NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
467878 | 2kjn | 16332 | cing | 4-filtered-FRED | STAR | entry | full | 268 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2kjn # This FRED archive file contains, for PDB entry <2kjn>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2kjn _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2kjn _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2787.53 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 $lah4 A . 1 1 stop_ save_ save_lah4 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name lah4 _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code KKALLALALHHLAHLALHLALALKKA _Entity.Number_of_monomers 26 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 LYS . 1 1 2 LYS . 1 1 3 ALA . 1 1 4 LEU . 1 1 5 LEU . 1 1 6 ALA . 1 1 7 LEU . 1 1 8 ALA . 1 1 9 LEU . 1 1 10 HIS . 1 1 11 HIS . 1 1 12 LEU . 1 1 13 ALA . 1 1 14 HIS . 1 1 15 LEU . 1 1 16 ALA . 1 1 17 LEU . 1 1 18 HIS . 1 1 19 LEU . 1 1 20 ALA . 1 1 21 LEU . 1 1 22 ALA . 1 1 23 LEU . 1 1 24 LYS . 1 1 25 LYS . 1 1 26 ALA . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID LYS 1 1 1 1 LYS 2 2 1 1 ALA 3 3 1 1 LEU 4 4 1 1 LEU 5 5 1 1 ALA 6 6 1 1 LEU 7 7 1 1 ALA 8 8 1 1 LEU 9 9 1 1 HIS 10 10 1 1 HIS 11 11 1 1 LEU 12 12 1 1 ALA 13 13 1 1 HIS 14 14 1 1 LEU 15 15 1 1 ALA 16 16 1 1 LEU 17 17 1 1 HIS 18 18 1 1 LEU 19 19 1 1 ALA 20 20 1 1 LEU 21 21 1 1 ALA 22 22 1 1 LEU 23 23 1 1 LYS 24 24 1 1 LYS 25 25 1 1 ALA 26 26 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_2 _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 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 LYS HA . 2 . HA 1 1 1 1 2 1 1 3 ALA H . 3 . HN 1 1 2 1 1 1 1 2 LYS QB . 2 . HB# 1 1 2 1 2 1 1 3 ALA H . 3 . HN 1 1 3 1 1 1 1 2 LYS H . 2 . HN 1 1 3 1 2 1 1 2 LYS HA . 2 . HA 1 1 4 1 1 1 1 2 LYS QE . 2 . HE* 1 1 4 1 2 1 1 3 ALA H . 3 . HN 1 1 5 1 1 1 1 2 LYS QG . 2 . HG* 1 1 5 1 2 1 1 3 ALA H . 3 . HN 1 1 6 1 1 1 1 3 ALA HA . 3 . HA 1 1 6 1 2 1 1 4 LEU H . 4 . HN 1 1 7 1 1 1 1 3 ALA MB . 3 . HB# 1 1 7 1 2 1 1 4 LEU H . 4 . HN 1 1 8 1 1 1 1 3 ALA H . 3 . HN 1 1 8 1 2 1 1 3 ALA MB . 3 . HB# 1 1 9 1 1 1 1 3 ALA H . 3 . HN 1 1 9 1 2 1 1 3 ALA HA . 3 . HA 1 1 10 1 1 1 1 3 ALA HA . 3 . HA 1 1 10 1 2 1 1 3 ALA MB . 3 . HB# 1 1 11 1 1 1 1 4 LEU HA . 4 . HA 1 1 11 1 2 1 1 5 LEU H . 5 . HN 1 1 12 1 1 1 1 4 LEU QB . 4 . HB# 1 1 12 1 2 1 1 5 LEU H . 5 . HN 1 1 13 1 1 1 1 4 LEU H . 4 . HN 1 1 13 1 2 1 1 4 LEU QB . 4 . HB# 1 1 14 1 1 1 1 4 LEU H . 4 . HN 1 1 14 1 2 1 1 4 LEU HA . 4 . HA 1 1 15 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 15 1 2 1 1 5 LEU H . 5 . HN 1 1 16 1 1 1 1 4 LEU HG . 4 . HG 1 1 16 1 2 1 1 5 LEU H . 5 . HN 1 1 17 1 1 1 1 5 LEU HA . 5 . HA 1 1 17 1 2 1 1 6 ALA H . 6 . HN 1 1 18 1 1 1 1 5 LEU QB . 5 . HB# 1 1 18 1 2 1 1 6 ALA H . 6 . HN 1 1 19 1 1 1 1 5 LEU H . 5 . HN 1 1 19 1 2 1 1 5 LEU HB2 . 5 . HB1 1 1 20 1 1 1 1 5 LEU H . 5 . HN 1 1 20 1 2 1 1 5 LEU HB3 . 5 . HB2 1 1 21 1 1 1 1 5 LEU H . 5 . HN 1 1 21 1 2 1 1 5 LEU HA . 5 . HA 1 1 22 1 1 1 1 5 LEU QD . 5 . HD2# 1 1 22 1 2 1 1 6 ALA H . 6 . HN 1 1 23 1 1 1 1 5 LEU HG . 5 . HG 1 1 23 1 2 1 1 6 ALA H . 6 . HN 1 1 24 1 1 1 1 6 ALA HA . 6 . HA 1 1 24 1 2 1 1 7 LEU H . 7 . HN 1 1 25 1 1 1 1 6 ALA MB . 6 . HB# 1 1 25 1 2 1 1 7 LEU H . 7 . HN 1 1 26 1 1 1 1 6 ALA H . 6 . HN 1 1 26 1 2 1 1 6 ALA MB . 6 . HB# 1 1 27 1 1 1 1 6 ALA H . 6 . HN 1 1 27 1 2 1 1 6 ALA HA . 6 . HA 1 1 28 1 1 1 1 6 ALA HA . 6 . HA 1 1 28 1 2 1 1 6 ALA MB . 6 . HB# 1 1 29 1 1 1 1 7 LEU HA . 7 . HA 1 1 29 1 2 1 1 8 ALA H . 8 . HN 1 1 30 1 1 1 1 7 LEU QB . 7 . HB# 1 1 30 1 2 1 1 8 ALA H . 8 . HN 1 1 31 1 1 1 1 7 LEU H . 7 . HN 1 1 31 1 2 1 1 7 LEU HB3 . 7 . HB1 1 1 32 1 1 1 1 7 LEU H . 7 . HN 1 1 32 1 2 1 1 7 LEU HB2 . 7 . HB2 1 1 33 1 1 1 1 7 LEU H . 7 . HN 1 1 33 1 2 1 1 7 LEU HA . 7 . HA 1 1 34 1 1 1 1 7 LEU QD . 7 . HD1# 1 1 34 1 2 1 1 8 ALA H . 8 . HN 1 1 35 1 1 1 1 8 ALA HA . 8 . HA 1 1 35 1 2 1 1 9 LEU H . 9 . HN 1 1 36 1 1 1 1 8 ALA H . 8 . HN 1 1 36 1 2 1 1 9 LEU H . 9 . HN 1 1 37 1 1 1 1 8 ALA H . 8 . HN 1 1 37 1 2 1 1 10 HIS H . 10 . HN 1 1 38 1 1 1 1 8 ALA HA . 8 . HA 1 1 38 1 2 1 1 10 HIS H . 10 . HN 1 1 39 1 1 1 1 8 ALA MB . 8 . HB# 1 1 39 1 2 1 1 9 LEU H . 9 . HN 1 1 40 1 1 1 1 8 ALA H . 8 . HN 1 1 40 1 2 1 1 8 ALA MB . 8 . HB# 1 1 41 1 1 1 1 8 ALA H . 8 . HN 1 1 41 1 2 1 1 8 ALA HA . 8 . HA 1 1 42 1 1 1 1 8 ALA HA . 8 . HA 1 1 42 1 2 1 1 8 ALA MB . 8 . HB# 1 1 43 1 1 1 1 8 ALA HA . 8 . HA 1 1 43 1 2 1 1 11 HIS QB . 11 . HB1 1 1 44 1 1 1 1 9 LEU H . 9 . HN 1 1 44 1 2 1 1 10 HIS H . 10 . HN 1 1 45 1 1 1 1 9 LEU H . 9 . HN 1 1 45 1 2 1 1 11 HIS H . 11 . HN 1 1 46 1 1 1 1 9 LEU HA . 9 . HA 1 1 46 1 2 1 1 10 HIS H . 10 . HN 1 1 47 1 1 1 1 9 LEU HA . 9 . HA 1 1 47 1 2 1 1 11 HIS H . 11 . HN 1 1 48 1 1 1 1 9 LEU HA . 9 . HA 1 1 48 1 2 1 1 12 LEU H . 12 . HN 1 1 49 1 1 1 1 9 LEU HA . 9 . HA 1 1 49 1 2 1 1 13 ALA H . 13 . HN 1 1 50 1 1 1 1 9 LEU QB . 9 . HB# 1 1 50 1 2 1 1 10 HIS H . 10 . HN 1 1 51 1 1 1 1 9 LEU HA . 9 . HA 1 1 51 1 2 1 1 12 LEU QB . 12 . HB# 1 1 52 1 1 1 1 9 LEU H . 9 . HN 1 1 52 1 2 1 1 11 HIS HD2 . 11 . HD2 1 1 53 1 1 1 1 9 LEU H . 9 . HN 1 1 53 1 2 1 1 10 HIS HD2 . 10 . HD2 1 1 54 1 1 1 1 9 LEU H . 9 . HN 1 1 54 1 2 1 1 9 LEU QB . 9 . HB# 1 1 55 1 1 1 1 9 LEU H . 9 . HN 1 1 55 1 2 1 1 9 LEU HA . 9 . HA 1 1 56 1 1 1 1 9 LEU MD1 . 9 . HD1# 1 1 56 1 2 1 1 10 HIS H . 10 . HN 1 1 57 1 1 1 1 9 LEU MD2 . 9 . HD2# 1 1 57 1 2 1 1 10 HIS H . 10 . HN 1 1 58 1 1 1 1 9 LEU HG . 9 . HG 1 1 58 1 2 1 1 10 HIS H . 10 . HN 1 1 59 1 1 1 1 9 LEU QB . 9 . HB# 1 1 59 1 2 1 1 11 HIS QB . 11 . HB2 1 1 60 1 1 1 1 10 HIS H . 10 . HN 1 1 60 1 2 1 1 11 HIS H . 11 . HN 1 1 61 1 1 1 1 10 HIS H . 10 . HN 1 1 61 1 2 1 1 12 LEU H . 12 . HN 1 1 62 1 1 1 1 10 HIS HA . 10 . HA 1 1 62 1 2 1 1 11 HIS H . 11 . HN 1 1 63 1 1 1 1 10 HIS HA . 10 . HA 1 1 63 1 2 1 1 12 LEU H . 12 . HN 1 1 64 1 1 1 1 10 HIS HA . 10 . HA 1 1 64 1 2 1 1 13 ALA H . 13 . HN 1 1 65 1 1 1 1 10 HIS HA . 10 . HA 1 1 65 1 2 1 1 14 HIS H . 14 . HN 1 1 66 1 1 1 1 10 HIS HB2 . 10 . HB1 1 1 66 1 2 1 1 11 HIS H . 11 . HN 1 1 67 1 1 1 1 10 HIS HB3 . 10 . HB2 1 1 67 1 2 1 1 11 HIS H . 11 . HN 1 1 68 1 1 1 1 10 HIS HB2 . 10 . HB1 1 1 68 1 2 1 1 12 LEU H . 12 . HN 1 1 69 1 1 1 1 10 HIS HB3 . 10 . HB2 1 1 69 1 2 1 1 12 LEU H . 12 . HN 1 1 70 1 1 1 1 10 HIS HA . 10 . HA 1 1 70 1 2 1 1 13 ALA MB . 13 . HB# 1 1 71 1 1 1 1 10 HIS H . 10 . HN 1 1 71 1 2 1 1 10 HIS HD2 . 10 . HD2 1 1 72 1 1 1 1 10 HIS HB2 . 10 . HB1 1 1 72 1 2 1 1 10 HIS HD2 . 10 . HD2 1 1 73 1 1 1 1 10 HIS HB2 . 10 . HB1 1 1 73 1 2 1 1 10 HIS HE1 . 10 . HE1 1 1 74 1 1 1 1 10 HIS HB3 . 10 . HB2 1 1 74 1 2 1 1 10 HIS HE1 . 10 . HE1 1 1 75 1 1 1 1 10 HIS HB3 . 10 . HB2 1 1 75 1 2 1 1 10 HIS HD2 . 10 . HD2 1 1 76 1 1 1 1 10 HIS H . 10 . HN 1 1 76 1 2 1 1 10 HIS HB2 . 10 . HB1 1 1 77 1 1 1 1 10 HIS H . 10 . HN 1 1 77 1 2 1 1 10 HIS HB3 . 10 . HB2 1 1 78 1 1 1 1 10 HIS H . 10 . HN 1 1 78 1 2 1 1 10 HIS HA . 10 . HA 1 1 79 1 1 1 1 10 HIS H . 10 . HN 1 1 79 1 2 1 1 11 HIS HD2 . 11 . HD2 1 1 80 1 1 1 1 11 HIS H . 11 . HN 1 1 80 1 2 1 1 12 LEU H . 12 . HN 1 1 81 1 1 1 1 11 HIS H . 11 . HN 1 1 81 1 2 1 1 13 ALA H . 13 . HN 1 1 82 1 1 1 1 11 HIS HA . 11 . HA 1 1 82 1 2 1 1 12 LEU H . 12 . HN 1 1 83 1 1 1 1 11 HIS HA . 11 . HA 1 1 83 1 2 1 1 13 ALA H . 13 . HN 1 1 84 1 1 1 1 11 HIS HA . 11 . HA 1 1 84 1 2 1 1 14 HIS H . 14 . HN 1 1 85 1 1 1 1 11 HIS QB . 11 . HB1 1 1 85 1 2 1 1 12 LEU H . 12 . HN 1 1 86 1 1 1 1 11 HIS QB . 11 . HB1 1 1 86 1 2 1 1 13 ALA H . 13 . HN 1 1 87 1 1 1 1 11 HIS HA . 11 . HA 1 1 87 1 2 1 1 14 HIS QB . 14 . HB# 1 1 88 1 1 1 1 11 HIS H . 11 . HN 1 1 88 1 2 1 1 11 HIS HD2 . 11 . HD2 1 1 89 1 1 1 1 11 HIS QB . 11 . HB2 1 1 89 1 2 1 1 11 HIS HD1 . 11 . HD1 1 1 90 1 1 1 1 11 HIS QB . 11 . HB1 1 1 90 1 2 1 1 11 HIS HE1 . 11 . HE1 1 1 91 1 1 1 1 11 HIS QB . 11 . HB1 1 1 91 1 2 1 1 11 HIS HD2 . 11 . HD2 1 1 92 1 1 1 1 11 HIS H . 11 . HN 1 1 92 1 2 1 1 11 HIS HA . 11 . HA 1 1 93 1 1 1 1 12 LEU H . 12 . HN 1 1 93 1 2 1 1 13 ALA H . 13 . HN 1 1 94 1 1 1 1 12 LEU H . 12 . HN 1 1 94 1 2 1 1 14 HIS H . 14 . HN 1 1 95 1 1 1 1 12 LEU HA . 12 . HA 1 1 95 1 2 1 1 13 ALA H . 13 . HN 1 1 96 1 1 1 1 12 LEU HA . 12 . HA 1 1 96 1 2 1 1 14 HIS H . 14 . HN 1 1 97 1 1 1 1 12 LEU HA . 12 . HA 1 1 97 1 2 1 1 15 LEU H . 15 . HN 1 1 98 1 1 1 1 12 LEU QB . 12 . HB# 1 1 98 1 2 1 1 13 ALA H . 13 . HN 1 1 99 1 1 1 1 12 LEU H . 12 . HN 1 1 99 1 2 1 1 12 LEU QB . 12 . HB# 1 1 100 1 1 1 1 12 LEU H . 12 . HN 1 1 100 1 2 1 1 12 LEU HA . 12 . HA 1 1 101 1 1 1 1 12 LEU QD . 12 . HD# 1 1 101 1 2 1 1 13 ALA H . 13 . HN 1 1 102 1 1 1 1 12 LEU HG . 12 . HG 1 1 102 1 2 1 1 13 ALA H . 13 . HN 1 1 103 1 1 1 1 12 LEU HA . 12 . HA 1 1 103 1 2 1 1 14 HIS HD2 . 14 . HD2 1 1 104 1 1 1 1 13 ALA H . 13 . HN 1 1 104 1 2 1 1 15 LEU H . 15 . HN 1 1 105 1 1 1 1 13 ALA H . 13 . HN 1 1 105 1 2 1 1 14 HIS H . 14 . HN 1 1 106 1 1 1 1 13 ALA HA . 13 . HA 1 1 106 1 2 1 1 14 HIS H . 14 . HN 1 1 107 1 1 1 1 13 ALA HA . 13 . HA 1 1 107 1 2 1 1 15 LEU H . 15 . HN 1 1 108 1 1 1 1 13 ALA HA . 13 . HA 1 1 108 1 2 1 1 16 ALA H . 16 . HN 1 1 109 1 1 1 1 13 ALA MB . 13 . HB# 1 1 109 1 2 1 1 14 HIS H . 14 . HN 1 1 110 1 1 1 1 13 ALA HA . 13 . HA 1 1 110 1 2 1 1 16 ALA MB . 16 . HB# 1 1 111 1 1 1 1 13 ALA H . 13 . HN 1 1 111 1 2 1 1 13 ALA MB . 13 . HB# 1 1 112 1 1 1 1 13 ALA H . 13 . HN 1 1 112 1 2 1 1 13 ALA HA . 13 . HA 1 1 113 1 1 1 1 14 HIS H . 14 . HN 1 1 113 1 2 1 1 15 LEU H . 15 . HN 1 1 114 1 1 1 1 14 HIS H . 14 . HN 1 1 114 1 2 1 1 16 ALA H . 16 . HN 1 1 115 1 1 1 1 14 HIS HA . 14 . HA 1 1 115 1 2 1 1 15 LEU H . 15 . HN 1 1 116 1 1 1 1 14 HIS HA . 14 . HA 1 1 116 1 2 1 1 16 ALA H . 16 . HN 1 1 117 1 1 1 1 14 HIS HA . 14 . HA 1 1 117 1 2 1 1 17 LEU H . 17 . HN 1 1 118 1 1 1 1 14 HIS HA . 14 . HA 1 1 118 1 2 1 1 18 HIS H . 18 . HN 1 1 119 1 1 1 1 14 HIS HB3 . 14 . HB1 1 1 119 1 2 1 1 15 LEU H . 15 . HN 1 1 120 1 1 1 1 14 HIS HB2 . 14 . HB2 1 1 120 1 2 1 1 15 LEU H . 15 . HN 1 1 121 1 1 1 1 14 HIS HB3 . 14 . HB1 1 1 121 1 2 1 1 16 ALA H . 16 . HN 1 1 122 1 1 1 1 14 HIS HB2 . 14 . HB2 1 1 122 1 2 1 1 16 ALA H . 16 . HN 1 1 123 1 1 1 1 14 HIS H . 14 . HN 1 1 123 1 2 1 1 14 HIS HD2 . 14 . HD2 1 1 124 1 1 1 1 14 HIS HB2 . 14 . HB2 1 1 124 1 2 1 1 14 HIS HD2 . 14 . HD2 1 1 125 1 1 1 1 14 HIS HB3 . 14 . HB1 1 1 125 1 2 1 1 14 HIS HE1 . 14 . HE1 1 1 126 1 1 1 1 14 HIS HB3 . 14 . HB1 1 1 126 1 2 1 1 14 HIS HD2 . 14 . HD2 1 1 127 1 1 1 1 14 HIS HB2 . 14 . HB2 1 1 127 1 2 1 1 14 HIS HE1 . 14 . HE1 1 1 128 1 1 1 1 14 HIS H . 14 . HN 1 1 128 1 2 1 1 14 HIS HB2 . 14 . HB2 1 1 129 1 1 1 1 14 HIS H . 14 . HN 1 1 129 1 2 1 1 14 HIS HB3 . 14 . HB1 1 1 130 1 1 1 1 14 HIS H . 14 . HN 1 1 130 1 2 1 1 14 HIS HA . 14 . HA 1 1 131 1 1 1 1 14 HIS HA . 14 . HA 1 1 131 1 2 1 1 17 LEU HB2 . 17 . HB1 1 1 132 1 1 1 1 14 HIS HE1 . 14 . HE1 1 1 132 1 2 1 1 18 HIS HD2 . 18 . HD2 1 1 133 1 1 1 1 15 LEU H . 15 . HN 1 1 133 1 2 1 1 16 ALA H . 16 . HN 1 1 134 1 1 1 1 15 LEU H . 15 . HN 1 1 134 1 2 1 1 17 LEU H . 17 . HN 1 1 135 1 1 1 1 15 LEU HA . 15 . HA 1 1 135 1 2 1 1 16 ALA H . 16 . HN 1 1 136 1 1 1 1 15 LEU HA . 15 . HA 1 1 136 1 2 1 1 17 LEU H . 17 . HN 1 1 137 1 1 1 1 15 LEU HA . 15 . HA 1 1 137 1 2 1 1 18 HIS H . 18 . HN 1 1 138 1 1 1 1 15 LEU HA . 15 . HA 1 1 138 1 2 1 1 19 LEU H . 19 . HN 1 1 139 1 1 1 1 15 LEU QB . 15 . HB# 1 1 139 1 2 1 1 16 ALA H . 16 . HN 1 1 140 1 1 1 1 15 LEU H . 15 . HN 1 1 140 1 2 1 1 15 LEU QB . 15 . HB# 1 1 141 1 1 1 1 15 LEU H . 15 . HN 1 1 141 1 2 1 1 15 LEU HA . 15 . HA 1 1 142 1 1 1 1 15 LEU MD1 . 15 . HD1# 1 1 142 1 2 1 1 16 ALA H . 16 . HN 1 1 143 1 1 1 1 15 LEU MD2 . 15 . HD2# 1 1 143 1 2 1 1 16 ALA H . 16 . HN 1 1 144 1 1 1 1 15 LEU HG . 15 . HG 1 1 144 1 2 1 1 16 ALA H . 16 . HN 1 1 145 1 1 1 1 15 LEU H . 15 . HN 1 1 145 1 2 1 1 16 ALA MB . 16 . HB# 1 1 146 1 1 1 1 15 LEU H . 15 . HN 1 1 146 1 2 1 1 16 ALA HA . 16 . HA 1 1 147 1 1 1 1 14 HIS HE1 . 14 . HE1 1 1 147 1 2 1 1 15 LEU MD1 . 15 . HD1# 1 1 148 1 1 1 1 16 ALA H . 16 . HN 1 1 148 1 2 1 1 17 LEU H . 17 . HN 1 1 149 1 1 1 1 16 ALA H . 16 . HN 1 1 149 1 2 1 1 18 HIS H . 18 . HN 1 1 150 1 1 1 1 16 ALA HA . 16 . HA 1 1 150 1 2 1 1 17 LEU H . 17 . HN 1 1 151 1 1 1 1 16 ALA HA . 16 . HA 1 1 151 1 2 1 1 18 HIS H . 18 . HN 1 1 152 1 1 1 1 16 ALA HA . 16 . HA 1 1 152 1 2 1 1 19 LEU H . 19 . HN 1 1 153 1 1 1 1 16 ALA MB . 16 . HB# 1 1 153 1 2 1 1 17 LEU H . 17 . HN 1 1 154 1 1 1 1 16 ALA HA . 16 . HA 1 1 154 1 2 1 1 19 LEU QB . 19 . HB# 1 1 155 1 1 1 1 16 ALA H . 