 7 2701 1 1 17 ILE CG1 C -4.967 17.558 -12.597 1.00 . A A . 17 ILE CG1 1 1 7 2702 1 1 17 ILE CG2 C -2.644 17.466 -13.613 1.00 . A A . 17 ILE CG2 1 1 7 2703 1 1 17 ILE H H -5.176 15.102 -11.657 1.00 . A A . 17 ILE H 1 1 7 2704 1 1 17 ILE HA H -4.569 15.520 -14.276 1.00 . A A . 17 ILE HA 1 1 7 2705 1 1 17 ILE HB H -3.262 16.591 -11.778 1.00 . A A . 17 ILE HB 1 1 7 2706 1 1 17 ILE HD11 H -4.006 19.352 -11.889 1.00 . A A . 17 ILE HD11 1 1 7 2707 1 1 17 ILE HD12 H -5.711 19.191 -11.404 1.00 . A A . 17 ILE HD12 1 1 7 2708 1 1 17 ILE HD13 H -4.462 18.207 -10.605 1.00 . A A . 17 ILE HD13 1 1 7 2709 1 1 17 ILE HG12 H -5.247 18.007 -13.550 1.00 . A A . 17 ILE HG12 1 1 7 2710 1 1 17 ILE HG13 H -5.788 16.906 -12.298 1.00 . A A . 17 ILE HG13 1 1 7 2711 1 1 17 ILE HG21 H -2.969 17.492 -14.653 1.00 . A A . 17 ILE HG21 1 1 7 2712 1 1 17 ILE HG22 H -2.529 18.485 -13.243 1.00 . A A . 17 ILE HG22 1 1 7 2713 1 1 17 ILE HG23 H -1.690 16.944 -13.543 1.00 . A A . 17 ILE HG23 1 1 7 2714 1 1 17 ILE N N -4.847 14.595 -12.454 1.00 . A A . 17 ILE N 1 1 7 2715 1 1 17 ILE O O -2.282 14.563 -14.834 1.00 . A A . 17 ILE O 1 1 7 2716 1 1 18 GLN C C -1.473 11.559 -13.175 1.00 . A A . 18 GLN C 1 1 7 2717 1 1 18 GLN CA C -1.077 13.005 -12.872 1.00 . A A . 18 GLN CA 1 1 7 2718 1 1 18 GLN CB C -0.171 13.079 -11.641 1.00 . A A . 18 GLN CB 1 1 7 2719 1 1 18 GLN CD C 1.473 14.658 -12.721 1.00 . A A . 18 GLN CD 1 1 7 2720 1 1 18 GLN CG C 0.515 14.443 -11.547 1.00 . A A . 18 GLN CG 1 1 7 2721 1 1 18 GLN H H -2.658 13.806 -11.777 1.00 . A A . 18 GLN H 1 1 7 2722 1 1 18 GLN HA H -0.554 13.432 -13.727 1.00 . A A . 18 GLN HA 1 1 7 2723 1 1 18 GLN HB2 H -0.759 12.901 -10.741 1.00 . A A . 18 GLN HB2 1 1 7 2724 1 1 18 GLN HB3 H 0.582 12.292 -11.692 1.00 . A A . 18 GLN HB3 1 1 7 2725 1 1 18 GLN HE21 H 0.156 15.988 -13.491 1.00 . A A . 18 GLN HE21 1 1 7 2726 1 1 18 GLN HE22 H 1.594 15.745 -14.425 1.00 . A A . 18 GLN HE22 1 1 7 2727 1 1 18 GLN HG2 H -0.236 15.233 -11.537 1.00 . A A . 18 GLN HG2 1 1 7 2728 1 1 18 GLN HG3 H 1.064 14.514 -10.608 1.00 . A A . 18 GLN HG3 1 1 7 2729 1 1 18 GLN N N -2.263 13.826 -12.695 1.00 . A A . 18 GLN N 1 1 7 2730 1 1 18 GLN NE2 N 1.038 15.536 -13.620 1.00 . A A . 18 GLN NE2 1 1 7 2731 1 1 18 GLN O O -0.806 10.878 -13.952 1.00 . A A . 18 GLN O 1 1 7 2732 1 1 18 GLN OE1 O 2.536 14.065 -12.805 1.00 . A A . 18 GLN OE1 1 1 7 2733 1 1 19 ALA C C -3.302 9.529 -14.217 1.00 . A A . 19 ALA C 1 1 7 2734 1 1 19 ALA CA C -3.045 9.775 -12.729 1.00 . A A . 19 ALA CA 1 1 7 2735 1 1 19 ALA CB C -4.298 9.563 -11.878 1.00 . A A . 19 ALA CB 1 1 7 2736 1 1 19 ALA H H -3.098 11.693 -11.918 1.00 . A A . 19 ALA H 1 1 7 2737 1 1 19 ALA HA H -2.267 9.093 -12.385 1.00 . A A . 19 ALA HA 1 1 7 2738 1 1 19 ALA HB1 H -5.075 10.259 -12.194 1.00 . A A . 19 ALA HB1 1 1 7 2739 1 1 19 ALA HB2 H -4.654 8.540 -12.003 1.00 . A A . 19 ALA HB2 1 1 7 2740 1 1 19 ALA HB3 H -4.059 9.738 -10.829 1.00 . A A . 19 ALA HB3 1 1 7 2741 1 1 19 ALA N N -2.558 11.131 -12.544 1.00 . A A . 19 ALA N 1 1 7 2742 1 1 19 ALA O O -2.863 8.520 -14.768 1.00 . A A . 19 ALA O 1 1 7 2743 1 1 20 ILE C C -3.117 10.461 -17.087 1.00 . A A . 20 ILE C 1 1 7 2744 1 1 20 ILE CA C -4.376 10.340 -16.227 1.00 . A A . 20 ILE CA 1 1 7 2745 1 1 20 ILE CB C -5.469 11.347 -16.591 1.00 . A A . 20 ILE CB 1 1 7 2746 1 1 20 ILE CD1 C -4.230 13.246 -17.695 1.00 . A A . 20 ILE CD1 1 1 7 2747 1 1 20 ILE CG1 C -4.964 12.783 -16.435 1.00 . A A . 20 ILE CG1 1 1 7 2748 1 1 20 ILE CG2 C -6.740 11.095 -15.777 1.00 . A A . 20 ILE CG2 1 1 7 2749 1 1 20 ILE H H -4.340 11.299 -14.378 1.00 . A A . 20 ILE H 1 1 7 2750 1 1 20 ILE HA H -4.796 9.344 -16.367 1.00 . A A . 20 ILE HA 1 1 7 2751 1 1 20 ILE HB H -5.725 11.208 -17.641 1.00 . A A . 20 ILE HB 1 1 7 2752 1 1 20 ILE HD11 H -4.058 12.392 -18.350 1.00 . A A . 20 ILE HD11 1 1 7 2753 1 1 20 ILE HD12 H -4.835 13.988 -18.217 1.00 . A A . 20 ILE HD12 1 1 7 2754 1 1 20 ILE HD13 H -3.273 13.688 -17.416 1.00 . A A . 20 ILE HD13 1 1 7 2755 1 1 20 ILE HG12 H -5.805 13.448 -16.235 1.00 . A A . 20 ILE HG12 1 1 7 2756 1 1 20 ILE HG13 H -4.296 12.847 -15.576 1.00 . A A . 20 ILE HG13 1 1 7 2757 1 1 20 ILE HG21 H -6.905 10.021 -15.686 1.00 . A A . 20 ILE HG21 1 1 7 2758 1 1 20 ILE HG22 H -6.629 11.531 -14.785 1.00 . A A . 20 ILE HG22 1 1 7 2759 1 1 20 ILE HG23 H -7.591 11.552 -16.282 1.00 . A A . 20 ILE HG23 1 1 7 2760 1 1 20 ILE N N -4.013 10.466 -14.825 1.00 . A A . 20 ILE N 1 1 7 2761 1 1 20 ILE O O -3.000 9.801 -18.119 1.00 . A A . 20 ILE O 1 1 7 2762 1 1 21 HIS C C -0.162 10.254 -17.441 1.00 . A A . 21 HIS C 1 1 7 2763 1 1 21 HIS CA C -0.974 11.548 -17.364 1.00 . A A . 21 HIS CA 1 1 7 2764 1 1 21 HIS CB C -0.189 12.705 -16.742 1.00 . A A . 21 HIS CB 1 1 7 2765 1 1 21 HIS CD2 C 2.367 13.174 -16.467 1.00 . A A . 21 HIS CD2 1 1 7 2766 1 1 21 HIS CE1 C 3.024 12.487 -18.438 1.00 . A A . 21 HIS CE1 1 1 7 2767 1 1 21 HIS CG C 1.264 12.749 -17.148 1.00 . A A . 21 HIS CG 1 1 7 2768 1 1 21 HIS H H -2.299 11.824 -15.780 1.00 . A A . 21 HIS H 1 1 7 2769 1 1 21 HIS HA H -1.263 11.846 -18.372 1.00 . A A . 21 HIS HA 1 1 7 2770 1 1 21 HIS HB2 H -0.663 13.645 -17.024 1.00 . A A . 21 HIS HB2 1 1 7 2771 1 1 21 HIS HB3 H -0.251 12.631 -15.657 1.00 . A A . 21 HIS HB3 1 1 7 2772 1 1 21 HIS HD1 H 1.138 11.953 -19.119 1.00 . A A . 21 HIS HD1 1 1 7 2773 1 1 21 HIS HD2 H 2.375 13.577 -15.454 1.00 . A A . 21 HIS HD2 1 1 7 2774 1 1 21 HIS HE1 H 3.668 12.244 -19.283 1.00 . A A . 21 HIS HE1 1 1 7 2775 1 1 21 HIS HE2 H 4.363 13.296 -17.023 1.00 . A A . 21 HIS HE2 1 1 7 2776 1 1 21 HIS N N -2.206 11.308 -16.631 1.00 . A A . 21 HIS N 1 1 7 2777 1 1 21 HIS ND1 N 1.710 12.323 -18.387 1.00 . A A . 21 HIS ND1 1 1 7 2778 1 1 21 HIS NE2 N 3.429 13.015 -17.247 1.00 . A A . 21 HIS NE2 1 1 7 2779 1 1 21 HIS O O 0.336 9.892 -18.505 1.00 . A A . 21 HIS O 1 1 7 2780 1 1 22 ASP C C 0.170 7.382 -17.289 1.00 . A A . 22 ASP C 1 1 7 2781 1 1 22 ASP CA C 0.690 8.347 -16.222 1.00 . A A . 22 ASP CA 1 1 7 2782 1 1 22 ASP CB C 0.512 7.681 -14.856 1.00 . A A . 22 ASP CB 1 1 7 2783 1 1 22 ASP CG C 1.801 7.157 -14.219 1.00 . A A . 22 ASP CG 1 1 7 2784 1 1 22 ASP H H -0.460 9.895 -15.436 1.00 . A A . 22 ASP H 1 1 7 2785 1 1 22 ASP HA H 1.732 8.624 -16.383 1.00 . A A . 22 ASP HA 1 1 7 2786 1 1 22 ASP HB2 H 0.054 8.399 -14.176 1.00 . A A . 22 ASP HB2 1 1 7 2787 1 1 22 ASP HB3 H -0.187 6.852 -14.961 1.00 . A A . 22 ASP HB3 1 1 7 2788 1 1 22 ASP N N -0.053 9.593 -16.298 1.00 . A A . 22 ASP N 1 1 7 2789 1 1 22 ASP O O 0.951 6.690 -17.940 1.00 . A A . 22 ASP O 1 1 7 2790 1 1 22 ASP OD1 O 2.372 6.206 -14.794 1.00 . A A . 22 ASP OD1 1 1 7 2791 1 1 22 ASP OD2 O 2.186 7.720 -13.171 1.00 . A A . 22 ASP OD2 1 1 7 2792 1 1 23 ALA C C -1.490 7.000 -19.817 1.00 . A A . 23 ALA C 1 1 7 2793 1 1 23 ALA CA C -1.782 6.489 -18.404 1.00 . A A . 23 ALA CA 1 1 7 2794 1 1 23 ALA CB C -3.282 6.407 -18.112 1.00 . A A . 23 ALA CB 1 1 7 2795 1 1 23 ALA H H -1.775 7.938 -16.908 1.00 . A A . 23 ALA H 1 1 7 2796 1 1 23 ALA HA H -1.347 5.497 -18.289 1.00 . A A . 23 ALA HA 1 1 7 2797 1 1 23 ALA HB1 H -3.736 5.652 -18.754 1.00 . A A . 23 ALA HB1 1 1 7 2798 1 1 23 ALA HB2 H -3.434 6.135 -17.068 1.00 . A A . 23 ALA HB2 1 1 7 2799 1 1 23 ALA HB3 H -3.744 7.375 -18.307 1.00 . A A . 23 ALA HB3 1 1 7 2800 1 1 23 ALA N N -1.147 7.367 -17.436 1.00 . A A . 23 ALA N 1 1 7 2801 1 1 23 ALA O O -1.207 6.214 -20.719 1.00 . A A . 23 ALA O 1 1 7 2802 1 1 24 GLN C C 0.187 8.879 -21.573 1.00 . A A . 24 GLN C 1 1 7 2803 1 1 24 GLN CA C -1.307 8.941 -21.249 1.00 . A A . 24 GLN CA 1 1 7 2804 1 1 24 GLN CB C -1.813 10.384 -21.270 1.00 . A A . 24 GLN CB 1 1 7 2805 1 1 24 GLN CD C -3.851 11.870 -21.293 1.00 . A A . 24 GLN CD 1 1 7 2806 1 1 24 GLN CG C -3.341 10.430 -21.208 1.00 . A A . 24 GLN CG 1 1 7 2807 1 1 24 GLN H H -1.809 8.947 -19.227 1.00 . A A . 24 GLN H 1 1 7 2808 1 1 24 GLN HA H -1.868 8.355 -21.977 1.00 . A A . 24 GLN HA 1 1 7 2809 1 1 24 GLN HB2 H -1.395 10.932 -20.425 1.00 . A A . 24 GLN HB2 1 1 7 2810 1 1 24 GLN HB3 H -1.467 10.882 -22.175 1.00 . A A . 24 GLN HB3 1 1 7 2811 1 1 24 GLN HE21 H -2.264 12.312 -22.470 1.00 . A A . 24 GLN HE21 1 1 7 2812 1 1 24 GLN HE22 H -3.337 13.633 -22.147 1.00 . A A . 24 GLN HE22 1 1 7 2813 1 1 24 GLN HG2 H -3.759 9.844 -22.027 1.00 . A A . 24 GLN HG2 1 1 7 2814 1 1 24 GLN HG3 H -3.686 9.973 -20.281 1.00 . A A . 24 GLN HG3 1 1 7 2815 1 1 24 GLN N N -1.570 8.315 -19.965 1.00 . A A . 24 GLN N 1 1 7 2816 1 1 24 GLN NE2 N -3.087 12.671 -22.031 1.00 . A A . 24 GLN NE2 1 1 7 2817 1 1 24 GLN O O 0.572 8.488 -22.674 1.00 . A A . 24 GLN O 1 1 7 2818 1 1 24 GLN OE1 O -4.869 12.230 -20.726 1.00 . A A . 24 GLN OE1 1 1 7 2819 1 1 25 ARG C C 2.822 10.033 -22.028 1.00 . A A . 25 ARG C 1 1 7 2820 1 1 25 ARG CA C 2.432 9.267 -20.762 1.00 . A A . 25 ARG CA 1 1 7 2821 1 1 25 ARG CB C 2.972 7.838 -20.852 1.00 . A A . 25 ARG CB 1 1 7 2822 1 1 25 ARG CD C 4.009 5.944 -19.549 1.00 . A A . 25 ARG CD 1 1 7 2823 1 1 25 ARG CG C 3.688 7.440 -19.559 1.00 . A A . 25 ARG CG 1 1 7 2824 1 1 25 ARG CZ C 2.502 4.116 -20.321 1.00 . A A . 25 ARG CZ 1 1 7 2825 1 1 25 ARG H H 0.668 9.588 -19.701 1.00 . A A . 25 ARG H 1 1 7 2826 1 1 25 ARG HA H 2.818 9.761 -19.870 1.00 . A A . 25 ARG HA 1 1 7 2827 1 1 25 ARG HB2 H 2.151 7.147 -21.044 1.00 . A A . 25 ARG HB2 1 1 7 2828 1 1 25 ARG HB3 H 3.660 7.757 -21.693 1.00 . A A . 25 ARG HB3 1 1 7 2829 1 1 25 ARG HD2 H 4.590 5.682 -20.434 1.00 . A A . 25 ARG HD2 1 1 7 2830 1 1 25 ARG HD3 H 4.623 5.701 -18.682 1.00 . A A . 25 ARG HD3 1 1 7 2831 1 1 25 ARG HE H 2.056 5.419 -18.853 1.00 . A A . 25 ARG HE 1 1 7 2832 1 1 25 ARG HG2 H 4.609 8.014 -19.458 1.00 . A A . 25 ARG HG2 1 1 7 2833 1 1 25 ARG HG3 H 3.062 7.687 -18.702 1.00 . A A . 25 ARG HG3 1 1 7 2834 1 1 25 ARG HH11 H 4.281 4.219 -21.301 1.00 . A A . 25 ARG HH11 1 1 7 2835 1 1 25 ARG HH12 H 3.222 2.953 -21.826 1.00 . A A . 25 ARG HH12 1 1 7 2836 1 1 25 ARG HH21 H 0.658 3.749 -19.546 1.00 . A A . 25 ARG HH21 1 1 7 2837 1 1 25 ARG HH22 H 1.148 2.684 -20.821 1.00 . A A . 25 ARG HH22 1 1 7 2838 1 1 25 ARG N N 0.989 9.272 -20.594 1.00 . A A . 25 ARG N 1 1 7 2839 1 1 25 ARG NE N 2.756 5.157 -19.517 1.00 . A A . 25 ARG NE 1 1 7 2840 1 1 25 ARG NH1 N 3.412 3.730 -21.226 1.00 . A A . 25 ARG NH1 1 1 7 2841 1 1 25 ARG NH2 N 1.338 3.461 -20.221 1.00 . A A . 25 ARG NH2 1 1 7 2842 1 1 25 ARG O O 2.040 10.832 -22.540 1.00 . A A . 25 ARG O 1 1 8 2843 1 1 1 PHE C C 1.131 0.000 -2.451 1.00 . A A . 1 PHE C 1 1 8 2844 1 1 1 PHE CA C 2.073 0.000 -1.245 1.00 . A A . 1 PHE CA 1 1 8 2845 1 1 1 PHE CB C 2.908 -1.282 -1.266 1.00 . A A . 1 PHE CB 1 1 8 2846 1 1 1 PHE CD1 C 5.120 -0.165 -1.632 1.00 . A A . 1 PHE CD1 1 1 8 2847 1 1 1 PHE CD2 C 4.561 -1.994 -3.007 1.00 . A A . 1 PHE CD2 1 1 8 2848 1 1 1 PHE CE1 C 6.361 -0.035 -2.310 1.00 . A A . 1 PHE CE1 1 1 8 2849 1 1 1 PHE CE2 C 5.802 -1.864 -3.685 1.00 . A A . 1 PHE CE2 1 1 8 2850 1 1 1 PHE CG C 4.246 -1.142 -1.995 1.00 . A A . 1 PHE CG 1 1 8 2851 1 1 1 PHE CZ C 6.676 -0.888 -3.321 1.00 . A A . 1 PHE CZ 1 1 8 2852 1 1 1 PHE H1 H 1.884 0.000 0.829 1.00 . A A . 1 PHE H1 1 1 8 2853 1 1 1 PHE HA H 2.678 0.907 -1.259 1.00 . A A . 1 PHE HA 1 1 8 2854 1 1 1 PHE HB2 H 3.097 -1.597 -0.239 1.00 . A A . 1 PHE HB2 1 1 8 2855 1 1 1 PHE HB3 H 2.328 -2.074 -1.740 1.00 . A A . 1 PHE HB3 1 1 8 2856 1 1 1 PHE HD1 H 4.867 0.518 -0.821 1.00 . A A . 1 PHE HD1 1 1 8 2857 1 1 1 PHE HD2 H 3.860 -2.777 -3.298 1.00 . A A . 1 PHE HD2 1 1 8 2858 1 1 1 PHE HE1 H 7.061 0.747 -2.018 1.00 . A A . 1 PHE HE1 1 1 8 2859 1 1 1 PHE HE2 H 6.054 -2.548 -4.496 1.00 . A A . 1 PHE HE2 1 1 8 2860 1 1 1 PHE HZ H 7.629 -0.788 -3.841 1.00 . A A . 1 PHE HZ 1 1 8 2861 1 1 1 PHE N N 1.325 0.000 0.000 1.00 . A A . 1 PHE N 1 1 8 2862 1 1 1 PHE O O -0.085 0.090 -2.293 1.00 . A A . 1 PHE O 1 1 8 2863 1 1 2 LEU C C 0.920 -1.565 -5.397 1.00 . A A . 2 LEU C 1 1 8 2864 1 1 2 LEU CA C 0.958 -0.133 -4.860 1.00 . A A . 2 LEU CA 1 1 8 2865 1 1 2 LEU CB C 1.506 0.885 -5.861 1.00 . A A . 2 LEU CB 1 1 8 2866 1 1 2 LEU CD1 C 0.464 3.059 -5.120 1.00 . A A . 2 LEU CD1 1 1 8 2867 1 1 2 LEU CD2 C 0.977 2.661 -7.572 1.00 . A A . 2 LEU CD2 1 1 8 2868 1 1 2 LEU CG C 0.560 2.026 -6.244 1.00 . A A . 2 LEU CG 1 1 8 2869 1 1 2 LEU H H 2.720 -0.163 -3.750 1.00 . A A . 2 LEU H 1 1 8 2870 1 1 2 LEU HA H -0.060 0.171 -4.615 1.00 . A A . 2 LEU HA 1 1 8 2871 1 1 2 LEU HB2 H 2.417 1.319 -5.447 1.00 . A A . 