16 . HN 1 1 155 1 2 1 1 16 ALA MB . 16 . HB# 1 1 156 1 1 1 1 16 ALA H . 16 . HN 1 1 156 1 2 1 1 16 ALA HA . 16 . HA 1 1 157 1 1 1 1 17 LEU H . 17 . HN 1 1 157 1 2 1 1 18 HIS H . 18 . HN 1 1 158 1 1 1 1 17 LEU H . 17 . HN 1 1 158 1 2 1 1 19 LEU H . 19 . HN 1 1 159 1 1 1 1 17 LEU HA . 17 . HA 1 1 159 1 2 1 1 18 HIS H . 18 . HN 1 1 160 1 1 1 1 17 LEU HA . 17 . HA 1 1 160 1 2 1 1 19 LEU H . 19 . HN 1 1 161 1 1 1 1 17 LEU HA . 17 . HA 1 1 161 1 2 1 1 20 ALA H . 20 . HN 1 1 162 1 1 1 1 17 LEU HA . 17 . HA 1 1 162 1 2 1 1 21 LEU H . 21 . HN 1 1 163 1 1 1 1 17 LEU QB . 17 . HB# 1 1 163 1 2 1 1 18 HIS H . 18 . HN 1 1 164 1 1 1 1 17 LEU HA . 17 . HA 1 1 164 1 2 1 1 20 ALA MB . 20 . HB# 1 1 165 1 1 1 1 17 LEU QD . 17 . HD# 1 1 165 1 2 1 1 18 HIS HD2 . 18 . HD2 1 1 166 1 1 1 1 17 LEU QB . 17 . HB# 1 1 166 1 2 1 1 18 HIS HD2 . 18 . HD2 1 1 167 1 1 1 1 17 LEU HG . 17 . HG 1 1 167 1 2 1 1 18 HIS HD2 . 18 . HD2 1 1 168 1 1 1 1 17 LEU H . 17 . HN 1 1 168 1 2 1 1 17 LEU QB . 17 . HB# 1 1 169 1 1 1 1 17 LEU H . 17 . HN 1 1 169 1 2 1 1 17 LEU HA . 17 . HA 1 1 170 1 1 1 1 17 LEU QD . 17 . HD# 1 1 170 1 2 1 1 18 HIS H . 18 . HN 1 1 171 1 1 1 1 17 LEU HG . 17 . HG 1 1 171 1 2 1 1 18 HIS H . 18 . HN 1 1 172 1 1 1 1 17 LEU HG . 17 . HG 1 1 172 1 2 1 1 18 HIS HB2 . 18 . HB2 1 1 173 1 1 1 1 18 HIS H . 18 . HN 1 1 173 1 2 1 1 19 LEU H . 19 . HN 1 1 174 1 1 1 1 18 HIS H . 18 . HN 1 1 174 1 2 1 1 20 ALA H . 20 . HN 1 1 175 1 1 1 1 18 HIS HA . 18 . HA 1 1 175 1 2 1 1 19 LEU H . 19 . HN 1 1 176 1 1 1 1 18 HIS HA . 18 . HA 1 1 176 1 2 1 1 20 ALA H . 20 . HN 1 1 177 1 1 1 1 18 HIS HA . 18 . HA 1 1 177 1 2 1 1 21 LEU H . 21 . HN 1 1 178 1 1 1 1 18 HIS HB3 . 18 . HB1 1 1 178 1 2 1 1 19 LEU H . 19 . HN 1 1 179 1 1 1 1 18 HIS HB2 . 18 . HB2 1 1 179 1 2 1 1 19 LEU H . 19 . HN 1 1 180 1 1 1 1 18 HIS HB3 . 18 . HB1 1 1 180 1 2 1 1 20 ALA H . 20 . HN 1 1 181 1 1 1 1 18 HIS HB2 . 18 . HB2 1 1 181 1 2 1 1 20 ALA H . 20 . HN 1 1 182 1 1 1 1 18 HIS H . 18 . HN 1 1 182 1 2 1 1 18 HIS HD2 . 18 . HD2 1 1 183 1 1 1 1 18 HIS HB2 . 18 . HB2 1 1 183 1 2 1 1 18 HIS HE1 . 18 . HE1 1 1 184 1 1 1 1 18 HIS HB3 . 18 . HB1 1 1 184 1 2 1 1 18 HIS HD2 . 18 . HD2 1 1 185 1 1 1 1 18 HIS HB3 . 18 . HB1 1 1 185 1 2 1 1 18 HIS HE1 . 18 . HE1 1 1 186 1 1 1 1 18 HIS HB2 . 18 . HB2 1 1 186 1 2 1 1 18 HIS HD2 . 18 . HD2 1 1 187 1 1 1 1 18 HIS H . 18 . HN 1 1 187 1 2 1 1 18 HIS HB3 . 18 . HB1 1 1 188 1 1 1 1 18 HIS H . 18 . HN 1 1 188 1 2 1 1 18 HIS HB2 . 18 . HB2 1 1 189 1 1 1 1 18 HIS H . 18 . HN 1 1 189 1 2 1 1 18 HIS HA . 18 . HA 1 1 190 1 1 1 1 18 HIS HE1 . 18 . HE1 1 1 190 1 2 1 1 19 LEU QD . 19 . HD# 1 1 191 1 1 1 1 19 LEU H . 19 . HN 1 1 191 1 2 1 1 20 ALA H . 20 . HN 1 1 192 1 1 1 1 19 LEU H . 19 . HN 1 1 192 1 2 1 1 21 LEU H . 21 . HN 1 1 193 1 1 1 1 19 LEU HA . 19 . HA 1 1 193 1 2 1 1 20 ALA H . 20 . HN 1 1 194 1 1 1 1 19 LEU HA . 19 . HA 1 1 194 1 2 1 1 21 LEU H . 21 . HN 1 1 195 1 1 1 1 19 LEU HA . 19 . HA 1 1 195 1 2 1 1 22 ALA H . 22 . HN 1 1 196 1 1 1 1 19 LEU QB . 19 . HB# 1 1 196 1 2 1 1 20 ALA H . 20 . HN 1 1 197 1 1 1 1 19 LEU HA . 19 . HA 1 1 197 1 2 1 1 22 ALA MB . 22 . HB# 1 1 198 1 1 1 1 19 LEU H . 19 . HN 1 1 198 1 2 1 1 19 LEU QB . 19 . HB# 1 1 199 1 1 1 1 19 LEU H . 19 . HN 1 1 199 1 2 1 1 19 LEU HA . 19 . HA 1 1 200 1 1 1 1 19 LEU QD . 19 . HD# 1 1 200 1 2 1 1 20 ALA H . 20 . HN 1 1 201 1 1 1 1 19 LEU HG . 19 . HG 1 1 201 1 2 1 1 20 ALA H . 20 . HN 1 1 202 1 1 1 1 20 ALA H . 20 . HN 1 1 202 1 2 1 1 21 LEU H . 21 . HN 1 1 203 1 1 1 1 20 ALA H . 20 . HN 1 1 203 1 2 1 1 22 ALA H . 22 . HN 1 1 204 1 1 1 1 20 ALA HA . 20 . HA 1 1 204 1 2 1 1 21 LEU H . 21 . HN 1 1 205 1 1 1 1 20 ALA HA . 20 . HA 1 1 205 1 2 1 1 22 ALA H . 22 . HN 1 1 206 1 1 1 1 20 ALA HA . 20 . HA 1 1 206 1 2 1 1 23 LEU H . 23 . HN 1 1 207 1 1 1 1 20 ALA HA . 20 . HA 1 1 207 1 2 1 1 24 LYS H . 24 . HN 1 1 208 1 1 1 1 20 ALA MB . 20 . HB# 1 1 208 1 2 1 1 21 LEU H . 21 . HN 1 1 209 1 1 1 1 20 ALA HA . 20 . HA 1 1 209 1 2 1 1 23 LEU QB . 23 . HB# 1 1 210 1 1 1 1 20 ALA H . 20 . HN 1 1 210 1 2 1 1 20 ALA MB . 20 . HB# 1 1 211 1 1 1 1 20 ALA H . 20 . HN 1 1 211 1 2 1 1 20 ALA HA . 20 . HA 1 1 212 1 1 1 1 21 LEU H . 21 . HN 1 1 212 1 2 1 1 22 ALA H . 22 . HN 1 1 213 1 1 1 1 21 LEU H . 21 . HN 1 1 213 1 2 1 1 23 LEU H . 23 . HN 1 1 214 1 1 1 1 21 LEU HA . 21 . HA 1 1 214 1 2 1 1 22 ALA H . 22 . HN 1 1 215 1 1 1 1 21 LEU HA . 21 . HA 1 1 215 1 2 1 1 23 LEU H . 23 . HN 1 1 216 1 1 1 1 21 LEU HA . 21 . HA 1 1 216 1 2 1 1 24 LYS H . 24 . HN 1 1 217 1 1 1 1 21 LEU QB . 21 . HB# 1 1 217 1 2 1 1 22 ALA H . 22 . HN 1 1 218 1 1 1 1 21 LEU HA . 21 . HA 1 1 218 1 2 1 1 24 LYS QB . 24 . HB# 1 1 219 1 1 1 1 21 LEU H . 21 . HN 1 1 219 1 2 1 1 21 LEU QB . 21 . HB# 1 1 220 1 1 1 1 21 LEU H . 21 . HN 1 1 220 1 2 1 1 21 LEU HA . 21 . HA 1 1 221 1 1 1 1 21 LEU QD . 21 . HD# 1 1 221 1 2 1 1 22 ALA H . 22 . HN 1 1 222 1 1 1 1 22 ALA H . 22 . HN 1 1 222 1 2 1 1 23 LEU H . 23 . HN 1 1 223 1 1 1 1 22 ALA H . 22 . HN 1 1 223 1 2 1 1 24 LYS H . 24 . HN 1 1 224 1 1 1 1 22 ALA HA . 22 . HA 1 1 224 1 2 1 1 23 LEU H . 23 . HN 1 1 225 1 1 1 1 22 ALA HA . 22 . HA 1 1 225 1 2 1 1 24 LYS H . 24 . HN 1 1 226 1 1 1 1 22 ALA HA . 22 . HA 1 1 226 1 2 1 1 25 LYS H . 25 . HN 1 1 227 1 1 1 1 22 ALA MB . 22 . HB# 1 1 227 1 2 1 1 23 LEU H . 23 . HN 1 1 228 1 1 1 1 22 ALA H . 22 . HN 1 1 228 1 2 1 1 22 ALA MB . 22 . HB# 1 1 229 1 1 1 1 22 ALA H . 22 . HN 1 1 229 1 2 1 1 22 ALA HA . 22 . HA 1 1 230 1 1 1 1 23 LEU H . 23 . HN 1 1 230 1 2 1 1 24 LYS H . 24 . HN 1 1 231 1 1 1 1 23 LEU HA . 23 . HA 1 1 231 1 2 1 1 24 LYS H . 24 . HN 1 1 232 1 1 1 1 23 LEU QB . 23 . HB# 1 1 232 1 2 1 1 24 LYS H . 24 . HN 1 1 233 1 1 1 1 23 LEU H . 23 . HN 1 1 233 1 2 1 1 23 LEU HB2 . 23 . HB1 1 1 234 1 1 1 1 23 LEU H . 23 . HN 1 1 234 1 2 1 1 23 LEU HB3 . 23 . HB2 1 1 235 1 1 1 1 23 LEU H . 23 . HN 1 1 235 1 2 1 1 23 LEU HA . 23 . HA 1 1 236 1 1 1 1 23 LEU QD . 23 . HD# 1 1 236 1 2 1 1 24 LYS H . 24 . HN 1 1 237 1 1 1 1 24 LYS HA . 24 . HA 1 1 237 1 2 1 1 25 LYS H . 25 . HN 1 1 238 1 1 1 1 24 LYS QB . 24 . HB# 1 1 238 1 2 1 1 25 LYS H . 25 . HN 1 1 239 1 1 1 1 24 LYS H . 24 . HN 1 1 239 1 2 1 1 24 LYS QB . 24 . HB# 1 1 240 1 1 1 1 24 LYS H . 24 . HN 1 1 240 1 2 1 1 24 LYS HA . 24 . HA 1 1 241 1 1 1 1 24 LYS HA . 24 . HA 1 1 241 1 2 1 1 24 LYS QD . 24 . HD# 1 1 242 1 1 1 1 24 LYS HA . 24 . HA 1 1 242 1 2 1 1 24 LYS QG . 24 . HG# 1 1 243 1 1 1 1 24 LYS QG . 24 . HG* 1 1 243 1 2 1 1 25 LYS H . 25 . HN 1 1 244 1 1 1 1 24 LYS QE . 24 . HE* 1 1 244 1 2 1 1 25 LYS H . 25 . HN 1 1 245 1 1 1 1 25 LYS HA . 25 . HA 1 1 245 1 2 1 1 26 ALA H . 26 . HN 1 1 246 1 1 1 1 25 LYS H . 25 . HN 1 1 246 1 2 1 1 25 LYS QB . 25 . HB# 1 1 247 1 1 1 1 25 LYS H . 25 . HN 1 1 247 1 2 1 1 25 LYS HA . 25 . HA 1 1 248 1 1 1 1 25 LYS HA . 25 . HA 1 1 248 1 2 1 1 25 LYS QG . 25 . HG# 1 1 249 1 1 1 1 25 LYS HA . 25 . HA 1 1 249 1 2 1 1 25 LYS QD . 25 . HD# 1 1 250 1 1 1 1 25 LYS QG . 25 . HG* 1 1 250 1 2 1 1 26 ALA H . 26 . HN 1 1 251 1 1 1 1 25 LYS QE . 25 . HE* 1 1 251 1 2 1 1 26 ALA H . 26 . HN 1 1 252 1 1 1 1 26 ALA H . 26 . HN 1 1 252 1 2 1 1 26 ALA MB . 26 . HB# 1 1 253 1 1 1 1 26 ALA H . 26 . HN 1 1 253 1 2 1 1 26 ALA HA . 26 . HA 1 1 254 1 1 1 1 26 ALA HA . 26 . HA 1 1 254 1 2 1 1 26 ALA MB . 26 . HB# 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.7 3.3 4.1 1 1 2 1 . . . . . 4.3 3.7 6.1 1 1 3 1 . . . . . 2.6 2.3 2.9 1 1 4 1 . . . . . 4.2 3.6 6.0 1 1 5 1 . . . . . 3.9 3.5 5.3 1 1 6 1 . . . . . 4.1 3.5 4.9 1 1 7 1 . . . . . 4.1 3.5 5.9 1 1 8 1 . . . . . 3.0 2.6 3.4 1 1 9 1 . . . . . 2.7 2.4 3.0 1 1 10 1 . . . . . 2.8 2.4 3.2 1 1 11 1 . . . . . 4.3 3.7 5.1 1 1 12 1 . . . . . 4.1 3.5 5.9 1 1 13 1 . . . . . 3.0 2.6 4.0 1 1 14 1 . . . . . 2.7 2.4 3.0 1 1 15 1 . . . . . 4.1 3.8 5.9 1 1 16 1 . . . . . 4.0 3.4 4.8 1 1 17 1 . . . . . 4.1 3.5 4.9 1 1 18 1 . . . . . 4.1 3.5 5.9 1 1 19 1 . . . . . 2.6 2.3 2.9 1 1 20 1 . . . . . 3.0 2.6 3.4 1 1 21 1 . . . . . 2.6 2.3 2.9 1 1 22 1 . . . . . 4.1 3.7 5.9 1 1 23 1 . . . . . 3.9 3.5 4.3 1 1 24 1 . . . . . 4.2 3.6 5.0 1 1 25 1 . . . . . 4.1 3.5 5.9 1 1 26 1 . . . . . 3.2 2.8 3.6 1 1 27 1 . . . . . 2.7 2.4 3.0 1 1 28 1 . . . . . 2.8 2.4 3.2 1 1 29 1 . . . . . 4.1 3.5 4.9 1 1 30 1 . . . . . 4.1 3.5 5.9 1 1 31 1 . . . . . 3.5 2.9 4.3 1 1 32 1 . . . . . 2.5 2.2 2.8 1 1 33 1 . . . . . 2.7 2.4 3.0 1 1 34 1 . . . . . 4.1 3.7 5.9 1 1 35 1 . . . . . 3.2 2.9 3.5 1 1 36 1 . . . . . 2.5 2.2 2.8 1 1 37 1 . . . . . 4.0 3.4 4.8 1 1 38 1 . . . . . 4.0 3.4 4.8 1 1 39 1 . . . . . 2.9 2.6 4.2 1 1 40 1 . . . . . 3.0 2.6 3.4 1 1 41 1 . . . . . 2.6 2.3 2.9 1 1 42 1 . . . . . 2.8 2.4 3.2 1 1 43 1 . . . . . 3.2 2.8 3.6 1 1 44 1 . . . . . 2.5 2.2 2.8 1 1 45 1 . . . . . 4.0 3.4 4.8 1 1 46 1 . . . . . 3.2 2.9 3.5 1 1 47 1 . . . . . 4.0 3.4 4.8 1 1 48 1 . . . . . 3.1 2.8 3.4 1 1 49 1 . . . . . 4.0 3.4 4.8 1 1 50 1 . . . . . 2.8 2.5 4.1 1 1 51 1 . . . . . 3.1 2.8 4.4 1 1 52 1 . . . . . 3.6 3.2 4.0 1 1 53 1 . . . . . 4.0 3.4 4.8 1 1 54 1 . . . . . 2.8 2.5 3.8 1 1 55 1 . . . . . 2.5 2.2 2.8 1 1 56 1 . . . . . 4.0 3.6 5.4 1 1 57 1 . . . . . 3.7 3.3 5.1 1 1 58 1 . . . . . 3.6 3.2 4.0 1 1 59 1 . . . . . 4.0 3.4 5.8 1 1 60 1 . . . . . 2.5 2.2 2.8 1 1 61 1 . . . . . 4.0 3.4 4.8 1 1 62 1 . . . . . 3.2 2.9 3.5 1 1 63 1 . . . . . 4.0 3.4 4.8 1 1 64 1 . . . . . 3.1 2.8 3.4 1 1 65 1 . . . . . 4.0 3.4 4.8 1 1 66 1 . . . . . 3.1 2.8 3.4 1 1 67 1 . . . . . 3.6 3.2 4.0 1 1 68 1 . . . . . 4.0 3.4 4.8 1 1 69 1 . . . . . 4.3 3.7 5.1 1 1 70 1 . . . . . 3.1 2.8 4.4 1 1 71 1 . . . . . 3.4 3.1 3.7 1 1 72 1 . . . . . 3.1 2.7 3.5 1 1 73 1 . . . . . 4.9 4.6 5.2 1 1 74 1 . . . . . 4.9 4.6 5.2 1 1 75 1 . . . . . 3.1 2.7 3.5 1 1 76 1 . . . . . 2.5 2.2 2.8 1 1 77 1 . . . . . 3.6 3.0 4.4 1 1 78 1 . . . . . 2.5 2.2 2.8 1 1 79 1 . . . . . 3.9 3.5 4.3 1 1 80 1 . . . . . 2.5 2.2 2.8 1 1 81 1 . . . . . 4.0 3.4 4.8 1 1 82 1 . . . . . 3.2 2.9 3.5 1 1 83 1 . . . . . 4.0 3.4 4.8 1 1 84 1 . . . . . 3.1 2.8 3.4 1 1 85 1 . . . . . . 3.2 3.4 1 1 86 1 . . . . . 4.0 3.7 4.8 1 1 87 1 . . . . . 3.1 2.8 4.4 1 1 88 1 . . . . . 3.6 3.2 4.0 1 1 89 1 . . . . . 3.1 2.7 3.5 1 1 90 1 . . . . . 4.9 4.6 5.2 1 1 91 1 . . . . . 3.1 2.7 3.5 1 1 92 1 . . . . . 2.5 2.2 2.8 1 1 93 1 . . . . . 2.5 2.2 2.8 1 1 94 1 . . . . . 4.0 3.4 4.8 1 1 95 1 . . . . . 3.2 2.9 3.5 1 1 96 1 . . . . . 4.0 3.4 4.8 1 1 97 1 . . . . . 3.1 2.8 3.4 1 1 98 1 . . . . . 2.8 2.5 4.1 1 1 99 1 . . . . . 2.8 2.5 3.8 1 1 100 1 . . . . . 2.5 2.2 2.8 1 1 101 1 . . . . . 4.0 3.4 6.4 1 1 102 1 . . . . . 4.4 3.8 5.2 1 1 103 1 . . . . . 4.0 3.4 4.8 1 1 104 1 . . . . . 4.0 3.4 4.8 1 1 105 1 . . . . . 2.5 2.2 2.8 1 1 106 1 . . . . . 3.2 2.9 3.5 1 1 107 1 . . . . . 4.0 3.4 4.8 1 1 108 1 . . . . . 3.1 2.8 3.4 1 1 109 1 . . . . . 2.9 2.6 4.2 1 1 110 1 . . . . . 3.2 2.9 4.5 1 1 111 1 . . . . . 3.0 2.6 3.4 1 1 112 1 . . . . . 2.5 2.2 2.8 1 1 113 1 . . . . . 2.5 2.2 2.8 1 1 114 1 . . . . . 4.0 3.4 4.8 1 1 115 1 . . . . . 3.2 2.9 3.5 1 1 116 1 . . . . . 4.0 3.4 4.8 1 1 117 1 . . . . . 3.1 2.8 3.4 1 1 118 1 . . . . . 4.0 3.4 4.8 1 1 119 1 . . . . . 2.9 2.6 3.2 1 1 120 1 . . . . . 3.6 3.2 4.0 1 1 121 1 . . . . . 4.0 3.4 4.8 1 1 122 1 . . . . . 4.3 3.7 5.1 1 1 123 1 . . . . . 3.4 3.1 3.7 1 1 124 1 . . . . . 3.1 2.7 3.5 1 1 125 1 . . . . . 4.9 4.6 5.2 1 1 126 1 . . . . . 3.1 2.7 3.5 1 1 127 1 . . . . . 4.8 4.5 5.1 1 1 128 1 . . . . . 3.5 2.9 4.3 1 1 129 1 . . . . . 2.5 2.2 2.8 1 1 130 1 . . . . . 2.5 2.2 2.8 1 1 131 1 . . . . . 3.0 2.6 3.4 1 1 132 1 . . . . . 3.9 3.5 4.3 1 1 133 1 . . . . . 2.5 2.2 2.8 1 1 134 1 . . . . . 4.0 3.4 4.8 1 1 135 1 . . . . . 3.2 2.9 3.5 1 1 136 1 . . . . . 4.0 3.4 4.8 1 1 137 1 . . . . . 3.1 2.8 3.4 1 1 138 1 . . . . . 4.0 3.4 4.8 1 1 139 1 . . . . . 2.8 2.5 4.1 1 1 140 1 . . . . . 2.8 2.4 3.8 1 1 141 1 . . . . . 2.5 2.2 2.8 1 1 142 1 . . . . . 3.7 3.3 5.1 1 1 143 1 . . . . . 4.0 3.6 5.4 1 1 144 1 . . . . . 3.6 3.2 4.0 1 1 145 1 . . . . . 4.5 3.9 6.3 1 1 146 1 . . . . . 4.3 3.7 5.1 1 1 147 1 . . . . . 4.1 3.5 5.9 1 1 148 1 . . . . . 2.5 2.2 2.8 1 1 149 1 . . . . . 4.0 3.4 4.8 1 1 150 1 . . . . . 3.2 2.9 3.5 1 1 151 1 . . . . . 4.0 3.4 4.8 1 1 152 1 . . . . . 3.1 2.8 3.4 1 1 153 1 . . . . . 3.2 2.9 4.5 1 1 154 1 . . . . . 3.3 3.0 4.6 1 1 155 1 . . . . . 3.0 2.6 3.4 1 1 156 1 . . . . . 2.5 2.2 2.8 1 1 157 1 . . . . . 2.5 2.2 2.8 1 1 158 1 . . . . . 4.0 3.4 4.8 1 1 159 1 . . . . . 3.2 2.9 3.5 1 1 160 1 . . . . . 4.0 3.4 4.8 1 1 161 1 . . . . . 3.1 2.8 3.4 1 1 162 1 . . . . . 4.0 3.4 4.8 1 1 163 1 . . . . . 2.9 2.6 4.2 1 1 164 1 . . . . . 