2 LEU HB2 1 1 8 2872 1 1 2 LEU HB3 H 1.790 0.355 -6.770 1.00 . A A . 2 LEU HB3 1 1 8 2873 1 1 2 LEU HD11 H 0.070 2.582 -4.222 1.00 . A A . 2 LEU HD11 1 1 8 2874 1 1 2 LEU HD12 H 1.454 3.463 -4.912 1.00 . A A . 2 LEU HD12 1 1 8 2875 1 1 2 LEU HD13 H -0.202 3.866 -5.425 1.00 . A A . 2 LEU HD13 1 1 8 2876 1 1 2 LEU HD21 H 0.782 1.963 -8.386 1.00 . A A . 2 LEU HD21 1 1 8 2877 1 1 2 LEU HD22 H 0.405 3.575 -7.733 1.00 . A A . 2 LEU HD22 1 1 8 2878 1 1 2 LEU HD23 H 2.041 2.898 -7.544 1.00 . A A . 2 LEU HD23 1 1 8 2879 1 1 2 LEU HG H -0.437 1.609 -6.386 1.00 . A A . 2 LEU HG 1 1 8 2880 1 1 2 LEU N N 1.729 -0.102 -3.629 1.00 . A A . 2 LEU N 1 1 8 2881 1 1 2 LEU O O -0.136 -2.194 -5.425 1.00 . A A . 2 LEU O 1 1 8 2882 1 1 3 PRO C C 2.147 -4.449 -5.280 1.00 . A A . 3 PRO C 1 1 8 2883 1 1 3 PRO CA C 2.227 -3.389 -6.380 1.00 . A A . 3 PRO CA 1 1 8 2884 1 1 3 PRO CB C 3.554 -3.399 -7.120 1.00 . A A . 3 PRO CB 1 1 8 2885 1 1 3 PRO CD C 3.394 -1.343 -5.783 1.00 . A A . 3 PRO CD 1 1 8 2886 1 1 3 PRO CG C 4.350 -2.229 -6.564 1.00 . A A . 3 PRO CG 1 1 8 2887 1 1 3 PRO HA H 1.459 -3.573 -6.993 1.00 . A A . 3 PRO HA 1 1 8 2888 1 1 3 PRO HB2 H 4.081 -4.340 -6.963 1.00 . A A . 3 PRO HB2 1 1 8 2889 1 1 3 PRO HB3 H 3.403 -3.293 -8.194 1.00 . A A . 3 PRO HB3 1 1 8 2890 1 1 3 PRO HD2 H 3.735 -1.199 -4.758 1.00 . A A . 3 PRO HD2 1 1 8 2891 1 1 3 PRO HD3 H 3.312 -0.355 -6.234 1.00 . A A . 3 PRO HD3 1 1 8 2892 1 1 3 PRO HG2 H 5.153 -2.586 -5.919 1.00 . A A . 3 PRO HG2 1 1 8 2893 1 1 3 PRO HG3 H 4.818 -1.667 -7.372 1.00 . A A . 3 PRO HG3 1 1 8 2894 1 1 3 PRO N N 2.117 -2.051 -5.822 1.00 . A A . 3 PRO N 1 1 8 2895 1 1 3 PRO O O 1.396 -5.417 -5.399 1.00 . A A . 3 PRO O 1 1 8 2896 1 1 4 LEU C C 1.621 -5.209 -2.431 1.00 . A A . 4 LEU C 1 1 8 2897 1 1 4 LEU CA C 2.982 -5.174 -3.129 1.00 . A A . 4 LEU CA 1 1 8 2898 1 1 4 LEU CB C 4.145 -4.838 -2.193 1.00 . A A . 4 LEU CB 1 1 8 2899 1 1 4 LEU CD1 C 6.003 -4.847 -3.899 1.00 . A A . 4 LEU CD1 1 1 8 2900 1 1 4 LEU CD2 C 6.520 -5.239 -1.446 1.00 . A A . 4 LEU CD2 1 1 8 2901 1 1 4 LEU CG C 5.504 -5.429 -2.574 1.00 . A A . 4 LEU CG 1 1 8 2902 1 1 4 LEU H H 3.522 -3.432 -4.136 1.00 . A A . 4 LEU H 1 1 8 2903 1 1 4 LEU HA H 3.180 -6.160 -3.549 1.00 . A A . 4 LEU HA 1 1 8 2904 1 1 4 LEU HB2 H 4.244 -3.754 -2.142 1.00 . A A . 4 LEU HB2 1 1 8 2905 1 1 4 LEU HB3 H 3.890 -5.183 -1.191 1.00 . A A . 4 LEU HB3 1 1 8 2906 1 1 4 LEU HD11 H 5.918 -3.761 -3.873 1.00 . A A . 4 LEU HD11 1 1 8 2907 1 1 4 LEU HD12 H 7.046 -5.127 -4.049 1.00 . A A . 4 LEU HD12 1 1 8 2908 1 1 4 LEU HD13 H 5.400 -5.240 -4.718 1.00 . A A . 4 LEU HD13 1 1 8 2909 1 1 4 LEU HD21 H 6.128 -5.672 -0.526 1.00 . A A . 4 LEU HD21 1 1 8 2910 1 1 4 LEU HD22 H 7.454 -5.734 -1.711 1.00 . A A . 4 LEU HD22 1 1 8 2911 1 1 4 LEU HD23 H 6.703 -4.174 -1.298 1.00 . A A . 4 LEU HD23 1 1 8 2912 1 1 4 LEU HG H 5.382 -6.502 -2.720 1.00 . A A . 4 LEU HG 1 1 8 2913 1 1 4 LEU N N 2.931 -4.232 -4.234 1.00 . A A . 4 LEU N 1 1 8 2914 1 1 4 LEU O O 1.340 -6.123 -1.657 1.00 . A A . 4 LEU O 1 1 8 2915 1 1 5 LEU C C -1.545 -4.627 -3.154 1.00 . A A . 5 LEU C 1 1 8 2916 1 1 5 LEU CA C -0.515 -4.111 -2.147 1.00 . A A . 5 LEU CA 1 1 8 2917 1 1 5 LEU CB C -0.791 -2.687 -1.660 1.00 . A A . 5 LEU CB 1 1 8 2918 1 1 5 LEU CD1 C -2.987 -3.225 -0.542 1.00 . A A . 5 LEU CD1 1 1 8 2919 1 1 5 LEU CD2 C -0.851 -3.125 0.823 1.00 . A A . 5 LEU CD2 1 1 8 2920 1 1 5 LEU CG C -1.616 -2.565 -0.377 1.00 . A A . 5 LEU CG 1 1 8 2921 1 1 5 LEU H H 1.052 -3.459 -3.353 1.00 . A A . 5 LEU H 1 1 8 2922 1 1 5 LEU HA H -0.533 -4.760 -1.271 1.00 . A A . 5 LEU HA 1 1 8 2923 1 1 5 LEU HB2 H 0.164 -2.187 -1.503 1.00 . A A . 5 LEU HB2 1 1 8 2924 1 1 5 LEU HB3 H -1.307 -2.147 -2.453 1.00 . A A . 5 LEU HB3 1 1 8 2925 1 1 5 LEU HD11 H -3.649 -2.893 0.258 1.00 . A A . 5 LEU HD11 1 1 8 2926 1 1 5 LEU HD12 H -3.412 -2.944 -1.506 1.00 . A A . 5 LEU HD12 1 1 8 2927 1 1 5 LEU HD13 H -2.876 -4.308 -0.496 1.00 . A A . 5 LEU HD13 1 1 8 2928 1 1 5 LEU HD21 H -1.075 -4.186 0.933 1.00 . A A . 5 LEU HD21 1 1 8 2929 1 1 5 LEU HD22 H 0.220 -2.995 0.664 1.00 . A A . 5 LEU HD22 1 1 8 2930 1 1 5 LEU HD23 H -1.152 -2.595 1.726 1.00 . A A . 5 LEU HD23 1 1 8 2931 1 1 5 LEU HG H -1.790 -1.507 -0.183 1.00 . A A . 5 LEU HG 1 1 8 2932 1 1 5 LEU N N 0.813 -4.202 -2.728 1.00 . A A . 5 LEU N 1 1 8 2933 1 1 5 LEU O O -2.436 -5.397 -2.798 1.00 . A A . 5 LEU O 1 1 8 2934 1 1 6 ILE C C -2.230 -6.125 -5.592 1.00 . A A . 6 ILE C 1 1 8 2935 1 1 6 ILE CA C -2.283 -4.602 -5.457 1.00 . A A . 6 ILE CA 1 1 8 2936 1 1 6 ILE CB C -1.959 -3.858 -6.754 1.00 . A A . 6 ILE CB 1 1 8 2937 1 1 6 ILE CD1 C -0.205 -3.414 -8.512 1.00 . A A . 6 ILE CD1 1 1 8 2938 1 1 6 ILE CG1 C -0.515 -4.119 -7.189 1.00 . A A . 6 ILE CG1 1 1 8 2939 1 1 6 ILE CG2 C -2.256 -2.363 -6.618 1.00 . A A . 6 ILE CG2 1 1 8 2940 1 1 6 ILE H H -0.667 -3.548 -4.672 1.00 . A A . 6 ILE H 1 1 8 2941 1 1 6 ILE HA H -3.294 -4.316 -5.166 1.00 . A A . 6 ILE HA 1 1 8 2942 1 1 6 ILE HB H -2.607 -4.245 -7.541 1.00 . A A . 6 ILE HB 1 1 8 2943 1 1 6 ILE HD11 H -0.112 -2.342 -8.339 1.00 . A A . 6 ILE HD11 1 1 8 2944 1 1 6 ILE HD12 H 0.729 -3.800 -8.919 1.00 . A A . 6 ILE HD12 1 1 8 2945 1 1 6 ILE HD13 H -1.014 -3.599 -9.220 1.00 . A A . 6 ILE HD13 1 1 8 2946 1 1 6 ILE HG12 H 0.170 -3.768 -6.417 1.00 . A A . 6 ILE HG12 1 1 8 2947 1 1 6 ILE HG13 H -0.352 -5.191 -7.297 1.00 . A A . 6 ILE HG13 1 1 8 2948 1 1 6 ILE HG21 H -3.117 -2.106 -7.235 1.00 . A A . 6 ILE HG21 1 1 8 2949 1 1 6 ILE HG22 H -2.472 -2.129 -5.576 1.00 . A A . 6 ILE HG22 1 1 8 2950 1 1 6 ILE HG23 H -1.389 -1.790 -6.947 1.00 . A A . 6 ILE HG23 1 1 8 2951 1 1 6 ILE N N -1.388 -4.182 -4.392 1.00 . A A . 6 ILE N 1 1 8 2952 1 1 6 ILE O O -3.242 -6.763 -5.878 1.00 . A A . 6 ILE O 1 1 8 2953 1 1 7 LEU C C -1.760 -8.801 -4.467 1.00 . A A . 7 LEU C 1 1 8 2954 1 1 7 LEU CA C -0.840 -8.101 -5.469 1.00 . A A . 7 LEU CA 1 1 8 2955 1 1 7 LEU CB C 0.639 -8.450 -5.294 1.00 . A A . 7 LEU CB 1 1 8 2956 1 1 7 LEU CD1 C 3.032 -8.282 -6.072 1.00 . A A . 7 LEU CD1 1 1 8 2957 1 1 7 LEU CD2 C 1.173 -8.698 -7.747 1.00 . A A . 7 LEU CD2 1 1 8 2958 1 1 7 LEU CG C 1.568 -8.022 -6.432 1.00 . A A . 7 LEU CG 1 1 8 2959 1 1 7 LEU H H -0.219 -6.138 -5.151 1.00 . A A . 7 LEU H 1 1 8 2960 1 1 7 LEU HA H -1.127 -8.409 -6.475 1.00 . A A . 7 LEU HA 1 1 8 2961 1 1 7 LEU HB2 H 0.993 -7.992 -4.371 1.00 . A A . 7 LEU HB2 1 1 8 2962 1 1 7 LEU HB3 H 0.725 -9.529 -5.168 1.00 . A A . 7 LEU HB3 1 1 8 2963 1 1 7 LEU HD11 H 3.253 -7.834 -5.103 1.00 . A A . 7 LEU HD11 1 1 8 2964 1 1 7 LEU HD12 H 3.210 -9.356 -6.024 1.00 . A A . 7 LEU HD12 1 1 8 2965 1 1 7 LEU HD13 H 3.677 -7.840 -6.831 1.00 . A A . 7 LEU HD13 1 1 8 2966 1 1 7 LEU HD21 H 0.334 -8.164 -8.192 1.00 . A A . 7 LEU HD21 1 1 8 2967 1 1 7 LEU HD22 H 2.019 -8.681 -8.433 1.00 . A A . 7 LEU HD22 1 1 8 2968 1 1 7 LEU HD23 H 0.884 -9.731 -7.551 1.00 . A A . 7 LEU HD23 1 1 8 2969 1 1 7 LEU HG H 1.458 -6.947 -6.577 1.00 . A A . 7 LEU HG 1 1 8 2970 1 1 7 LEU N N -1.038 -6.664 -5.380 1.00 . A A . 7 LEU N 1 1 8 2971 1 1 7 LEU O O -2.382 -9.812 -4.790 1.00 . A A . 7 LEU O 1 1 8 2972 1 1 8 GLY C C -4.124 -8.813 -2.645 1.00 . A A . 8 GLY C 1 1 8 2973 1 1 8 GLY CA C -2.655 -8.790 -2.220 1.00 . A A . 8 GLY CA 1 1 8 2974 1 1 8 GLY H H -1.305 -7.416 -3.013 1.00 . A A . 8 GLY H 1 1 8 2975 1 1 8 GLY HA2 H -2.325 -9.802 -1.982 1.00 . A A . 8 GLY HA2 1 1 8 2976 1 1 8 GLY HA3 H -2.545 -8.198 -1.311 1.00 . A A . 8 GLY HA3 1 1 8 2977 1 1 8 GLY N N -1.817 -8.236 -3.270 1.00 . A A . 8 GLY N 1 1 8 2978 1 1 8 GLY O O -4.794 -9.837 -2.522 1.00 . A A . 8 GLY O 1 1 8 2979 1 1 9 SER C C -6.100 -8.096 -5.007 1.00 . A A . 9 SER C 1 1 8 2980 1 1 9 SER CA C -5.960 -7.549 -3.585 1.00 . A A . 9 SER CA 1 1 8 2981 1 1 9 SER CB C -6.429 -6.094 -3.527 1.00 . A A . 9 SER CB 1 1 8 2982 1 1 9 SER H H -4.031 -6.843 -3.235 1.00 . A A . 9 SER H 1 1 8 2983 1 1 9 SER HA H -6.544 -8.146 -2.885 1.00 . A A . 9 SER HA 1 1 8 2984 1 1 9 SER HB2 H -6.121 -5.650 -2.581 1.00 . A A . 9 SER HB2 1 1 8 2985 1 1 9 SER HB3 H -5.943 -5.524 -4.319 1.00 . A A . 9 SER HB3 1 1 8 2986 1 1 9 SER HG H -8.081 -5.788 -4.616 1.00 . A A . 9 SER HG 1 1 8 2987 1 1 9 SER N N -4.582 -7.672 -3.139 1.00 . A A . 9 SER N 1 1 8 2988 1 1 9 SER O O -7.205 -8.165 -5.543 1.00 . A A . 9 SER O 1 1 8 2989 1 1 9 SER OG O -7.843 -5.984 -3.664 1.00 . A A . 9 SER OG 1 1 8 2990 1 1 10 LEU C C -5.850 -10.251 -6.982 1.00 . A A . 10 LEU C 1 1 8 2991 1 1 10 LEU CA C -4.948 -9.016 -6.924 1.00 . A A . 10 LEU CA 1 1 8 2992 1 1 10 LEU CB C -3.511 -9.283 -7.376 1.00 . A A . 10 LEU CB 1 1 8 2993 1 1 10 LEU CD1 C -4.009 -9.900 -9.770 1.00 . A A . 10 LEU CD1 1 1 8 2994 1 1 10 LEU CD2 C -3.429 -7.506 -9.164 1.00 . A A . 10 LEU CD2 1 1 8 2995 1 1 10 LEU CG C -3.204 -8.985 -8.845 1.00 . A A . 10 LEU CG 1 1 8 2996 1 1 10 LEU H H -4.070 -8.409 -5.135 1.00 . A A . 10 LEU H 1 1 8 2997 1 1 10 LEU HA H -5.359 -8.256 -7.588 1.00 . A A . 10 LEU HA 1 1 8 2998 1 1 10 LEU HB2 H -2.840 -8.687 -6.757 1.00 . A A . 10 LEU HB2 1 1 8 2999 1 1 10 LEU HB3 H -3.278 -10.330 -7.182 1.00 . A A . 10 LEU HB3 1 1 8 3000 1 1 10 LEU HD11 H -4.050 -10.902 -9.344 1.00 . A A . 10 LEU HD11 1 1 8 3001 1 1 10 LEU HD12 H -5.021 -9.509 -9.877 1.00 . A A . 10 LEU HD12 1 1 8 3002 1 1 10 LEU HD13 H -3.530 -9.940 -10.748 1.00 . A A . 10 LEU HD13 1 1 8 3003 1 1 10 LEU HD21 H -3.186 -6.904 -8.288 1.00 . A A . 10 LEU HD21 1 1 8 3004 1 1 10 LEU HD22 H -2.789 -7.211 -9.995 1.00 . A A . 10 LEU HD22 1 1 8 3005 1 1 10 LEU HD23 H -4.473 -7.348 -9.434 1.00 . A A . 10 LEU HD23 1 1 8 3006 1 1 10 LEU HG H -2.149 -9.195 -9.023 1.00 . A A . 10 LEU HG 1 1 8 3007 1 1 10 LEU N N -4.965 -8.472 -5.577 1.00 . A A . 10 LEU N 1 1 8 3008 1 1 10 LEU O O -6.516 -10.490 -7.987 1.00 . A A . 10 LEU O 1 1 8 3009 1 1 11 LEU C C -8.008 -11.872 -5.205 1.00 . A A . 11 LEU C 1 1 8 3010 1 1 11 LEU CA C -6.644 -12.211 -5.808 1.00 . A A . 11 LEU CA 1 1 8 3011 1 1 11 LEU CB C -5.889 -13.303 -5.047 1.00 . A A . 11 LEU CB 1 1 8 3012 1 1 11 LEU CD1 C -5.542 -14.747 -7.086 1.00 . A A . 11 LEU CD1 1 1 8 3013 1 1 11 LEU CD2 C -3.672 -13.253 -6.247 1.00 . A A . 11 LEU CD2 1 1 8 3014 1 1 11 LEU CG C -4.878 -14.112 -5.863 1.00 . A A . 11 LEU CG 1 1 8 3015 1 1 11 LEU H H -5.301 -10.797 -5.074 1.00 . A A . 11 LEU H 1 1 8 3016 1 1 11 LEU HA H -6.796 -12.572 -6.825 1.00 . A A . 11 LEU HA 1 1 8 3017 1 1 11 LEU HB2 H -5.365 -12.841 -4.211 1.00 . A A . 11 LEU HB2 1 1 8 3018 1 1 11 LEU HB3 H -6.619 -13.993 -4.624 1.00 . A A . 11 LEU HB3 1 1 8 3019 1 1 11 LEU HD11 H -4.981 -15.632 -7.385 1.00 . A A . 11 LEU HD11 1 1 8 3020 1 1 11 LEU HD12 H -6.565 -15.031 -6.838 1.00 . A A . 11 LEU HD12 1 1 8 3021 1 1 11 LEU HD13 H -5.554 -14.029 -7.907 1.00 . A A . 11 LEU HD13 1 1 8 3022 1 1 11 LEU HD21 H -3.928 -12.628 -7.103 1.00 . A A . 11 LEU HD21 1 1 8 3023 1 1 11 LEU HD22 H -3.394 -12.619 -5.405 1.00 . A A . 11 LEU HD22 1 1 8 3024 1 1 11 LEU HD23 H -2.833 -13.899 -6.507 1.00 . A A . 11 LEU HD23 1 1 8 3025 1 1 11 LEU HG H -4.508 -14.925 -5.239 1.00 . A A . 11 LEU HG 1 1 8 3026 1 1 11 LEU N N -5.842 -11.002 -5.890 1.00 . A A . 11 LEU N 1 1 8 3027 1 1 11 LEU O O -8.739 -12.762 -4.773 1.00 . A A . 11 LEU O 1 1 8 3028 1 1 12 MET C C -10.237 -9.104 -5.582 1.00 . A A . 12 MET C 1 1 8 3029 1 1 12 MET CA C -9.572 -10.114 -4.644 1.00 . A A . 12 MET CA 1 1 8 3030 1 1 12 MET CB C -9.325 -9.460 -3.283 1.00 . A A . 12 MET CB 1 1 8 3031 1 1 12 MET CE C -10.231 -9.767 0.014 1.00 . A A . 12 MET CE 1 1 8 3032 1 1 12 MET CG C -8.881 -10.498 -2.249 1.00 . A A . 12 MET CG 1 1 8 3033 1 1 12 MET H H -7.713 -9.864 -5.550 1.00 . A A . 12 MET H 1 1 8 3034 1 1 12 MET HA H -10.198 -11.001 -4.551 1.00 . A A . 12 MET HA 1 1 8 3035 1 1 12 MET HB2 H -8.561 -8.689 -3.379 1.00 . A A . 12 MET HB2 1 1 8 3036 1 1 12 MET HB3 H -10.235 -8.968 -2.941 1.00 . A A . 12 MET HB3 1 1 8 3037 1 1 12 MET HE1 H -10.460 -10.788 0.319 1.00 . A A . 12 MET HE1 1 1 8 3038 1 1 12 MET HE2 H -10.286 -9.108 0.881 1.00 . A A . 12 MET HE2 1 1 8 3039 1 1 12 MET HE3 H -10.952 -9.441 -0.736 1.00 . A A . 12 MET HE3 1 1 8 3040 1 1 12 MET HG2 H -9.647 -11.266 -2.141 1.00 . A A . 12 MET HG2 1 1 8 3041 1 1 12 MET HG3 H -7.974 -10.998 -2.590 1.00 . A A . 12 MET HG3 1 1 8 3042 1 1 12 MET N N -8.311 -10.582 -5.194 1.00 . A A . 12 MET N 1 1 8 3043 1 1 12 MET O O -11.350 -9.331 -6.055 1.00 . A A . 12 MET O 1 1 8 3044 1 1 12 MET SD S -8.586 -9.706 -0.677 1.00 . A A . 12 MET SD 1 1 8 3045 1 1 13 THR C C -8.896 -6.194 -7.338 1.00 . A A . 13 THR C 1 1 8 3046 1 1 13 THR CA C -10.046 -6.956 -6.677 1.00 . A A . 13 THR CA 1 1 8 3047 1 1 13 THR CB C -10.958 -6.066 -5.831 1.00 . A A . 13 THR CB 1 1 8 3048 1 1 13 THR CG2 C -12.028 -5.361 -6.667 1.00 . A A . 13 THR CG2 1 1 8 3049 1 1 13 THR H H -8.619 -7.840 -5.443 1.00 . A A . 13 THR H 1 1 8 3050 1 1 13 THR HA H -10.626 -7.416 -7.477 1.00 . A A . 13 THR HA 1 1 8 3051 1 1 13 THR HB H -10.375 -5.345 -5.258 1.00 . A A . 13 THR HB 1 1 8 3052 1 1 13 THR HG1 H -11.302 -7.026 -4.109 1.00 . A A . 13 THR HG1 1 1 8 3053 1 1 13 THR HG21 H -12.632 -4.724 -6.022 1.00 . A A . 13 THR HG21 1 1 8 3054 1 1 13 THR HG22 H -11.548 -4.752 -7.433 1.00 . A A . 13 THR HG22 1 1 8 3055 1 1 13 THR HG23 H -12.666 -6.107 -7.143 1.00 . A A . 13 THR HG23 1 1 8 3056 1 1 13 THR N N -9.529 -8.011 -5.821 1.00 . A A . 13 THR N 1 1 8 3057 1 1 13 THR O O -8.024 -5.661 -6.653 1.00 . A A . 13 THR O 1 1 8 3058 1 1 13 THR OG1 O -11.693 -6.985 -5.028 1.00 . A A . 13 THR OG1 1 1 8 3059 1 1 14 PRO C C -8.091 -3.961 -9.388 1.00 . A A . 14 PRO C 1 1 8 3060 1 1 14 PRO CA C -7.903 -5.478 -9.459 1.00 . A A . 14 PRO CA 1 1 8 3061 1 1 14 PRO CB C -8.026 -6.026 -10.871 1.00 . A A . 14 PRO CB 1 1 8 3062 1 1 14 PRO CD C -9.948 -6.787 -9.542 1.00 . A A . 14 PRO CD 1 1 8 3063 1 1 14 PRO CG C -9.409 -6.651 -10.957 1.00 . A A . 14 PRO CG 1 1 8 3064 1 1 14 PRO HA H -7.001 -5.660 -9.068 1.00 . A A . 14 PRO HA 1 1 8 3065 1 1 14 PRO HB2 H -7.909 -5.233 -11.610 1.00 . A A . 14 PRO HB2 1 1 8 3066 1 1 14 PRO HB3 H -7.251 -6.765 -11.072 1.00 . A A . 14 PRO HB3 1 1 8 3067 1 1 14 PRO HD2 H -10.911 -6.287 -9.435 1.00 . A A . 14 PRO HD2 1 1 8 3068 1 1 14 PRO HD3 H -10.100 -7.832 -9.275 1.00 . A A . 14 PRO HD3 1 1 8 3069 1 1 14 PRO HG2 H -10.072 -6.030 -11.560 1.00 . A A . 14 PRO HG2 1 1 8 3070 1 1 14 PRO HG3 H -9.359 -7.626 -11.441 1.00 . A A . 14 PRO HG3 1 1 8 3071 1 1 14 PRO N N -8.931 -6.166 -8.698 1.00 . A A . 14 PRO N 1 1 8 3072 1 1 14 PRO O O -8.919 -3.470 -8.623 1.00 . A A . 14 PRO O 1 1 8 3073 1 1 15 PRO C C -8.622 -1.346 -11.037 1.00 . A A . 15 PRO C 1 1 8 3074 1 1 15 PRO CA C -7.374 -1.793 -10.274 1.00 . A A . 15 PRO CA 1 1 8 3075 1 1 15 PRO CB C -6.081 -1.348 -10.936 1.00 . A A . 15 PRO CB 1 1 8 3076 1 1 15 PRO CD C -6.282 -3.790 -11.124 1.00 . A A . 15 PRO CD 1 1 8 3077 1 1 15 PRO CG C -5.531 -2.575 -11.645 1.00 . A A . 15 PRO CG 1 1 8 3078 1 1 15 PRO HA H -7.468 -1.416 -9.352 1.00 . A A . 15 PRO HA 1 1 8 3079 1 1 15 PRO HB2 H -6.263 -0.538 -11.642 1.00 . A A . 15 PRO HB2 1 1 8 3080 1 1 15 PRO HB3 H -5.372 -0.973 -10.198 1.00 . A A . 15 PRO HB3 1 1 8 3081 1 1 15 PRO HD2 H -6.743 -4.350 -11.937 1.00 . A A . 15 PRO HD2 1 1 8 3082 1 1 15 PRO HD3 H -5.613 -4.475 -10.604 1.00 . A A . 15 PRO HD3 1 1 8 3083 1 1 15 PRO HG2 H -5.658 -2.482 -12.724 1.00 . A A . 15 PRO HG2 1 1 8 3084 1 1 15 PRO HG3 H -4.462 -2.677 -11.458 1.00 . A A . 15 PRO HG3 1 1 8 3085 1 1 15 PRO N N -7.289 -3.243 -10.219 1.00 . A A . 15 PRO N 1 1 8 3086 1 1 15 PRO O O -8.522 -0.627 -12.030 1.00 . A A . 15 PRO O 1 1 8 3087 1 1 16 VAL C C -11.255 0.069 -11.046 1.00 . A A . 16 VAL C 1 1 8 3088 1 1 16 VAL CA C -11.036 -1.440 -11.165 1.00 . A A . 16 VAL CA 1 1 8 3089 1 1 16 VAL CB C -12.168 -2.260 -10.542 1.00 . A A . 16 VAL CB 1 1 8 3090 1 1 16 VAL CG1 C -12.286 -1.980 -9.042 1.00 . A A . 16 VAL CG1 1 1 8 3091 1 1 16 VAL CG2 C -13.494 -1.993 -11.256 1.00 . A A . 16 VAL CG2 1 1 8 3092 1 1 16 VAL H H -9.841 -2.381 -9.741 1.00 . A A . 16 VAL H 1 1 8 3093 1 1 16 VAL HA H -10.970 -1.703 -12.220 1.00 . A A . 16 VAL HA 1 1 8 3094 1 1 16 VAL HB H -11.926 -3.315 -10.668 1.00 . A A . 16 VAL HB 1 1 8 3095 1 1 16 VAL HG11 H -12.888 -2.758 -8.574 1.00 . A A . 16 VAL HG11 1 1 8 3096 1 1 16 VAL HG12 H -11.292 -1.971 -8.595 1.00 . A A . 16 VAL HG12 1 1 8 3097 1 1 16 VAL HG13 H -12.762 -1.011 -8.890 1.00 . A A . 16 VAL HG13 1 1 8 3098 1 1 16 VAL HG21 H -13.358 -2.111 -12.331 1.00 . A A . 16 VAL HG21 1 1 8 3099 1 1 16 VAL HG22 H -14.245 -2.702 -10.905 1.00 . A A . 16 VAL HG22 1 1 8 3100 1 1 16 VAL HG23 H -13.825 -0.977 -11.041 1.00 . A A . 16 VAL HG23 1 1 8 3101 1 1 16 VAL N N -9.769 -1.791 -10.545 1.00 . A A . 16 VAL N 1 1 8 3102 1 1 16 VAL O O -11.584 0.731 -12.029 1.00 . A A . 16 VAL O 1 1 8 3103 1 1 17 ILE C C -10.396 2.786 -10.586 1.00 . A A . 17 ILE C 1 1 8 3104 1 1 17 ILE CA C -11.227 1.990 -9.577 1.00 . A A . 17 ILE CA 1 1 8 3105 1 1 17 ILE CB C -10.896 2.312 -8.118 1.00 . A A . 17 ILE CB 1 1 8 3106 1 1 17 ILE CD1 C -9.100 2.314 -6.347 1.00 . A A . 17 ILE CD1 1 1 8 3107 1 1 17 ILE CG1 C -9.447 1.943 -7.791 1.00 . A A . 17 ILE CG1 1 1 8 3108 1 1 17 ILE CG2 C -11.888 1.637 -7.169 1.00 . A A . 17 ILE CG2 1 1 8 3109 1 1 17 ILE H H -10.803 0.023 -9.039 1.00 . A A . 17 ILE H 1 1 8 3110 1 1 17 ILE HA H -12.279 2.231 -9.729 1.00 . A A . 17 ILE HA 1 1 8 3111 1 1 17 ILE HB H -10.994 3.388 -7.975 1.00 . A A . 17 ILE HB 1 1 8 3112 1 1 17 ILE HD11 H -8.018 2.393 -6.243 1.00 . A A . 17 ILE HD11 1 1 8 3113 1 1 17 ILE HD12 H -9.560 3.270 -6.097 1.00 . A A . 17 ILE HD12 1 1 8 3114 1 1 17 ILE HD13 H -9.474 1.543 -5.674 1.00 . A A . 17 ILE HD13 1 1 8 3115 1 1 17 ILE HG12 H -9.298 0.874 -7.941 1.00 . A A . 17 ILE HG12 1 1 8 3116 1 1 17 ILE HG13 H -8.773 2.458 -8.475 1.00 . A A . 17 ILE HG13 1 1 8 3117 1 1 17 ILE HG21 H -11.502 0.662 -6.873 1.00 . A A . 17 ILE HG21 1 1 8 3118 1 1 17 ILE HG22 H -12.023 2.258 -6.284 1.00 . A A . 17 ILE HG22 1 1 8 3119 1 1 17 ILE HG23 H -12.845 1.511 -7.674 1.00 . A A . 17 ILE HG23 1 1 8 3120 1 1 17 ILE N N -11.064 0.570 -9.834 1.00 . A A . 17 ILE N 1 1 8 3121 1 1 17 ILE O O -10.749 3.910 -10.937 1.00 . A A . 17 ILE O 1 1 8 3122 1 1 18 GLN C C -8.788 2.487 -13.396 1.00 . A A . 18 GLN C 1 1 8 3123 1 1 18 GLN CA C -8.402 2.823 -11.954 1.00 . A A . 18 GLN CA 1 1 8 3124 1 1 18 GLN CB C -6.950 2.433 -11.670 1.00 . A A . 18 GLN CB 1 1 8 3125 1 1 18 GLN CD C -5.146 2.293 -9.913 1.00 . A A . 18 GLN CD 1 1 8 3126 1 1 18 GLN CG C -6.558 2.789 -10.234 1.00 . A A . 18 GLN CG 1 1 8 3127 1 1 18 GLN H H -9.042 1.244 -10.755 1.00 . A A . 18 GLN H 1 1 8 3128 1 1 18 GLN HA H -8.526 3.891 -11.777 1.00 . A A . 18 GLN HA 1 1 8 3129 1 1 18 GLN HB2 H -6.818 1.363 -11.832 1.00 . A A . 18 GLN HB2 1 1 8 3130 1 1 18 GLN HB3 H -6.289 2.945 -12.369 1.00 . A A . 18 GLN HB3 1 1 8 3131 1 1 18 GLN HE21 H -5.941 1.110 -8.474 1.00 . A A . 18 GLN HE21 1 1 8 3132 1 1 18 GLN HE22 H -4.220 1.014 -8.646 1.00 . A A . 18 GLN HE22 1 1 8 3133 1 1 18 GLN HG2 H -6.607 3.869 -10.097 1.00 . A A . 18 GLN HG2 1 1 8 3134 1 1 18 GLN HG3 H -7.270 2.346 -9.538 1.00 . A A . 18 GLN HG3 1 1 8 3135 1 1 18 GLN N N -9.308 2.170 -11.024 1.00 . A A . 18 GLN N 1 1 8 3136 1 1 18 GLN NE2 N -5.098 1.398 -8.930 1.00 . A A . 18 GLN NE2 1 1 8 3137 1 1 18 GLN O O -8.734 3.347 -14.273 1.00 . A A . 18 GLN O 1 1 8 3138 1 1 18 GLN OE1 O -4.166 2.696 -10.517 1.00 . A A . 18 GLN OE1 1 1 8 3139 1 1 19 ALA C C -10.696 1.637 -15.446 1.00 . A A . 19 ALA C 1 1 8 3140 1 1 19 ALA CA C -9.552 0.770 -14.918 1.00 . A A . 19 ALA CA 1 1 8 3141 1 1 19 ALA CB C -9.926 -0.712 -14.852 1.00 . A A . 19 ALA CB 1 1 8 3142 1 1 19 ALA H H -9.217 0.542 -12.875 1.00 . A A . 19 ALA H 1 1 8 3143 1 1 19 ALA HA H -8.688 0.885 -15.574 1.00 . A A . 19 ALA HA 1 1 8 3144 1 1 19 ALA HB1 H -10.155 -1.075 -15.854 1.00 . A A . 19 ALA HB1 1 1 8 3145 1 1 19 ALA HB2 H -9.091 -1.280 -14.442 1.00 . A A . 19 ALA HB2 1 1 8 3146 1 1 19 ALA HB3 H -10.799 -0.837 -14.212 1.00 . A A . 19 ALA HB3 1 1 8 3147 1 1 19 ALA N N -9.168 1.233 -13.596 1.00 . A A . 19 ALA N 1 1 8 3148 1 1 19 ALA O O -10.620 2.165 -16.555 1.00 . A A . 19 ALA O 1 1 8 3149 1 1 20 ILE C C -12.527 3.985 -15.201 1.00 . A A . 20 ILE C 1 1 8 3150 1 1 20 ILE CA C -12.909 2.515 -15.016 1.00 . A A . 20 ILE CA 1 1 8 3151 1 1 20 ILE CB C -14.042 2.296 -14.012 1.00 . A A . 20 ILE CB 1 1 8 3152 1 1 20 ILE CD1 C -13.915 4.256 -12.430 1.00 . A A . 20 ILE CD1 1 1 8 3153 1 1 20 ILE CG1 C -13.633 2.764 -12.613 1.00 . A A . 20 ILE CG1 1 1 8 3154 1 1 20 ILE CG2 C -14.504 0.837 -14.016 1.00 . A A . 20 ILE CG2 1 1 8 3155 1 1 20 ILE H H -11.773 1.350 -13.715 1.00 . A A . 20 ILE H 1 1 8 3156 1 1 20 ILE HA H -13.247 2.122 -15.975 1.00 . A A . 20 ILE HA 1 1 8 3157 1 1 20 ILE HB H -14.893 2.904 -14.319 1.00 . A A . 20 ILE HB 1 1 8 3158 1 1 20 ILE HD11 H -13.001 4.764 -12.124 1.00 . A A . 20 ILE HD11 1 1 8 3159 1 1 20 ILE HD12 H -14.266 4.678 -13.372 1.00 . A A . 20 ILE HD12 1 1 8 3160 1 1 20 ILE HD13 H -14.680 4.391 -11.665 1.00 . A A . 20 ILE HD13 1 1 8 3161 1 1 20 ILE HG12 H -14.177 2.192 -11.861 1.00 . A A . 20 ILE HG12 1 1 8 3162 1 1 20 ILE HG13 H -12.572 2.568 -12.456 1.00 . A A . 20 ILE HG13 1 1 8 3163 1 1 20 ILE HG21 H -14.581 0.484 -15.044 1.00 . A A . 20 ILE HG21 1 1 8 3164 1 1 20 ILE HG22 H -13.782 0.226 -13.475 1.00 . A A . 20 ILE HG22 1 1 8 3165 1 1 20 ILE HG23 H -15.478 0.764 -13.532 1.00 . A A . 20 ILE HG23 1 1 8 3166 1 1 20 ILE N N -11.731 1.758 -14.627 1.00 . A A . 20 ILE N 1 1 8 3167 1 1 20 ILE O O -13.079 4.670 -16.061 1.00 . A A . 20 ILE O 1 1 8 3168 1 1 21 HIS C C -10.455 6.093 -15.756 1.00 . A A . 21 HIS C 1 1 8 3169 1 1 21 HIS CA C -11.146 5.811 -14.420 1.00 . A A . 21 HIS CA 1 1 8 3170 1 1 21 HIS CB C -10.262 6.136 -13.215 1.00 . A A . 21 HIS CB 1 1 8 3171 1 1 21 HIS CD2 C -8.240 7.781 -13.020 1.00 . A A . 21 HIS CD2 1 1 8 3172 1 1 21 HIS CE1 C -9.227 9.579 -13.783 1.00 . A A . 21 HIS CE1 1 1 8 3173 1 1 21 HIS CG C -9.527 7.450 -13.328 1.00 . A A . 21 HIS CG 1 1 8 3174 1 1 21 HIS H H -11.123 3.856 -13.701 1.00 . A A . 21 HIS H 1 1 8 3175 1 1 21 HIS HA H -12.044 6.425 -14.349 1.00 . A A . 21 HIS HA 1 1 8 3176 1 1 21 HIS HB2 H -10.881 6.154 -12.318 1.00 . A A . 21 HIS HB2 1 1 8 3177 1 1 21 HIS HB3 H -9.535 5.334 -13.084 1.00 . A A . 21 HIS HB3 1 1 8 3178 1 1 21 HIS HD1 H -11.071 8.687 -14.116 1.00 . A A . 21 HIS HD1 1 1 8 3179 1 1 21 HIS HD2 H -7.488 7.104 -12.616 1.00 . A A . 21 HIS HD2 1 1 8 3180 1 1 21 HIS HE1 H -9.393 10.609 -14.098 1.00 . A A . 21 HIS HE1 1 1 8 3181 1 1 21 HIS HE2 H -7.227 9.589 -13.116 1.00 . A A . 21 HIS HE2 1 1 8 3182 1 1 21 HIS N N -11.584 4.426 -14.381 1.00 . A A . 21 HIS N 1 1 8 3183 1 1 21 HIS ND1 N -10.124 8.604 -13.806 1.00 . A A . 21 HIS ND1 1 1 8 3184 1 1 21 HIS NE2 N -8.060 9.067 -13.296 1.00 . A A . 21 HIS NE2 1 1 8 3185 1 1 21 HIS O O -10.746 7.092 -16.411 1.00 . A A . 21 HIS O 1 1 8 3186 1 1 22 ASP C C -9.775 5.385 -18.535 1.00 . A A . 22 ASP C 1 1 8 3187 1 1 22 ASP CA C -8.802 5.344 -17.355 1.00 . A A . 22 ASP CA 1 1 8 3188 1 1 22 ASP CB C -7.850 4.166 -17.568 1.00 . A A . 22 ASP CB 1 1 8 3189 1 1 22 ASP CG C -6.521 4.521 -18.238 1.00 . A A . 22 ASP CG 1 1 8 3190 1 1 22 ASP H H -9.330 4.377 -15.587 1.00 . A A . 22 ASP H 1 1 8 3191 1 1 22 ASP HA H -8.246 6.274 -17.241 1.00 . A A . 22 ASP HA 1 1 8 3192 1 1 22 ASP HB2 H -7.641 3.708 -16.601 1.00 . A A . 22 ASP HB2 1 1 8 3193 1 1 22 ASP HB3 H -8.355 3.414 -18.174 1.00 . A A . 22 ASP HB3 1 1 8 3194 1 1 22 ASP N N -9.552 5.194 -16.119 1.00 . A A . 22 ASP N 1 1 8 3195 1 1 22 ASP O O -9.689 6.270 -19.385 1.00 . A A . 22 ASP O 1 1 8 3196 1 1 22 ASP OD1 O -5.703 5.181 -17.561 1.00 . A A . 22 ASP OD1 1 1 8 3197 1 1 22 ASP OD2 O -6.353 4.126 -19.411 1.00 . A A . 22 ASP OD2 1 1 8 3198 1 1 23 ALA C C -12.411 5.642 -19.739 1.00 . A A . 23 ALA C 1 1 8 3199 1 1 23 ALA CA C -11.654 4.318 -19.622 1.00 . A A . 23 ALA CA 1 1 8 3200 1 1 23 ALA CB C -12.586 3.134 -19.358 1.00 . A A . 23 ALA CB 1 1 8 3201 1 1 23 ALA H H -10.750 3.708 -17.847 1.00 . A A . 23 ALA H 1 1 8 3202 1 1 23 ALA HA H -11.110 4.137 -20.549 1.00 . A A . 23 ALA HA 1 1 8 3203 1 1 23 ALA HB1 H -13.148 3.312 -18.441 1.00 . A A . 23 ALA HB1 1 1 8 3204 1 1 23 ALA HB2 H -13.278 3.024 -20.193 1.00 . A A . 23 ALA HB2 1 1 8 3205 1 1 23 ALA HB3 H -11.997 2.224 -19.252 1.00 . A A . 23 ALA HB3 1 1 8 3206 1 1 23 ALA N N -10.679 4.416 -18.550 1.00 . A A . 23 ALA N 1 1 8 3207 1 1 23 ALA O O -12.729 6.084 -20.842 1.00 . A A . 23 ALA O 1 1 8 3208 1 1 24 GLN C C -12.466 8.646 -18.977 1.00 . A A . 24 GLN C 1 1 8 3209 1 1 24 GLN CA C -13.390 7.505 -18.546 1.00 . A A . 24 GLN CA 1 1 8 3210 1 1 24 GLN CB C -13.969 7.764 -17.154 1.00 . A A . 24 GLN CB 1 1 8 3211 1 1 24 GLN CD C -16.457 7.771 -17.566 1.00 . A A . 