3.1 2.8 4.4 1 1 165 1 . . . . . 3.9 3.5 6.3 1 1 166 1 . . . . . 3.6 3.2 5.0 1 1 167 1 . . . . . 4.1 3.5 4.9 1 1 168 1 . . . . . 2.8 2.5 3.8 1 1 169 1 . . . . . 2.5 2.2 2.8 1 1 170 1 . . . . . 3.9 3.5 6.3 1 1 171 1 . . . . . 4.4 3.8 5.2 1 1 172 1 . . . . . 4.0 3.4 4.8 1 1 173 1 . . . . . 2.5 2.2 2.8 1 1 174 1 . . . . . 4.0 3.4 4.8 1 1 175 1 . . . . . 3.2 2.9 3.5 1 1 176 1 . . . . . 4.0 3.4 4.8 1 1 177 1 . . . . . 3.1 2.8 3.4 1 1 178 1 . . . . . 3.1 2.8 3.4 1 1 179 1 . . . . . 3.6 3.2 4.0 1 1 180 1 . . . . . 4.0 3.4 4.8 1 1 181 1 . . . . . 4.3 3.7 5.1 1 1 182 1 . . . . . 3.4 3.1 3.7 1 1 183 1 . . . . . 4.9 4.6 5.2 1 1 184 1 . . . . . 3.1 2.7 3.5 1 1 185 1 . . . . . 4.9 4.6 5.2 1 1 186 1 . . . . . 3.1 2.7 3.5 1 1 187 1 . . . . . 2.5 2.2 2.8 1 1 188 1 . . . . . 3.6 3.0 4.4 1 1 189 1 . . . . . 2.5 2.2 2.8 1 1 190 1 . . . . . 3.1 2.7 5.5 1 1 191 1 . . . . . 2.5 2.2 2.8 1 1 192 1 . . . . . 4.0 3.4 4.8 1 1 193 1 . . . . . 3.2 2.9 3.5 1 1 194 1 . . . . . 4.0 3.4 4.8 1 1 195 1 . . . . . 3.1 2.8 3.4 1 1 196 1 . . . . . 2.9 2.6 4.2 1 1 197 1 . . . . . 3.4 3.1 4.7 1 1 198 1 . . . . . 2.7 2.4 3.7 1 1 199 1 . . . . . 2.5 2.2 2.8 1 1 200 1 . . . . . 4.2 3.6 6.6 1 1 201 1 . . . . . 4.3 3.7 5.1 1 1 202 1 . . . . . 2.5 2.2 2.8 1 1 203 1 . . . . . 4.0 3.4 4.8 1 1 204 1 . . . . . 3.2 2.9 3.5 1 1 205 1 . . . . . 4.0 3.4 4.8 1 1 206 1 . . . . . 3.1 2.8 3.4 1 1 207 1 . . . . . 4.0 3.4 4.8 1 1 208 1 . . . . . 2.8 2.5 4.1 1 1 209 1 . . . . . 3.1 2.8 4.4 1 1 210 1 . . . . . 3.0 2.6 3.4 1 1 211 1 . . . . . 2.5 2.2 2.8 1 1 212 1 . . . . . 2.5 2.2 2.8 1 1 213 1 . . . . . 4.0 3.4 4.8 1 1 214 1 . . . . . 3.2 2.9 3.5 1 1 215 1 . . . . . 4.0 3.4 4.8 1 1 216 1 . . . . . 3.1 2.8 3.4 1 1 217 1 . . . . . 2.8 2.5 4.1 1 1 218 1 . . . . . 3.2 2.9 4.5 1 1 219 1 . . . . . 2.6 2.3 3.6 1 1 220 1 . . . . . 2.5 2.2 2.8 1 1 221 1 . . . . . 3.9 3.5 6.3 1 1 222 1 . . . . . 2.5 2.2 2.8 1 1 223 1 . . . . . 4.0 3.4 4.8 1 1 224 1 . . . . . 3.2 2.9 3.5 1 1 225 1 . . . . . 4.0 3.4 4.8 1 1 226 1 . . . . . 3.1 2.8 3.4 1 1 227 1 . . . . . 3.1 2.8 4.4 1 1 228 1 . . . . . 3.0 2.6 3.4 1 1 229 1 . . . . . 2.5 2.2 2.8 1 1 230 1 . . . . . 2.5 2.2 2.8 1 1 231 1 . . . . . 3.2 2.9 3.5 1 1 232 1 . . . . . 2.8 2.5 4.1 1 1 233 1 . . . . . 2.5 2.2 2.8 1 1 234 1 . . . . . 3.5 2.9 4.3 1 1 235 1 . . . . . 2.5 2.2 2.8 1 1 236 1 . . . . . 4.2 3.6 6.6 1 1 237 1 . . . . . 3.2 2.9 3.5 1 1 238 1 . . . . . 3.9 3.5 5.3 1 1 239 1 . . . . . 2.9 2.5 3.9 1 1 240 1 . . . . . 2.5 2.2 2.8 1 1 241 1 . . . . . 4.1 3.5 4.9 1 1 242 1 . . . . . 2.7 2.4 3.6 1 1 243 1 . . . . . 3.9 3.5 5.3 1 1 244 1 . . . . . 4.3 3.7 6.1 1 1 245 1 . . . . . 3.9 3.5 4.3 1 1 246 1 . . . . . 3.0 2.6 4.0 1 1 247 1 . . . . . 2.6 2.3 2.9 1 1 248 1 . . . . . 2.7 2.4 3.6 1 1 249 1 . . . . . 4.1 3.5 4.9 1 1 250 1 . . . . . 4.0 3.4 5.8 1 1 251 1 . . . . . 3.9 3.5 5.3 1 1 252 1 . . . . . 3.0 2.6 3.4 1 1 253 1 . . . . . 2.7 2.4 3.0 1 1 254 1 . . . . . 2.8 2.4 3.2 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_2 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 9 LEU O . 9 . O 1 2 1 1 2 1 1 12 LEU H . 12 . HN 1 2 2 1 1 1 1 9 LEU O . 9 . O 1 2 2 1 2 1 1 13 ALA H . 13 . HN 1 2 3 1 1 1 1 10 HIS O . 10 . O 1 2 3 1 2 1 1 14 HIS H . 14 . HN 1 2 4 1 1 1 1 11 HIS O . 11 . O 1 2 4 1 2 1 1 15 LEU H . 15 . HN 1 2 5 1 1 1 1 12 LEU O . 12 . O 1 2 5 1 2 1 1 16 ALA H . 16 . HN 1 2 6 1 1 1 1 13 ALA O . 13 . O 1 2 6 1 2 1 1 17 LEU H . 17 . HN 1 2 7 1 1 1 1 14 HIS O . 14 . O 1 2 7 1 2 1 1 18 HIS H . 18 . HN 1 2 8 1 1 1 1 15 LEU O . 15 . O 1 2 8 1 2 1 1 19 LEU H . 19 . HN 1 2 9 1 1 1 1 16 ALA O . 16 . O 1 2 9 1 2 1 1 20 ALA H . 20 . HN 1 2 10 1 1 1 1 17 LEU O . 17 . O 1 2 10 1 2 1 1 21 LEU H . 21 . HN 1 2 11 1 1 1 1 18 HIS O . 18 . O 1 2 11 1 2 1 1 22 ALA H . 22 . HN 1 2 12 1 1 1 1 19 LEU O . 19 . O 1 2 12 1 2 1 1 23 LEU H . 23 . HN 1 2 13 1 1 1 1 20 ALA O . 20 . O 1 2 13 1 2 1 1 24 LYS H . 24 . HN 1 2 14 1 1 1 1 21 LEU O . 21 . O 1 2 14 1 2 1 1 25 LYS H . 25 . HN 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.8 1.5 2.3 1 2 2 1 . . . . . 1.8 1.5 2.3 1 2 3 1 . . . . . 1.8 1.5 2.3 1 2 4 1 . . . . . 1.8 1.5 2.3 1 2 5 1 . . . . . 1.8 1.5 2.3 1 2 6 1 . . . . . 1.8 1.5 2.3 1 2 7 1 . . . . . 1.8 1.5 2.3 1 2 8 1 . . . . . 1.8 1.5 2.3 1 2 9 1 . . . . . 1.8 1.5 2.3 1 2 10 1 . . . . . 1.8 1.5 2.3 1 2 11 1 . . . . . 1.8 1.5 2.3 1 2 12 1 . . . . . 1.8 1.5 2.3 1 2 13 1 . . . . . 1.8 1.5 2.3 1 2 14 1 . . . . . 1.8 1.5 2.3 1 2 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 LYS C C -8.845 3.669 15.110 1.00 . A A . 1 LYS C 1 1 1 2 1 1 1 LYS CA C -8.011 2.777 16.016 1.00 . A A . 1 LYS CA 1 1 1 3 1 1 1 LYS CB C -6.878 2.123 15.209 1.00 . A A . 1 LYS CB 1 1 1 4 1 1 1 LYS CD C -6.343 0.318 13.555 1.00 . A A . 1 LYS CD 1 1 1 5 1 1 1 LYS CE C -6.924 -0.962 12.944 1.00 . A A . 1 LYS CE 1 1 1 6 1 1 1 LYS CG C -7.468 1.147 14.186 1.00 . A A . 1 LYS CG 1 1 1 7 1 1 1 LYS H1 H -9.372 2.111 17.434 1.00 . A A . 1 LYS H1 1 1 1 8 1 1 1 LYS H2 H -8.325 0.903 16.869 1.00 . A A . 1 LYS H2 1 1 1 9 1 1 1 LYS H3 H -9.603 1.447 15.898 1.00 . A A . 1 LYS H3 1 1 1 10 1 1 1 LYS HA H -7.589 3.369 16.814 1.00 . A A . 1 LYS HA 1 1 1 11 1 1 1 LYS HB2 H -6.315 2.890 14.695 1.00 . A A . 1 LYS HB2 1 1 1 12 1 1 1 LYS HB3 H -6.221 1.588 15.878 1.00 . A A . 1 LYS HB3 1 1 1 13 1 1 1 LYS HD2 H -5.861 0.900 12.781 1.00 . A A . 1 LYS HD2 1 1 1 14 1 1 1 LYS HD3 H -5.617 0.057 14.310 1.00 . A A . 1 LYS HD3 1 1 1 15 1 1 1 LYS HE2 H -7.575 -0.707 12.121 1.00 . A A . 1 LYS HE2 1 1 1 16 1 1 1 LYS HE3 H -6.120 -1.584 12.581 1.00 . A A . 1 LYS HE3 1 1 1 17 1 1 1 LYS HG2 H -8.169 0.492 14.681 1.00 . A A . 1 LYS HG2 1 1 1 18 1 1 1 LYS HG3 H -7.980 1.704 13.415 1.00 . A A . 1 LYS HG3 1 1 1 19 1 1 1 LYS HZ1 H -7.469 -1.315 14.919 1.00 . A A . 1 LYS HZ1 1 1 1 20 1 1 1 LYS HZ2 H -7.449 -2.709 13.945 1.00 . A A . 1 LYS HZ2 1 1 1 21 1 1 1 LYS HZ3 H -8.712 -1.587 13.803 1.00 . A A . 1 LYS HZ3 1 1 1 22 1 1 1 LYS N N -8.891 1.729 16.597 1.00 . A A . 1 LYS N 1 1 1 23 1 1 1 LYS NZ N -7.695 -1.697 13.980 1.00 . A A . 1 LYS NZ 1 1 1 24 1 1 1 LYS O O -9.787 3.202 14.458 1.00 . A A . 1 LYS O 1 1 1 25 1 1 2 LYS C C -8.763 5.753 12.771 1.00 . A A . 2 LYS C 1 1 1 26 1 1 2 LYS CA C -9.207 5.902 14.222 1.00 . A A . 2 LYS CA 1 1 1 27 1 1 2 LYS CB C -8.939 7.335 14.699 1.00 . A A . 2 LYS CB 1 1 1 28 1 1 2 LYS CD C -10.521 8.719 16.073 1.00 . A A . 2 LYS CD 1 1 1 29 1 1 2 LYS CE C -11.916 8.240 15.659 1.00 . A A . 2 LYS CE 1 1 1 30 1 1 2 LYS CG C -9.548 7.531 16.093 1.00 . A A . 2 LYS CG 1 1 1 31 1 1 2 LYS H H -7.729 5.257 15.595 1.00 . A A . 2 LYS H 1 1 1 32 1 1 2 LYS HA H -10.267 5.703 14.285 1.00 . A A . 2 LYS HA 1 1 1 33 1 1 2 LYS HB2 H -7.873 7.506 14.744 1.00 . A A . 2 LYS HB2 1 1 1 34 1 1 2 LYS HB3 H -9.387 8.035 14.010 1.00 . A A . 2 LYS HB3 1 1 1 35 1 1 2 LYS HD2 H -10.567 9.163 17.056 1.00 . A A . 2 LYS HD2 1 1 1 36 1 1 2 LYS HD3 H -10.174 9.456 15.363 1.00 . A A . 2 LYS HD3 1 1 1 37 1 1 2 LYS HE2 H -12.500 9.080 15.315 1.00 . A A . 2 LYS HE2 1 1 1 38 1 1 2 LYS HE3 H -11.828 7.518 14.860 1.00 . A A . 2 LYS HE3 1 1 1 39 1 1 2 LYS HG2 H -10.076 6.633 16.386 1.00 . A A . 2 LYS HG2 1 1 1 40 1 1 2 LYS HG3 H -8.759 7.728 16.805 1.00 . A A . 2 LYS HG3 1 1 1 41 1 1 2 LYS HZ1 H -12.608 8.255 17.627 1.00 . A A . 2 LYS HZ1 1 1 1 42 1 1 2 LYS HZ2 H -12.098 6.732 17.082 1.00 . A A . 2 LYS HZ2 1 1 1 43 1 1 2 LYS HZ3 H -13.581 7.374 16.553 1.00 . A A . 2 LYS HZ3 1 1 1 44 1 1 2 LYS N N -8.491 4.949 15.060 1.00 . A A . 2 LYS N 1 1 1 45 1 1 2 LYS NZ N -12.600 7.604 16.818 1.00 . A A . 2 LYS NZ 1 1 1 46 1 1 2 LYS O O -7.600 6.004 12.443 1.00 . A A . 2 LYS O 1 1 1 47 1 1 3 ALA C C -10.302 6.017 9.641 1.00 . A A . 3 ALA C 1 1 1 48 1 1 3 ALA CA C -9.374 5.161 10.492 1.00 . A A . 3 ALA CA 1 1 1 49 1 1 3 ALA CB C -9.529 3.689 10.100 1.00 . A A . 3 ALA CB 1 1 1 50 1 1 3 ALA H H -10.596 5.152 12.226 1.00 . A A . 3 ALA H 1 1 1 51 1 1 3 ALA HA H -8.352 5.463 10.314 1.00 . A A . 3 ALA HA 1 1 1 52 1 1 3 ALA HB1 H -9.083 3.527 9.130 1.00 . A A . 3 ALA HB1 1 1 1 53 1 1 3 ALA HB2 H -10.578 3.434 10.061 1.00 . A A . 3 ALA HB2 1 1 1 54 1 1 3 ALA HB3 H -9.034 3.067 10.831 1.00 . A A . 3 ALA HB3 1 1 1 55 1 1 3 ALA N N -9.686 5.338 11.908 1.00 . A A . 3 ALA N 1 1 1 56 1 1 3 ALA O O -11.388 6.399 10.086 1.00 . A A . 3 ALA O 1 1 1 57 1 1 4 LEU C C -11.138 6.263 6.348 1.00 . A A . 4 LEU C 1 1 1 58 1 1 4 LEU CA C -10.678 7.116 7.514 1.00 . A A . 4 LEU CA 1 1 1 59 1 1 4 LEU CB C -9.864 8.296 6.978 1.00 . A A . 4 LEU CB 1 1 1 60 1 1 4 LEU CD1 C -8.151 10.027 7.513 1.00 . A A . 4 LEU CD1 1 1 1 61 1 1 4 LEU CD2 C -9.893 9.440 9.207 1.00 . A A . 4 LEU CD2 1 1 1 62 1 1 4 LEU CG C -8.996 8.891 8.090 1.00 . A A . 4 LEU CG 1 1 1 63 1 1 4 LEU H H -9.005 5.976 8.122 1.00 . A A . 4 LEU H 1 1 1 64 1 1 4 LEU HA H -11.541 7.494 8.041 1.00 . A A . 4 LEU HA 1 1 1 65 1 1 4 LEU HB2 H -9.231 7.953 6.170 1.00 . A A . 4 LEU HB2 1 1 1 66 1 1 4 LEU HB3 H -10.539 9.053 6.605 1.00 . A A . 4 LEU HB3 1 1 1 67 1 1 4 LEU HD11 H -7.849 10.694 8.307 1.00 . A A . 4 LEU HD11 1 1 1 68 1 1 4 LEU HD12 H -8.734 10.574 6.787 1.00 . A A . 4 LEU HD12 1 1 1 69 1 1 4 LEU HD13 H -7.276 9.615 7.032 1.00 . A A . 4 LEU HD13 1 1 1 70 1 1 4 LEU HD21 H -10.312 8.619 9.768 1.00 . A A . 4 LEU HD21 1 1 1 71 1 1 4 LEU HD22 H -10.693 10.021 8.775 1.00 . A A . 4 LEU HD22 1 1 1 72 1 1 4 LEU HD23 H -9.308 10.065 9.864 1.00 . A A . 4 LEU HD23 1 1 1 73 1 1 4 LEU HG H -8.344 8.126 8.488 1.00 . A A . 4 LEU HG 1 1 1 74 1 1 4 LEU N N -9.875 6.311 8.422 1.00 . A A . 4 LEU N 1 1 1 75 1 1 4 LEU O O -10.866 5.062 6.303 1.00 . A A . 4 LEU O 1 1 1 76 1 1 5 LEU C C -11.170 6.017 3.217 1.00 . A A . 5 LEU C 1 1 1 77 1 1 5 LEU CA C -12.300 6.177 4.222 1.00 . A A . 5 LEU CA 1 1 1 78 1 1 5 LEU CB C -13.462 6.943 3.575 1.00 . A A . 5 LEU CB 1 1 1 79 1 1 5 LEU CD1 C -14.826 4.893 3.078 1.00 . A A . 5 LEU CD1 1 1 1 80 1 1 5 LEU CD2 C -14.944 5.938 5.345 1.00 . A A . 5 LEU CD2 1 1 1 81 1 1 5 LEU CG C -14.790 6.217 3.843 1.00 . A A . 5 LEU CG 1 1 1 82 1 1 5 LEU H H -11.985 7.851 5.487 1.00 . A A . 5 LEU H 1 1 1 83 1 1 5 LEU HA H -12.645 5.199 4.521 1.00 . A A . 5 LEU HA 1 1 1 84 1 1 5 LEU HB2 H -13.508 7.940 3.988 1.00 . A A . 5 LEU HB2 1 1 1 85 1 1 5 LEU HB3 H -13.300 7.006 2.508 1.00 . A A . 5 LEU HB3 1 1 1 86 1 1 5 LEU HD11 H -15.713 4.345 3.355 1.00 . A A . 5 LEU HD11 1 1 1 87 1 1 5 LEU HD12 H -13.949 4.310 3.321 1.00 . A A . 5 LEU HD12 1 1 1 88 1 1 5 LEU HD13 H -14.847 5.090 2.017 1.00 . A A . 5 LEU HD13 1 1 1 89 1 1 5 LEU HD21 H -14.509 4.978 5.582 1.00 . A A . 5 LEU HD21 1 1 1 90 1 1 5 LEU HD22 H -15.994 5.924 5.600 1.00 . A A . 5 LEU HD22 1 1 1 91 1 1 5 LEU HD23 H -14.443 6.712 5.913 1.00 . A A . 5 LEU HD23 1 1 1 92 1 1 5 LEU HG H -15.604 6.841 3.511 1.00 . A A . 5 LEU HG 1 1 1 93 1 1 5 LEU N N -11.817 6.890 5.401 1.00 . A A . 5 LEU N 1 1 1 94 1 1 5 LEU O O -10.522 6.994 2.838 1.00 . A A . 5 LEU O 1 1 1 95 1 1 6 ALA C C -9.966 3.072 1.321 1.00 . A A . 6 ALA C 1 1 1 96 1 1 6 ALA CA C -9.877 4.506 1.819 1.00 . A A . 6 ALA CA 1 1 1 97 1 1 6 ALA CB C -8.510 4.734 2.461 1.00 . A A . 6 ALA CB 1 1 1 98 1 1 6 ALA H H -11.484 4.041 3.128 1.00 . A A . 6 ALA H 1 1 1 99 1 1 6 ALA HA H -9.985 5.173 0.978 1.00 . A A . 6 ALA HA 1 1 1 100 1 1 6 ALA HB1 H -8.592 5.502 3.214 1.00 . A A . 6 ALA HB1 1 1 1 101 1 1 6 ALA HB2 H -7.805 5.043 1.706 1.00 . A A . 6 ALA HB2 1 1 1 102 1 1 6 ALA HB3 H -8.170 3.818 2.920 1.00 . A A . 6 ALA HB3 1 1 1 103 1 1 6 ALA N N -10.938 4.783 2.784 1.00 . A A . 6 ALA N 1 1 1 104 1 1 6 ALA O O -10.726 2.262 1.858 1.00 . A A . 6 ALA O 1 1 1 105 1 1 7 LEU C C -8.023 0.612 0.388 1.00 . A A . 7 LEU C 1 1 1 106 1 1 7 LEU CA C -9.164 1.402 -0.235 1.00 . A A . 7 LEU CA 1 1 1 107 1 1 7 LEU CB C -9.011 1.420 -1.753 1.00 . A A . 7 LEU CB 1 1 1 108 1 1 7 LEU CD1 C -11.226 0.983 -2.839 1.00 . A A . 7 LEU CD1 1 1 1 109 1 1 7 LEU CD2 C -9.221 -0.329 -3.523 1.00 . A A . 7 LEU CD2 1 1 1 110 1 1 7 LEU CG C -9.925 0.346 -2.353 1.00 . A A . 7 LEU CG 1 1 1 111 1 1 7 LEU H H -8.577 3.433 -0.080 1.00 . A A . 7 LEU H 1 1 1 112 1 1 7 LEU HA H -10.101 0.923 0.017 1.00 . A A . 7 LEU HA 1 1 1 113 1 1 7 LEU HB2 H -9.287 2.392 -2.138 1.00 . A A . 7 LEU HB2 1 1 1 114 1 1 7 LEU HB3 H -7.985 1.207 -2.011 1.00 . A A . 7 LEU HB3 1 1 1 115 1 1 7 LEU HD11 H -11.819 1.282 -1.988 1.00 . A A . 7 LEU HD11 1 1 1 116 1 1 7 LEU HD12 H -11.777 0.263 -3.425 1.00 . A A . 7 LEU HD12 1 1 1 117 1 1 7 LEU HD13 H -11.002 1.845 -3.442 1.00 . A A . 7 LEU HD13 1 1 1 118 1 1 7 LEU HD21 H -9.652 -1.306 -3.684 1.00 . A A . 