24 GLN CD 1 1 8 3212 1 1 24 GLN CG C -15.282 7.003 -16.957 1.00 . A A . 24 GLN CG 1 1 8 3213 1 1 24 GLN H H -12.418 5.871 -17.694 1.00 . A A . 24 GLN H 1 1 8 3214 1 1 24 GLN HA H -14.207 7.401 -19.260 1.00 . A A . 24 GLN HA 1 1 8 3215 1 1 24 GLN HB2 H -13.250 7.459 -16.394 1.00 . A A . 24 GLN HB2 1 1 8 3216 1 1 24 GLN HB3 H -14.140 8.832 -17.020 1.00 . A A . 24 GLN HB3 1 1 8 3217 1 1 24 GLN HE21 H -17.182 8.051 -15.696 1.00 . A A . 24 GLN HE21 1 1 8 3218 1 1 24 GLN HE22 H -18.133 8.739 -16.970 1.00 . A A . 24 GLN HE22 1 1 8 3219 1 1 24 GLN HG2 H -15.209 6.018 -17.418 1.00 . A A . 24 GLN HG2 1 1 8 3220 1 1 24 GLN HG3 H -15.459 6.845 -15.893 1.00 . A A . 24 GLN HG3 1 1 8 3221 1 1 24 GLN N N -12.678 6.238 -18.587 1.00 . A A . 24 GLN N 1 1 8 3222 1 1 24 GLN NE2 N -17.329 8.225 -16.670 1.00 . A A . 24 GLN NE2 1 1 8 3223 1 1 24 GLN O O -12.821 9.444 -19.843 1.00 . A A . 24 GLN O 1 1 8 3224 1 1 24 GLN OE1 O -16.565 7.940 -18.769 1.00 . A A . 24 GLN OE1 1 1 8 3225 1 1 25 ARG C C -9.867 9.603 -20.115 1.00 . A A . 25 ARG C 1 1 8 3226 1 1 25 ARG CA C -10.322 9.719 -18.659 1.00 . A A . 25 ARG CA 1 1 8 3227 1 1 25 ARG CB C -9.102 9.613 -17.741 1.00 . A A . 25 ARG CB 1 1 8 3228 1 1 25 ARG CD C -6.822 8.861 -18.513 1.00 . A A . 25 ARG CD 1 1 8 3229 1 1 25 ARG CG C -7.824 10.016 -18.479 1.00 . A A . 25 ARG CG 1 1 8 3230 1 1 25 ARG CZ C -6.617 6.965 -20.117 1.00 . A A . 25 ARG CZ 1 1 8 3231 1 1 25 ARG H H -11.017 8.035 -17.649 1.00 . A A . 25 ARG H 1 1 8 3232 1 1 25 ARG HA H -10.845 10.659 -18.484 1.00 . A A . 25 ARG HA 1 1 8 3233 1 1 25 ARG HB2 H -9.241 10.253 -16.870 1.00 . A A . 25 ARG HB2 1 1 8 3234 1 1 25 ARG HB3 H -9.007 8.591 -17.374 1.00 . A A . 25 ARG HB3 1 1 8 3235 1 1 25 ARG HD2 H -5.876 9.201 -18.933 1.00 . A A . 25 ARG HD2 1 1 8 3236 1 1 25 ARG HD3 H -6.616 8.517 -17.499 1.00 . A A . 25 ARG HD3 1 1 8 3237 1 1 25 ARG HE H -8.344 7.565 -19.276 1.00 . A A . 25 ARG HE 1 1 8 3238 1 1 25 ARG HG2 H -8.068 10.321 -19.497 1.00 . A A . 25 ARG HG2 1 1 8 3239 1 1 25 ARG HG3 H -7.373 10.879 -17.988 1.00 . A A . 25 ARG HG3 1 1 8 3240 1 1 25 ARG HH11 H -4.867 7.908 -19.690 1.00 . A A . 25 ARG HH11 1 1 8 3241 1 1 25 ARG HH12 H -4.741 6.588 -20.805 1.00 . A A . 25 ARG HH12 1 1 8 3242 1 1 25 ARG HH21 H -8.178 5.823 -20.746 1.00 . A A . 25 ARG HH21 1 1 8 3243 1 1 25 ARG HH22 H -6.637 5.394 -21.409 1.00 . A A . 25 ARG HH22 1 1 8 3244 1 1 25 ARG N N -11.298 8.688 -18.352 1.00 . A A . 25 ARG N 1 1 8 3245 1 1 25 ARG NE N -7.362 7.746 -19.324 1.00 . A A . 25 ARG NE 1 1 8 3246 1 1 25 ARG NH1 N -5.296 7.171 -20.212 1.00 . A A . 25 ARG NH1 1 1 8 3247 1 1 25 ARG NH2 N -7.193 5.977 -20.817 1.00 . A A . 25 ARG NH2 1 1 8 3248 1 1 25 ARG O O -9.721 8.499 -20.637 1.00 . A A . 25 ARG O 1 1 9 3249 1 1 1 PHE C C 1.131 0.000 -2.451 1.00 . A A . 1 PHE C 1 1 9 3250 1 1 1 PHE CA C 2.073 0.000 -1.245 1.00 . A A . 1 PHE CA 1 1 9 3251 1 1 1 PHE CB C 2.908 -1.282 -1.266 1.00 . A A . 1 PHE CB 1 1 9 3252 1 1 1 PHE CD1 C 5.276 -0.468 -1.234 1.00 . A A . 1 PHE CD1 1 1 9 3253 1 1 1 PHE CD2 C 4.525 -1.617 -3.148 1.00 . A A . 1 PHE CD2 1 1 9 3254 1 1 1 PHE CE1 C 6.557 -0.314 -1.828 1.00 . A A . 1 PHE CE1 1 1 9 3255 1 1 1 PHE CE2 C 5.806 -1.463 -3.743 1.00 . A A . 1 PHE CE2 1 1 9 3256 1 1 1 PHE CG C 4.288 -1.116 -1.906 1.00 . A A . 1 PHE CG 1 1 9 3257 1 1 1 PHE CZ C 6.794 -0.815 -3.070 1.00 . A A . 1 PHE CZ 1 1 9 3258 1 1 1 PHE H1 H 1.884 0.000 0.829 1.00 . A A . 1 PHE H1 1 1 9 3259 1 1 1 PHE HA H 2.678 0.907 -1.259 1.00 . A A . 1 PHE HA 1 1 9 3260 1 1 1 PHE HB2 H 3.034 -1.638 -0.243 1.00 . A A . 1 PHE HB2 1 1 9 3261 1 1 1 PHE HB3 H 2.359 -2.053 -1.806 1.00 . A A . 1 PHE HB3 1 1 9 3262 1 1 1 PHE HD1 H 5.086 -0.066 -0.238 1.00 . A A . 1 PHE HD1 1 1 9 3263 1 1 1 PHE HD2 H 3.733 -2.137 -3.687 1.00 . A A . 1 PHE HD2 1 1 9 3264 1 1 1 PHE HE1 H 7.349 0.206 -1.289 1.00 . A A . 1 PHE HE1 1 1 9 3265 1 1 1 PHE HE2 H 5.996 -1.864 -4.738 1.00 . A A . 1 PHE HE2 1 1 9 3266 1 1 1 PHE HZ H 7.777 -0.697 -3.527 1.00 . A A . 1 PHE HZ 1 1 9 3267 1 1 1 PHE N N 1.325 0.000 0.000 1.00 . A A . 1 PHE N 1 1 9 3268 1 1 1 PHE O O -0.088 -0.029 -2.291 1.00 . A A . 1 PHE O 1 1 9 3269 1 1 2 LEU C C 1.090 -1.349 -5.529 1.00 . A A . 2 LEU C 1 1 9 3270 1 1 2 LEU CA C 0.963 0.023 -4.864 1.00 . A A . 2 LEU CA 1 1 9 3271 1 1 2 LEU CB C 1.382 1.185 -5.766 1.00 . A A . 2 LEU CB 1 1 9 3272 1 1 2 LEU CD1 C -0.738 1.412 -7.112 1.00 . A A . 2 LEU CD1 1 1 9 3273 1 1 2 LEU CD2 C 1.467 2.233 -8.059 1.00 . A A . 2 LEU CD2 1 1 9 3274 1 1 2 LEU CG C 0.775 1.197 -7.171 1.00 . A A . 2 LEU CG 1 1 9 3275 1 1 2 LEU H H 2.725 0.066 -3.753 1.00 . A A . 2 LEU H 1 1 9 3276 1 1 2 LEU HA H -0.082 0.183 -4.598 1.00 . A A . 2 LEU HA 1 1 9 3277 1 1 2 LEU HB2 H 1.117 2.119 -5.270 1.00 . A A . 2 LEU HB2 1 1 9 3278 1 1 2 LEU HB3 H 2.468 1.172 -5.861 1.00 . A A . 2 LEU HB3 1 1 9 3279 1 1 2 LEU HD11 H -1.206 0.568 -6.604 1.00 . A A . 2 LEU HD11 1 1 9 3280 1 1 2 LEU HD12 H -0.954 2.330 -6.566 1.00 . A A . 2 LEU HD12 1 1 9 3281 1 1 2 LEU HD13 H -1.134 1.490 -8.125 1.00 . A A . 2 LEU HD13 1 1 9 3282 1 1 2 LEU HD21 H 0.977 2.263 -9.032 1.00 . A A . 2 LEU HD21 1 1 9 3283 1 1 2 LEU HD22 H 1.403 3.214 -7.590 1.00 . A A . 2 LEU HD22 1 1 9 3284 1 1 2 LEU HD23 H 2.515 1.959 -8.188 1.00 . A A . 2 LEU HD23 1 1 9 3285 1 1 2 LEU HG H 0.944 0.220 -7.624 1.00 . A A . 2 LEU HG 1 1 9 3286 1 1 2 LEU N N 1.733 0.033 -3.631 1.00 . A A . 2 LEU N 1 1 9 3287 1 1 2 LEU O O 0.128 -2.113 -5.571 1.00 . A A . 2 LEU O 1 1 9 3288 1 1 3 PRO C C 2.695 -4.035 -5.733 1.00 . A A . 3 PRO C 1 1 9 3289 1 1 3 PRO CA C 2.575 -2.881 -6.730 1.00 . A A . 3 PRO CA 1 1 9 3290 1 1 3 PRO CB C 3.852 -2.643 -7.520 1.00 . A A . 3 PRO CB 1 1 9 3291 1 1 3 PRO CD C 3.488 -0.755 -5.990 1.00 . A A . 3 PRO CD 1 1 9 3292 1 1 3 PRO CG C 4.512 -1.428 -6.888 1.00 . A A . 3 PRO CG 1 1 9 3293 1 1 3 PRO HA H 1.808 -3.114 -7.327 1.00 . A A . 3 PRO HA 1 1 9 3294 1 1 3 PRO HB2 H 4.507 -3.512 -7.474 1.00 . A A . 3 PRO HB2 1 1 9 3295 1 1 3 PRO HB3 H 3.632 -2.465 -8.573 1.00 . A A . 3 PRO HB3 1 1 9 3296 1 1 3 PRO HD2 H 3.860 -0.656 -4.970 1.00 . A A . 3 PRO HD2 1 1 9 3297 1 1 3 PRO HD3 H 3.251 0.249 -6.342 1.00 . A A . 3 PRO HD3 1 1 9 3298 1 1 3 PRO HG2 H 5.388 -1.727 -6.312 1.00 . A A . 3 PRO HG2 1 1 9 3299 1 1 3 PRO HG3 H 4.857 -0.738 -7.658 1.00 . A A . 3 PRO HG3 1 1 9 3300 1 1 3 PRO N N 2.317 -1.626 -6.045 1.00 . A A . 3 PRO N 1 1 9 3301 1 1 3 PRO O O 2.042 -5.066 -5.889 1.00 . A A . 3 PRO O 1 1 9 3302 1 1 4 LEU C C 2.444 -5.214 -3.058 1.00 . A A . 4 LEU C 1 1 9 3303 1 1 4 LEU CA C 3.771 -4.845 -3.724 1.00 . A A . 4 LEU CA 1 1 9 3304 1 1 4 LEU CB C 4.847 -4.386 -2.737 1.00 . A A . 4 LEU CB 1 1 9 3305 1 1 4 LEU CD1 C 5.085 -6.629 -1.610 1.00 . A A . 4 LEU CD1 1 1 9 3306 1 1 4 LEU CD2 C 6.726 -5.927 -3.412 1.00 . A A . 4 LEU CD2 1 1 9 3307 1 1 4 LEU CG C 5.826 -5.463 -2.265 1.00 . A A . 4 LEU CG 1 1 9 3308 1 1 4 LEU H H 4.049 -2.976 -4.601 1.00 . A A . 4 LEU H 1 1 9 3309 1 1 4 LEU HA H 4.158 -5.726 -4.236 1.00 . A A . 4 LEU HA 1 1 9 3310 1 1 4 LEU HB2 H 5.418 -3.582 -3.201 1.00 . A A . 4 LEU HB2 1 1 9 3311 1 1 4 LEU HB3 H 4.353 -3.964 -1.862 1.00 . A A . 4 LEU HB3 1 1 9 3312 1 1 4 LEU HD11 H 4.351 -6.242 -0.902 1.00 . A A . 4 LEU HD11 1 1 9 3313 1 1 4 LEU HD12 H 4.577 -7.214 -2.377 1.00 . A A . 4 LEU HD12 1 1 9 3314 1 1 4 LEU HD13 H 5.798 -7.263 -1.083 1.00 . A A . 4 LEU HD13 1 1 9 3315 1 1 4 LEU HD21 H 7.601 -6.433 -3.006 1.00 . A A . 4 LEU HD21 1 1 9 3316 1 1 4 LEU HD22 H 6.172 -6.615 -4.052 1.00 . A A . 4 LEU HD22 1 1 9 3317 1 1 4 LEU HD23 H 7.044 -5.064 -3.996 1.00 . A A . 4 LEU HD23 1 1 9 3318 1 1 4 LEU HG H 6.474 -5.026 -1.505 1.00 . A A . 4 LEU HG 1 1 9 3319 1 1 4 LEU N N 3.535 -3.824 -4.730 1.00 . A A . 4 LEU N 1 1 9 3320 1 1 4 LEU O O 2.256 -6.352 -2.630 1.00 . A A . 4 LEU O 1 1 9 3321 1 1 5 LEU C C -0.658 -5.173 -3.346 1.00 . A A . 5 LEU C 1 1 9 3322 1 1 5 LEU CA C 0.260 -4.434 -2.370 1.00 . A A . 5 LEU CA 1 1 9 3323 1 1 5 LEU CB C -0.311 -3.104 -1.876 1.00 . A A . 5 LEU CB 1 1 9 3324 1 1 5 LEU CD1 C -2.232 -4.066 -0.555 1.00 . A A . 5 LEU CD1 1 1 9 3325 1 1 5 LEU CD2 C -0.038 -3.521 0.596 1.00 . A A . 5 LEU CD2 1 1 9 3326 1 1 5 LEU CG C -1.015 -3.139 -0.518 1.00 . A A . 5 LEU CG 1 1 9 3327 1 1 5 LEU H H 1.714 -3.312 -3.354 1.00 . A A . 5 LEU H 1 1 9 3328 1 1 5 LEU HA H 0.412 -5.065 -1.495 1.00 . A A . 5 LEU HA 1 1 9 3329 1 1 5 LEU HB2 H 0.502 -2.380 -1.822 1.00 . A A . 5 LEU HB2 1 1 9 3330 1 1 5 LEU HB3 H -1.017 -2.735 -2.620 1.00 . A A . 5 LEU HB3 1 1 9 3331 1 1 5 LEU HD11 H -2.873 -3.859 0.302 1.00 . A A . 5 LEU HD11 1 1 9 3332 1 1 5 LEU HD12 H -2.790 -3.896 -1.476 1.00 . A A . 5 LEU HD12 1 1 9 3333 1 1 5 LEU HD13 H -1.900 -5.104 -0.519 1.00 . A A . 5 LEU HD13 1 1 9 3334 1 1 5 LEU HD21 H -0.360 -3.065 1.533 1.00 . A A . 5 LEU HD21 1 1 9 3335 1 1 5 LEU HD22 H -0.019 -4.605 0.708 1.00 . A A . 5 LEU HD22 1 1 9 3336 1 1 5 LEU HD23 H 0.960 -3.164 0.342 1.00 . A A . 5 LEU HD23 1 1 9 3337 1 1 5 LEU HG H -1.381 -2.137 -0.296 1.00 . A A . 5 LEU HG 1 1 9 3338 1 1 5 LEU N N 1.558 -4.232 -2.992 1.00 . A A . 5 LEU N 1 1 9 3339 1 1 5 LEU O O -1.201 -6.226 -3.017 1.00 . A A . 5 LEU O 1 1 9 3340 1 1 6 ILE C C -1.117 -6.570 -5.908 1.00 . A A . 6 ILE C 1 1 9 3341 1 1 6 ILE CA C -1.648 -5.180 -5.553 1.00 . A A . 6 ILE CA 1 1 9 3342 1 1 6 ILE CB C -1.766 -4.241 -6.755 1.00 . A A . 6 ILE CB 1 1 9 3343 1 1 6 ILE CD1 C 0.025 -4.285 -8.531 1.00 . A A . 6 ILE CD1 1 1 9 3344 1 1 6 ILE CG1 C -0.392 -3.713 -7.175 1.00 . A A . 6 ILE CG1 1 1 9 3345 1 1 6 ILE CG2 C -2.753 -3.107 -6.471 1.00 . A A . 6 ILE CG2 1 1 9 3346 1 1 6 ILE H H -0.359 -3.734 -4.788 1.00 . A A . 6 ILE H 1 1 9 3347 1 1 6 ILE HA H -2.647 -5.289 -5.131 1.00 . A A . 6 ILE HA 1 1 9 3348 1 1 6 ILE HB H -2.162 -4.810 -7.596 1.00 . A A . 6 ILE HB 1 1 9 3349 1 1 6 ILE HD11 H -0.709 -5.024 -8.854 1.00 . A A . 6 ILE HD11 1 1 9 3350 1 1 6 ILE HD12 H 0.078 -3.481 -9.264 1.00 . A A . 6 ILE HD12 1 1 9 3351 1 1 6 ILE HD13 H 1.002 -4.759 -8.440 1.00 . A A . 6 ILE HD13 1 1 9 3352 1 1 6 ILE HG12 H -0.418 -2.625 -7.227 1.00 . A A . 6 ILE HG12 1 1 9 3353 1 1 6 ILE HG13 H 0.349 -3.978 -6.421 1.00 . A A . 6 ILE HG13 1 1 9 3354 1 1 6 ILE HG21 H -2.355 -2.467 -5.684 1.00 . A A . 6 ILE HG21 1 1 9 3355 1 1 6 ILE HG22 H -2.902 -2.520 -7.377 1.00 . A A . 6 ILE HG22 1 1 9 3356 1 1 6 ILE HG23 H -3.706 -3.528 -6.150 1.00 . A A . 6 ILE HG23 1 1 9 3357 1 1 6 ILE N N -0.804 -4.591 -4.527 1.00 . A A . 6 ILE N 1 1 9 3358 1 1 6 ILE O O -1.894 -7.497 -6.132 1.00 . A A . 6 ILE O 1 1 9 3359 1 1 7 LEU C C 0.559 -8.956 -5.190 1.00 . A A . 7 LEU C 1 1 9 3360 1 1 7 LEU CA C 0.847 -7.929 -6.287 1.00 . A A . 7 LEU CA 1 1 9 3361 1 1 7 LEU CB C 2.339 -7.714 -6.550 1.00 . A A . 7 LEU CB 1 1 9 3362 1 1 7 LEU CD1 C 2.673 -9.413 -8.382 1.00 . A A . 7 LEU CD1 1 1 9 3363 1 1 7 LEU CD2 C 4.633 -8.684 -6.946 1.00 . A A . 7 LEU CD2 1 1 9 3364 1 1 7 LEU CG C 3.126 -8.947 -6.998 1.00 . A A . 7 LEU CG 1 1 9 3365 1 1 7 LEU H H 0.828 -5.915 -5.755 1.00 . A A . 7 LEU H 1 1 9 3366 1 1 7 LEU HA H 0.404 -8.283 -7.217 1.00 . A A . 7 LEU HA 1 1 9 3367 1 1 7 LEU HB2 H 2.446 -6.942 -7.312 1.00 . A A . 7 LEU HB2 1 1 9 3368 1 1 7 LEU HB3 H 2.796 -7.326 -5.639 1.00 . A A . 7 LEU HB3 1 1 9 3369 1 1 7 LEU HD11 H 1.701 -9.900 -8.301 1.00 . A A . 7 LEU HD11 1 1 9 3370 1 1 7 LEU HD12 H 2.595 -8.554 -9.048 1.00 . A A . 7 LEU HD12 1 1 9 3371 1 1 7 LEU HD13 H 3.400 -10.119 -8.784 1.00 . A A . 7 LEU HD13 1 1 9 3372 1 1 7 LEU HD21 H 4.930 -8.475 -5.918 1.00 . A A . 7 LEU HD21 1 1 9 3373 1 1 7 LEU HD22 H 5.167 -9.563 -7.307 1.00 . A A . 7 LEU HD22 1 1 9 3374 1 1 7 LEU HD23 H 4.874 -7.828 -7.576 1.00 . A A . 7 LEU HD23 1 1 9 3375 1 1 7 LEU HG H 2.917 -9.758 -6.300 1.00 . A A . 7 LEU HG 1 1 9 3376 1 1 7 LEU N N 0.203 -6.671 -5.948 1.00 . A A . 7 LEU N 1 1 9 3377 1 1 7 LEU O O 0.169 -10.086 -5.480 1.00 . A A . 7 LEU O 1 1 9 3378 1 1 8 GLY C C -0.905 -9.945 -2.831 1.00 . A A . 8 GLY C 1 1 9 3379 1 1 8 GLY CA C 0.522 -9.393 -2.811 1.00 . A A . 8 GLY CA 1 1 9 3380 1 1 8 GLY H H 1.081 -7.607 -3.726 1.00 . A A . 8 GLY H 1 1 9 3381 1 1 8 GLY HA2 H 1.235 -10.218 -2.821 1.00 . A A . 8 GLY HA2 1 1 9 3382 1 1 8 GLY HA3 H 0.689 -8.839 -1.888 1.00 . A A . 8 GLY HA3 1 1 9 3383 1 1 8 GLY N N 0.761 -8.527 -3.953 1.00 . A A . 8 GLY N 1 1 9 3384 1 1 8 GLY O O -1.127 -11.112 -2.513 1.00 . A A . 8 GLY O 1 1 9 3385 1 1 9 SER C C -3.586 -9.902 -4.700 1.00 . A A . 9 SER C 1 1 9 3386 1 1 9 SER CA C -3.233 -9.466 -3.276 1.00 . A A . 9 SER CA 1 1 9 3387 1 1 9 SER CB C -4.145 -8.321 -2.830 1.00 . A A . 9 SER CB 1 1 9 3388 1 1 9 SER H H -1.646 -8.131 -3.461 1.00 . A A . 9 SER H 1 1 9 3389 1 1 9 SER HA H -3.336 -10.302 -2.584 1.00 . A A . 9 SER HA 1 1 9 3390 1 1 9 SER HB2 H -3.781 -7.915 -1.886 1.00 . A A . 9 SER HB2 1 1 9 3391 1 1 9 SER HB3 H -4.099 -7.515 -3.562 1.00 . A A . 9 SER HB3 1 1 9 3392 1 1 9 SER HG H -6.028 -8.030 -2.220 1.00 . A A . 9 SER HG 1 1 9 3393 1 1 9 SER N N -1.835 -9.079 -3.207 1.00 . A A . 9 SER N 1 1 9 3394 1 1 9 SER O O -4.746 -9.836 -5.103 1.00 . A A . 9 SER O 1 1 9 3395 1 1 9 SER OG O -5.497 -8.744 -2.675 1.00 . A A . 9 SER OG 1 1 9 3396 1 1 10 LEU C C -2.539 -12.297 -6.865 1.00 . A A . 10 LEU C 1 1 9 3397 1 1 10 LEU CA C -2.751 -10.783 -6.791 1.00 . A A . 10 LEU CA 1 1 9 3398 1 1 10 LEU CB C -1.851 -9.990 -7.741 1.00 . A A . 10 LEU CB 1 1 9 3399 1 1 10 LEU CD1 C -3.079 -10.501 -9.883 1.00 . A A . 10 LEU CD1 1 1 9 3400 1 1 10 LEU CD2 C -3.621 -8.398 -8.573 1.00 . A A . 10 LEU CD2 1 1 9 3401 1 1 10 LEU CG C -2.535 -9.397 -8.975 1.00 . A A . 10 LEU CG 1 1 9 3402 1 1 10 LEU H H -1.624 -10.389 -5.085 1.00 . A A . 10 LEU H 1 1 9 3403 1 1 10 LEU HA H -3.783 -10.565 -7.068 1.00 . A A . 10 LEU HA 1 1 9 3404 1 1 10 LEU HB2 H -1.392 -9.176 -7.179 1.00 . A A . 10 LEU HB2 1 1 9 3405 1 1 10 LEU HB3 H -1.044 -10.642 -8.075 1.00 . A A . 10 LEU HB3 1 1 9 3406 1 1 10 LEU HD11 H -3.469 -10.058 -10.799 1.00 . A A . 10 LEU HD11 1 1 9 3407 1 1 10 LEU HD12 H -2.278 -11.198 -10.128 1.00 . A A . 10 LEU HD12 1 1 9 3408 1 1 10 LEU HD13 H -3.879 -11.034 -9.368 1.00 . A A . 10 LEU HD13 1 1 9 3409 1 1 10 LEU HD21 H -3.547 -8.190 -7.505 1.00 . A A . 10 LEU HD21 1 1 9 3410 1 1 10 LEU HD22 H -3.488 -7.472 -9.133 1.00 . A A . 10 LEU HD22 1 1 9 3411 1 1 10 LEU HD23 H -4.602 -8.818 -8.794 1.00 . A A . 10 LEU HD23 1 1 9 3412 1 1 10 LEU HG H -1.788 -8.848 -9.548 1.00 . A A . 10 LEU HG 1 1 9 3413 1 1 10 LEU N N -2.564 -10.338 -5.421 1.00 . A A . 10 LEU N 1 1 9 3414 1 1 10 LEU O O -1.404 -12.770 -6.839 1.00 . A A . 10 LEU O 1 1 9 3415 1 1 11 LEU C C -4.918 -14.987 -7.601 1.00 . A A . 11 LEU C 1 1 9 3416 1 1 11 LEU CA C -3.600 -14.464 -7.026 1.00 . A A . 11 LEU CA 1 1 9 3417 1 1 11 LEU CB C -3.247 -15.057 -5.661 1.00 . A A . 11 LEU CB 1 1 9 3418 1 1 11 LEU CD1 C -1.860 -17.036 -6.383 1.00 . A A . 11 LEU CD1 1 1 9 3419 1 1 11 LEU CD2 C -3.086 -17.079 -4.162 1.00 . A A . 11 LEU CD2 1 1 9 3420 1 1 11 LEU CG C -3.098 -16.579 -5.608 1.00 . A A . 11 LEU CG 1 1 9 3421 1 1 11 LEU H H -4.569 -12.621 -6.977 1.00 . A A . 11 LEU H 1 1 9 3422 1 1 11 LEU HA H -2.795 -14.730 -7.711 1.00 . A A . 11 LEU HA 1 1 9 3423 1 1 11 LEU HB2 H -2.312 -14.608 -5.323 1.00 . A A . 11 LEU HB2 1 1 9 3424 1 1 11 LEU HB3 H -4.017 -14.762 -4.948 1.00 . A A . 11 LEU HB3 1 1 9 3425 1 1 11 LEU HD11 H -2.072 -17.013 -7.452 1.00 . A A . 11 LEU HD11 1 1 9 3426 1 1 11 LEU HD12 H -1.027 -16.368 -6.164 1.00 . A A . 11 LEU HD12 1 1 9 3427 1 1 11 LEU HD13 H -1.600 -18.051 -6.086 1.00 . A A . 11 LEU HD13 1 1 9 3428 1 1 11 LEU HD21 H -3.126 -18.168 -4.154 1.00 . A A . 11 LEU HD21 1 1 9 3429 1 1 11 LEU HD22 H -2.172 -16.746 -3.670 1.00 . A A . 11 LEU HD22 1 1 9 3430 1 1 11 LEU HD23 H -3.950 -16.679 -3.632 1.00 . A A . 11 LEU HD23 1 1 9 3431 1 1 11 LEU HG H -3.965 -17.024 -6.095 1.00 . A A . 11 LEU HG 1 1 9 3432 1 1 11 LEU N N -3.650 -13.014 -6.954 1.00 . A A . 11 LEU N 1 1 9 3433 1 1 11 LEU O O -4.943 -15.542 -8.699 1.00 . A A . 11 LEU O 1 1 9 3434 1 1 12 MET C C -8.195 -14.071 -7.622 1.00 . A A . 12 MET C 1 1 9 3435 1 1 12 MET CA C -7.296 -15.251 -7.247 1.00 . A A . 12 MET CA 1 1 9 3436 1 1 12 MET CB C -7.941 -16.043 -6.108 1.00 . A A . 12 MET CB 1 1 9 3437 1 1 12 MET CE C -9.301 -19.048 -5.377 1.00 . A A . 12 MET CE 1 1 9 3438 1 1 12 MET CG C -7.204 -17.364 -5.873 1.00 . A A . 12 MET CG 1 1 9 3439 1 1 12 MET H H -5.952 -14.331 -5.947 1.00 . A A . 12 MET H 1 1 9 3440 1 1 12 MET HA H -7.126 -15.880 -8.121 1.00 . A A . 12 MET HA 1 1 9 3441 1 1 12 MET HB2 H -7.929 -15.448 -5.194 1.00 . A A . 12 MET HB2 1 1 9 3442 1 1 12 MET HB3 H -8.986 -16.243 -6.345 1.00 . A A . 12 MET HB3 1 1 9 3443 1 1 12 MET HE1 H -9.928 -18.293 -5.853 1.00 . A A . 12 MET HE1 1 1 9 3444 1 1 12 MET HE2 H -8.900 -19.718 -6.137 1.00 . A A . 12 MET HE2 1 1 9 3445 1 1 12 MET HE3 H -9.898 -19.620 -4.666 1.00 . A A . 12 MET HE3 1 1 9 3446 1 1 12 MET HG2 H -7.234 -17.972 -6.776 1.00 . A A . 12 MET HG2 1 1 9 3447 1 1 12 MET HG3 H -6.154 -17.170 -5.653 1.00 . A A . 12 MET HG3 1 1 9 3448 1 1 12 MET N N -5.980 -14.792 -6.834 1.00 . A A . 12 MET N 1 1 9 3449 1 1 12 MET O O -8.812 -14.070 -8.686 1.00 . A A . 12 MET O 1 1 9 3450 1 1 12 MET SD S -7.956 -18.249 -4.517 1.00 . A A . 12 MET SD 1 1 9 3451 1 1 13 THR C C -8.440 -10.694 -6.284 1.00 . A A . 13 THR C 1 1 9 3452 1 1 13 THR CA C -9.073 -11.923 -6.939 1.00 . A A . 13 THR CA 1 1 9 3453 1 1 13 THR CB C -10.475 -12.238 -6.415 1.00 . A A . 13 THR CB 1 1 9 3454 1 1 13 THR CG2 C -11.510 -11.199 -6.852 1.00 . A A . 13 THR CG2 1 1 9 3455 1 1 13 THR H H -7.723 -13.096 -5.871 1.00 . A A . 13 THR H 1 1 9 3456 1 1 13 THR HA H -9.120 -11.725 -8.010 1.00 . A A . 13 THR HA 1 1 9 3457 1 1 13 THR HB H -10.469 -12.349 -5.330 1.00 . A A . 13 THR HB 1 1 9 3458 1 1 13 THR HG1 H -10.830 -14.205 -6.499 1.00 . A A . 13 THR HG1 1 1 9 3459 1 1 13 THR HG21 H -11.535 -11.147 -7.940 1.00 . A A . 13 THR HG21 1 1 9 3460 1 1 13 THR HG22 H -12.493 -11.487 -6.479 1.00 . A A . 13 THR HG22 1 1 9 3461 1 1 13 THR HG23 H -11.239 -10.224 -6.447 1.00 . A A . 13 THR HG23 1 1 9 3462 1 1 13 THR N N -8.240 -13.095 -6.727 1.00 . A A . 13 THR N 1 1 9 3463 1 1 13 THR O O -7.982 -10.761 -5.144 1.00 . A A . 13 THR O 1 1 9 3464 1 1 13 THR OG1 O -10.851 -13.419 -7.117 1.00 . A A . 13 THR OG1 1 1 9 3465 1 1 14 PRO C C -8.792 -7.668 -5.536 1.00 . A A . 14 PRO C 1 1 9 3466 1 1 14 PRO CA C -7.865 -8.330 -6.558 1.00 . A A . 14 PRO CA 1 1 9 3467 1 1 14 PRO CB C -7.644 -7.478 -7.798 1.00 . A A . 14 PRO CB 1 1 9 3468 1 1 14 PRO CD C -8.971 -9.455 -8.405 1.00 . A A . 14 PRO CD 1 1 9 3469 1 1 14 PRO CG C -8.522 -8.083 -8.881 1.00 . A A . 14 PRO CG 1 1 9 3470 1 1 14 PRO HA H -7.009 -8.509 -6.074 1.00 . A A . 14 PRO HA 1 1 9 3471 1 1 14 PRO HB2 H -7.914 -6.439 -7.611 1.00 . A A . 14 PRO HB2 1 1 9 3472 1 1 14 PRO HB3 H -6.595 -7.486 -8.095 1.00 . A A . 14 PRO HB3 1 1 9 3473 1 1 14 PRO HD2 H -10.057 -9.540 -8.409 1.00 . A A . 14 PRO HD2 1 1 9 3474 1 1 14 PRO HD3 H -8.586 -10.244 -9.052 1.00 . A A . 14 PRO HD3 1 1 9 3475 1 1 14 PRO HG2 H -9.384 -7.445 -9.074 1.00 . A A . 14 PRO HG2 1 1 9 3476 1 1 14 PRO HG3 H -7.970 -8.166 -9.817 1.00 . A A . 14 PRO HG3 1 1 9 3477 1 1 14 PRO N N -8.435 -9.572 -7.052 1.00 . A A . 14 PRO N 1 1 9 3478 1 1 14 PRO O O -9.899 -8.148 -5.296 1.00 . A A . 14 PRO O 1 1 9 3479 1 1 15 PRO C C -10.183 -5.009 -4.626 1.00 . A A . 15 PRO C 1 1 9 3480 1 1 15 PRO CA C -9.066 -5.815 -3.960 1.00 . A A . 15 PRO CA 1 1 9 3481 1 1 15 PRO CB C -8.053 -4.942 -3.237 1.00 . A A . 15 PRO CB 1 1 9 3482 1 1 15 PRO CD C -6.985 -5.954 -5.205 1.00 . A A . 15 PRO CD 1 1 9 3483 1 1 15 PRO CG C -6.838 -4.872 -4.148 1.00 . A A . 15 PRO CG 1 1 9 3484 1 1 15 PRO HA H -9.522 -6.449 -3.335 1.00 . A A . 15 PRO HA 1 1 9 3485 1 1 15 PRO HB2 H -8.458 -3.948 -3.049 1.00 . A A . 15 PRO HB2 1 1 9 3486 1 1 15 PRO HB3 H -7.791 -5.368 -2.268 1.00 . A A . 15 PRO HB3 1 1 9 3487 1 1 15 PRO HD2 H -6.931 -5.536 -6.210 1.00 . A A . 15 PRO HD2 1 1 9 3488 1 1 15 PRO HD3 H -6.190 -6.696 -5.125 1.00 . A A . 15 PRO HD3 1 1 9 3489 1 1 15 PRO HG2 H -6.768 -3.889 -4.615 1.00 . A A . 15 PRO HG2 1 1 9 3490 1 1 15 PRO HG3 H -5.923 -5.019 -3.575 1.00 . A A . 15 PRO HG3 1 1 9 3491 1 1 15 PRO N N -8.293 -6.549 -4.947 1.00 . A A . 15 PRO N 1 1 9 3492 1 1 15 PRO O O -10.221 -3.784 -4.514 1.00 . A A . 15 PRO O 1 1 9 3493 1 1 16 VAL C C -12.976 -4.257 -4.984 1.00 . A A . 16 VAL C 1 1 9 3494 1 1 16 VAL CA C -12.181 -5.095 -5.986 1.00 . A A . 16 VAL CA 1 1 9 3495 1 1 16 VAL CB C -13.033 -6.154 -6.689 1.00 . A A . 16 VAL CB 1 1 9 3496 1 1 16 VAL CG1 C -12.298 -6.733 -7.900 1.00 . A A . 16 VAL CG1 1 1 9 3497 1 1 16 VAL CG2 C -13.445 -7.260 -5.717 1.00 . A A . 16 VAL CG2 1 1 9 3498 1 1 16 VAL H H -11.026 -6.724 -5.391 1.00 . A A . 16 VAL H 1 1 9 3499 1 1 16 VAL HA H -11.768 -4.433 -6.748 1.00 . A A . 16 VAL HA 1 1 9 3500 1 1 16 VAL HB H -13.940 -5.669 -7.049 1.00 . A A . 16 VAL HB 1 1 9 3501 1 1 16 VAL HG11 H -13.012 -7.238 -8.551 1.00 . A A . 16 VAL HG11 1 1 9 3502 1 1 16 VAL HG12 H -11.811 -5.928 -8.449 1.00 . A A . 16 VAL HG12 1 1 9 3503 1 1 16 VAL HG13 H -11.547 -7.448 -7.561 1.00 . A A . 16 VAL HG13 1 1 9 3504 1 1 16 VAL HG21 H -14.450 -7.060 -5.344 1.00 . A A . 16 VAL HG21 1 1 9 3505 1 1 16 VAL HG22 H -13.434 -8.220 -6.233 1.00 . A A . 16 VAL HG22 1 1 9 3506 1 1 16 VAL HG23 H -12.746 -7.289 -4.881 1.00 . A A . 16 VAL HG23 1 1 9 3507 1 1 16 VAL N N -11.065 -5.728 -5.304 1.00 . A A . 16 VAL N 1 1 9 3508 1 1 16 VAL O O -13.325 -3.111 -5.265 1.00 . A A . 16 VAL O 1 1 9 3509 1 1 17 ILE C C -13.415 -2.783 -2.579 1.00 . A A . 17 ILE C 1 1 9 3510 1 1 17 ILE CA C -13.991 -4.184 -2.789 1.00 . A A . 17 ILE CA 1 1 9 3511 1 1 17 ILE CB C -14.023 -5.034 -1.517 1.00 . A A . 17 ILE CB 1 1 9 3512 1 1 17 ILE CD1 C -14.060 -7.492 -0.955 1.00 . A A . 17 ILE CD1 1 1 9 3513 1 1 17 ILE CG1 C -14.715 -6.375 -1.771 1.00 . A A . 17 ILE CG1 1 1 9 3514 1 1 17 ILE CG2 C -14.667 -4.266 -0.361 1.00 . A A . 17 ILE CG2 1 1 9 3515 1 1 17 ILE H H -12.952 -5.792 -3.612 1.00 . A A . 17 ILE H 1 1 9 3516 1 1 17 ILE HA H -15.020 -4.086 -3.137 1.00 . A A . 17 ILE HA 1 1 9 3517 1 1 17 ILE HB H -12.995 -5.252 -1.226 1.00 . A A . 17 ILE HB 1 1 9 3518 1 1 17 ILE HD11 H -14.680 -8.388 -1.004 1.00 . A A . 17 ILE HD11 1 1 9 3519 1 1 17 ILE HD12 H -13.074 -7.710 -1.364 1.00 . A A . 17 ILE HD12 1 1 9 3520 1 1 17 ILE HD13 H -13.962 -7.174 0.083 1.00 . A A . 17 ILE HD13 1 1 9 3521 1 1 17 ILE HG12 H -15.770 -6.299 -1.509 1.00 . A A . 17 ILE HG12 1 1 9 3522 1 1 17 ILE HG13 H -14.666 -6.619 -2.832 1.00 . A A . 17 ILE HG13 1 1 9 3523 1 1 17 ILE HG21 H -15.576 -3.777 -0.712 1.00 . A A . 17 ILE HG21 1 1 9 3524 1 1 17 ILE HG22 H -14.915 -4.960 0.442 1.00 . A A . 17 ILE HG22 1 1 9 3525 1 1 17 ILE HG23 H -13.970 -3.515 0.009 1.00 . A A . 17 ILE HG23 1 1 9 3526 1 1 17 ILE N N -13.241 -4.860 -3.834 1.00 . A A . 17 ILE N 1 1 9 3527 1 1 17 ILE O O -14.156 -1.836 -2.320 1.00 . A A . 17 ILE O 1 1 9 3528 1 1 18 GLN C C -11.250 -0.711 -3.853 1.00 . A A . 18 GLN C 1 1 9 3529 1 1 18 GLN CA C -11.413 -1.428 -2.511 1.00 . A A . 18 GLN CA 1 1 9 3530 1 1 18 GLN CB C -10.058 -1.631 -1.831 1.00 . A A . 18 GLN CB 1 1 9 3531 1 1 18 GLN CD C -8.862 -2.611 0.162 1.00 . A A . 18 GLN CD 1 1 9 3532 1 1 18 GLN CG C -10.223 -2.324 -0.476 1.00 . A A . 18 GLN CG 1 1 9 3533 1 1 18 GLN H H -11.504 -3.470 -2.914 1.00 . A A . 18 GLN H 1 1 9 3534 1 1 18 GLN HA H -12.057 -0.843 -1.855 1.00 . A A . 18 GLN HA 1 1 9 3535 1 1 18 GLN HB2 H -9.411 -2.230 -2.472 1.00 . A A . 18 GLN HB2 1 1 9 3536 1 1 18 GLN HB3 H -9.567 -0.668 -1.693 1.00 . A A . 18 GLN HB3 1 1 9 3537 1 1 18 GLN HE21 H -9.237 -4.590 -0.042 1.00 . A A . 18 GLN HE21 1 1 9 3538 1 1 18 GLN HE22 H -7.714 -4.195 0.683 1.00 . A A . 18 GLN HE22 1 1 9 3539 1 1 18 GLN HG2 H -10.815 -1.694 0.188 1.00 . A A . 18 GLN HG2 1 1 9 3540 1 1 18 GLN HG3 H -10.772 -3.257 -0.605 1.00 . A A . 18 GLN HG3 1 1 9 3541 1 1 18 GLN N N -12.098 -2.696 -2.697 1.00 . A A . 18 GLN N 1 1 9 3542 1 1 18 GLN NE2 N -8.581 -3.906 0.277 1.00 . A A . 18 GLN NE2 1 1 9 3543 1 1 18 GLN O O -11.405 0.506 -3.934 1.00 . A A . 18 GLN O 1 1 9 3544 1 1 18 GLN OE1 O -8.118 -1.716 0.526 1.00 . A A . 18 GLN OE1 1 1 9 3545 1 1 19 ALA C C -12.006 -0.183 -6.622 1.00 . A A . 19 ALA C 1 1 9 3546 1 1 19 ALA CA C -10.751 -0.953 -6.208 1.00 . A A . 19 ALA CA 1 1 9 3547 1 1 19 ALA CB C -10.414 -2.086 -7.179 1.00 . A A . 19 ALA CB 1 1 9 3548 1 1 19 ALA H H -10.819 -2.487 -4.801 1.00 . A A . 19 ALA H 1 1 9 3549 1 1 19 ALA HA H -9.908 -0.263 -6.168 1.00 . A A . 19 ALA HA 1 1 9 3550 1 1 19 ALA HB1 H -11.281 -2.737 -7.292 1.00 . A A . 19 ALA HB1 1 1 9 3551 1 1 19 ALA HB2 H -10.146 -1.666 -8.148 1.00 . A A . 19 ALA HB2 1 1 9 3552 1 1 19 ALA HB3 H -9.575 -2.662 -6.788 1.00 . A A . 19 ALA HB3 1 1 9 3553 1 1 19 ALA N N -10.940 -1.497 -4.874 1.00 . A A . 