7 LEU HD21 1 1 1 119 1 1 7 LEU HD22 H -8.171 -0.432 -3.301 1.00 . A A . 7 LEU HD22 1 1 1 120 1 1 7 LEU HD23 H -9.346 0.273 -4.410 1.00 . A A . 7 LEU HD23 1 1 1 121 1 1 7 LEU HG H -10.154 -0.396 -1.599 1.00 . A A . 7 LEU HG 1 1 1 122 1 1 7 LEU N N -9.172 2.752 0.305 1.00 . A A . 7 LEU N 1 1 1 123 1 1 7 LEU O O -6.849 0.917 0.170 1.00 . A A . 7 LEU O 1 1 1 124 1 1 8 ALA C C -6.456 -1.903 0.855 1.00 . A A . 8 ALA C 1 1 1 125 1 1 8 ALA CA C -7.393 -1.238 1.846 1.00 . A A . 8 ALA CA 1 1 1 126 1 1 8 ALA CB C -8.105 -2.316 2.658 1.00 . A A . 8 ALA CB 1 1 1 127 1 1 8 ALA H H -9.336 -0.590 1.286 1.00 . A A . 8 ALA H 1 1 1 128 1 1 8 ALA HA H -6.813 -0.624 2.510 1.00 . A A . 8 ALA HA 1 1 1 129 1 1 8 ALA HB1 H -8.620 -1.858 3.489 1.00 . A A . 8 ALA HB1 1 1 1 130 1 1 8 ALA HB2 H -7.380 -3.024 3.028 1.00 . A A . 8 ALA HB2 1 1 1 131 1 1 8 ALA HB3 H -8.817 -2.825 2.029 1.00 . A A . 8 ALA HB3 1 1 1 132 1 1 8 ALA N N -8.382 -0.402 1.163 1.00 . A A . 8 ALA N 1 1 1 133 1 1 8 ALA O O -5.329 -2.269 1.194 1.00 . A A . 8 ALA O 1 1 1 134 1 1 9 LEU C C -5.052 -1.743 -1.859 1.00 . A A . 9 LEU C 1 1 1 135 1 1 9 LEU CA C -6.167 -2.669 -1.419 1.00 . A A . 9 LEU CA 1 1 1 136 1 1 9 LEU CB C -7.080 -2.938 -2.602 1.00 . A A . 9 LEU CB 1 1 1 137 1 1 9 LEU CD1 C -7.960 -4.677 -4.166 1.00 . A A . 9 LEU CD1 1 1 1 138 1 1 9 LEU CD2 C -5.567 -4.761 -3.453 1.00 . A A . 9 LEU CD2 1 1 1 139 1 1 9 LEU CG C -6.997 -4.412 -3.012 1.00 . A A . 9 LEU CG 1 1 1 140 1 1 9 LEU H H -7.848 -1.736 -0.537 1.00 . A A . 9 LEU H 1 1 1 141 1 1 9 LEU HA H -5.747 -3.592 -1.068 1.00 . A A . 9 LEU HA 1 1 1 142 1 1 9 LEU HB2 H -8.095 -2.696 -2.314 1.00 . A A . 9 LEU HB2 1 1 1 143 1 1 9 LEU HB3 H -6.780 -2.310 -3.424 1.00 . A A . 9 LEU HB3 1 1 1 144 1 1 9 LEU HD11 H -7.809 -5.678 -4.534 1.00 . A A . 9 LEU HD11 1 1 1 145 1 1 9 LEU HD12 H -7.777 -3.971 -4.961 1.00 . A A . 9 LEU HD12 1 1 1 146 1 1 9 LEU HD13 H -8.978 -4.573 -3.819 1.00 . A A . 9 LEU HD13 1 1 1 147 1 1 9 LEU HD21 H -5.307 -4.192 -4.331 1.00 . A A . 9 LEU HD21 1 1 1 148 1 1 9 LEU HD22 H -5.508 -5.815 -3.680 1.00 . A A . 9 LEU HD22 1 1 1 149 1 1 9 LEU HD23 H -4.874 -4.529 -2.657 1.00 . A A . 9 LEU HD23 1 1 1 150 1 1 9 LEU HG H -7.276 -5.030 -2.169 1.00 . A A . 9 LEU HG 1 1 1 151 1 1 9 LEU N N -6.940 -2.052 -0.355 1.00 . A A . 9 LEU N 1 1 1 152 1 1 9 LEU O O -3.873 -2.015 -1.636 1.00 . A A . 9 LEU O 1 1 1 153 1 1 10 HIS C C -3.564 0.651 -1.772 1.00 . A A . 10 HIS C 1 1 1 154 1 1 10 HIS CA C -4.489 0.364 -2.918 1.00 . A A . 10 HIS CA 1 1 1 155 1 1 10 HIS CB C -5.207 1.649 -3.310 1.00 . A A . 10 HIS CB 1 1 1 156 1 1 10 HIS CD2 C -6.223 0.657 -5.526 1.00 . A A . 10 HIS CD2 1 1 1 157 1 1 10 HIS CE1 C -5.738 2.302 -6.852 1.00 . A A . 10 HIS CE1 1 1 1 158 1 1 10 HIS CG C -5.578 1.605 -4.767 1.00 . A A . 10 HIS CG 1 1 1 159 1 1 10 HIS H H -6.405 -0.470 -2.580 1.00 . A A . 10 HIS H 1 1 1 160 1 1 10 HIS HA H -3.930 -0.019 -3.759 1.00 . A A . 10 HIS HA 1 1 1 161 1 1 10 HIS HB2 H -6.098 1.759 -2.713 1.00 . A A . 10 HIS HB2 1 1 1 162 1 1 10 HIS HB3 H -4.550 2.482 -3.126 1.00 . A A . 10 HIS HB3 1 1 1 163 1 1 10 HIS HD1 H -4.818 3.483 -5.399 1.00 . A A . 10 HIS HD1 1 1 1 164 1 1 10 HIS HD2 H -6.581 -0.292 -5.162 1.00 . A A . 10 HIS HD2 1 1 1 165 1 1 10 HIS HE1 H -5.634 2.922 -7.735 1.00 . A A . 10 HIS HE1 1 1 1 166 1 1 10 HIS HE2 H -6.734 0.629 -7.600 1.00 . A A . 10 HIS HE2 1 1 1 167 1 1 10 HIS N N -5.448 -0.630 -2.463 1.00 . A A . 10 HIS N 1 1 1 168 1 1 10 HIS ND1 N -5.280 2.644 -5.633 1.00 . A A . 10 HIS ND1 1 1 1 169 1 1 10 HIS NE2 N -6.324 1.100 -6.843 1.00 . A A . 10 HIS NE2 1 1 1 170 1 1 10 HIS O O -2.352 0.781 -1.928 1.00 . A A . 10 HIS O 1 1 1 171 1 1 11 HIS C C -2.230 0.121 0.689 1.00 . A A . 11 HIS C 1 1 1 172 1 1 11 HIS CA C -3.492 0.948 0.630 1.00 . A A . 11 HIS CA 1 1 1 173 1 1 11 HIS CB C -4.404 0.511 1.760 1.00 . A A . 11 HIS CB 1 1 1 174 1 1 11 HIS CD2 C -5.747 2.705 2.217 1.00 . A A . 11 HIS CD2 1 1 1 175 1 1 11 HIS CE1 C -4.929 3.187 4.170 1.00 . A A . 11 HIS CE1 1 1 1 176 1 1 11 HIS CG C -4.857 1.713 2.531 1.00 . A A . 11 HIS CG 1 1 1 177 1 1 11 HIS H H -5.155 0.581 -0.599 1.00 . A A . 11 HIS H 1 1 1 178 1 1 11 HIS HA H -3.258 1.992 0.731 1.00 . A A . 11 HIS HA 1 1 1 179 1 1 11 HIS HB2 H -5.260 -0.006 1.330 1.00 . A A . 11 HIS HB2 1 1 1 180 1 1 11 HIS HB3 H -3.866 -0.163 2.411 1.00 . A A . 11 HIS HB3 1 1 1 181 1 1 11 HIS HD1 H -3.698 1.506 4.296 1.00 . A A . 11 HIS HD1 1 1 1 182 1 1 11 HIS HD2 H -6.340 2.743 1.310 1.00 . A A . 11 HIS HD2 1 1 1 183 1 1 11 HIS HE1 H -4.729 3.681 5.111 1.00 . A A . 11 HIS HE1 1 1 1 184 1 1 11 HIS HE2 H -6.325 4.470 3.286 1.00 . A A . 11 HIS HE2 1 1 1 185 1 1 11 HIS N N -4.184 0.716 -0.615 1.00 . A A . 11 HIS N 1 1 1 186 1 1 11 HIS ND1 N -4.349 2.031 3.781 1.00 . A A . 11 HIS ND1 1 1 1 187 1 1 11 HIS NE2 N -5.790 3.640 3.250 1.00 . A A . 11 HIS NE2 1 1 1 188 1 1 11 HIS O O -1.165 0.597 1.079 1.00 . A A . 11 HIS O 1 1 1 189 1 1 12 LEU C C -0.264 -1.649 -0.772 1.00 . A A . 12 LEU C 1 1 1 190 1 1 12 LEU CA C -1.239 -2.042 0.312 1.00 . A A . 12 LEU CA 1 1 1 191 1 1 12 LEU CB C -1.720 -3.479 0.095 1.00 . A A . 12 LEU CB 1 1 1 192 1 1 12 LEU CD1 C -1.957 -5.712 1.188 1.00 . A A . 12 LEU CD1 1 1 1 193 1 1 12 LEU CD2 C 0.263 -4.579 1.130 1.00 . A A . 12 LEU CD2 1 1 1 194 1 1 12 LEU CG C -1.245 -4.359 1.251 1.00 . A A . 12 LEU CG 1 1 1 195 1 1 12 LEU H H -3.251 -1.433 -0.014 1.00 . A A . 12 LEU H 1 1 1 196 1 1 12 LEU HA H -0.745 -1.969 1.267 1.00 . A A . 12 LEU HA 1 1 1 197 1 1 12 LEU HB2 H -2.800 -3.494 0.052 1.00 . A A . 12 LEU HB2 1 1 1 198 1 1 12 LEU HB3 H -1.319 -3.858 -0.832 1.00 . A A . 12 LEU HB3 1 1 1 199 1 1 12 LEU HD11 H -1.572 -6.280 0.352 1.00 . A A . 12 LEU HD11 1 1 1 200 1 1 12 LEU HD12 H -3.017 -5.555 1.059 1.00 . A A . 12 LEU HD12 1 1 1 201 1 1 12 LEU HD13 H -1.782 -6.260 2.105 1.00 . A A . 12 LEU HD13 1 1 1 202 1 1 12 LEU HD21 H 0.512 -4.788 0.103 1.00 . A A . 12 LEU HD21 1 1 1 203 1 1 12 LEU HD22 H 0.557 -5.415 1.746 1.00 . A A . 12 LEU HD22 1 1 1 204 1 1 12 LEU HD23 H 0.785 -3.693 1.454 1.00 . A A . 12 LEU HD23 1 1 1 205 1 1 12 LEU HG H -1.469 -3.875 2.193 1.00 . A A . 12 LEU HG 1 1 1 206 1 1 12 LEU N N -2.367 -1.127 0.297 1.00 . A A . 12 LEU N 1 1 1 207 1 1 12 LEU O O 0.943 -1.525 -0.542 1.00 . A A . 12 LEU O 1 1 1 208 1 1 13 ALA C C 0.683 0.305 -2.746 1.00 . A A . 13 ALA C 1 1 1 209 1 1 13 ALA CA C 0.003 -1.010 -3.085 1.00 . A A . 13 ALA CA 1 1 1 210 1 1 13 ALA CB C -0.867 -0.832 -4.331 1.00 . A A . 13 ALA CB 1 1 1 211 1 1 13 ALA H H -1.781 -1.519 -2.039 1.00 . A A . 13 ALA H 1 1 1 212 1 1 13 ALA HA H 0.752 -1.759 -3.276 1.00 . A A . 13 ALA HA 1 1 1 213 1 1 13 ALA HB1 H -0.239 -0.590 -5.175 1.00 . A A . 13 ALA HB1 1 1 1 214 1 1 13 ALA HB2 H -1.572 -0.032 -4.169 1.00 . A A . 13 ALA HB2 1 1 1 215 1 1 13 ALA HB3 H -1.402 -1.745 -4.533 1.00 . A A . 13 ALA HB3 1 1 1 216 1 1 13 ALA N N -0.810 -1.425 -1.947 1.00 . A A . 13 ALA N 1 1 1 217 1 1 13 ALA O O 1.767 0.611 -3.236 1.00 . A A . 13 ALA O 1 1 1 218 1 1 14 HIS C C 1.704 2.172 -0.554 1.00 . A A . 14 HIS C 1 1 1 219 1 1 14 HIS CA C 0.518 2.361 -1.469 1.00 . A A . 14 HIS CA 1 1 1 220 1 1 14 HIS CB C -0.605 3.124 -0.772 1.00 . A A . 14 HIS CB 1 1 1 221 1 1 14 HIS CD2 C -0.530 3.684 1.785 1.00 . A A . 14 HIS CD2 1 1 1 222 1 1 14 HIS CE1 C 1.083 5.136 1.759 1.00 . A A . 14 HIS CE1 1 1 1 223 1 1 14 HIS CG C -0.118 3.797 0.484 1.00 . A A . 14 HIS CG 1 1 1 224 1 1 14 HIS H H -0.851 0.751 -1.564 1.00 . A A . 14 HIS H 1 1 1 225 1 1 14 HIS HA H 0.830 2.916 -2.326 1.00 . A A . 14 HIS HA 1 1 1 226 1 1 14 HIS HB2 H -0.970 3.857 -1.442 1.00 . A A . 14 HIS HB2 1 1 1 227 1 1 14 HIS HB3 H -1.405 2.440 -0.521 1.00 . A A . 14 HIS HB3 1 1 1 228 1 1 14 HIS HD1 H 1.419 5.037 -0.300 1.00 . A A . 14 HIS HD1 1 1 1 229 1 1 14 HIS HD2 H -1.312 3.021 2.133 1.00 . A A . 14 HIS HD2 1 1 1 230 1 1 14 HIS HE1 H 1.816 5.865 2.070 1.00 . A A . 14 HIS HE1 1 1 1 231 1 1 14 HIS HE2 H 0.160 4.644 3.568 1.00 . A A . 14 HIS HE2 1 1 1 232 1 1 14 HIS N N 0.017 1.069 -1.904 1.00 . A A . 14 HIS N 1 1 1 233 1 1 14 HIS ND1 N 0.910 4.728 0.485 1.00 . A A . 14 HIS ND1 1 1 1 234 1 1 14 HIS NE2 N 0.230 4.527 2.593 1.00 . A A . 14 HIS NE2 1 1 1 235 1 1 14 HIS O O 2.776 2.732 -0.776 1.00 . A A . 14 HIS O 1 1 1 236 1 1 15 LEU C C 3.733 0.560 0.498 1.00 . A A . 15 LEU C 1 1 1 237 1 1 15 LEU CA C 2.616 1.058 1.352 1.00 . A A . 15 LEU CA 1 1 1 238 1 1 15 LEU CB C 2.248 -0.066 2.320 1.00 . A A . 15 LEU CB 1 1 1 239 1 1 15 LEU CD1 C 0.778 1.718 3.305 1.00 . A A . 15 LEU CD1 1 1 1 240 1 1 15 LEU CD2 C 0.672 -0.623 4.137 1.00 . A A . 15 LEU CD2 1 1 1 241 1 1 15 LEU CG C 1.595 0.463 3.599 1.00 . A A . 15 LEU CG 1 1 1 242 1 1 15 LEU H H 0.662 0.897 0.560 1.00 . A A . 15 LEU H 1 1 1 243 1 1 15 LEU HA H 2.918 1.945 1.877 1.00 . A A . 15 LEU HA 1 1 1 244 1 1 15 LEU HB2 H 1.562 -0.741 1.828 1.00 . A A . 15 LEU HB2 1 1 1 245 1 1 15 LEU HB3 H 3.146 -0.611 2.581 1.00 . A A . 15 LEU HB3 1 1 1 246 1 1 15 LEU HD11 H 0.215 1.572 2.399 1.00 . A A . 15 LEU HD11 1 1 1 247 1 1 15 LEU HD12 H 1.437 2.563 3.188 1.00 . A A . 15 LEU HD12 1 1 1 248 1 1 15 LEU HD13 H 0.097 1.904 4.124 1.00 . A A . 15 LEU HD13 1 1 1 249 1 1 15 LEU HD21 H 1.033 -1.589 3.810 1.00 . A A . 15 LEU HD21 1 1 1 250 1 1 15 LEU HD22 H -0.327 -0.469 3.750 1.00 . A A . 15 LEU HD22 1 1 1 251 1 1 15 LEU HD23 H 0.661 -0.585 5.213 1.00 . A A . 15 LEU HD23 1 1 1 252 1 1 15 LEU HG H 2.355 0.686 4.330 1.00 . A A . 15 LEU HG 1 1 1 253 1 1 15 LEU N N 1.523 1.346 0.451 1.00 . A A . 15 LEU N 1 1 1 254 1 1 15 LEU O O 4.905 0.840 0.719 1.00 . A A . 15 LEU O 1 1 1 255 1 1 16 ALA C C 4.935 0.318 -2.238 1.00 . A A . 16 ALA C 1 1 1 256 1 1 16 ALA CA C 4.260 -0.771 -1.435 1.00 . A A . 16 ALA CA 1 1 1 257 1 1 16 ALA CB C 3.542 -1.739 -2.375 1.00 . A A . 16 ALA CB 1 1 1 258 1 1 16 ALA H H 2.344 -0.343 -0.598 1.00 . A A . 16 ALA H 1 1 1 259 1 1 16 ALA HA H 5.006 -1.307 -0.883 1.00 . A A . 16 ALA HA 1 1 1 260 1 1 16 ALA HB1 H 2.714 -2.197 -1.859 1.00 . A A . 16 ALA HB1 1 1 1 261 1 1 16 ALA HB2 H 4.232 -2.501 -2.698 1.00 . A A . 16 ALA HB2 1 1 1 262 1 1 16 ALA HB3 H 3.176 -1.199 -3.234 1.00 . A A . 16 ALA HB3 1 1 1 263 1 1 16 ALA N N 3.322 -0.188 -0.497 1.00 . A A . 16 ALA N 1 1 1 264 1 1 16 ALA O O 6.088 0.188 -2.641 1.00 . A A . 16 ALA O 1 1 1 265 1 1 17 LEU C C 5.980 3.056 -2.600 1.00 . A A . 17 LEU C 1 1 1 266 1 1 17 LEU CA C 4.724 2.509 -3.233 1.00 . A A . 17 LEU CA 1 1 1 267 1 1 17 LEU CB C 3.639 3.594 -3.369 1.00 . A A . 17 LEU CB 1 1 1 268 1 1 17 LEU CD1 C 5.137 5.628 -3.401 1.00 . A A . 17 LEU CD1 1 1 1 269 1 1 17 LEU CD2 C 2.789 5.803 -2.580 1.00 . A A . 17 LEU CD2 1 1 1 270 1 1 17 LEU CG C 4.021 4.899 -2.645 1.00 . A A . 17 LEU CG 1 1 1 271 1 1 17 LEU H H 3.289 1.429 -2.115 1.00 . A A . 17 LEU H 1 1 1 272 1 1 17 LEU HA H 4.982 2.148 -4.206 1.00 . A A . 17 LEU HA 1 1 1 273 1 1 17 LEU HB2 H 3.480 3.802 -4.411 1.00 . A A . 17 LEU HB2 1 1 1 274 1 1 17 LEU HB3 H 2.721 3.218 -2.942 1.00 . A A . 17 LEU HB3 1 1 1 275 1 1 17 LEU HD11 H 4.921 6.686 -3.431 1.00 . A A . 17 LEU HD11 1 1 1 276 1 1 17 LEU HD12 H 5.203 5.246 -4.407 1.00 . A A . 17 LEU HD12 1 1 1 277 1 1 17 LEU HD13 H 6.079 5.469 -2.896 1.00 . A A . 17 LEU HD13 1 1 1 278 1 1 17 LEU HD21 H 3.020 6.690 -2.011 1.00 . A A . 17 LEU HD21 1 1 1 279 1 1 17 LEU HD22 H 1.980 5.272 -2.104 1.00 . A A . 17 LEU HD22 1 1 1 280 1 1 17 LEU HD23 H 2.497 6.082 -3.581 1.00 . A A . 17 LEU HD23 1 1 1 281 1 1 17 LEU HG H 4.350 4.678 -1.640 1.00 . A A . 17 LEU HG 1 1 1 282 1 1 17 LEU N N 4.203 1.391 -2.466 1.00 . A A . 17 LEU N 1 1 1 283 1 1 17 LEU O O 7.001 3.219 -3.273 1.00 . A A . 17 LEU O 1 1 1 284 1 1 18 HIS C C 8.048 2.707 -0.385 1.00 . A A . 18 HIS C 1 1 1 285 1 1 18 HIS CA C 7.107 3.842 -0.650 1.00 . A A . 18 HIS CA 1 1 1 286 1 1 18 HIS CB C 6.744 4.558 0.631 1.00 . A A . 18 HIS CB 1 1 1 287 1 1 18 HIS CD2 C 4.948 3.176 1.910 1.00 . A A . 18 HIS CD2 1 1 1 288 1 1 18 HIS CE1 C 6.238 2.276 3.406 1.00 . A A . 18 HIS CE1 1 1 1 289 1 1 18 HIS CG C 6.217 3.610 1.657 1.00 . A A . 18 HIS CG 1 1 1 290 1 1 18 HIS H H 5.083 3.159 -0.812 1.00 . A A . 18 HIS H 1 1 1 291 1 1 18 HIS HA H 7.596 4.542 -1.311 1.00 . A A . 18 HIS HA 1 1 1 292 1 1 18 HIS HB2 H 7.614 5.063 1.022 1.00 . A A . 18 HIS HB2 1 1 1 293 1 1 18 HIS HB3 H 5.987 5.266 0.400 1.00 . A A . 18 HIS HB3 1 1 1 294 1 1 18 HIS HD1 H 8.002 3.145 2.707 1.00 . A A . 18 HIS HD1 1 1 1 295 1 1 18 HIS HD2 H 4.073 3.447 1.330 1.00 . A A . 18 HIS HD2 1 1 1 296 1 1 18 HIS HE1 H 6.596 1.698 4.251 1.00 . A A . 18 HIS HE1 1 1 1 297 1 1 18 HIS HE2 H 4.184 1.886 3.435 1.00 . A A . 18 HIS HE2 1 1 1 298 1 1 18 HIS N N 5.923 3.325 -1.315 1.00 . A A . 18 HIS N 1 1 1 299 1 1 18 HIS ND1 N 7.028 3.027 2.616 1.00 . A A . 18 HIS ND1 1 1 1 300 1 1 18 HIS NE2 N 4.956 2.333 3.021 1.00 . A A . 18 HIS NE2 1 1 1 301 1 1 18 HIS O O 9.251 2.800 -0.631 1.00 . A A . 18 HIS O 1 1 1 302 1 1 19 LEU C C 9.129 0.202 -0.915 1.00 . A A . 19 LEU C 1 1 1 303 1 1 19 LEU CA C 8.262 0.418 0.303 1.00 . A A . 19 LEU CA 1 1 1 304 1 1 19 LEU CB C 7.373 -0.817 0.479 1.00 . A A . 19 LEU CB 1 1 1 305 1 1 19 LEU CD1 C 9.071 -1.703 2.088 1.00 . A A . 19 LEU CD1 1 1 1 306 1 1 19 LEU CD2 C 7.076 -0.469 2.931 1.00 . A A . 19 LEU CD2 1 1 1 307 1 1 19 LEU CG C 7.584 -1.430 1.860 1.00 . A A . 19 LEU CG 1 1 1 308 1 1 19 LEU H H 6.497 1.608 0.204 1.00 . A A . 19 LEU H 1 1 1 309 1 1 19 LEU HA H 8.881 0.561 1.170 1.00 . A A . 19 LEU HA 1 1 1 310 1 1 19 LEU HB2 H 6.342 -0.544 0.361 1.00 . A A . 19 LEU HB2 1 1 1 311 1 1 19 LEU HB3 H 7.632 -1.549 -0.270 1.00 . A A . 19 LEU HB3 1 1 1 312 1 1 19 LEU HD11 H 9.188 -2.616 2.652 1.00 . A A . 19 LEU HD11 1 1 1 313 1 1 19 LEU HD12 H 9.508 -0.883 2.638 1.00 . A A . 19 LEU HD12 1 1 1 314 1 1 19 LEU HD13 H 9.571 -1.802 1.135 1.00 . A A . 19 LEU HD13 1 1 1 315 1 1 19 LEU HD21 H 7.720 0.396 2.965 1.00 . A A . 19 LEU HD21 1 1 1 316 1 1 19 LEU HD22 H 7.082 -0.961 3.889 1.00 . A A . 19 LEU HD22 1 1 1 317 1 1 19 LEU HD23 H 6.073 -0.160 2.688 1.00 . A A . 19 LEU HD23 1 1 1 318 1 1 19 LEU HG H 7.037 -2.355 1.913 1.00 . A A . 19 LEU HG 1 1 1 319 1 1 19 LEU N N 7.472 1.613 0.065 1.00 . A A . 19 LEU N 1 1 1 320 1 1 19 LEU O O 10.258 -0.272 -0.827 1.00 . A A . 19 LEU O 1 1 1 321 1 1 20 ALA C C 10.488 1.356 -3.319 1.00 . A A . 20 ALA C 1 1 1 322 1 1 20 ALA CA C 9.299 0.427 -3.309 1.00 . A A . 20 ALA CA 1 1 1 323 1 1 20 ALA CB C 8.392 0.736 -4.502 1.00 . A A . 20 ALA CB 1 1 1 324 1 1 20 ALA H H 7.658 0.962 -2.039 1.00 . A A . 20 ALA H 1 1 1 325 1 1 20 ALA HA H 9.657 -0.582 -3.390 1.00 . A A . 20 ALA HA 1 1 1 326 1 1 20 ALA HB1 H 7.460 0.206 -4.388 1.00 . A A . 20 ALA HB1 1 1 1 327 1 1 20 ALA HB2 H 8.876 0.424 -5.415 1.00 . A A . 20 ALA HB2 1 1 1 328 1 1 20 ALA HB3 H 8.198 1.799 -4.544 1.00 . A A . 20 ALA HB3 1 1 1 329 1 1 20 ALA N N 8.575 0.572 -2.055 1.00 . A A . 20 ALA N 1 1 1 330 1 1 20 ALA O O 11.639 0.917 -3.351 1.00 . A A . 20 ALA O 1 1 1 331 1 1 21 LEU C C 12.242 3.336 -2.151 1.00 . A A . 21 LEU C 1 1 1 332 1 1 21 LEU CA C 11.261 3.642 -3.265 1.00 . A A . 21 LEU CA 1 1 1 333 1 1 21 LEU CB C 10.671 5.038 -3.050 1.00 . A A . 21 LEU CB 1 1 1 334 1 1 21 LEU CD1 C 11.919 5.870 -5.067 1.00 . A A . 21 LEU CD1 1 1 1 335 1 1 21 LEU CD2 C 9.575 5.016 -5.307 1.00 . A A . 21 LEU CD2 1 1 1 336 1 1 21 LEU CG C 10.545 5.771 -4.391 1.00 . A A . 21 LEU CG 1 1 1 337 1 1 21 LEU H H 9.268 2.920 -3.240 1.00 . A A . 21 LEU H 1 1 1 338 1 1 21 LEU HA H 11.777 3.612 -4.206 1.00 . A A . 21 LEU HA 1 1 1 339 1 1 21 LEU HB2 H 9.695 4.948 -2.597 1.00 . A A . 21 LEU HB2 1 1 1 340 1 1 21 LEU HB3 H 11.317 5.602 -2.395 1.00 . A A . 21 LEU HB3 1 1 1 341 1 1 21 LEU HD11 H 12.013 6.835 -5.543 1.00 . A A . 21 LEU HD11 1 1 1 342 1 1 21 LEU HD12 H 12.007 5.094 -5.814 1.00 . A A . 21 LEU HD12 1 1 1 343 1 1 21 LEU HD13 H 12.699 5.750 -4.331 1.00 . A A . 21 LEU HD13 1 1 1 344 1 1 21 LEU HD21 H 9.154 5.702 -6.026 1.00 . A A . 21 LEU HD21 1 1 1 345 1 1 21 LEU HD22 H 8.781 4.587 -4.715 1.00 . A A . 21 LEU HD22 1 1 1 346 1 1 21 LEU HD23 H 10.102 4.231 -5.826 1.00 . A A . 21 LEU HD23 1 1 1 347 1 1 21 LEU HG H 10.165 6.765 -4.213 1.00 . A A . 21 LEU HG 1 1 1 348 1 1 21 LEU N N 10.205 2.642 -3.274 1.00 . A A . 21 LEU N 1 1 1 349 1 1 21 LEU O O 13.456 3.363 -2.346 1.00 . A A . 21 LEU O 1 1 1 350 1 1 22 ALA C C 13.458 1.574 -0.106 1.00 . A A . 22 ALA C 1 1 1 351 1 1 22 ALA CA C 12.514 2.732 0.184 1.00 . A A . 22 ALA CA 1 1 1 352 1 1 22 ALA CB C 11.616 2.375 1.372 1.00 . A A . 22 ALA CB 1 1 1 353 1 1 22 ALA H H 10.717 3.042 -0.908 1.00 . A A . 22 ALA H 1 1 1 354 1 1 22 ALA HA H 13.097 3.596 0.439 1.00 . A A . 22 ALA HA 1 1 1 355 1 1 22 ALA HB1 H 11.227 3.284 1.813 1.00 . A A . 22 ALA HB1 1 1 1 356 1 1 22 ALA HB2 H 12.194 1.834 2.108 1.00 . A A . 22 ALA HB2 1 1 1 357 1 1 22 ALA HB3 H 10.794 1.759 1.031 1.00 . A A . 22 ALA HB3 1 1 1 358 1 1 22 ALA N N 11.698 3.045 -0.984 1.00 . A A . 22 ALA N 1 1 1 359 1 1 22 ALA O O 14.594 1.548 0.372 1.00 . A A . 22 ALA O 1 1 1 360 1 1 23 LEU C C 14.641 -0.272 -2.446 1.00 . A A . 23 LEU C 1 1 1 361 1 1 23 LEU CA C 13.791 -0.552 -1.223 1.00 . A A . 23 LEU CA 1 1 1 362 1 1 23 LEU CB C 12.880 -1.752 -1.502 1.00 . A A . 23 LEU CB 1 1 1 363 1 1 23 LEU CD1 C 12.424 -1.635 0.977 1.00 . A A . 23 LEU CD1 1 1 1 364 1 1 23 LEU CD2 C 11.455 -3.485 -0.397 1.00 . A A . 23 LEU CD2 1 1 1 365 1 1 23 LEU CG C 12.669 -2.567 -0.218 1.00 . A A . 23 LEU CG 1 1 1 366 1 1 23 LEU H H 12.063 0.686 -1.224 1.00 . A A . 23 LEU H 1 1 1 367 1 1 23 LEU HA H 14.440 -0.789 -0.398 1.00 . A A . 23 LEU HA 1 1 1 368 1 1 23 LEU HB2 H 11.928 -1.399 -1.867 1.00 . A A . 23 LEU HB2 1 1 1 369 1 1 23 LEU HB3 H 13.338 -2.384 -2.252 1.00 . A A . 23 LEU HB3 1 1 1 370 1 1 23 LEU HD11 H 11.817 -0.799 0.668 1.00 . A A . 23 LEU HD11 1 1 1 371 1 1 23 LEU HD12 H 13.371 -1.274 1.354 1.00 . A A . 23 LEU HD12 1 1 1 372 1 1 23 LEU HD13 H 11.914 -2.180 1.758 1.00 . A A . 23 LEU HD13 1 1 1 373 1 1 23 LEU HD21 H 11.104 -3.809 0.572 1.00 . A A . 23 LEU HD21 1 1 1 374 1 1 23 LEU HD22 H 11.739 -4.348 -0.983 1.00 . A A . 23 LEU HD22 1 1 1 375 1 1 23 LEU HD23 H 10.666 -2.946 -0.904 1.00 . A A . 23 LEU HD23 1 1 1 376 1 1 23 LEU HG H 13.546 -3.164 -0.029 1.00 . A A . 23 LEU HG 1 1 1 377 1 1 23 LEU N N 12.981 0.613 -0.881 1.00 . A A . 23 LEU N 1 1 1 378 1 1 23 LEU O O 15.813 -0.644 -2.509 1.00 . A A . 23 LEU O 1 1 1 379 1 1 24 LYS C C 15.735 1.788 -4.495 1.00 . A A . 24 LYS C 1 1 1 380 1 1 24 LYS CA C 14.707 0.677 -4.668 1.00 . A A . 24 LYS CA 1 1 1 381 1 1 24 LYS CB C 13.685 1.101 -5.725 1.00 . A A . 24 LYS CB 1 1 1 382 1 1 24 LYS CD C 14.346 2.355 -7.795 1.00 . A A . 24 LYS CD 1 1 1 383 1 1 24 LYS CE C 15.593 3.129 -7.345 1.00 . A A . 24 LYS CE 1 1 1 384 1 1 24 LYS CG C 14.303 0.978 -7.122 1.00 . A A . 24 LYS CG 1 1 1 385 1 1 24 LYS H H 13.083 0.605 -3.305 1.00 . A A . 24 LYS H 1 1 1 386 1 1 24 LYS HA H 15.214 -0.203 -5.014 1.00 . A A . 24 LYS HA 1 1 1 387 1 1 24 LYS HB2 H 12.817 0.461 -5.656 1.00 . A A . 24 LYS HB2 1 1 1 388 1 1 24 LYS HB3 H 13.391 2.125 -5.551 1.00 . A A . 24 LYS HB3 1 1 1 389 1 1 24 LYS HD2 H 14.371 2.226 -8.867 1.00 . A A . 24 LYS HD2 1 1 1 390 1 1 24 LYS HD3 H 13.464 2.915 -7.525 1.00 . A A . 24 LYS HD3 1 1 1 391 1 1 24 LYS HE2 H 15.718 3.997 -7.971 1.00 . A A . 24 LYS HE2 1 1 1 392 1 1 24 LYS HE3 H 15.472 3.448 -6.321 1.00 . A A . 24 LYS HE3 1 1 1 393 1 1 24 LYS HG2 H 15.305 0.586 -7.042 1.00 . A A . 24 LYS HG2 1 1 1 394 1 1 24 LYS HG3 H 13.702 0.308 -7.719 1.00 . A A . 24 LYS HG3 1 1 1 395 1 1 24 LYS HZ1 H 16.593 1.449 -8.077 1.00 . A A . 24 LYS HZ1 1 1 1 396 1 1 24 LYS HZ2 H 17.065 1.901 -6.507 1.00 . A A . 24 LYS HZ2 1 1 1 397 1 1 24 LYS HZ3 H 17.589 2.805 -7.856 1.00 . A A . 24 LYS HZ3 1 1 1 398 1 1 24 LYS N N 14.028 0.362 -3.421 1.00 . A A . 24 LYS N 1 1 1 399 1 1 24 LYS NZ N 16.798 2.255 -7.457 1.00 . A A . 24 LYS NZ 1 1 1 400 1 1 24 LYS O O 16.806 1.745 -5.098 1.00 . A A . 24 LYS O 1 1 1 401 1 1 25 LYS C C 17.444 3.537 -2.548 1.00 . A A . 25 LYS C 1 1 1 402 1 1 25 LYS CA C 16.318 3.911 -3.499 1.00 . A A . 25 LYS CA 1 1 1 403 1 1 25 LYS CB C 15.567 5.123 -2.945 1.00 . A A . 25 LYS CB 1 1 1 404 1 1 25 LYS CD C 16.504 7.168 -1.831 1.00 . A A . 25 LYS CD 1 1 1 405 1 1 25 LYS CE C 17.839 6.884 -1.139 1.00 . A A . 25 LYS CE 1 1 1 406 1 1 25 LYS CG C 16.417 6.384 -3.147 1.00 . A A . 25 LYS CG 1 1 1 407 1 1 25 LYS H H 14.530 2.785 -3.255 1.00 . A A . 25 LYS H 1 1 1 408 1 1 25 LYS HA H 16.746 4.180 -4.451 1.00 . A A . 25 LYS HA 1 1 1 409 1 1 25 LYS HB2 H 14.628 5.233 -3.466 1.00 . A A . 25 LYS HB2 1 1 1 410 1 1 25 LYS HB3 H 15.381 4.979 -1.893 1.00 . A A . 25 LYS HB3 1 1 1 411 1 1 25 LYS HD2 H 16.424 8.225 -2.036 1.00 . A A . 25 LYS HD2 1 1 1 412 1 1 25 LYS HD3 H 15.695 6.869 -1.180 1.00 . A A . 25 LYS HD3 1 1 1 413 1 1 25 LYS HE2 H 17.893 7.454 -0.225 1.00 . A A . 25 LYS HE2 1 1 1 414 1 1 25 LYS HE3 H 17.912 5.831 -0.910 1.00 . A A . 25 LYS HE3 1 1 1 415 1 1 25 LYS HG2 H 17.411 6.100 -3.466 1.00 . A A . 25 LYS HG2 1 1 1 416 1 1 25 LYS HG3 H 15.963 7.006 -3.906 1.00 . A A . 25 LYS HG3 1 1 1 417 1 1 25 LYS HZ1 H 19.534 8.008 -1.553 1.00 . A A . 25 LYS HZ1 1 1 1 418 1 1 25 LYS HZ2 H 18.593 7.658 -2.916 1.00 . A A . 25 LYS HZ2 1 1 1 419 1 1 25 LYS HZ3 H 19.569 6.440 -2.223 1.00 . A A . 25 LYS HZ3 1 1 1 420 1 1 25 LYS N N 15.406 2.789 -3.700 1.00 . A A . 25 LYS N 1 1 1 421 1 1 25 LYS NZ N 18.963 7.277 -2.027 1.00 . A A . 25 LYS NZ 1 1 1 422 1 1 25 LYS O O 17.213 3.297 -1.361 1.00 . A A . 25 LYS O 1 1 1 423 1 1 26 ALA C C 20.461 4.472 -1.743 1.00 . A A . 26 ALA C 1 1 1 424 1 1 26 ALA CA C 19.826 3.188 -2.260 1.00 . A A . 26 ALA CA 1 1 1 425 1 1 26 ALA CB C 20.850 2.409 -3.092 1.00 . A A . 26 ALA CB 1 1 1 426 1 1 26 ALA H H 18.784 3.727 -4.019 1.00 . A A . 26 ALA H 1 1 1 427 1 1 26 ALA HA H 19.514 2.581 -1.422 1.00 . A A . 26 ALA HA 1 1 1 428 1 1 26 ALA HB1 H 20.944 2.867 -4.066 1.00 . A A . 26 ALA HB1 1 1 1 429 1 1 26 ALA HB2 H 20.521 1.386 -3.204 1.00 . A A . 26 ALA HB2 1 1 1 430 1 1 26 ALA HB3 H 21.809 2.427 -2.593 1.00 . A A . 26 ALA HB3 1 1 1 431 1 1 26 ALA N N 18.664 3.510 -3.071 1.00 . A A . 26 ALA N 1 1 1 432 1 1 26 ALA O O 20.512 5.424 -2.498 1.00 . A A . 26 ALA O 1 1 1 433 1 1 26 ALA OXT O 20.885 4.489 -0.609 1.00 . A A . 26 ALA OXT 1 1 2 434 1 1 1 LYS C C -22.952 7.957 2.440 1.00 . A A . 1 LYS C 1 1 2 435 1 1 1 LYS CA C -23.020 6.603 3.127 1.00 . A A . 1 LYS CA 1 1 2 436 1 1 1 LYS CB C -24.182 6.583 4.124 1.00 . A A . 1 LYS CB 1 1 2 437 1 1 1 LYS CD C -25.995 4.923 3.623 1.00 . A A . 1 LYS CD 1 1 2 438 1 1 1 LYS CE C -26.250 3.426 3.435 1.00 . A A . 1 LYS CE 1 1 2 439 1 1 1 LYS CG C -24.660 5.139 4.348 1.00 . A A . 1 LYS CG 1 1 2 440 1 1 1 LYS H1 H -21.203 5.623 3.364 1.00 . A A . 1 LYS H1 1 1 2 441 1 1 1 LYS H2 H -21.951 6.058 4.821 1.00 . A A . 1 LYS H2 1 1 2 442 1 1 1 LYS H3 H -21.190 7.240 3.876 1.00 . A A . 1 LYS H3 1 1 2 443 1 1 1 LYS HA H -23.165 5.835 2.388 1.00 . A A . 1 LYS HA 1 1 2 444 1 1 1 LYS HB2 H -23.851 7.002 5.061 1.00 . A A . 1 LYS HB2 1 1 2 445 1 1 1 LYS HB3 H -24.998 7.173 3.736 1.00 . A A . 1 LYS HB3 1 1 2 446 1 1 1 LYS HD2 H -26.794 5.351 4.211 1.00 . A A . 1 LYS HD2 1 1 2 447 1 1 1 LYS HD3 H -25.962 5.405 2.657 1.00 . A A . 1 LYS HD3 1 1 2 448 1 1 1 LYS HE2 H -26.518 2.985 4.384 1.00 . A A . 1 LYS HE2 1 1 2 449 1 1 1 LYS HE3 H -27.060 3.285 2.736 1.00 . A A . 1 LYS HE3 1 1 2 450 1 1 1 LYS HG2 H -23.920 4.450 3.968 1.00 . A A . 1 LYS HG2 1 1 2 451 1 1 1 LYS HG3 H -24.796 4.970 5.406 1.00 . A A . 1 LYS HG3 1 1 2 452 1 1 1 LYS HZ1 H -24.430 3.464 2.416 1.00 . A A . 1 LYS HZ1 1 1 2 453 1 1 1 LYS HZ2 H -25.286 2.009 2.247 1.00 . A A . 1 LYS HZ2 1 1 2 454 1 1 1 LYS HZ3 H -24.482 2.350 3.701 1.00 . A A . 1 LYS HZ3 1 1 2 455 1 1 1 LYS N N -21.745 6.362 3.852 1.00 . A A . 1 LYS N 1 1 2 456 1 1 1 LYS NZ N -25.020 2.764 2.911 1.00 . A A . 1 LYS NZ 1 1 2 457 1 1 1 LYS O O -22.346 8.889 2.964 1.00 . A A . 1 LYS O 1 1 2 458 1 1 2 LYS C C -22.239 9.845 0.159 1.00 . A A . 2 LYS C 1 1 2 459 1 1 2 LYS CA C -23.630 9.266 0.450 1.00 . A A . 2 LYS CA 1 1 2 460 1 1 2 LYS CB C -24.553 10.323 1.091 1.00 . A A . 2 LYS CB 1 1 2 461 1 1 2 LYS CD C -24.665 12.284 2.648 1.00 . A A . 2 LYS CD 1 1 2 462 1 1 2 LYS CE C -23.685 13.411 3.004 1.00 . A A . 2 LYS CE 1 1 2 463 1 1 2 LYS CG C -23.880 11.016 2.286 1.00 . A A . 2 LYS CG 1 1 2 464 1 1 2 LYS H H -24.038 7.242 0.927 1.00 . A A . 2 LYS H 1 1 2 465 1 1 2 LYS HA H -24.067 8.993 -0.502 1.00 . A A . 2 LYS HA 1 1 2 466 1 1 2 LYS HB2 H -24.803 11.067 0.350 1.00 . A A . 2 LYS HB2 1 1 2 467 1 1 2 LYS HB3 H -25.463 9.842 1.426 1.00 . A A . 2 LYS HB3 1 1 2 468 1 1 2 LYS HD2 H -25.267 12.590 1.803 1.00 . A A . 2 LYS HD2 1 1 2 469 1 1 2 LYS HD3 H -25.308 12.083 3.493 1.00 . A A . 2 LYS HD3 1 1 2 470 1 1 2 LYS HE2 H -23.035 13.599 2.163 1.00 . A A . 2 LYS HE2 1 1 2 471 1 1 2 LYS HE3 H -24.238 14.311 3.239 1.00 . A A . 2 LYS HE3 1 1 2 472 1 1 2 LYS HG2 H -23.870 10.348 3.132 1.00 . A A . 2 LYS HG2 1 1 2 473 1 1 2 LYS HG3 H -22.870 11.288 2.027 1.00 . A A . 2 LYS HG3 1 1 2 474 1 1 2 LYS HZ1 H -21.861 13.203 3.981 1.00 . A A . 2 LYS HZ1 1 1 2 475 1 1 2 LYS HZ2 H -22.985 12.001 4.376 1.00 . A A . 2 LYS HZ2 1 1 2 476 1 1 2 LYS HZ3 H -23.155 13.567 5.013 1.00 . A A . 