19 ALA N 1 1 9 3554 1 1 19 ALA O O -11.919 0.960 -7.068 1.00 . A A . 19 ALA O 1 1 9 3555 1 1 20 ILE C C -14.700 0.967 -5.978 1.00 . A A . 20 ILE C 1 1 9 3556 1 1 20 ILE CA C -14.412 -0.251 -6.858 1.00 . A A . 20 ILE CA 1 1 9 3557 1 1 20 ILE CB C -15.523 -1.303 -6.835 1.00 . A A . 20 ILE CB 1 1 9 3558 1 1 20 ILE CD1 C -16.681 -0.976 -4.619 1.00 . A A . 20 ILE CD1 1 1 9 3559 1 1 20 ILE CG1 C -15.724 -1.858 -5.423 1.00 . A A . 20 ILE CG1 1 1 9 3560 1 1 20 ILE CG2 C -15.250 -2.411 -7.854 1.00 . A A . 20 ILE CG2 1 1 9 3561 1 1 20 ILE H H -13.210 -1.758 -6.070 1.00 . A A . 20 ILE H 1 1 9 3562 1 1 20 ILE HA H -14.308 0.085 -7.890 1.00 . A A . 20 ILE HA 1 1 9 3563 1 1 20 ILE HB H -16.456 -0.820 -7.127 1.00 . A A . 20 ILE HB 1 1 9 3564 1 1 20 ILE HD11 H -16.210 -0.693 -3.677 1.00 . A A . 20 ILE HD11 1 1 9 3565 1 1 20 ILE HD12 H -16.917 -0.080 -5.191 1.00 . A A . 20 ILE HD12 1 1 9 3566 1 1 20 ILE HD13 H -17.598 -1.529 -4.414 1.00 . A A . 20 ILE HD13 1 1 9 3567 1 1 20 ILE HG12 H -16.118 -2.872 -5.481 1.00 . A A . 20 ILE HG12 1 1 9 3568 1 1 20 ILE HG13 H -14.763 -1.918 -4.913 1.00 . A A . 20 ILE HG13 1 1 9 3569 1 1 20 ILE HG21 H -14.479 -3.077 -7.467 1.00 . A A . 20 ILE HG21 1 1 9 3570 1 1 20 ILE HG22 H -16.165 -2.977 -8.028 1.00 . A A . 20 ILE HG22 1 1 9 3571 1 1 20 ILE HG23 H -14.912 -1.968 -8.791 1.00 . A A . 20 ILE HG23 1 1 9 3572 1 1 20 ILE N N -13.145 -0.841 -6.462 1.00 . A A . 20 ILE N 1 1 9 3573 1 1 20 ILE O O -15.258 1.958 -6.447 1.00 . A A . 20 ILE O 1 1 9 3574 1 1 21 HIS C C -13.762 3.169 -4.186 1.00 . A A . 21 HIS C 1 1 9 3575 1 1 21 HIS CA C -14.540 1.922 -3.762 1.00 . A A . 21 HIS CA 1 1 9 3576 1 1 21 HIS CB C -14.200 1.465 -2.342 1.00 . A A . 21 HIS CB 1 1 9 3577 1 1 21 HIS CD2 C -12.782 3.042 -0.815 1.00 . A A . 21 HIS CD2 1 1 9 3578 1 1 21 HIS CE1 C -14.409 4.302 -0.072 1.00 . A A . 21 HIS CE1 1 1 9 3579 1 1 21 HIS CG C -13.942 2.597 -1.377 1.00 . A A . 21 HIS CG 1 1 9 3580 1 1 21 HIS H H -13.837 0.051 -4.349 1.00 . A A . 21 HIS H 1 1 9 3581 1 1 21 HIS HA H -15.607 2.143 -3.794 1.00 . A A . 21 HIS HA 1 1 9 3582 1 1 21 HIS HB2 H -15.021 0.856 -1.961 1.00 . A A . 21 HIS HB2 1 1 9 3583 1 1 21 HIS HB3 H -13.319 0.824 -2.379 1.00 . A A . 21 HIS HB3 1 1 9 3584 1 1 21 HIS HD1 H -15.921 3.339 -1.116 1.00 . A A . 21 HIS HD1 1 1 9 3585 1 1 21 HIS HD2 H -11.790 2.622 -0.983 1.00 . A A . 21 HIS HD2 1 1 9 3586 1 1 21 HIS HE1 H -14.944 5.082 0.470 1.00 . A A . 21 HIS HE1 1 1 9 3587 1 1 21 HIS HE2 H -12.411 4.557 0.553 1.00 . A A . 21 HIS HE2 1 1 9 3588 1 1 21 HIS N N -14.307 0.854 -4.718 1.00 . A A . 21 HIS N 1 1 9 3589 1 1 21 HIS ND1 N -14.950 3.411 -0.890 1.00 . A A . 21 HIS ND1 1 1 9 3590 1 1 21 HIS NE2 N -13.065 4.072 -0.027 1.00 . A A . 21 HIS NE2 1 1 9 3591 1 1 21 HIS O O -14.320 4.264 -4.246 1.00 . A A . 21 HIS O 1 1 9 3592 1 1 22 ASP C C -12.126 4.644 -6.190 1.00 . A A . 22 ASP C 1 1 9 3593 1 1 22 ASP CA C -11.619 4.058 -4.871 1.00 . A A . 22 ASP CA 1 1 9 3594 1 1 22 ASP CB C -10.184 3.576 -5.089 1.00 . A A . 22 ASP CB 1 1 9 3595 1 1 22 ASP CG C -9.298 3.599 -3.841 1.00 . A A . 22 ASP CG 1 1 9 3596 1 1 22 ASP H H -12.040 2.067 -4.426 1.00 . A A . 22 ASP H 1 1 9 3597 1 1 22 ASP HA H -11.665 4.775 -4.051 1.00 . A A . 22 ASP HA 1 1 9 3598 1 1 22 ASP HB2 H -10.213 2.558 -5.477 1.00 . A A . 22 ASP HB2 1 1 9 3599 1 1 22 ASP HB3 H -9.720 4.196 -5.856 1.00 . A A . 22 ASP HB3 1 1 9 3600 1 1 22 ASP N N -12.484 2.962 -4.468 1.00 . A A . 22 ASP N 1 1 9 3601 1 1 22 ASP O O -12.080 5.856 -6.394 1.00 . A A . 22 ASP O 1 1 9 3602 1 1 22 ASP OD1 O -9.000 4.720 -3.377 1.00 . A A . 22 ASP OD1 1 1 9 3603 1 1 22 ASP OD2 O -8.939 2.494 -3.380 1.00 . A A . 22 ASP OD2 1 1 9 3604 1 1 23 ALA C C -14.250 5.166 -8.149 1.00 . A A . 23 ALA C 1 1 9 3605 1 1 23 ALA CA C -13.108 4.168 -8.349 1.00 . A A . 23 ALA CA 1 1 9 3606 1 1 23 ALA CB C -13.543 2.935 -9.143 1.00 . A A . 23 ALA CB 1 1 9 3607 1 1 23 ALA H H -12.636 2.772 -6.878 1.00 . A A . 23 ALA H 1 1 9 3608 1 1 23 ALA HA H -12.295 4.661 -8.883 1.00 . A A . 23 ALA HA 1 1 9 3609 1 1 23 ALA HB1 H -12.706 2.242 -9.226 1.00 . A A . 23 ALA HB1 1 1 9 3610 1 1 23 ALA HB2 H -14.370 2.446 -8.629 1.00 . A A . 23 ALA HB2 1 1 9 3611 1 1 23 ALA HB3 H -13.864 3.239 -10.140 1.00 . A A . 23 ALA HB3 1 1 9 3612 1 1 23 ALA N N -12.598 3.755 -7.053 1.00 . A A . 23 ALA N 1 1 9 3613 1 1 23 ALA O O -14.365 6.141 -8.891 1.00 . A A . 23 ALA O 1 1 9 3614 1 1 24 GLN C C -15.726 7.200 -6.679 1.00 . A A . 24 GLN C 1 1 9 3615 1 1 24 GLN CA C -16.194 5.752 -6.834 1.00 . A A . 24 GLN CA 1 1 9 3616 1 1 24 GLN CB C -16.922 5.273 -5.576 1.00 . A A . 24 GLN CB 1 1 9 3617 1 1 24 GLN CD C -18.505 3.526 -4.682 1.00 . A A . 24 GLN CD 1 1 9 3618 1 1 24 GLN CG C -17.485 3.864 -5.772 1.00 . A A . 24 GLN CG 1 1 9 3619 1 1 24 GLN H H -14.968 4.092 -6.547 1.00 . A A . 24 GLN H 1 1 9 3620 1 1 24 GLN HA H -16.865 5.669 -7.689 1.00 . A A . 24 GLN HA 1 1 9 3621 1 1 24 GLN HB2 H -16.236 5.280 -4.729 1.00 . A A . 24 GLN HB2 1 1 9 3622 1 1 24 GLN HB3 H -17.731 5.962 -5.336 1.00 . A A . 24 GLN HB3 1 1 9 3623 1 1 24 GLN HE21 H -19.918 3.357 -6.123 1.00 . A A . 24 GLN HE21 1 1 9 3624 1 1 24 GLN HE22 H -20.470 3.069 -4.507 1.00 . A A . 24 GLN HE22 1 1 9 3625 1 1 24 GLN HG2 H -17.956 3.790 -6.752 1.00 . A A . 24 GLN HG2 1 1 9 3626 1 1 24 GLN HG3 H -16.673 3.138 -5.752 1.00 . A A . 24 GLN HG3 1 1 9 3627 1 1 24 GLN N N -15.067 4.888 -7.143 1.00 . A A . 24 GLN N 1 1 9 3628 1 1 24 GLN NE2 N -19.732 3.299 -5.142 1.00 . A A . 24 GLN NE2 1 1 9 3629 1 1 24 GLN O O -16.416 8.127 -7.100 1.00 . A A . 24 GLN O 1 1 9 3630 1 1 24 GLN OE1 O -18.198 3.474 -3.503 1.00 . A A . 24 GLN OE1 1 1 9 3631 1 1 25 ARG C C -13.589 9.303 -7.187 1.00 . A A . 25 ARG C 1 1 9 3632 1 1 25 ARG CA C -13.991 8.669 -5.854 1.00 . A A . 25 ARG CA 1 1 9 3633 1 1 25 ARG CB C -12.765 8.598 -4.941 1.00 . A A . 25 ARG CB 1 1 9 3634 1 1 25 ARG CD C -12.601 7.686 -2.596 1.00 . A A . 25 ARG CD 1 1 9 3635 1 1 25 ARG CG C -13.160 8.805 -3.477 1.00 . A A . 25 ARG CG 1 1 9 3636 1 1 25 ARG CZ C -14.538 6.294 -1.873 1.00 . A A . 25 ARG CZ 1 1 9 3637 1 1 25 ARG H H -14.000 6.590 -5.738 1.00 . A A . 25 ARG H 1 1 9 3638 1 1 25 ARG HA H -14.787 9.238 -5.374 1.00 . A A . 25 ARG HA 1 1 9 3639 1 1 25 ARG HB2 H -12.277 7.631 -5.057 1.00 . A A . 25 ARG HB2 1 1 9 3640 1 1 25 ARG HB3 H -12.042 9.358 -5.237 1.00 . A A . 25 ARG HB3 1 1 9 3641 1 1 25 ARG HD2 H -11.594 7.424 -2.920 1.00 . A A . 25 ARG HD2 1 1 9 3642 1 1 25 ARG HD3 H -12.525 8.028 -1.564 1.00 . A A . 25 ARG HD3 1 1 9 3643 1 1 25 ARG HE H -13.271 5.801 -3.357 1.00 . A A . 25 ARG HE 1 1 9 3644 1 1 25 ARG HG2 H -12.787 9.768 -3.128 1.00 . A A . 25 ARG HG2 1 1 9 3645 1 1 25 ARG HG3 H -14.246 8.833 -3.390 1.00 . A A . 25 ARG HG3 1 1 9 3646 1 1 25 ARG HH11 H -14.303 8.027 -0.834 1.00 . A A . 25 ARG HH11 1 1 9 3647 1 1 25 ARG HH12 H -15.645 7.049 -0.343 1.00 . A A . 25 ARG HH12 1 1 9 3648 1 1 25 ARG HH21 H -15.042 4.510 -2.709 1.00 . A A . 25 ARG HH21 1 1 9 3649 1 1 25 ARG HH22 H -16.068 5.035 -1.417 1.00 . A A . 25 ARG HH22 1 1 9 3650 1 1 25 ARG N N -14.557 7.349 -6.074 1.00 . A A . 25 ARG N 1 1 9 3651 1 1 25 ARG NE N -13.480 6.497 -2.669 1.00 . A A . 25 ARG NE 1 1 9 3652 1 1 25 ARG NH1 N -14.855 7.200 -0.937 1.00 . A A . 25 ARG NH1 1 1 9 3653 1 1 25 ARG NH2 N -15.279 5.186 -2.011 1.00 . A A . 25 ARG NH2 1 1 9 3654 1 1 25 ARG O O -12.731 8.777 -7.895 1.00 . A A . 25 ARG O 1 1 10 3655 1 1 1 PHE C C 1.131 0.000 -2.451 1.00 . A A . 1 PHE C 1 1 10 3656 1 1 1 PHE CA C 2.073 0.000 -1.245 1.00 . A A . 1 PHE CA 1 1 10 3657 1 1 1 PHE CB C 2.908 -1.282 -1.266 1.00 . A A . 1 PHE CB 1 1 10 3658 1 1 1 PHE CD1 C 1.374 -2.984 -0.255 1.00 . A A . 1 PHE CD1 1 1 10 3659 1 1 1 PHE CD2 C 2.043 -3.285 -2.494 1.00 . A A . 1 PHE CD2 1 1 10 3660 1 1 1 PHE CE1 C 0.603 -4.174 -0.325 1.00 . A A . 1 PHE CE1 1 1 10 3661 1 1 1 PHE CE2 C 1.272 -4.476 -2.564 1.00 . A A . 1 PHE CE2 1 1 10 3662 1 1 1 PHE CG C 2.077 -2.565 -1.341 1.00 . A A . 1 PHE CG 1 1 10 3663 1 1 1 PHE CZ C 0.568 -4.895 -1.478 1.00 . A A . 1 PHE CZ 1 1 10 3664 1 1 1 PHE H1 H 1.884 0.000 0.829 1.00 . A A . 1 PHE H1 1 1 10 3665 1 1 1 PHE HA H 2.678 0.907 -1.259 1.00 . A A . 1 PHE HA 1 1 10 3666 1 1 1 PHE HB2 H 3.585 -1.249 -2.119 1.00 . A A . 1 PHE HB2 1 1 10 3667 1 1 1 PHE HB3 H 3.527 -1.314 -0.369 1.00 . A A . 1 PHE HB3 1 1 10 3668 1 1 1 PHE HD1 H 1.402 -2.406 0.669 1.00 . A A . 1 PHE HD1 1 1 10 3669 1 1 1 PHE HD2 H 2.607 -2.949 -3.364 1.00 . A A . 1 PHE HD2 1 1 10 3670 1 1 1 PHE HE1 H 0.039 -4.510 0.545 1.00 . A A . 1 PHE HE1 1 1 10 3671 1 1 1 PHE HE2 H 1.244 -5.054 -3.488 1.00 . A A . 1 PHE HE2 1 1 10 3672 1 1 1 PHE HZ H -0.024 -5.809 -1.532 1.00 . A A . 1 PHE HZ 1 1 10 3673 1 1 1 PHE N N 1.325 0.000 0.000 1.00 . A A . 1 PHE N 1 1 10 3674 1 1 1 PHE O O -0.003 0.467 -2.357 1.00 . A A . 1 PHE O 1 1 10 3675 1 1 2 LEU C C -0.638 -0.461 -4.419 1.00 . A A . 2 LEU C 1 1 10 3676 1 1 2 LEU CA C 0.842 -0.629 -4.769 1.00 . A A . 2 LEU CA 1 1 10 3677 1 1 2 LEU CB C 1.154 -1.931 -5.508 1.00 . A A . 2 LEU CB 1 1 10 3678 1 1 2 LEU CD1 C 2.224 -3.141 -7.445 1.00 . A A . 2 LEU CD1 1 1 10 3679 1 1 2 LEU CD2 C 0.878 -1.028 -7.847 1.00 . A A . 2 LEU CD2 1 1 10 3680 1 1 2 LEU CG C 1.801 -1.781 -6.887 1.00 . A A . 2 LEU CG 1 1 10 3681 1 1 2 LEU H H 2.568 -0.885 -3.631 1.00 . A A . 2 LEU H 1 1 10 3682 1 1 2 LEU HA H 1.138 0.192 -5.422 1.00 . A A . 2 LEU HA 1 1 10 3683 1 1 2 LEU HB2 H 1.815 -2.532 -4.883 1.00 . A A . 2 LEU HB2 1 1 10 3684 1 1 2 LEU HB3 H 0.227 -2.492 -5.623 1.00 . A A . 2 LEU HB3 1 1 10 3685 1 1 2 LEU HD11 H 1.337 -3.730 -7.678 1.00 . A A . 2 LEU HD11 1 1 10 3686 1 1 2 LEU HD12 H 2.811 -2.995 -8.353 1.00 . A A . 2 LEU HD12 1 1 10 3687 1 1 2 LEU HD13 H 2.826 -3.667 -6.704 1.00 . A A . 2 LEU HD13 1 1 10 3688 1 1 2 LEU HD21 H 1.125 -1.296 -8.874 1.00 . A A . 2 LEU HD21 1 1 10 3689 1 1 2 LEU HD22 H -0.158 -1.298 -7.641 1.00 . A A . 2 LEU HD22 1 1 10 3690 1 1 2 LEU HD23 H 1.008 0.045 -7.710 1.00 . A A . 2 LEU HD23 1 1 10 3691 1 1 2 LEU HG H 2.706 -1.183 -6.776 1.00 . A A . 2 LEU HG 1 1 10 3692 1 1 2 LEU N N 1.636 -0.529 -3.556 1.00 . A A . 2 LEU N 1 1 10 3693 1 1 2 LEU O O -1.288 0.473 -4.887 1.00 . A A . 2 LEU O 1 1 10 3694 1 1 3 PRO C C -2.795 -0.275 -2.149 1.00 . A A . 3 PRO C 1 1 10 3695 1 1 3 PRO CA C -2.537 -1.380 -3.176 1.00 . A A . 3 PRO CA 1 1 10 3696 1 1 3 PRO CB C -2.813 -2.773 -2.632 1.00 . A A . 3 PRO CB 1 1 10 3697 1 1 3 PRO CD C -0.395 -2.510 -2.986 1.00 . A A . 3 PRO CD 1 1 10 3698 1 1 3 PRO CG C -1.453 -3.374 -2.317 1.00 . A A . 3 PRO CG 1 1 10 3699 1 1 3 PRO HA H -3.120 -1.166 -3.960 1.00 . A A . 3 PRO HA 1 1 10 3700 1 1 3 PRO HB2 H -3.435 -2.727 -1.738 1.00 . A A . 3 PRO HB2 1 1 10 3701 1 1 3 PRO HB3 H -3.348 -3.378 -3.363 1.00 . A A . 3 PRO HB3 1 1 10 3702 1 1 3 PRO HD2 H 0.339 -2.153 -2.263 1.00 . A A . 3 PRO HD2 1 1 10 3703 1 1 3 PRO HD3 H 0.151 -3.070 -3.745 1.00 . A A . 3 PRO HD3 1 1 10 3704 1 1 3 PRO HG2 H -1.291 -3.410 -1.240 1.00 . A A . 3 PRO HG2 1 1 10 3705 1 1 3 PRO HG3 H -1.395 -4.399 -2.683 1.00 . A A . 3 PRO HG3 1 1 10 3706 1 1 3 PRO N N -1.141 -1.403 -3.577 1.00 . A A . 3 PRO N 1 1 10 3707 1 1 3 PRO O O -3.635 0.596 -2.368 1.00 . A A . 3 PRO O 1 1 10 3708 1 1 4 LEU C C -1.941 2.017 -0.492 1.00 . A A . 4 LEU C 1 1 10 3709 1 1 4 LEU CA C -2.228 0.608 0.030 1.00 . A A . 4 LEU CA 1 1 10 3710 1 1 4 LEU CB C -1.373 0.212 1.235 1.00 . A A . 4 LEU CB 1 1 10 3711 1 1 4 LEU CD1 C -3.313 -0.145 2.807 1.00 . A A . 4 LEU CD1 1 1 10 3712 1 1 4 LEU CD2 C -2.263 -2.118 1.606 1.00 . A A . 4 LEU CD2 1 1 10 3713 1 1 4 LEU CG C -2.026 -0.743 2.236 1.00 . A A . 4 LEU CG 1 1 10 3714 1 1 4 LEU H H -1.356 -1.043 -0.894 1.00 . A A . 4 LEU H 1 1 10 3715 1 1 4 LEU HA H -3.271 0.562 0.345 1.00 . A A . 4 LEU HA 1 1 10 3716 1 1 4 LEU HB2 H -0.455 -0.247 0.869 1.00 . A A . 4 LEU HB2 1 1 10 3717 1 1 4 LEU HB3 H -1.085 1.120 1.765 1.00 . A A . 4 LEU HB3 1 1 10 3718 1 1 4 LEU HD11 H -4.138 -0.335 2.120 1.00 . A A . 4 LEU HD11 1 1 10 3719 1 1 4 LEU HD12 H -3.530 -0.603 3.771 1.00 . A A . 4 LEU HD12 1 1 10 3720 1 1 4 LEU HD13 H -3.187 0.930 2.935 1.00 . A A . 4 LEU HD13 1 1 10 3721 1 1 4 LEU HD21 H -2.564 -2.824 2.380 1.00 . A A . 4 LEU HD21 1 1 10 3722 1 1 4 LEU HD22 H -3.050 -2.043 0.856 1.00 . A A . 4 LEU HD22 1 1 10 3723 1 1 4 LEU HD23 H -1.344 -2.465 1.135 1.00 . A A . 4 LEU HD23 1 1 10 3724 1 1 4 LEU HG H -1.339 -0.886 3.070 1.00 . A A . 