2 LYS HZ3 1 1 2 477 1 1 2 LYS N N -23.582 8.042 1.265 1.00 . A A . 2 LYS N 1 1 2 478 1 1 2 LYS NZ N -22.862 13.014 4.181 1.00 . A A . 2 LYS NZ 1 1 2 479 1 1 2 LYS O O -21.957 10.226 -0.978 1.00 . A A . 2 LYS O 1 1 2 480 1 1 3 ALA C C -19.230 9.553 0.056 1.00 . A A . 3 ALA C 1 1 2 481 1 1 3 ALA CA C -20.034 10.447 0.989 1.00 . A A . 3 ALA CA 1 1 2 482 1 1 3 ALA CB C -19.322 10.544 2.337 1.00 . A A . 3 ALA CB 1 1 2 483 1 1 3 ALA H H -21.654 9.594 2.056 1.00 . A A . 3 ALA H 1 1 2 484 1 1 3 ALA HA H -20.105 11.432 0.558 1.00 . A A . 3 ALA HA 1 1 2 485 1 1 3 ALA HB1 H -20.032 10.812 3.105 1.00 . A A . 3 ALA HB1 1 1 2 486 1 1 3 ALA HB2 H -18.550 11.298 2.283 1.00 . A A . 3 ALA HB2 1 1 2 487 1 1 3 ALA HB3 H -18.874 9.591 2.577 1.00 . A A . 3 ALA HB3 1 1 2 488 1 1 3 ALA N N -21.380 9.912 1.169 1.00 . A A . 3 ALA N 1 1 2 489 1 1 3 ALA O O -19.611 8.409 -0.211 1.00 . A A . 3 ALA O 1 1 2 490 1 1 4 LEU C C -16.361 8.378 -0.529 1.00 . A A . 4 LEU C 1 1 2 491 1 1 4 LEU CA C -17.266 9.306 -1.332 1.00 . A A . 4 LEU CA 1 1 2 492 1 1 4 LEU CB C -16.417 10.258 -2.184 1.00 . A A . 4 LEU CB 1 1 2 493 1 1 4 LEU CD1 C -15.300 10.031 -4.418 1.00 . A A . 4 LEU CD1 1 1 2 494 1 1 4 LEU CD2 C -14.007 9.578 -2.329 1.00 . A A . 4 LEU CD2 1 1 2 495 1 1 4 LEU CG C -15.381 9.464 -3.000 1.00 . A A . 4 LEU CG 1 1 2 496 1 1 4 LEU H H -17.855 10.985 -0.184 1.00 . A A . 4 LEU H 1 1 2 497 1 1 4 LEU HA H -17.890 8.713 -1.982 1.00 . A A . 4 LEU HA 1 1 2 498 1 1 4 LEU HB2 H -17.061 10.805 -2.857 1.00 . A A . 4 LEU HB2 1 1 2 499 1 1 4 LEU HB3 H -15.905 10.954 -1.536 1.00 . A A . 4 LEU HB3 1 1 2 500 1 1 4 LEU HD11 H -16.274 9.979 -4.884 1.00 . A A . 4 LEU HD11 1 1 2 501 1 1 4 LEU HD12 H -14.594 9.454 -4.998 1.00 . A A . 4 LEU HD12 1 1 2 502 1 1 4 LEU HD13 H -14.974 11.060 -4.379 1.00 . A A . 4 LEU HD13 1 1 2 503 1 1 4 LEU HD21 H -13.582 10.551 -2.544 1.00 . A A . 4 LEU HD21 1 1 2 504 1 1 4 LEU HD22 H -13.352 8.805 -2.708 1.00 . A A . 4 LEU HD22 1 1 2 505 1 1 4 LEU HD23 H -14.114 9.464 -1.261 1.00 . A A . 4 LEU HD23 1 1 2 506 1 1 4 LEU HG H -15.675 8.423 -3.050 1.00 . A A . 4 LEU HG 1 1 2 507 1 1 4 LEU N N -18.115 10.073 -0.434 1.00 . A A . 4 LEU N 1 1 2 508 1 1 4 LEU O O -15.916 8.727 0.566 1.00 . A A . 4 LEU O 1 1 2 509 1 1 5 LEU C C -13.956 6.007 -1.233 1.00 . A A . 5 LEU C 1 1 2 510 1 1 5 LEU CA C -15.222 6.232 -0.416 1.00 . A A . 5 LEU CA 1 1 2 511 1 1 5 LEU CB C -15.953 4.898 -0.231 1.00 . A A . 5 LEU CB 1 1 2 512 1 1 5 LEU CD1 C -17.571 3.660 1.206 1.00 . A A . 5 LEU CD1 1 1 2 513 1 1 5 LEU CD2 C -15.553 4.694 2.242 1.00 . A A . 5 LEU CD2 1 1 2 514 1 1 5 LEU CG C -16.619 4.853 1.149 1.00 . A A . 5 LEU CG 1 1 2 515 1 1 5 LEU H H -16.467 6.980 -1.960 1.00 . A A . 5 LEU H 1 1 2 516 1 1 5 LEU HA H -14.951 6.620 0.554 1.00 . A A . 5 LEU HA 1 1 2 517 1 1 5 LEU HB2 H -16.709 4.791 -0.998 1.00 . A A . 5 LEU HB2 1 1 2 518 1 1 5 LEU HB3 H -15.244 4.088 -0.311 1.00 . A A . 5 LEU HB3 1 1 2 519 1 1 5 LEU HD11 H -18.523 3.938 0.782 1.00 . A A . 5 LEU HD11 1 1 2 520 1 1 5 LEU HD12 H -17.707 3.355 2.233 1.00 . A A . 5 LEU HD12 1 1 2 521 1 1 5 LEU HD13 H -17.155 2.839 0.639 1.00 . A A . 5 LEU HD13 1 1 2 522 1 1 5 LEU HD21 H -15.914 5.131 3.162 1.00 . A A . 5 LEU HD21 1 1 2 523 1 1 5 LEU HD22 H -14.646 5.192 1.942 1.00 . A A . 5 LEU HD22 1 1 2 524 1 1 5 LEU HD23 H -15.350 3.643 2.399 1.00 . A A . 5 LEU HD23 1 1 2 525 1 1 5 LEU HG H -17.175 5.765 1.315 1.00 . A A . 5 LEU HG 1 1 2 526 1 1 5 LEU N N -16.088 7.200 -1.083 1.00 . A A . 5 LEU N 1 1 2 527 1 1 5 LEU O O -13.870 6.424 -2.391 1.00 . A A . 5 LEU O 1 1 2 528 1 1 6 ALA C C -11.547 3.542 -1.436 1.00 . A A . 6 ALA C 1 1 2 529 1 1 6 ALA CA C -11.728 5.046 -1.299 1.00 . A A . 6 ALA CA 1 1 2 530 1 1 6 ALA CB C -10.550 5.638 -0.512 1.00 . A A . 6 ALA CB 1 1 2 531 1 1 6 ALA H H -13.126 5.021 0.295 1.00 . A A . 6 ALA H 1 1 2 532 1 1 6 ALA HA H -11.747 5.487 -2.286 1.00 . A A . 6 ALA HA 1 1 2 533 1 1 6 ALA HB1 H -9.685 5.709 -1.158 1.00 . A A . 6 ALA HB1 1 1 2 534 1 1 6 ALA HB2 H -10.319 5.000 0.327 1.00 . A A . 6 ALA HB2 1 1 2 535 1 1 6 ALA HB3 H -10.812 6.622 -0.153 1.00 . A A . 6 ALA HB3 1 1 2 536 1 1 6 ALA N N -12.988 5.338 -0.624 1.00 . A A . 6 ALA N 1 1 2 537 1 1 6 ALA O O -12.427 2.764 -1.065 1.00 . A A . 6 ALA O 1 1 2 538 1 1 7 LEU C C -9.689 1.101 -0.832 1.00 . A A . 7 LEU C 1 1 2 539 1 1 7 LEU CA C -10.126 1.719 -2.150 1.00 . A A . 7 LEU CA 1 1 2 540 1 1 7 LEU CB C -9.032 1.525 -3.210 1.00 . A A . 7 LEU CB 1 1 2 541 1 1 7 LEU CD1 C -10.538 0.175 -4.693 1.00 . A A . 7 LEU CD1 1 1 2 542 1 1 7 LEU CD2 C -10.514 2.667 -4.878 1.00 . A A . 7 LEU CD2 1 1 2 543 1 1 7 LEU CG C -9.658 1.425 -4.609 1.00 . A A . 7 LEU CG 1 1 2 544 1 1 7 LEU H H -9.737 3.798 -2.247 1.00 . A A . 7 LEU H 1 1 2 545 1 1 7 LEU HA H -11.027 1.225 -2.482 1.00 . A A . 7 LEU HA 1 1 2 546 1 1 7 LEU HB2 H -8.357 2.365 -3.181 1.00 . A A . 7 LEU HB2 1 1 2 547 1 1 7 LEU HB3 H -8.484 0.621 -2.998 1.00 . A A . 7 LEU HB3 1 1 2 548 1 1 7 LEU HD11 H -11.571 0.450 -4.548 1.00 . A A . 7 LEU HD11 1 1 2 549 1 1 7 LEU HD12 H -10.244 -0.527 -3.926 1.00 . A A . 7 LEU HD12 1 1 2 550 1 1 7 LEU HD13 H -10.422 -0.283 -5.662 1.00 . A A . 7 LEU HD13 1 1 2 551 1 1 7 LEU HD21 H -11.440 2.595 -4.323 1.00 . A A . 7 LEU HD21 1 1 2 552 1 1 7 LEU HD22 H -10.733 2.733 -5.935 1.00 . A A . 7 LEU HD22 1 1 2 553 1 1 7 LEU HD23 H -9.977 3.552 -4.569 1.00 . A A . 7 LEU HD23 1 1 2 554 1 1 7 LEU HG H -8.872 1.359 -5.350 1.00 . A A . 7 LEU HG 1 1 2 555 1 1 7 LEU N N -10.404 3.134 -1.971 1.00 . A A . 7 LEU N 1 1 2 556 1 1 7 LEU O O -9.755 1.747 0.217 1.00 . A A . 7 LEU O 1 1 2 557 1 1 8 ALA C C -7.522 -1.604 0.107 1.00 . A A . 8 ALA C 1 1 2 558 1 1 8 ALA CA C -8.816 -0.844 0.332 1.00 . A A . 8 ALA CA 1 1 2 559 1 1 8 ALA CB C -9.902 -1.820 0.793 1.00 . A A . 8 ALA CB 1 1 2 560 1 1 8 ALA H H -9.224 -0.620 -1.742 1.00 . A A . 8 ALA H 1 1 2 561 1 1 8 ALA HA H -8.650 -0.116 1.101 1.00 . A A . 8 ALA HA 1 1 2 562 1 1 8 ALA HB1 H -10.786 -1.683 0.189 1.00 . A A . 8 ALA HB1 1 1 2 563 1 1 8 ALA HB2 H -10.139 -1.633 1.830 1.00 . A A . 8 ALA HB2 1 1 2 564 1 1 8 ALA HB3 H -9.546 -2.837 0.686 1.00 . A A . 8 ALA HB3 1 1 2 565 1 1 8 ALA N N -9.249 -0.152 -0.882 1.00 . A A . 8 ALA N 1 1 2 566 1 1 8 ALA O O -6.727 -1.791 1.027 1.00 . A A . 8 ALA O 1 1 2 567 1 1 9 LEU C C -4.993 -1.887 -1.818 1.00 . A A . 9 LEU C 1 1 2 568 1 1 9 LEU CA C -6.126 -2.810 -1.455 1.00 . A A . 9 LEU CA 1 1 2 569 1 1 9 LEU CB C -6.409 -3.709 -2.644 1.00 . A A . 9 LEU CB 1 1 2 570 1 1 9 LEU CD1 C -5.103 -5.575 -1.610 1.00 . A A . 9 LEU CD1 1 1 2 571 1 1 9 LEU CD2 C -7.553 -5.321 -1.134 1.00 . A A . 9 LEU CD2 1 1 2 572 1 1 9 LEU CG C -6.461 -5.169 -2.195 1.00 . A A . 9 LEU CG 1 1 2 573 1 1 9 LEU H H -7.998 -1.885 -1.799 1.00 . A A . 9 LEU H 1 1 2 574 1 1 9 LEU HA H -5.832 -3.413 -0.620 1.00 . A A . 9 LEU HA 1 1 2 575 1 1 9 LEU HB2 H -7.357 -3.426 -3.077 1.00 . A A . 9 LEU HB2 1 1 2 576 1 1 9 LEU HB3 H -5.626 -3.581 -3.373 1.00 . A A . 9 LEU HB3 1 1 2 577 1 1 9 LEU HD11 H -4.975 -6.642 -1.707 1.00 . A A . 9 LEU HD11 1 1 2 578 1 1 9 LEU HD12 H -5.060 -5.299 -0.568 1.00 . A A . 9 LEU HD12 1 1 2 579 1 1 9 LEU HD13 H -4.313 -5.071 -2.150 1.00 . A A . 9 LEU HD13 1 1 2 580 1 1 9 LEU HD21 H -7.281 -4.762 -0.250 1.00 . A A . 9 LEU HD21 1 1 2 581 1 1 9 LEU HD22 H -7.664 -6.362 -0.882 1.00 . A A . 9 LEU HD22 1 1 2 582 1 1 9 LEU HD23 H -8.485 -4.943 -1.525 1.00 . A A . 9 LEU HD23 1 1 2 583 1 1 9 LEU HG H -6.690 -5.799 -3.041 1.00 . A A . 9 LEU HG 1 1 2 584 1 1 9 LEU N N -7.323 -2.055 -1.112 1.00 . A A . 9 LEU N 1 1 2 585 1 1 9 LEU O O -3.933 -1.908 -1.204 1.00 . A A . 9 LEU O 1 1 2 586 1 1 10 HIS C C -3.547 0.465 -2.070 1.00 . A A . 10 HIS C 1 1 2 587 1 1 10 HIS CA C -4.238 -0.114 -3.283 1.00 . A A . 10 HIS CA 1 1 2 588 1 1 10 HIS CB C -4.908 1.019 -4.047 1.00 . A A . 10 HIS CB 1 1 2 589 1 1 10 HIS CD2 C -5.337 -0.659 -6.030 1.00 . A A . 10 HIS CD2 1 1 2 590 1 1 10 HIS CE1 C -5.680 0.797 -7.599 1.00 . A A . 10 HIS CE1 1 1 2 591 1 1 10 HIS CG C -5.206 0.584 -5.458 1.00 . A A . 10 HIS CG 1 1 2 592 1 1 10 HIS H H -6.116 -1.119 -3.256 1.00 . A A . 10 HIS H 1 1 2 593 1 1 10 HIS HA H -3.518 -0.608 -3.913 1.00 . A A . 10 HIS HA 1 1 2 594 1 1 10 HIS HB2 H -5.827 1.291 -3.547 1.00 . A A . 10 HIS HB2 1 1 2 595 1 1 10 HIS HB3 H -4.242 1.866 -4.059 1.00 . A A . 10 HIS HB3 1 1 2 596 1 1 10 HIS HD1 H -5.392 2.474 -6.400 1.00 . A A . 10 HIS HD1 1 1 2 597 1 1 10 HIS HD2 H -5.214 -1.603 -5.516 1.00 . A A . 10 HIS HD2 1 1 2 598 1 1 10 HIS HE1 H -5.897 1.248 -8.557 1.00 . A A . 10 HIS HE1 1 1 2 599 1 1 10 HIS HE2 H -5.782 -1.239 -8.041 1.00 . A A . 10 HIS HE2 1 1 2 600 1 1 10 HIS N N -5.239 -1.073 -2.824 1.00 . A A . 10 HIS N 1 1 2 601 1 1 10 HIS ND1 N -5.428 1.496 -6.478 1.00 . A A . 10 HIS ND1 1 1 2 602 1 1 10 HIS NE2 N -5.636 -0.521 -7.384 1.00 . A A . 10 HIS NE2 1 1 2 603 1 1 10 HIS O O -2.344 0.718 -2.054 1.00 . A A . 10 HIS O 1 1 2 604 1 1 11 HIS C C -2.608 0.506 0.637 1.00 . A A . 11 HIS C 1 1 2 605 1 1 11 HIS CA C -3.921 1.142 0.226 1.00 . A A . 11 HIS CA 1 1 2 606 1 1 11 HIS CB C -4.995 0.780 1.231 1.00 . A A . 11 HIS CB 1 1 2 607 1 1 11 HIS CD2 C -6.901 2.574 0.938 1.00 . A A . 11 HIS CD2 1 1 2 608 1 1 11 HIS CE1 C -6.389 3.857 2.606 1.00 . A A . 11 HIS CE1 1 1 2 609 1 1 11 HIS CG C -5.806 2.010 1.550 1.00 . A A . 11 HIS CG 1 1 2 610 1 1 11 HIS H H -5.292 0.385 -1.156 1.00 . A A . 11 HIS H 1 1 2 611 1 1 11 HIS HA H -3.814 2.210 0.183 1.00 . A A . 11 HIS HA 1 1 2 612 1 1 11 HIS HB2 H -5.633 0.011 0.790 1.00 . A A . 11 HIS HB2 1 1 2 613 1 1 11 HIS HB3 H -4.529 0.396 2.126 1.00 . A A . 11 HIS HB3 1 1 2 614 1 1 11 HIS HD1 H -4.757 2.727 3.252 1.00 . A A . 11 HIS HD1 1 1 2 615 1 1 11 HIS HD2 H -7.394 2.182 0.062 1.00 . A A . 11 HIS HD2 1 1 2 616 1 1 11 HIS HE1 H -6.389 4.673 3.315 1.00 . A A . 11 HIS HE1 1 1 2 617 1 1 11 HIS HE2 H -8.007 4.348 1.385 1.00 . A A . 11 HIS HE2 1 1 2 618 1 1 11 HIS N N -4.357 0.635 -1.050 1.00 . A A . 11 HIS N 1 1 2 619 1 1 11 HIS ND1 N -5.500 2.846 2.614 1.00 . A A . 11 HIS ND1 1 1 2 620 1 1 11 HIS NE2 N -7.266 3.738 1.606 1.00 . A A . 11 HIS NE2 1 1 2 621 1 1 11 HIS O O -1.710 1.170 1.163 1.00 . A A . 11 HIS O 1 1 2 622 1 1 12 LEU C C -0.287 -1.290 -0.394 1.00 . A A . 12 LEU C 1 1 2 623 1 1 12 LEU CA C -1.301 -1.528 0.697 1.00 . A A . 12 LEU CA 1 1 2 624 1 1 12 LEU CB C -1.605 -3.024 0.806 1.00 . A A . 12 LEU CB 1 1 2 625 1 1 12 LEU CD1 C -3.670 -2.997 2.229 1.00 . A A . 12 LEU CD1 1 1 2 626 1 1 12 LEU CD2 C -1.985 -4.834 2.489 1.00 . A A . 12 LEU CD2 1 1 2 627 1 1 12 LEU CG C -2.177 -3.342 2.194 1.00 . A A . 12 LEU CG 1 1 2 628 1 1 12 LEU H H -3.262 -1.233 -0.062 1.00 . A A . 12 LEU H 1 1 2 629 1 1 12 LEU HA H -0.906 -1.169 1.632 1.00 . A A . 12 LEU HA 1 1 2 630 1 1 12 LEU HB2 H -2.318 -3.300 0.041 1.00 . A A . 12 LEU HB2 1 1 2 631 1 1 12 LEU HB3 H -0.693 -3.581 0.659 1.00 . A A . 12 LEU HB3 1 1 2 632 1 1 12 LEU HD11 H -3.797 -1.976 2.564 1.00 . A A . 12 LEU HD11 1 1 2 633 1 1 12 LEU HD12 H -4.176 -3.661 2.912 1.00 . A A . 12 LEU HD12 1 1 2 634 1 1 12 LEU HD13 H -4.091 -3.110 1.241 1.00 . A A . 12 LEU HD13 1 1 2 635 1 1 12 LEU HD21 H -2.590 -5.116 3.338 1.00 . A A . 12 LEU HD21 1 1 2 636 1 1 12 LEU HD22 H -0.945 -5.029 2.709 1.00 . A A . 12 LEU HD22 1 1 2 637 1 1 12 LEU HD23 H -2.282 -5.412 1.628 1.00 . A A . 12 LEU HD23 1 1 2 638 1 1 12 LEU HG H -1.655 -2.757 2.940 1.00 . A A . 12 LEU HG 1 1 2 639 1 1 12 LEU N N -2.508 -0.782 0.377 1.00 . A A . 12 LEU N 1 1 2 640 1 1 12 LEU O O 0.884 -1.019 -0.130 1.00 . A A . 12 LEU O 1 1 2 641 1 1 13 ALA C C 0.778 0.235 -2.563 1.00 . A A . 13 ALA C 1 1 2 642 1 1 13 ALA CA C 0.082 -1.100 -2.781 1.00 . A A . 13 ALA CA 1 1 2 643 1 1 13 ALA CB C -0.750 -1.061 -4.068 1.00 . A A . 13 ALA CB 1 1 2 644 1 1 13 ALA H H -1.723 -1.538 -1.744 1.00 . A A . 13 ALA H 1 1 2 645 1 1 13 ALA HA H 0.824 -1.881 -2.855 1.00 . A A . 13 ALA HA 1 1 2 646 1 1 13 ALA HB1 H -0.089 -1.063 -4.923 1.00 . A A . 13 ALA HB1 1 1 2 647 1 1 13 ALA HB2 H -1.353 -0.165 -4.083 1.00 . A A . 13 ALA HB2 1 1 2 648 1 1 13 ALA HB3 H -1.391 -1.930 -4.110 1.00 . A A . 13 ALA HB3 1 1 2 649 1 1 13 ALA N N -0.770 -1.351 -1.624 1.00 . A A . 13 ALA N 1 1 2 650 1 1 13 ALA O O 1.912 0.453 -2.983 1.00 . A A . 13 ALA O 1 1 2 651 1 1 14 HIS C C 1.725 2.273 -0.537 1.00 . A A . 14 HIS C 1 1 2 652 1 1 14 HIS CA C 0.589 2.423 -1.529 1.00 . A A . 14 HIS CA 1 1 2 653 1 1 14 HIS CB C -0.536 3.264 -0.940 1.00 . A A . 14 HIS CB 1 1 2 654 1 1 14 HIS CD2 C -0.188 4.503 1.335 1.00 . A A . 