4 LEU HG 1 1 10 3725 1 1 4 LEU N N -2.058 -0.348 -1.051 1.00 . A A . 4 LEU N 1 1 10 3726 1 1 4 LEU O O -2.569 2.983 -0.061 1.00 . A A . 4 LEU O 1 1 10 3727 1 1 5 LEU C C -1.785 3.972 -2.736 1.00 . A A . 5 LEU C 1 1 10 3728 1 1 5 LEU CA C -0.598 3.368 -1.983 1.00 . A A . 5 LEU CA 1 1 10 3729 1 1 5 LEU CB C 0.658 3.208 -2.842 1.00 . A A . 5 LEU CB 1 1 10 3730 1 1 5 LEU CD1 C 2.010 5.140 -1.947 1.00 . A A . 5 LEU CD1 1 1 10 3731 1 1 5 LEU CD2 C 2.226 2.838 -0.902 1.00 . A A . 5 LEU CD2 1 1 10 3732 1 1 5 LEU CG C 1.975 3.629 -2.187 1.00 . A A . 5 LEU CG 1 1 10 3733 1 1 5 LEU H H -0.495 1.299 -1.769 1.00 . A A . 5 LEU H 1 1 10 3734 1 1 5 LEU HA H -0.341 4.030 -1.156 1.00 . A A . 5 LEU HA 1 1 10 3735 1 1 5 LEU HB2 H 0.740 2.163 -3.139 1.00 . A A . 5 LEU HB2 1 1 10 3736 1 1 5 LEU HB3 H 0.526 3.790 -3.754 1.00 . A A . 5 LEU HB3 1 1 10 3737 1 1 5 LEU HD11 H 1.688 5.659 -2.850 1.00 . A A . 5 LEU HD11 1 1 10 3738 1 1 5 LEU HD12 H 1.341 5.392 -1.124 1.00 . A A . 5 LEU HD12 1 1 10 3739 1 1 5 LEU HD13 H 3.026 5.444 -1.695 1.00 . A A . 5 LEU HD13 1 1 10 3740 1 1 5 LEU HD21 H 3.289 2.864 -0.661 1.00 . A A . 5 LEU HD21 1 1 10 3741 1 1 5 LEU HD22 H 1.658 3.283 -0.085 1.00 . A A . 5 LEU HD22 1 1 10 3742 1 1 5 LEU HD23 H 1.911 1.805 -1.044 1.00 . A A . 5 LEU HD23 1 1 10 3743 1 1 5 LEU HG H 2.788 3.394 -2.874 1.00 . A A . 5 LEU HG 1 1 10 3744 1 1 5 LEU N N -0.991 2.091 -1.413 1.00 . A A . 5 LEU N 1 1 10 3745 1 1 5 LEU O O -2.209 5.089 -2.441 1.00 . A A . 5 LEU O 1 1 10 3746 1 1 6 ILE C C -4.629 3.865 -3.588 1.00 . A A . 6 ILE C 1 1 10 3747 1 1 6 ILE CA C -3.415 3.656 -4.495 1.00 . A A . 6 ILE CA 1 1 10 3748 1 1 6 ILE CB C -3.670 2.685 -5.650 1.00 . A A . 6 ILE CB 1 1 10 3749 1 1 6 ILE CD1 C -4.244 0.312 -6.282 1.00 . A A . 6 ILE CD1 1 1 10 3750 1 1 6 ILE CG1 C -4.019 1.290 -5.127 1.00 . A A . 6 ILE CG1 1 1 10 3751 1 1 6 ILE CG2 C -2.483 2.656 -6.615 1.00 . A A . 6 ILE CG2 1 1 10 3752 1 1 6 ILE H H -1.940 2.299 -3.926 1.00 . A A . 6 ILE H 1 1 10 3753 1 1 6 ILE HA H -3.142 4.615 -4.935 1.00 . A A . 6 ILE HA 1 1 10 3754 1 1 6 ILE HB H -4.533 3.043 -6.212 1.00 . A A . 6 ILE HB 1 1 10 3755 1 1 6 ILE HD11 H -3.289 0.086 -6.758 1.00 . A A . 6 ILE HD11 1 1 10 3756 1 1 6 ILE HD12 H -4.685 -0.608 -5.899 1.00 . A A . 6 ILE HD12 1 1 10 3757 1 1 6 ILE HD13 H -4.917 0.761 -7.013 1.00 . A A . 6 ILE HD13 1 1 10 3758 1 1 6 ILE HG12 H -3.213 0.926 -4.489 1.00 . A A . 6 ILE HG12 1 1 10 3759 1 1 6 ILE HG13 H -4.915 1.342 -4.510 1.00 . A A . 6 ILE HG13 1 1 10 3760 1 1 6 ILE HG21 H -2.827 2.896 -7.621 1.00 . A A . 6 ILE HG21 1 1 10 3761 1 1 6 ILE HG22 H -1.741 3.389 -6.300 1.00 . A A . 6 ILE HG22 1 1 10 3762 1 1 6 ILE HG23 H -2.036 1.662 -6.611 1.00 . A A . 6 ILE HG23 1 1 10 3763 1 1 6 ILE N N -2.288 3.208 -3.694 1.00 . A A . 6 ILE N 1 1 10 3764 1 1 6 ILE O O -5.388 4.815 -3.771 1.00 . A A . 6 ILE O 1 1 10 3765 1 1 7 LEU C C -5.773 4.305 -0.863 1.00 . A A . 7 LEU C 1 1 10 3766 1 1 7 LEU CA C -5.889 3.030 -1.700 1.00 . A A . 7 LEU CA 1 1 10 3767 1 1 7 LEU CB C -5.969 1.751 -0.865 1.00 . A A . 7 LEU CB 1 1 10 3768 1 1 7 LEU CD1 C -7.412 0.062 0.327 1.00 . A A . 7 LEU CD1 1 1 10 3769 1 1 7 LEU CD2 C -7.418 2.490 1.062 1.00 . A A . 7 LEU CD2 1 1 10 3770 1 1 7 LEU CG C -7.282 1.521 -0.114 1.00 . A A . 7 LEU CG 1 1 10 3771 1 1 7 LEU H H -4.147 2.197 -2.482 1.00 . A A . 7 LEU H 1 1 10 3772 1 1 7 LEU HA H -6.803 3.087 -2.291 1.00 . A A . 7 LEU HA 1 1 10 3773 1 1 7 LEU HB2 H -5.796 0.899 -1.523 1.00 . A A . 7 LEU HB2 1 1 10 3774 1 1 7 LEU HB3 H -5.155 1.763 -0.139 1.00 . A A . 7 LEU HB3 1 1 10 3775 1 1 7 LEU HD11 H -7.313 -0.591 -0.540 1.00 . A A . 7 LEU HD11 1 1 10 3776 1 1 7 LEU HD12 H -6.629 -0.171 1.049 1.00 . A A . 7 LEU HD12 1 1 10 3777 1 1 7 LEU HD13 H -8.388 -0.093 0.788 1.00 . A A . 7 LEU HD13 1 1 10 3778 1 1 7 LEU HD21 H -8.012 2.025 1.849 1.00 . A A . 7 LEU HD21 1 1 10 3779 1 1 7 LEU HD22 H -6.428 2.732 1.449 1.00 . A A . 7 LEU HD22 1 1 10 3780 1 1 7 LEU HD23 H -7.910 3.402 0.726 1.00 . A A . 7 LEU HD23 1 1 10 3781 1 1 7 LEU HG H -8.106 1.725 -0.797 1.00 . A A . 7 LEU HG 1 1 10 3782 1 1 7 LEU N N -4.774 2.963 -2.629 1.00 . A A . 7 LEU N 1 1 10 3783 1 1 7 LEU O O -6.730 5.070 -0.754 1.00 . A A . 7 LEU O 1 1 10 3784 1 1 8 GLY C C -4.643 6.952 -0.240 1.00 . A A . 8 GLY C 1 1 10 3785 1 1 8 GLY CA C -4.338 5.665 0.530 1.00 . A A . 8 GLY CA 1 1 10 3786 1 1 8 GLY H H -3.820 3.866 -0.382 1.00 . A A . 8 GLY H 1 1 10 3787 1 1 8 GLY HA2 H -4.951 5.622 1.431 1.00 . A A . 8 GLY HA2 1 1 10 3788 1 1 8 GLY HA3 H -3.297 5.668 0.853 1.00 . A A . 8 GLY HA3 1 1 10 3789 1 1 8 GLY N N -4.593 4.494 -0.291 1.00 . A A . 8 GLY N 1 1 10 3790 1 1 8 GLY O O -5.208 7.893 0.316 1.00 . A A . 8 GLY O 1 1 10 3791 1 1 9 SER C C -5.771 7.921 -3.159 1.00 . A A . 9 SER C 1 1 10 3792 1 1 9 SER CA C -4.481 8.106 -2.359 1.00 . A A . 9 SER CA 1 1 10 3793 1 1 9 SER CB C -3.298 8.335 -3.303 1.00 . A A . 9 SER CB 1 1 10 3794 1 1 9 SER H H -3.793 6.183 -1.950 1.00 . A A . 9 SER H 1 1 10 3795 1 1 9 SER HA H -4.571 8.954 -1.679 1.00 . A A . 9 SER HA 1 1 10 3796 1 1 9 SER HB2 H -2.368 8.283 -2.737 1.00 . A A . 9 SER HB2 1 1 10 3797 1 1 9 SER HB3 H -3.266 7.536 -4.043 1.00 . A A . 9 SER HB3 1 1 10 3798 1 1 9 SER HG H -4.129 9.582 -4.629 1.00 . A A . 9 SER HG 1 1 10 3799 1 1 9 SER N N -4.254 6.952 -1.506 1.00 . A A . 9 SER N 1 1 10 3800 1 1 9 SER O O -5.931 8.506 -4.230 1.00 . A A . 9 SER O 1 1 10 3801 1 1 9 SER OG O -3.380 9.593 -3.966 1.00 . A A . 9 SER OG 1 1 10 3802 1 1 10 LEU C C -9.003 7.751 -2.685 1.00 . A A . 10 LEU C 1 1 10 3803 1 1 10 LEU CA C -7.927 6.830 -3.263 1.00 . A A . 10 LEU CA 1 1 10 3804 1 1 10 LEU CB C -8.271 5.342 -3.161 1.00 . A A . 10 LEU CB 1 1 10 3805 1 1 10 LEU CD1 C -10.095 5.423 -4.900 1.00 . A A . 10 LEU CD1 1 1 10 3806 1 1 10 LEU CD2 C -7.771 4.621 -5.525 1.00 . A A . 10 LEU CD2 1 1 10 3807 1 1 10 LEU CG C -8.835 4.696 -4.427 1.00 . A A . 10 LEU CG 1 1 10 3808 1 1 10 LEU H H -6.522 6.636 -1.737 1.00 . A A . 10 LEU H 1 1 10 3809 1 1 10 LEU HA H -7.807 7.060 -4.321 1.00 . A A . 10 LEU HA 1 1 10 3810 1 1 10 LEU HB2 H -7.371 4.801 -2.870 1.00 . A A . 10 LEU HB2 1 1 10 3811 1 1 10 LEU HB3 H -8.995 5.212 -2.357 1.00 . A A . 10 LEU HB3 1 1 10 3812 1 1 10 LEU HD11 H -9.816 6.365 -5.372 1.00 . A A . 10 LEU HD11 1 1 10 3813 1 1 10 LEU HD12 H -10.626 4.799 -5.619 1.00 . A A . 10 LEU HD12 1 1 10 3814 1 1 10 LEU HD13 H -10.742 5.622 -4.045 1.00 . A A . 10 LEU HD13 1 1 10 3815 1 1 10 LEU HD21 H -7.276 5.587 -5.617 1.00 . A A . 10 LEU HD21 1 1 10 3816 1 1 10 LEU HD22 H -7.036 3.859 -5.266 1.00 . A A . 10 LEU HD22 1 1 10 3817 1 1 10 LEU HD23 H -8.244 4.362 -6.472 1.00 . A A . 10 LEU HD23 1 1 10 3818 1 1 10 LEU HG H -9.124 3.672 -4.189 1.00 . A A . 10 LEU HG 1 1 10 3819 1 1 10 LEU N N -6.658 7.104 -2.610 1.00 . A A . 10 LEU N 1 1 10 3820 1 1 10 LEU O O -10.029 7.282 -2.195 1.00 . A A . 10 LEU O 1 1 10 3821 1 1 11 LEU C C -10.266 10.811 -3.431 1.00 . A A . 11 LEU C 1 1 10 3822 1 1 11 LEU CA C -9.666 10.037 -2.256 1.00 . A A . 11 LEU CA 1 1 10 3823 1 1 11 LEU CB C -8.989 10.929 -1.213 1.00 . A A . 11 LEU CB 1 1 10 3824 1 1 11 LEU CD1 C -10.357 10.043 0.711 1.00 . A A . 11 LEU CD1 1 1 10 3825 1 1 11 LEU CD2 C -8.004 9.183 0.316 1.00 . A A . 11 LEU CD2 1 1 10 3826 1 1 11 LEU CG C -8.950 10.381 0.215 1.00 . A A . 11 LEU CG 1 1 10 3827 1 1 11 LEU H H -7.893 9.419 -3.158 1.00 . A A . 11 LEU H 1 1 10 3828 1 1 11 LEU HA H -10.469 9.501 -1.749 1.00 . A A . 11 LEU HA 1 1 10 3829 1 1 11 LEU HB2 H -7.966 11.119 -1.536 1.00 . A A . 11 LEU HB2 1 1 10 3830 1 1 11 LEU HB3 H -9.502 11.890 -1.198 1.00 . A A . 11 LEU HB3 1 1 10 3831 1 1 11 LEU HD11 H -10.656 9.070 0.323 1.00 . A A . 11 LEU HD11 1 1 10 3832 1 1 11 LEU HD12 H -10.362 10.017 1.801 1.00 . A A . 11 LEU HD12 1 1 10 3833 1 1 11 LEU HD13 H -11.057 10.803 0.363 1.00 . A A . 11 LEU HD13 1 1 10 3834 1 1 11 LEU HD21 H -7.153 9.334 -0.348 1.00 . A A . 11 LEU HD21 1 1 10 3835 1 1 11 LEU HD22 H -7.651 9.085 1.343 1.00 . A A . 11 LEU HD22 1 1 10 3836 1 1 11 LEU HD23 H -8.534 8.275 0.026 1.00 . A A . 11 LEU HD23 1 1 10 3837 1 1 11 LEU HG H -8.556 11.158 0.869 1.00 . A A . 11 LEU HG 1 1 10 3838 1 1 11 LEU N N -8.732 9.046 -2.761 1.00 . A A . 11 LEU N 1 1 10 3839 1 1 11 LEU O O -11.486 10.882 -3.575 1.00 . A A . 11 LEU O 1 1 10 3840 1 1 12 MET C C -10.044 11.223 -6.605 1.00 . A A . 12 MET C 1 1 10 3841 1 1 12 MET CA C -9.809 12.138 -5.401 1.00 . A A . 12 MET CA 1 1 10 3842 1 1 12 MET CB C -8.740 13.176 -5.750 1.00 . A A . 12 MET CB 1 1 10 3843 1 1 12 MET CE C -8.340 16.609 -6.016 1.00 . A A . 12 MET CE 1 1 10 3844 1 1 12 MET CG C -8.645 14.251 -4.665 1.00 . A A . 12 MET CG 1 1 10 3845 1 1 12 MET H H -8.391 11.312 -4.117 1.00 . A A . 12 MET H 1 1 10 3846 1 1 12 MET HA H -10.745 12.614 -5.109 1.00 . A A . 12 MET HA 1 1 10 3847 1 1 12 MET HB2 H -7.774 12.684 -5.866 1.00 . A A . 12 MET HB2 1 1 10 3848 1 1 12 MET HB3 H -8.978 13.640 -6.707 1.00 . A A . 12 MET HB3 1 1 10 3849 1 1 12 MET HE1 H -7.681 17.370 -6.433 1.00 . A A . 12 MET HE1 1 1 10 3850 1 1 12 MET HE2 H -8.858 16.094 -6.825 1.00 . A A . 12 MET HE2 1 1 10 3851 1 1 12 MET HE3 H -9.070 17.080 -5.359 1.00 . A A . 12 MET HE3 1 1 10 3852 1 1 12 MET HG2 H -9.604 14.758 -4.559 1.00 . A A . 12 MET HG2 1 1 10 3853 1 1 12 MET HG3 H -8.421 13.789 -3.703 1.00 . A A . 12 MET HG3 1 1 10 3854 1 1 12 MET N N -9.382 11.373 -4.242 1.00 . A A . 12 MET N 1 1 10 3855 1 1 12 MET O O -11.122 11.237 -7.198 1.00 . A A . 12 MET O 1 1 10 3856 1 1 12 MET SD S -7.374 15.431 -5.085 1.00 . A A . 12 MET SD 1 1 10 3857 1 1 13 THR C C -8.241 8.297 -7.802 1.00 . A A . 13 THR C 1 1 10 3858 1 1 13 THR CA C -9.096 9.539 -8.059 1.00 . A A . 13 THR CA 1 1 10 3859 1 1 13 THR CB C -8.687 10.309 -9.316 1.00 . A A . 13 THR CB 1 1 10 3860 1 1 13 THR CG2 C -8.959 9.522 -10.600 1.00 . A A . 13 THR CG2 1 1 10 3861 1 1 13 THR H H -8.148 10.439 -6.437 1.00 . A A . 13 THR H 1 1 10 3862 1 1 13 THR HA H -10.128 9.202 -8.159 1.00 . A A . 13 THR HA 1 1 10 3863 1 1 13 THR HB H -7.642 10.616 -9.262 1.00 . A A . 13 THR HB 1 1 10 3864 1 1 13 THR HG1 H -9.218 12.197 -8.919 1.00 . A A . 13 THR HG1 1 1 10 3865 1 1 13 THR HG21 H -8.661 10.119 -11.462 1.00 . A A . 13 THR HG21 1 1 10 3866 1 1 13 THR HG22 H -8.388 8.594 -10.585 1.00 . A A . 13 THR HG22 1 1 10 3867 1 1 13 THR HG23 H -10.023 9.293 -10.667 1.00 . A A . 13 THR HG23 1 1 10 3868 1 1 13 THR N N -9.019 10.450 -6.930 1.00 . A A . 13 THR N 1 1 10 3869 1 1 13 THR O O -7.118 8.402 -7.311 1.00 . A A . 13 THR O 1 1 10 3870 1 1 13 THR OG1 O -9.607 11.396 -9.373 1.00 . A A . 13 THR OG1 1 1 10 3871 1 1 14 PRO C C -7.029 5.675 -9.025 1.00 . A A . 14 PRO C 1 1 10 3872 1 1 14 PRO CA C -8.123 5.857 -7.970 1.00 . A A . 14 PRO CA 1 1 10 3873 1 1 14 PRO CB C -9.206 4.793 -8.047 1.00 . A A . 14 PRO CB 1 1 10 3874 1 1 14 PRO CD C -10.149 6.955 -8.736 1.00 . A A . 14 PRO CD 1 1 10 3875 1 1 14 PRO CG C -10.391 5.454 -8.732 1.00 . A A . 14 PRO CG 1 1 10 3876 1 1 14 PRO HA H -7.654 5.845 -7.086 1.00 . A A . 14 PRO HA 1 1 10 3877 1 1 14 PRO HB2 H -8.862 3.926 -8.612 1.00 . A A . 14 PRO HB2 1 1 10 3878 1 1 14 PRO HB3 H -9.477 4.439 -7.053 1.00 . A A . 14 PRO HB3 1 1 10 3879 1 1 14 PRO HD2 H -10.191 7.360 -9.747 1.00 . A A . 14 PRO HD2 1 1 10 3880 1 1 14 PRO HD3 H -10.905 7.479 -8.151 1.00 . A A . 14 PRO HD3 1 1 10 3881 1 1 14 PRO HG2 H -10.499 5.082 -9.751 1.00 . A A . 14 PRO HG2 1 1 10 3882 1 1 14 PRO HG3 H -11.316 5.218 -8.207 1.00 . A A . 14 PRO HG3 1 1 10 3883 1 1 14 PRO N N -8.820 7.118 -8.155 1.00 . A A . 14 PRO N 1 1 10 3884 1 1 14 PRO O O -6.890 6.499 -9.927 1.00 . A A . 14 PRO O 1 1 10 3885 1 1 15 PRO C C -5.748 3.735 -11.130 1.00 . A A . 15 PRO C 1 1 10 3886 1 1 15 PRO CA C -5.190 4.258 -9.805 1.00 . A A . 15 PRO CA 1 1 10 3887 1 1 15 PRO CB C -4.318 3.243 -9.084 1.00 . A A . 15 PRO CB 1 1 10 3888 1 1 15 PRO CD C -6.395 3.567 -7.812 1.00 . A A . 15 PRO CD 1 1 10 3889 1 1 15 PRO CG C -5.180 2.669 -7.971 1.00 . A A . 15 PRO CG 1 1 10 3890 1 1 15 PRO HA H -4.682 5.089 -10.031 1.00 . A A . 15 PRO HA 1 1 10 3891 1 1 15 PRO HB2 H -3.987 2.460 -9.766 1.00 . A A . 15 PRO HB2 1 1 10 3892 1 1 15 PRO HB3 H -3.422 3.714 -8.681 1.00 . A A . 15 PRO HB3 1 1 10 3893 1 1 15 PRO HD2 H -7.322 3.002 -7.913 1.00 . A A . 15 PRO HD2 1 1 10 3894 1 1 15 PRO HD3 H -6.414 4.037 -6.828 1.00 . A A . 15 PRO HD3 1 1 10 3895 1 1 15 PRO HG2 H -5.487 1.651 -8.213 1.00 . A A . 