14 HIS CD2 1 1 2 655 1 1 14 HIS CE1 C 1.181 6.040 0.661 1.00 . A A . 14 HIS CE1 1 1 2 656 1 1 14 HIS CG C 0.013 4.297 -0.001 1.00 . A A . 14 HIS CG 1 1 2 657 1 1 14 HIS H H -0.820 0.848 -1.549 1.00 . A A . 14 HIS H 1 1 2 658 1 1 14 HIS HA H 0.958 2.897 -2.418 1.00 . A A . 14 HIS HA 1 1 2 659 1 1 14 HIS HB2 H -1.050 3.743 -1.742 1.00 . A A . 14 HIS HB2 1 1 2 660 1 1 14 HIS HB3 H -1.221 2.625 -0.406 1.00 . A A . 14 HIS HB3 1 1 2 661 1 1 14 HIS HD1 H 1.231 5.422 -1.328 1.00 . A A . 14 HIS HD1 1 1 2 662 1 1 14 HIS HD2 H -0.830 3.903 1.964 1.00 . A A . 14 HIS HD2 1 1 2 663 1 1 14 HIS HE1 H 1.837 6.896 0.642 1.00 . A A . 14 HIS HE1 1 1 2 664 1 1 14 HIS HE2 H 0.610 5.972 2.664 1.00 . A A . 14 HIS HE2 1 1 2 665 1 1 14 HIS N N 0.075 1.107 -1.864 1.00 . A A . 14 HIS N 1 1 2 666 1 1 14 HIS ND1 N 0.889 5.288 -0.414 1.00 . A A . 14 HIS ND1 1 1 2 667 1 1 14 HIS NE2 N 0.553 5.602 1.756 1.00 . A A . 14 HIS NE2 1 1 2 668 1 1 14 HIS O O 2.827 2.777 -0.745 1.00 . A A . 14 HIS O 1 1 2 669 1 1 15 LEU C C 3.638 0.646 0.746 1.00 . A A . 15 LEU C 1 1 2 670 1 1 15 LEU CA C 2.501 1.272 1.493 1.00 . A A . 15 LEU CA 1 1 2 671 1 1 15 LEU CB C 2.012 0.276 2.543 1.00 . A A . 15 LEU CB 1 1 2 672 1 1 15 LEU CD1 C 0.711 2.348 3.195 1.00 . A A . 15 LEU CD1 1 1 2 673 1 1 15 LEU CD2 C -0.024 0.094 3.958 1.00 . A A . 15 LEU CD2 1 1 2 674 1 1 15 LEU CG C 1.191 0.966 3.643 1.00 . A A . 15 LEU CG 1 1 2 675 1 1 15 LEU H H 0.585 1.115 0.606 1.00 . A A . 15 LEU H 1 1 2 676 1 1 15 LEU HA H 2.828 2.190 1.948 1.00 . A A . 15 LEU HA 1 1 2 677 1 1 15 LEU HB2 H 1.397 -0.467 2.054 1.00 . A A . 15 LEU HB2 1 1 2 678 1 1 15 LEU HB3 H 2.866 -0.213 2.985 1.00 . A A . 15 LEU HB3 1 1 2 679 1 1 15 LEU HD11 H 0.014 2.736 3.921 1.00 . A A . 15 LEU HD11 1 1 2 680 1 1 15 LEU HD12 H 0.222 2.265 2.236 1.00 . A A . 15 LEU HD12 1 1 2 681 1 1 15 LEU HD13 H 1.553 3.019 3.114 1.00 . A A . 15 LEU HD13 1 1 2 682 1 1 15 LEU HD21 H 0.270 -0.947 3.952 1.00 . A A . 15 LEU HD21 1 1 2 683 1 1 15 LEU HD22 H -0.786 0.255 3.207 1.00 . A A . 15 LEU HD22 1 1 2 684 1 1 15 LEU HD23 H -0.414 0.354 4.928 1.00 . A A . 15 LEU HD23 1 1 2 685 1 1 15 LEU HG H 1.798 1.067 4.525 1.00 . A A . 15 LEU HG 1 1 2 686 1 1 15 LEU N N 1.466 1.531 0.515 1.00 . A A . 15 LEU N 1 1 2 687 1 1 15 LEU O O 4.812 0.862 1.034 1.00 . A A . 15 LEU O 1 1 2 688 1 1 16 ALA C C 4.947 0.196 -1.939 1.00 . A A . 16 ALA C 1 1 2 689 1 1 16 ALA CA C 4.199 -0.812 -1.083 1.00 . A A . 16 ALA CA 1 1 2 690 1 1 16 ALA CB C 3.486 -1.828 -1.978 1.00 . A A . 16 ALA CB 1 1 2 691 1 1 16 ALA H H 2.270 -0.225 -0.390 1.00 . A A . 16 ALA H 1 1 2 692 1 1 16 ALA HA H 4.906 -1.328 -0.461 1.00 . A A . 16 ALA HA 1 1 2 693 1 1 16 ALA HB1 H 2.551 -2.116 -1.523 1.00 . A A . 16 ALA HB1 1 1 2 694 1 1 16 ALA HB2 H 4.110 -2.698 -2.101 1.00 . A A . 16 ALA HB2 1 1 2 695 1 1 16 ALA HB3 H 3.294 -1.386 -2.946 1.00 . A A . 16 ALA HB3 1 1 2 696 1 1 16 ALA N N 3.244 -0.125 -0.235 1.00 . A A . 16 ALA N 1 1 2 697 1 1 16 ALA O O 6.111 -0.005 -2.280 1.00 . A A . 16 ALA O 1 1 2 698 1 1 17 LEU C C 6.098 2.885 -2.459 1.00 . A A . 17 LEU C 1 1 2 699 1 1 17 LEU CA C 4.855 2.317 -3.109 1.00 . A A . 17 LEU CA 1 1 2 700 1 1 17 LEU CB C 3.816 3.425 -3.392 1.00 . A A . 17 LEU CB 1 1 2 701 1 1 17 LEU CD1 C 3.911 5.769 -4.311 1.00 . A A . 17 LEU CD1 1 1 2 702 1 1 17 LEU CD2 C 4.038 5.412 -1.841 1.00 . A A . 17 LEU CD2 1 1 2 703 1 1 17 LEU CG C 4.424 4.835 -3.212 1.00 . A A . 17 LEU CG 1 1 2 704 1 1 17 LEU H H 3.339 1.368 -1.977 1.00 . A A . 17 LEU H 1 1 2 705 1 1 17 LEU HA H 5.151 1.876 -4.038 1.00 . A A . 17 LEU HA 1 1 2 706 1 1 17 LEU HB2 H 3.464 3.319 -4.405 1.00 . A A . 17 LEU HB2 1 1 2 707 1 1 17 LEU HB3 H 2.985 3.308 -2.719 1.00 . A A . 17 LEU HB3 1 1 2 708 1 1 17 LEU HD11 H 2.859 5.966 -4.165 1.00 . A A . 17 LEU HD11 1 1 2 709 1 1 17 LEU HD12 H 4.059 5.306 -5.276 1.00 . A A . 17 LEU HD12 1 1 2 710 1 1 17 LEU HD13 H 4.460 6.700 -4.273 1.00 . A A . 17 LEU HD13 1 1 2 711 1 1 17 LEU HD21 H 4.798 6.110 -1.520 1.00 . A A . 17 LEU HD21 1 1 2 712 1 1 17 LEU HD22 H 3.957 4.614 -1.118 1.00 . A A . 17 LEU HD22 1 1 2 713 1 1 17 LEU HD23 H 3.091 5.923 -1.917 1.00 . A A . 17 LEU HD23 1 1 2 714 1 1 17 LEU HG H 5.496 4.778 -3.282 1.00 . A A . 17 LEU HG 1 1 2 715 1 1 17 LEU N N 4.265 1.274 -2.282 1.00 . A A . 17 LEU N 1 1 2 716 1 1 17 LEU O O 7.147 2.991 -3.100 1.00 . A A . 17 LEU O 1 1 2 717 1 1 18 HIS C C 8.105 2.664 -0.198 1.00 . A A . 18 HIS C 1 1 2 718 1 1 18 HIS CA C 7.170 3.790 -0.527 1.00 . A A . 18 HIS CA 1 1 2 719 1 1 18 HIS CB C 6.784 4.556 0.717 1.00 . A A . 18 HIS CB 1 1 2 720 1 1 18 HIS CD2 C 4.981 3.224 2.023 1.00 . A A . 18 HIS CD2 1 1 2 721 1 1 18 HIS CE1 C 6.260 2.324 3.523 1.00 . A A . 18 HIS CE1 1 1 2 722 1 1 18 HIS CG C 6.253 3.639 1.764 1.00 . A A . 18 HIS CG 1 1 2 723 1 1 18 HIS H H 5.140 3.135 -0.719 1.00 . A A . 18 HIS H 1 1 2 724 1 1 18 HIS HA H 7.671 4.462 -1.202 1.00 . A A . 18 HIS HA 1 1 2 725 1 1 18 HIS HB2 H 7.644 5.082 1.095 1.00 . A A . 18 HIS HB2 1 1 2 726 1 1 18 HIS HB3 H 6.024 5.249 0.448 1.00 . A A . 18 HIS HB3 1 1 2 727 1 1 18 HIS HD1 H 8.035 3.158 2.815 1.00 . A A . 18 HIS HD1 1 1 2 728 1 1 18 HIS HD2 H 4.112 3.487 1.429 1.00 . A A . 18 HIS HD2 1 1 2 729 1 1 18 HIS HE1 H 6.611 1.745 4.367 1.00 . A A . 18 HIS HE1 1 1 2 730 1 1 18 HIS HE2 H 4.208 1.953 3.558 1.00 . A A . 18 HIS HE2 1 1 2 731 1 1 18 HIS N N 6.000 3.247 -1.199 1.00 . A A . 18 HIS N 1 1 2 732 1 1 18 HIS ND1 N 7.057 3.056 2.727 1.00 . A A . 18 HIS ND1 1 1 2 733 1 1 18 HIS NE2 N 4.981 2.391 3.140 1.00 . A A . 18 HIS NE2 1 1 2 734 1 1 18 HIS O O 9.313 2.750 -0.422 1.00 . A A . 18 HIS O 1 1 2 735 1 1 19 LEU C C 9.188 0.138 -0.638 1.00 . A A . 19 LEU C 1 1 2 736 1 1 19 LEU CA C 8.312 0.400 0.571 1.00 . A A . 19 LEU CA 1 1 2 737 1 1 19 LEU CB C 7.406 -0.813 0.788 1.00 . A A . 19 LEU CB 1 1 2 738 1 1 19 LEU CD1 C 9.149 -1.641 2.384 1.00 . A A . 19 LEU CD1 1 1 2 739 1 1 19 LEU CD2 C 7.106 -0.490 3.238 1.00 . A A . 19 LEU CD2 1 1 2 740 1 1 19 LEU CG C 7.651 -1.424 2.164 1.00 . A A . 19 LEU CG 1 1 2 741 1 1 19 LEU H H 6.547 1.578 0.397 1.00 . A A . 19 LEU H 1 1 2 742 1 1 19 LEU HA H 8.924 0.573 1.439 1.00 . A A . 19 LEU HA 1 1 2 743 1 1 19 LEU HB2 H 6.377 -0.509 0.708 1.00 . A A . 19 LEU HB2 1 1 2 744 1 1 19 LEU HB3 H 7.616 -1.555 0.030 1.00 . A A . 19 LEU HB3 1 1 2 745 1 1 19 LEU HD11 H 9.605 -0.719 2.707 1.00 . A A . 19 LEU HD11 1 1 2 746 1 1 19 LEU HD12 H 9.607 -1.969 1.460 1.00 . A A . 19 LEU HD12 1 1 2 747 1 1 19 LEU HD13 H 9.292 -2.397 3.143 1.00 . A A . 19 LEU HD13 1 1 2 748 1 1 19 LEU HD21 H 7.850 0.254 3.482 1.00 . A A . 19 LEU HD21 1 1 2 749 1 1 19 LEU HD22 H 6.867 -1.061 4.122 1.00 . A A . 19 LEU HD22 1 1 2 750 1 1 19 LEU HD23 H 6.215 -0.002 2.870 1.00 . A A . 19 LEU HD23 1 1 2 751 1 1 19 LEU HG H 7.142 -2.367 2.220 1.00 . A A . 19 LEU HG 1 1 2 752 1 1 19 LEU N N 7.524 1.584 0.278 1.00 . A A . 19 LEU N 1 1 2 753 1 1 19 LEU O O 10.334 -0.316 -0.532 1.00 . A A . 19 LEU O 1 1 2 754 1 1 20 ALA C C 10.421 1.329 -3.163 1.00 . A A . 20 ALA C 1 1 2 755 1 1 20 ALA CA C 9.311 0.308 -3.072 1.00 . A A . 20 ALA CA 1 1 2 756 1 1 20 ALA CB C 8.342 0.518 -4.239 1.00 . A A . 20 ALA CB 1 1 2 757 1 1 20 ALA H H 7.700 0.846 -1.772 1.00 . A A . 20 ALA H 1 1 2 758 1 1 20 ALA HA H 9.731 -0.680 -3.132 1.00 . A A . 20 ALA HA 1 1 2 759 1 1 20 ALA HB1 H 8.191 1.576 -4.395 1.00 . A A . 20 ALA HB1 1 1 2 760 1 1 20 ALA HB2 H 7.399 0.047 -4.016 1.00 . A A . 20 ALA HB2 1 1 2 761 1 1 20 ALA HB3 H 8.760 0.085 -5.133 1.00 . A A . 20 ALA HB3 1 1 2 762 1 1 20 ALA N N 8.617 0.468 -1.794 1.00 . A A . 20 ALA N 1 1 2 763 1 1 20 ALA O O 11.588 0.993 -3.363 1.00 . A A . 20 ALA O 1 1 2 764 1 1 21 LEU C C 12.195 3.297 -2.191 1.00 . A A . 21 LEU C 1 1 2 765 1 1 21 LEU CA C 10.996 3.674 -3.037 1.00 . A A . 21 LEU CA 1 1 2 766 1 1 21 LEU CB C 10.377 4.972 -2.491 1.00 . A A . 21 LEU CB 1 1 2 767 1 1 21 LEU CD1 C 11.317 6.159 -4.489 1.00 . A A . 21 LEU CD1 1 1 2 768 1 1 21 LEU CD2 C 8.957 5.359 -4.523 1.00 . A A . 21 LEU CD2 1 1 2 769 1 1 21 LEU CG C 10.064 5.938 -3.641 1.00 . A A . 21 LEU CG 1 1 2 770 1 1 21 LEU H H 9.091 2.764 -2.835 1.00 . A A . 21 LEU H 1 1 2 771 1 1 21 LEU HA H 11.317 3.828 -4.049 1.00 . A A . 21 LEU HA 1 1 2 772 1 1 21 LEU HB2 H 9.471 4.744 -1.953 1.00 . A A . 21 LEU HB2 1 1 2 773 1 1 21 LEU HB3 H 11.079 5.445 -1.815 1.00 . A A . 21 LEU HB3 1 1 2 774 1 1 21 LEU HD11 H 12.190 5.856 -3.931 1.00 . A A . 21 LEU HD11 1 1 2 775 1 1 21 LEU HD12 H 11.398 7.203 -4.746 1.00 . A A . 21 LEU HD12 1 1 2 776 1 1 21 LEU HD13 H 11.246 5.574 -5.395 1.00 . A A . 21 LEU HD13 1 1 2 777 1 1 21 LEU HD21 H 8.106 5.102 -3.911 1.00 . A A . 21 LEU HD21 1 1 2 778 1 1 21 LEU HD22 H 9.322 4.476 -5.029 1.00 . A A . 21 LEU HD22 1 1 2 779 1 1 21 LEU HD23 H 8.664 6.094 -5.256 1.00 . A A . 21 LEU HD23 1 1 2 780 1 1 21 LEU HG H 9.741 6.885 -3.234 1.00 . A A . 21 LEU HG 1 1 2 781 1 1 21 LEU N N 10.037 2.581 -2.998 1.00 . A A . 21 LEU N 1 1 2 782 1 1 21 LEU O O 13.334 3.347 -2.648 1.00 . A A . 21 LEU O 1 1 2 783 1 1 22 ALA C C 13.742 1.321 -0.636 1.00 . A A . 22 ALA C 1 1 2 784 1 1 22 ALA CA C 12.968 2.486 -0.038 1.00 . A A . 22 ALA CA 1 1 2 785 1 1 22 ALA CB C 12.372 2.081 1.312 1.00 . A A . 22 ALA CB 1 1 2 786 1 1 22 ALA H H 10.974 2.868 -0.676 1.00 . A A . 22 ALA H 1 1 2 787 1 1 22 ALA HA H 13.641 3.310 0.110 1.00 . A A . 22 ALA HA 1 1 2 788 1 1 22 ALA HB1 H 11.554 1.393 1.155 1.00 . A A . 22 ALA HB1 1 1 2 789 1 1 22 ALA HB2 H 12.010 2.959 1.825 1.00 . A A . 22 ALA HB2 1 1 2 790 1 1 22 ALA HB3 H 13.133 1.604 1.913 1.00 . A A . 22 ALA HB3 1 1 2 791 1 1 22 ALA N N 11.913 2.899 -0.960 1.00 . A A . 22 ALA N 1 1 2 792 1 1 22 ALA O O 14.969 1.244 -0.524 1.00 . A A . 22 ALA O 1 1 2 793 1 1 23 LEU C C 14.540 -0.226 -3.048 1.00 . A A . 23 LEU C 1 1 2 794 1 1 23 LEU CA C 13.633 -0.719 -1.938 1.00 . A A . 23 LEU CA 1 1 2 795 1 1 23 LEU CB C 12.556 -1.638 -2.524 1.00 . A A . 23 LEU CB 1 1 2 796 1 1 23 LEU CD1 C 12.725 -3.931 -1.525 1.00 . A A . 23 LEU CD1 1 1 2 797 1 1 23 LEU CD2 C 12.566 -3.656 -4.007 1.00 . A A . 23 LEU CD2 1 1 2 798 1 1 23 LEU CG C 13.125 -3.053 -2.715 1.00 . A A . 23 LEU CG 1 1 2 799 1 1 23 LEU H H 12.048 0.564 -1.358 1.00 . A A . 23 LEU H 1 1 2 800 1 1 23 LEU HA H 14.212 -1.264 -1.215 1.00 . A A . 23 LEU HA 1 1 2 801 1 1 23 LEU HB2 H 11.710 -1.673 -1.851 1.00 . A A . 23 LEU HB2 1 1 2 802 1 1 23 LEU HB3 H 12.239 -1.248 -3.479 1.00 . A A . 23 LEU HB3 1 1 2 803 1 1 23 LEU HD11 H 12.800 -3.359 -0.610 1.00 . A A . 23 LEU HD11 1 1 2 804 1 1 23 LEU HD12 H 13.386 -4.783 -1.471 1.00 . A A . 23 LEU HD12 1 1 2 805 1 1 23 LEU HD13 H 11.708 -4.275 -1.657 1.00 . A A . 23 LEU HD13 1 1 2 806 1 1 23 LEU HD21 H 12.767 -4.716 -4.026 1.00 . A A . 23 LEU HD21 1 1 2 807 1 1 23 LEU HD22 H 13.034 -3.186 -4.862 1.00 . A A . 23 LEU HD22 1 1 2 808 1 1 23 LEU HD23 H 11.500 -3.493 -4.046 1.00 . A A . 23 LEU HD23 1 1 2 809 1 1 23 LEU HG H 14.204 -3.003 -2.778 1.00 . A A . 23 LEU HG 1 1 2 810 1 1 23 LEU N N 13.016 0.431 -1.290 1.00 . A A . 23 LEU N 1 1 2 811 1 1 23 LEU O O 15.700 -0.631 -3.167 1.00 . A A . 23 LEU O 1 1 2 812 1 1 24 LYS C C 15.888 2.100 -4.424 1.00 . A A . 24 LYS C 1 1 2 813 1 1 24 LYS CA C 14.725 1.268 -4.958 1.00 . A A . 24 LYS CA 1 1 2 814 1 1 24 LYS CB C 13.779 2.154 -5.782 1.00 . A A . 24 LYS CB 1 1 2 815 1 1 24 LYS CD C 14.470 3.753 -7.589 1.00 . A A . 24 LYS CD 1 1 2 816 1 1 24 LYS CE C 13.104 4.420 -7.793 1.00 . A A . 24 LYS CE 1 1 2 817 1 1 24 LYS CG C 14.284 2.273 -7.227 1.00 . A A . 24 LYS CG 1 1 2 818 1 1 24 LYS H H 13.066 0.945 -3.676 1.00 . A A . 24 LYS H 1 1 2 819 1 1 24 LYS HA H 15.111 0.484 -5.586 1.00 . A A . 24 LYS HA 1 1 2 820 1 1 24 LYS HB2 H 12.790 1.715 -5.784 1.00 . A A . 24 LYS HB2 1 1 2 821 1 1 24 LYS HB3 H 13.731 3.136 -5.336 1.00 . A A . 24 LYS HB3 1 1 2 822 1 1 24 LYS HD2 H 14.992 4.254 -6.783 1.00 . A A . 24 LYS HD2 1 1 2 823 1 1 24 LYS HD3 H 15.050 3.836 -8.496 1.00 . A A . 24 LYS HD3 1 1 2 824 1 1 24 LYS HE2 H 12.510 4.308 -6.898 1.00 . A A . 24 LYS HE2 1 1 2 825 1 1 24 LYS HE3 H 13.248 5.473 -7.995 1.00 . A A . 24 LYS HE3 1 1 2 826 1 1 24 LYS HG2 H 15.231 1.754 -7.321 1.00 . A A . 24 LYS HG2 1 1 2 827 1 1 24 LYS HG3 H 13.565 1.826 -7.896 1.00 . A A . 24 LYS HG3 1 1 2 828 1 1 24 LYS HZ1 H 11.606 4.405 -9.230 1.00 . A A . 24 LYS HZ1 1 1 2 829 1 1 24 LYS HZ2 H 12.010 2.869 -8.652 1.00 . A A . 24 LYS HZ2 1 1 2 830 1 1 24 LYS HZ3 H 13.049 3.664 -9.736 1.00 . A A . 24 LYS HZ3 1 1 2 831 1 1 24 LYS N N 13.993 0.670 -3.849 1.00 . A A . 24 LYS N 1 1 2 832 1 1 24 LYS NZ N 12.393 3.790 -8.939 1.00 . A A . 24 LYS NZ 1 1 2 833 1 1 24 LYS O O 17.036 1.947 -4.848 1.00 . A A . 