15 PRO HG2 1 1 10 3896 1 1 15 PRO HG3 H -4.617 2.619 -7.040 1.00 . A A . 15 PRO HG3 1 1 10 3897 1 1 15 PRO N N -6.263 4.562 -8.872 1.00 . A A . 15 PRO N 1 1 10 3898 1 1 15 PRO O O -5.455 2.609 -11.529 1.00 . A A . 15 PRO O 1 1 10 3899 1 1 16 VAL C C -6.038 3.866 -14.047 1.00 . A A . 16 VAL C 1 1 10 3900 1 1 16 VAL CA C -7.142 4.213 -13.047 1.00 . A A . 16 VAL CA 1 1 10 3901 1 1 16 VAL CB C -8.059 5.337 -13.534 1.00 . A A . 16 VAL CB 1 1 10 3902 1 1 16 VAL CG1 C -9.301 5.454 -12.649 1.00 . A A . 16 VAL CG1 1 1 10 3903 1 1 16 VAL CG2 C -7.306 6.668 -13.600 1.00 . A A . 16 VAL CG2 1 1 10 3904 1 1 16 VAL H H -6.776 5.490 -11.443 1.00 . A A . 16 VAL H 1 1 10 3905 1 1 16 VAL HA H -7.755 3.327 -12.880 1.00 . A A . 16 VAL HA 1 1 10 3906 1 1 16 VAL HB H -8.388 5.088 -14.543 1.00 . A A . 16 VAL HB 1 1 10 3907 1 1 16 VAL HG11 H -9.014 5.828 -11.666 1.00 . A A . 16 VAL HG11 1 1 10 3908 1 1 16 VAL HG12 H -10.010 6.144 -13.107 1.00 . A A . 16 VAL HG12 1 1 10 3909 1 1 16 VAL HG13 H -9.765 4.473 -12.543 1.00 . A A . 16 VAL HG13 1 1 10 3910 1 1 16 VAL HG21 H -8.001 7.488 -13.418 1.00 . A A . 16 VAL HG21 1 1 10 3911 1 1 16 VAL HG22 H -6.522 6.680 -12.842 1.00 . A A . 16 VAL HG22 1 1 10 3912 1 1 16 VAL HG23 H -6.858 6.783 -14.587 1.00 . A A . 16 VAL HG23 1 1 10 3913 1 1 16 VAL N N -6.542 4.576 -11.775 1.00 . A A . 16 VAL N 1 1 10 3914 1 1 16 VAL O O -6.109 2.844 -14.727 1.00 . A A . 16 VAL O 1 1 10 3915 1 1 17 ILE C C -3.358 3.129 -14.810 1.00 . A A . 17 ILE C 1 1 10 3916 1 1 17 ILE CA C -3.923 4.537 -15.010 1.00 . A A . 17 ILE CA 1 1 10 3917 1 1 17 ILE CB C -2.884 5.646 -14.833 1.00 . A A . 17 ILE CB 1 1 10 3918 1 1 17 ILE CD1 C -1.232 6.674 -13.228 1.00 . A A . 17 ILE CD1 1 1 10 3919 1 1 17 ILE CG1 C -2.459 5.771 -13.368 1.00 . A A . 17 ILE CG1 1 1 10 3920 1 1 17 ILE CG2 C -3.397 6.973 -15.396 1.00 . A A . 17 ILE CG2 1 1 10 3921 1 1 17 ILE H H -4.993 5.569 -13.551 1.00 . A A . 17 ILE H 1 1 10 3922 1 1 17 ILE HA H -4.306 4.614 -16.027 1.00 . A A . 17 ILE HA 1 1 10 3923 1 1 17 ILE HB H -1.995 5.377 -15.404 1.00 . A A . 17 ILE HB 1 1 10 3924 1 1 17 ILE HD11 H -0.882 6.654 -12.196 1.00 . A A . 17 ILE HD11 1 1 10 3925 1 1 17 ILE HD12 H -0.441 6.317 -13.887 1.00 . A A . 17 ILE HD12 1 1 10 3926 1 1 17 ILE HD13 H -1.499 7.695 -13.501 1.00 . A A . 17 ILE HD13 1 1 10 3927 1 1 17 ILE HG12 H -3.283 6.177 -12.781 1.00 . A A . 17 ILE HG12 1 1 10 3928 1 1 17 ILE HG13 H -2.237 4.784 -12.965 1.00 . A A . 17 ILE HG13 1 1 10 3929 1 1 17 ILE HG21 H -4.087 7.427 -14.685 1.00 . A A . 17 ILE HG21 1 1 10 3930 1 1 17 ILE HG22 H -2.556 7.645 -15.566 1.00 . A A . 17 ILE HG22 1 1 10 3931 1 1 17 ILE HG23 H -3.914 6.792 -16.339 1.00 . A A . 17 ILE HG23 1 1 10 3932 1 1 17 ILE N N -5.042 4.739 -14.106 1.00 . A A . 17 ILE N 1 1 10 3933 1 1 17 ILE O O -2.760 2.561 -15.722 1.00 . A A . 17 ILE O 1 1 10 3934 1 1 18 GLN C C -4.207 0.255 -13.365 1.00 . A A . 18 GLN C 1 1 10 3935 1 1 18 GLN CA C -3.076 1.282 -13.274 1.00 . A A . 18 GLN CA 1 1 10 3936 1 1 18 GLN CB C -2.437 1.271 -11.884 1.00 . A A . 18 GLN CB 1 1 10 3937 1 1 18 GLN CD C -0.132 1.496 -12.884 1.00 . A A . 18 GLN CD 1 1 10 3938 1 1 18 GLN CG C -1.131 2.068 -11.876 1.00 . A A . 18 GLN CG 1 1 10 3939 1 1 18 GLN H H -4.066 3.071 -12.878 1.00 . A A . 18 GLN H 1 1 10 3940 1 1 18 GLN HA H -2.313 1.058 -14.020 1.00 . A A . 18 GLN HA 1 1 10 3941 1 1 18 GLN HB2 H -3.130 1.695 -11.158 1.00 . A A . 18 GLN HB2 1 1 10 3942 1 1 18 GLN HB3 H -2.242 0.244 -11.578 1.00 . A A . 18 GLN HB3 1 1 10 3943 1 1 18 GLN HE21 H -0.422 3.138 -14.032 1.00 . A A . 18 GLN HE21 1 1 10 3944 1 1 18 GLN HE22 H 0.701 1.981 -14.665 1.00 . A A . 18 GLN HE22 1 1 10 3945 1 1 18 GLN HG2 H -1.336 3.112 -12.114 1.00 . A A . 18 GLN HG2 1 1 10 3946 1 1 18 GLN HG3 H -0.695 2.049 -10.877 1.00 . A A . 18 GLN HG3 1 1 10 3947 1 1 18 GLN N N -3.569 2.606 -13.611 1.00 . A A . 18 GLN N 1 1 10 3948 1 1 18 GLN NE2 N 0.065 2.269 -13.948 1.00 . A A . 18 GLN NE2 1 1 10 3949 1 1 18 GLN O O -3.983 -0.887 -13.763 1.00 . A A . 18 GLN O 1 1 10 3950 1 1 18 GLN OE1 O 0.422 0.424 -12.708 1.00 . A A . 18 GLN OE1 1 1 10 3951 1 1 19 ALA C C -6.793 -0.643 -14.463 1.00 . A A . 19 ALA C 1 1 10 3952 1 1 19 ALA CA C -6.565 -0.165 -13.028 1.00 . A A . 19 ALA CA 1 1 10 3953 1 1 19 ALA CB C -7.774 0.584 -12.463 1.00 . A A . 19 ALA CB 1 1 10 3954 1 1 19 ALA H H -5.571 1.629 -12.664 1.00 . A A . 19 ALA H 1 1 10 3955 1 1 19 ALA HA H -6.360 -1.028 -12.394 1.00 . A A . 19 ALA HA 1 1 10 3956 1 1 19 ALA HB1 H -7.564 0.894 -11.440 1.00 . A A . 19 ALA HB1 1 1 10 3957 1 1 19 ALA HB2 H -7.974 1.464 -13.075 1.00 . A A . 19 ALA HB2 1 1 10 3958 1 1 19 ALA HB3 H -8.645 -0.072 -12.473 1.00 . A A . 19 ALA HB3 1 1 10 3959 1 1 19 ALA N N -5.398 0.699 -12.989 1.00 . A A . 19 ALA N 1 1 10 3960 1 1 19 ALA O O -6.891 -1.844 -14.713 1.00 . A A . 19 ALA O 1 1 10 3961 1 1 20 ILE C C -5.915 -0.701 -17.359 1.00 . A A . 20 ILE C 1 1 10 3962 1 1 20 ILE CA C -7.130 0.016 -16.766 1.00 . A A . 20 ILE CA 1 1 10 3963 1 1 20 ILE CB C -7.528 1.283 -17.526 1.00 . A A . 20 ILE CB 1 1 10 3964 1 1 20 ILE CD1 C -5.373 2.542 -17.159 1.00 . A A . 20 ILE CD1 1 1 10 3965 1 1 20 ILE CG1 C -6.312 1.924 -18.198 1.00 . A A . 20 ILE CG1 1 1 10 3966 1 1 20 ILE CG2 C -8.260 2.265 -16.609 1.00 . A A . 20 ILE CG2 1 1 10 3967 1 1 20 ILE H H -6.763 1.293 -15.161 1.00 . A A . 20 ILE H 1 1 10 3968 1 1 20 ILE HA H -7.982 -0.662 -16.800 1.00 . A A . 20 ILE HA 1 1 10 3969 1 1 20 ILE HB H -8.222 1.002 -18.317 1.00 . A A . 20 ILE HB 1 1 10 3970 1 1 20 ILE HD11 H -5.498 2.029 -16.206 1.00 . A A . 20 ILE HD11 1 1 10 3971 1 1 20 ILE HD12 H -4.341 2.439 -17.495 1.00 . A A . 20 ILE HD12 1 1 10 3972 1 1 20 ILE HD13 H -5.612 3.599 -17.037 1.00 . A A . 20 ILE HD13 1 1 10 3973 1 1 20 ILE HG12 H -5.774 1.173 -18.777 1.00 . A A . 20 ILE HG12 1 1 10 3974 1 1 20 ILE HG13 H -6.641 2.691 -18.898 1.00 . A A . 20 ILE HG13 1 1 10 3975 1 1 20 ILE HG21 H -7.534 2.911 -16.115 1.00 . A A . 20 ILE HG21 1 1 10 3976 1 1 20 ILE HG22 H -8.944 2.874 -17.201 1.00 . A A . 20 ILE HG22 1 1 10 3977 1 1 20 ILE HG23 H -8.824 1.711 -15.859 1.00 . A A . 20 ILE HG23 1 1 10 3978 1 1 20 ILE N N -6.872 0.321 -15.369 1.00 . A A . 20 ILE N 1 1 10 3979 1 1 20 ILE O O -6.053 -1.498 -18.287 1.00 . A A . 20 ILE O 1 1 10 3980 1 1 21 HIS C C -3.514 -2.476 -17.059 1.00 . A A . 21 HIS C 1 1 10 3981 1 1 21 HIS CA C -3.512 -0.964 -17.292 1.00 . A A . 21 HIS CA 1 1 10 3982 1 1 21 HIS CB C -2.306 -0.268 -16.658 1.00 . A A . 21 HIS CB 1 1 10 3983 1 1 21 HIS CD2 C -0.392 -1.246 -18.145 1.00 . A A . 21 HIS CD2 1 1 10 3984 1 1 21 HIS CE1 C 0.945 -1.901 -16.542 1.00 . A A . 21 HIS CE1 1 1 10 3985 1 1 21 HIS CG C -0.985 -0.935 -16.957 1.00 . A A . 21 HIS CG 1 1 10 3986 1 1 21 HIS H H -4.655 0.232 -16.026 1.00 . A A . 21 HIS H 1 1 10 3987 1 1 21 HIS HA H -3.482 -0.770 -18.364 1.00 . A A . 21 HIS HA 1 1 10 3988 1 1 21 HIS HB2 H -2.268 0.763 -17.009 1.00 . A A . 21 HIS HB2 1 1 10 3989 1 1 21 HIS HB3 H -2.447 -0.232 -15.578 1.00 . A A . 21 HIS HB3 1 1 10 3990 1 1 21 HIS HD1 H -0.269 -1.274 -14.980 1.00 . A A . 21 HIS HD1 1 1 10 3991 1 1 21 HIS HD2 H -0.807 -1.050 -19.134 1.00 . A A . 21 HIS HD2 1 1 10 3992 1 1 21 HIS HE1 H 1.806 -2.328 -16.028 1.00 . A A . 21 HIS HE1 1 1 10 3993 1 1 21 HIS HE2 H 1.393 -2.211 -18.579 1.00 . A A . 21 HIS HE2 1 1 10 3994 1 1 21 HIS N N -4.754 -0.393 -16.800 1.00 . A A . 21 HIS N 1 1 10 3995 1 1 21 HIS ND1 N -0.118 -1.360 -15.965 1.00 . A A . 21 HIS ND1 1 1 10 3996 1 1 21 HIS NE2 N 0.773 -1.829 -17.893 1.00 . A A . 21 HIS NE2 1 1 10 3997 1 1 21 HIS O O -3.231 -3.249 -17.973 1.00 . A A . 21 HIS O 1 1 10 3998 1 1 22 ASP C C -4.857 -4.999 -16.352 1.00 . A A . 22 ASP C 1 1 10 3999 1 1 22 ASP CA C -3.859 -4.258 -15.460 1.00 . A A . 22 ASP CA 1 1 10 4000 1 1 22 ASP CB C -4.299 -4.437 -14.006 1.00 . A A . 22 ASP CB 1 1 10 4001 1 1 22 ASP CG C -3.366 -5.294 -13.149 1.00 . A A . 22 ASP CG 1 1 10 4002 1 1 22 ASP H H -4.078 -2.219 -15.096 1.00 . A A . 22 ASP H 1 1 10 4003 1 1 22 ASP HA H -2.836 -4.607 -15.600 1.00 . A A . 22 ASP HA 1 1 10 4004 1 1 22 ASP HB2 H -4.391 -3.453 -13.546 1.00 . A A . 22 ASP HB2 1 1 10 4005 1 1 22 ASP HB3 H -5.292 -4.887 -13.996 1.00 . A A . 22 ASP HB3 1 1 10 4006 1 1 22 ASP N N -3.836 -2.853 -15.831 1.00 . A A . 22 ASP N 1 1 10 4007 1 1 22 ASP O O -4.603 -6.129 -16.768 1.00 . A A . 22 ASP O 1 1 10 4008 1 1 22 ASP OD1 O -3.322 -6.516 -13.405 1.00 . A A . 22 ASP OD1 1 1 10 4009 1 1 22 ASP OD2 O -2.717 -4.706 -12.256 1.00 . A A . 22 ASP OD2 1 1 10 4010 1 1 23 ALA C C -6.477 -5.089 -18.876 1.00 . A A . 23 ALA C 1 1 10 4011 1 1 23 ALA CA C -7.010 -4.916 -17.452 1.00 . A A . 23 ALA CA 1 1 10 4012 1 1 23 ALA CB C -8.260 -4.036 -17.400 1.00 . A A . 23 ALA CB 1 1 10 4013 1 1 23 ALA H H -6.170 -3.416 -16.276 1.00 . A A . 23 ALA H 1 1 10 4014 1 1 23 ALA HA H -7.253 -5.897 -17.043 1.00 . A A . 23 ALA HA 1 1 10 4015 1 1 23 ALA HB1 H -8.055 -3.085 -17.891 1.00 . A A . 23 ALA HB1 1 1 10 4016 1 1 23 ALA HB2 H -9.080 -4.540 -17.912 1.00 . A A . 23 ALA HB2 1 1 10 4017 1 1 23 ALA HB3 H -8.535 -3.858 -16.361 1.00 . A A . 23 ALA HB3 1 1 10 4018 1 1 23 ALA N N -5.972 -4.334 -16.618 1.00 . A A . 23 ALA N 1 1 10 4019 1 1 23 ALA O O -6.646 -6.146 -19.482 1.00 . A A . 23 ALA O 1 1 10 4020 1 1 24 GLN C C -4.362 -5.281 -20.867 1.00 . A A . 24 GLN C 1 1 10 4021 1 1 24 GLN CA C -5.272 -4.061 -20.704 1.00 . A A . 24 GLN CA 1 1 10 4022 1 1 24 GLN CB C -4.511 -2.767 -21.001 1.00 . A A . 24 GLN CB 1 1 10 4023 1 1 24 GLN CD C -6.696 -2.123 -22.083 1.00 . A A . 24 GLN CD 1 1 10 4024 1 1 24 GLN CG C -5.478 -1.621 -21.306 1.00 . A A . 24 GLN CG 1 1 10 4025 1 1 24 GLN H H -5.720 -3.174 -18.873 1.00 . A A . 24 GLN H 1 1 10 4026 1 1 24 GLN HA H -6.121 -4.140 -21.382 1.00 . A A . 24 GLN HA 1 1 10 4027 1 1 24 GLN HB2 H -3.887 -2.504 -20.147 1.00 . A A . 24 GLN HB2 1 1 10 4028 1 1 24 GLN HB3 H -3.843 -2.920 -21.849 1.00 . A A . 24 GLN HB3 1 1 10 4029 1 1 24 GLN HE21 H -7.837 -1.726 -20.459 1.00 . A A . 24 GLN HE21 1 1 10 4030 1 1 24 GLN HE22 H -8.687 -2.379 -21.820 1.00 . A A . 24 GLN HE22 1 1 10 4031 1 1 24 GLN HG2 H -5.802 -1.157 -20.374 1.00 . A A . 24 GLN HG2 1 1 10 4032 1 1 24 GLN HG3 H -4.965 -0.852 -21.883 1.00 . A A . 24 GLN HG3 1 1 10 4033 1 1 24 GLN N N -5.844 -4.034 -19.369 1.00 . A A . 24 GLN N 1 1 10 4034 1 1 24 GLN NE2 N -7.834 -2.072 -21.397 1.00 . A A . 24 GLN NE2 1 1 10 4035 1 1 24 GLN O O -4.268 -5.849 -21.954 1.00 . A A . 24 GLN O 1 1 10 4036 1 1 24 GLN OE1 O -6.608 -2.530 -23.230 1.00 . A A . 24 GLN OE1 1 1 10 4037 1 1 25 ARG C C -3.589 -8.066 -20.132 1.00 . A A . 25 ARG C 1 1 10 4038 1 1 25 ARG CA C -2.820 -6.792 -19.777 1.00 . A A . 25 ARG CA 1 1 10 4039 1 1 25 ARG CB C -2.147 -6.973 -18.415 1.00 . A A . 25 ARG CB 1 1 10 4040 1 1 25 ARG CD C -0.298 -5.428 -17.671 1.00 . A A . 25 ARG CD 1 1 10 4041 1 1 25 ARG CG C -0.650 -6.666 -18.498 1.00 . A A . 25 ARG CG 1 1 10 4042 1 1 25 ARG CZ C -0.392 -3.459 -19.196 1.00 . A A . 25 ARG CZ 1 1 10 4043 1 1 25 ARG H H -3.797 -5.180 -18.890 1.00 . A A . 25 ARG H 1 1 10 4044 1 1 25 ARG HA H -2.076 -6.558 -20.539 1.00 . A A . 25 ARG HA 1 1 10 4045 1 1 25 ARG HB2 H -2.616 -6.315 -17.683 1.00 . A A . 25 ARG HB2 1 1 10 4046 1 1 25 ARG HB3 H -2.293 -7.995 -18.066 1.00 . A A . 25 ARG HB3 1 1 10 4047 1 1 25 ARG HD2 H -0.623 -5.565 -16.640 1.00 . A A . 25 ARG HD2 1 1 10 4048 1 1 25 ARG HD3 H 0.784 -5.291 -17.649 1.00 . A A . 25 ARG HD3 1 1 10 4049 1 1 25 ARG HE H -1.855 -3.981 -17.915 1.00 . A A . 25 ARG HE 1 1 10 4050 1 1 25 ARG HG2 H -0.079 -7.522 -18.139 1.00 . A A . 25 ARG HG2 1 1 10 4051 1 1 25 ARG HG3 H -0.365 -6.506 -19.538 1.00 . A A . 25 ARG HG3 1 1 10 4052 1 1 25 ARG HH11 H 1.318 -4.552 -19.326 1.00 . A A . 25 ARG HH11 1 1 10 4053 1 1 25 ARG HH12 H 1.238 -3.180 -20.380 1.00 . A A . 25 ARG HH12 1 1 10 4054 1 1 25 ARG HH21 H -1.962 -2.171 -19.306 1.00 . A A . 25 ARG HH21 1 1 10 4055 1 1 25 ARG HH22 H -0.641 -1.817 -20.368 1.00 . A A . 25 ARG HH22 1 1 10 4056 1 1 25 ARG N N -3.716 -5.648 -19.770 1.00 . A A . 25 ARG N 1 1 10 4057 1 1 25 ARG NE N -0.946 -4.231 -18.251 1.00 . A A . 25 ARG NE 1 1 10 4058 1 1 25 ARG NH1 N 0.824 -3.756 -19.674 1.00 . A A . 25 ARG NH1 1 1 10 4059 1 1 25 ARG NH2 N -1.054 -2.392 -19.663 1.00 . A A . 25 ARG NH2 1 1 10 4060 1 1 25 ARG O O -4.455 -8.504 -19.375 1.00 . A A . 25 ARG O 1 1 stop_ save_
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