24 LYS O 1 1 2 834 1 1 25 LYS C C 15.999 4.440 -1.586 1.00 . A A . 25 LYS C 1 1 2 835 1 1 25 LYS CA C 16.566 3.837 -2.868 1.00 . A A . 25 LYS CA 1 1 2 836 1 1 25 LYS CB C 16.963 4.964 -3.829 1.00 . A A . 25 LYS CB 1 1 2 837 1 1 25 LYS CD C 18.044 7.221 -3.678 1.00 . A A . 25 LYS CD 1 1 2 838 1 1 25 LYS CE C 18.042 8.127 -2.443 1.00 . A A . 25 LYS CE 1 1 2 839 1 1 25 LYS CG C 18.130 5.757 -3.234 1.00 . A A . 25 LYS CG 1 1 2 840 1 1 25 LYS H H 14.638 3.032 -3.197 1.00 . A A . 25 LYS H 1 1 2 841 1 1 25 LYS HA H 17.442 3.255 -2.627 1.00 . A A . 25 LYS HA 1 1 2 842 1 1 25 LYS HB2 H 17.264 4.536 -4.777 1.00 . A A . 25 LYS HB2 1 1 2 843 1 1 25 LYS HB3 H 16.121 5.619 -3.982 1.00 . A A . 25 LYS HB3 1 1 2 844 1 1 25 LYS HD2 H 18.897 7.459 -4.296 1.00 . A A . 25 LYS HD2 1 1 2 845 1 1 25 LYS HD3 H 17.137 7.379 -4.242 1.00 . A A . 25 LYS HD3 1 1 2 846 1 1 25 LYS HE2 H 18.881 7.874 -1.810 1.00 . A A . 25 LYS HE2 1 1 2 847 1 1 25 LYS HE3 H 18.124 9.157 -2.754 1.00 . A A . 25 LYS HE3 1 1 2 848 1 1 25 LYS HG2 H 18.092 5.702 -2.157 1.00 . A A . 25 LYS HG2 1 1 2 849 1 1 25 LYS HG3 H 19.062 5.333 -3.577 1.00 . A A . 25 LYS HG3 1 1 2 850 1 1 25 LYS HZ1 H 16.987 7.469 -0.766 1.00 . A A . 25 LYS HZ1 1 1 2 851 1 1 25 LYS HZ2 H 16.126 7.339 -2.228 1.00 . A A . 25 LYS HZ2 1 1 2 852 1 1 25 LYS HZ3 H 16.333 8.856 -1.508 1.00 . A A . 25 LYS HZ3 1 1 2 853 1 1 25 LYS N N 15.573 2.972 -3.486 1.00 . A A . 25 LYS N 1 1 2 854 1 1 25 LYS NZ N 16.776 7.933 -1.683 1.00 . A A . 25 LYS NZ 1 1 2 855 1 1 25 LYS O O 14.907 5.010 -1.591 1.00 . A A . 25 LYS O 1 1 2 856 1 1 26 ALA C C 16.395 6.378 0.765 1.00 . A A . 26 ALA C 1 1 2 857 1 1 26 ALA CA C 16.301 4.859 0.784 1.00 . A A . 26 ALA CA 1 1 2 858 1 1 26 ALA CB C 17.172 4.313 1.915 1.00 . A A . 26 ALA CB 1 1 2 859 1 1 26 ALA H H 17.607 3.861 -0.554 1.00 . A A . 26 ALA H 1 1 2 860 1 1 26 ALA HA H 15.275 4.569 0.959 1.00 . A A . 26 ALA HA 1 1 2 861 1 1 26 ALA HB1 H 16.756 4.617 2.864 1.00 . A A . 26 ALA HB1 1 1 2 862 1 1 26 ALA HB2 H 18.173 4.705 1.817 1.00 . A A . 26 ALA HB2 1 1 2 863 1 1 26 ALA HB3 H 17.199 3.237 1.862 1.00 . A A . 26 ALA HB3 1 1 2 864 1 1 26 ALA N N 16.742 4.316 -0.496 1.00 . A A . 26 ALA N 1 1 2 865 1 1 26 ALA O O 17.438 6.877 0.396 1.00 . A A . 26 ALA O 1 1 2 866 1 1 26 ALA OXT O 15.423 7.021 1.101 1.00 . A A . 26 ALA OXT 1 1 3 867 1 1 1 LYS C C -11.348 15.549 -1.403 1.00 . A A . 1 LYS C 1 1 3 868 1 1 1 LYS CA C -11.449 17.067 -1.407 1.00 . A A . 1 LYS CA 1 1 3 869 1 1 1 LYS CB C -10.116 17.684 -0.939 1.00 . A A . 1 LYS CB 1 1 3 870 1 1 1 LYS CD C -9.034 19.639 0.183 1.00 . A A . 1 LYS CD 1 1 3 871 1 1 1 LYS CE C -9.287 20.997 0.855 1.00 . A A . 1 LYS CE 1 1 3 872 1 1 1 LYS CG C -10.364 18.920 -0.061 1.00 . A A . 1 LYS CG 1 1 3 873 1 1 1 LYS H1 H -12.889 18.422 -0.765 1.00 . A A . 1 LYS H1 1 1 3 874 1 1 1 LYS H2 H -12.219 17.480 0.479 1.00 . A A . 1 LYS H2 1 1 3 875 1 1 1 LYS H3 H -13.339 16.797 -0.595 1.00 . A A . 1 LYS H3 1 1 3 876 1 1 1 LYS HA H -11.669 17.405 -2.408 1.00 . A A . 1 LYS HA 1 1 3 877 1 1 1 LYS HB2 H -9.565 16.949 -0.370 1.00 . A A . 1 LYS HB2 1 1 3 878 1 1 1 LYS HB3 H -9.536 17.972 -1.804 1.00 . A A . 1 LYS HB3 1 1 3 879 1 1 1 LYS HD2 H -8.410 19.033 0.826 1.00 . A A . 1 LYS HD2 1 1 3 880 1 1 1 LYS HD3 H -8.532 19.794 -0.760 1.00 . A A . 1 LYS HD3 1 1 3 881 1 1 1 LYS HE2 H -8.339 21.474 1.059 1.00 . A A . 1 LYS HE2 1 1 3 882 1 1 1 LYS HE3 H -9.868 21.626 0.192 1.00 . A A . 1 LYS HE3 1 1 3 883 1 1 1 LYS HG2 H -11.054 19.590 -0.554 1.00 . A A . 1 LYS HG2 1 1 3 884 1 1 1 LYS HG3 H -10.777 18.610 0.887 1.00 . A A . 1 LYS HG3 1 1 3 885 1 1 1 LYS HZ1 H -11.041 20.980 1.985 1.00 . A A . 1 LYS HZ1 1 1 3 886 1 1 1 LYS HZ2 H -9.660 21.453 2.857 1.00 . A A . 1 LYS HZ2 1 1 3 887 1 1 1 LYS HZ3 H -9.898 19.821 2.467 1.00 . A A . 1 LYS HZ3 1 1 3 888 1 1 1 LYS N N -12.555 17.475 -0.502 1.00 . A A . 1 LYS N 1 1 3 889 1 1 1 LYS NZ N -10.029 20.797 2.136 1.00 . A A . 1 LYS NZ 1 1 3 890 1 1 1 LYS O O -12.291 14.857 -1.011 1.00 . A A . 1 LYS O 1 1 3 891 1 1 2 LYS C C -9.402 13.132 -0.519 1.00 . A A . 2 LYS C 1 1 3 892 1 1 2 LYS CA C -9.973 13.599 -1.860 1.00 . A A . 2 LYS CA 1 1 3 893 1 1 2 LYS CB C -9.019 13.241 -3.006 1.00 . A A . 2 LYS CB 1 1 3 894 1 1 2 LYS CD C -8.902 13.052 -5.499 1.00 . A A . 2 LYS CD 1 1 3 895 1 1 2 LYS CE C -7.459 13.553 -5.641 1.00 . A A . 2 LYS CE 1 1 3 896 1 1 2 LYS CG C -9.593 13.760 -4.331 1.00 . A A . 2 LYS CG 1 1 3 897 1 1 2 LYS H H -9.485 15.647 -2.114 1.00 . A A . 2 LYS H 1 1 3 898 1 1 2 LYS HA H -10.922 13.105 -2.028 1.00 . A A . 2 LYS HA 1 1 3 899 1 1 2 LYS HB2 H -8.057 13.697 -2.827 1.00 . A A . 2 LYS HB2 1 1 3 900 1 1 2 LYS HB3 H -8.909 12.169 -3.060 1.00 . A A . 2 LYS HB3 1 1 3 901 1 1 2 LYS HD2 H -8.895 11.986 -5.319 1.00 . A A . 2 LYS HD2 1 1 3 902 1 1 2 LYS HD3 H -9.444 13.255 -6.412 1.00 . A A . 2 LYS HD3 1 1 3 903 1 1 2 LYS HE2 H -6.869 13.192 -4.811 1.00 . A A . 2 LYS HE2 1 1 3 904 1 1 2 LYS HE3 H -7.043 13.183 -6.566 1.00 . A A . 2 LYS HE3 1 1 3 905 1 1 2 LYS HG2 H -10.652 13.556 -4.365 1.00 . A A . 2 LYS HG2 1 1 3 906 1 1 2 LYS HG3 H -9.429 14.824 -4.408 1.00 . A A . 2 LYS HG3 1 1 3 907 1 1 2 LYS HZ1 H -6.548 15.382 -6.051 1.00 . A A . 2 LYS HZ1 1 1 3 908 1 1 2 LYS HZ2 H -7.542 15.401 -4.683 1.00 . A A . 2 LYS HZ2 1 1 3 909 1 1 2 LYS HZ3 H -8.232 15.399 -6.232 1.00 . A A . 2 LYS HZ3 1 1 3 910 1 1 2 LYS N N -10.199 15.039 -1.828 1.00 . A A . 2 LYS N 1 1 3 911 1 1 2 LYS NZ N -7.444 15.044 -5.652 1.00 . A A . 2 LYS NZ 1 1 3 912 1 1 2 LYS O O -10.009 13.370 0.525 1.00 . A A . 2 LYS O 1 1 3 913 1 1 3 ALA C C -8.578 11.272 1.571 1.00 . A A . 3 ALA C 1 1 3 914 1 1 3 ALA CA C -7.587 12.007 0.673 1.00 . A A . 3 ALA CA 1 1 3 915 1 1 3 ALA CB C -6.976 13.184 1.439 1.00 . A A . 3 ALA CB 1 1 3 916 1 1 3 ALA H H -7.792 12.336 -1.415 1.00 . A A . 3 ALA H 1 1 3 917 1 1 3 ALA HA H -6.798 11.324 0.402 1.00 . A A . 3 ALA HA 1 1 3 918 1 1 3 ALA HB1 H -7.732 13.936 1.609 1.00 . A A . 3 ALA HB1 1 1 3 919 1 1 3 ALA HB2 H -6.167 13.608 0.864 1.00 . A A . 3 ALA HB2 1 1 3 920 1 1 3 ALA HB3 H -6.597 12.837 2.389 1.00 . A A . 3 ALA HB3 1 1 3 921 1 1 3 ALA N N -8.234 12.489 -0.550 1.00 . A A . 3 ALA N 1 1 3 922 1 1 3 ALA O O -8.442 11.272 2.800 1.00 . A A . 3 ALA O 1 1 3 923 1 1 4 LEU C C -10.068 8.465 1.953 1.00 . A A . 4 LEU C 1 1 3 924 1 1 4 LEU CA C -10.555 9.888 1.734 1.00 . A A . 4 LEU CA 1 1 3 925 1 1 4 LEU CB C -11.915 9.860 1.020 1.00 . A A . 4 LEU CB 1 1 3 926 1 1 4 LEU CD1 C -10.882 8.725 -0.979 1.00 . A A . 4 LEU CD1 1 1 3 927 1 1 4 LEU CD2 C -13.122 9.813 -1.163 1.00 . A A . 4 LEU CD2 1 1 3 928 1 1 4 LEU CG C -11.744 9.902 -0.505 1.00 . A A . 4 LEU CG 1 1 3 929 1 1 4 LEU H H -9.626 10.652 -0.012 1.00 . A A . 4 LEU H 1 1 3 930 1 1 4 LEU HA H -10.677 10.363 2.693 1.00 . A A . 4 LEU HA 1 1 3 931 1 1 4 LEU HB2 H -12.439 8.955 1.293 1.00 . A A . 4 LEU HB2 1 1 3 932 1 1 4 LEU HB3 H -12.494 10.713 1.337 1.00 . A A . 4 LEU HB3 1 1 3 933 1 1 4 LEU HD11 H -11.197 8.429 -1.969 1.00 . A A . 4 LEU HD11 1 1 3 934 1 1 4 LEU HD12 H -10.999 7.894 -0.305 1.00 . A A . 4 LEU HD12 1 1 3 935 1 1 4 LEU HD13 H -9.846 9.024 -1.008 1.00 . A A . 4 LEU HD13 1 1 3 936 1 1 4 LEU HD21 H -13.508 8.810 -1.057 1.00 . A A . 4 LEU HD21 1 1 3 937 1 1 4 LEU HD22 H -13.040 10.060 -2.210 1.00 . A A . 4 LEU HD22 1 1 3 938 1 1 4 LEU HD23 H -13.795 10.507 -0.683 1.00 . A A . 4 LEU HD23 1 1 3 939 1 1 4 LEU HG H -11.271 10.830 -0.787 1.00 . A A . 4 LEU HG 1 1 3 940 1 1 4 LEU N N -9.567 10.635 0.962 1.00 . A A . 4 LEU N 1 1 3 941 1 1 4 LEU O O -9.021 8.068 1.427 1.00 . A A . 4 LEU O 1 1 3 942 1 1 5 LEU C C -11.448 5.371 2.299 1.00 . A A . 5 LEU C 1 1 3 943 1 1 5 LEU CA C -10.460 6.312 2.973 1.00 . A A . 5 LEU CA 1 1 3 944 1 1 5 LEU CB C -10.429 6.038 4.477 1.00 . A A . 5 LEU CB 1 1 3 945 1 1 5 LEU CD1 C -7.939 5.896 4.808 1.00 . A A . 5 LEU CD1 1 1 3 946 1 1 5 LEU CD2 C -9.469 4.473 6.172 1.00 . A A . 5 LEU CD2 1 1 3 947 1 1 5 LEU CG C -9.253 5.106 4.799 1.00 . A A . 5 LEU CG 1 1 3 948 1 1 5 LEU H H -11.659 8.054 3.092 1.00 . A A . 5 LEU H 1 1 3 949 1 1 5 LEU HA H -9.473 6.133 2.565 1.00 . A A . 5 LEU HA 1 1 3 950 1 1 5 LEU HB2 H -10.316 6.970 5.011 1.00 . A A . 5 LEU HB2 1 1 3 951 1 1 5 LEU HB3 H -11.353 5.562 4.773 1.00 . A A . 5 LEU HB3 1 1 3 952 1 1 5 LEU HD11 H -7.285 5.508 5.578 1.00 . A A . 5 LEU HD11 1 1 3 953 1 1 5 LEU HD12 H -8.144 6.937 5.004 1.00 . A A . 5 LEU HD12 1 1 3 954 1 1 5 LEU HD13 H -7.457 5.801 3.847 1.00 . A A . 5 LEU HD13 1 1 3 955 1 1 5 LEU HD21 H -8.767 3.664 6.307 1.00 . A A . 5 LEU HD21 1 1 3 956 1 1 5 LEU HD22 H -10.473 4.086 6.237 1.00 . A A . 5 LEU HD22 1 1 3 957 1 1 5 LEU HD23 H -9.316 5.217 6.943 1.00 . A A . 5 LEU HD23 1 1 3 958 1 1 5 LEU HG H -9.197 4.328 4.052 1.00 . A A . 5 LEU HG 1 1 3 959 1 1 5 LEU N N -10.830 7.693 2.709 1.00 . A A . 5 LEU N 1 1 3 960 1 1 5 LEU O O -12.663 5.506 2.459 1.00 . A A . 5 LEU O 1 1 3 961 1 1 6 ALA C C -10.868 2.269 0.427 1.00 . A A . 6 ALA C 1 1 3 962 1 1 6 ALA CA C -11.729 3.449 0.842 1.00 . A A . 6 ALA CA 1 1 3 963 1 1 6 ALA CB C -12.355 4.085 -0.399 1.00 . A A . 6 ALA CB 1 1 3 964 1 1 6 ALA H H -9.939 4.372 1.469 1.00 . A A . 6 ALA H 1 1 3 965 1 1 6 ALA HA H -12.516 3.102 1.496 1.00 . A A . 6 ALA HA 1 1 3 966 1 1 6 ALA HB1 H -13.289 3.592 -0.626 1.00 . A A . 6 ALA HB1 1 1 3 967 1 1 6 ALA HB2 H -11.680 3.979 -1.234 1.00 . A A . 6 ALA HB2 1 1 3 968 1 1 6 ALA HB3 H -12.537 5.131 -0.213 1.00 . A A . 6 ALA HB3 1 1 3 969 1 1 6 ALA N N -10.910 4.422 1.550 1.00 . A A . 6 ALA N 1 1 3 970 1 1 6 ALA O O -9.753 2.101 0.930 1.00 . A A . 6 ALA O 1 1 3 971 1 1 7 LEU C C -10.145 -0.524 0.217 1.00 . A A . 7 LEU C 1 1 3 972 1 1 7 LEU CA C -10.641 0.293 -0.972 1.00 . A A . 7 LEU CA 1 1 3 973 1 1 7 LEU CB C -9.448 0.730 -1.836 1.00 . A A . 7 LEU CB 1 1 3 974 1 1 7 LEU CD1 C -8.934 3.125 -2.348 1.00 . A A . 7 LEU CD1 1 1 3 975 1 1 7 LEU CD2 C -9.678 1.603 -4.187 1.00 . A A . 7 LEU CD2 1 1 3 976 1 1 7 LEU CG C -9.837 1.941 -2.699 1.00 . A A . 7 LEU CG 1 1 3 977 1 1 7 LEU H H -12.270 1.645 -0.860 1.00 . A A . 7 LEU H 1 1 3 978 1 1 7 LEU HA H -11.303 -0.318 -1.569 1.00 . A A . 7 LEU HA 1 1 3 979 1 1 7 LEU HB2 H -8.622 0.997 -1.191 1.00 . A A . 7 LEU HB2 1 1 3 980 1 1 7 LEU HB3 H -9.148 -0.087 -2.478 1.00 . A A . 7 LEU HB3 1 1 3 981 1 1 7 LEU HD11 H -9.179 3.966 -2.978 1.00 . A A . 7 LEU HD11 1 1 3 982 1 1 7 LEU HD12 H -7.901 2.849 -2.500 1.00 . A A . 7 LEU HD12 1 1 3 983 1 1 7 LEU HD13 H -9.084 3.395 -1.315 1.00 . A A . 7 LEU HD13 1 1 3 984 1 1 7 LEU HD21 H -8.665 1.285 -4.379 1.00 . A A . 7 LEU HD21 1 1 3 985 1 1 7 LEU HD22 H -9.896 2.480 -4.780 1.00 . A A . 7 LEU HD22 1 1 3 986 1 1 7 LEU HD23 H -10.362 0.812 -4.453 1.00 . A A . 7 LEU HD23 1 1 3 987 1 1 7 LEU HG H -10.866 2.207 -2.502 1.00 . A A . 7 LEU HG 1 1 3 988 1 1 7 LEU N N -11.378 1.458 -0.494 1.00 . A A . 7 LEU N 1 1 3 989 1 1 7 LEU O O -10.671 -0.396 1.325 1.00 . A A . 7 LEU O 1 1 3 990 1 1 8 ALA C C -7.187 -2.700 0.726 1.00 . A A . 8 ALA C 1 1 3 991 1 1 8 ALA CA C -8.579 -2.175 1.072 1.00 . A A . 8 ALA CA 1 1 3 992 1 1 8 ALA CB C -9.502 -3.359 1.367 1.00 . A A . 8 ALA CB 1 1 3 993 1 1 8 ALA H H -8.749 -1.415 -0.909 1.00 . A A . 8 ALA H 1 1 3 994 1 1 8 ALA HA H -8.505 -1.571 1.958 1.00 . A A . 8 ALA HA 1 1 3 995 1 1 8 ALA HB1 H -9.472 -4.056 0.541 1.00 . A A . 8 ALA HB1 1 1 3 996 1 1 8 ALA HB2 H -10.511 -3.007 1.503 1.00 . A A . 8 ALA HB2 1 1 3 997 1 1 8 ALA HB3 H -9.170 -3.856 2.266 1.00 . A A . 8 ALA HB3 1 1 3 998 1 1 8 ALA N N -9.132 -1.356 -0.009 1.00 . A A . 8 ALA N 1 1 3 999 1 1 8 ALA O O -6.335 -2.845 1.600 1.00 . A A . 8 ALA O 1 1 3 1000 1 1 9 LEU C C -4.805 -2.414 -1.508 1.00 . A A . 9 LEU C 1 1 3 1001 1 1 9 LEU CA C -5.685 -3.525 -0.991 1.00 . A A . 9 LEU CA 1 1 3 1002 1 1 9 LEU CB C -5.896 -4.536 -2.110 1.00 . A A . 9 LEU CB 1 1 3 1003 1 1 9 LEU CD1 C -6.529 -5.957 -0.137 1.00 . A A . 9 LEU CD1 1 1 3 1004 1 1 9 LEU CD2 C -8.237 -5.404 -1.868 1.00 . A A . 9 LEU CD2 1 1 3 1005 1 1 9 LEU CG C -6.757 -5.714 -1.627 1.00 . A A . 9 LEU CG 1 1 3 1006 1 1 9 LEU H H -7.693 -2.870 -1.189 1.00 . A A . 9 LEU H 1 1 3 1007 1 1 9 LEU HA H -5.189 -4.007 -0.169 1.00 . A A . 9 LEU HA 1 1 3 1008 1 1 9 LEU HB2 H -6.387 -4.041 -2.931 1.00 . A A . 9 LEU HB2 1 1 3 1009 1 1 9 LEU HB3 H -4.935 -4.900 -2.433 1.00 . A A . 9 LEU HB3 1 1 3 1010 1 1 9 LEU HD11 H -6.971 -6.901 0.145 1.00 . A A . 9 LEU HD11 1 1 3 1011 1 1 9 LEU HD12 H -6.989 -5.161 0.429 1.00 . A A . 9 LEU HD12 1 1 3 1012 1 1 9 LEU HD13 H -5.468 -5.979 0.066 1.00 . A A . 9 LEU HD13 1 1 3 1013 1 1 9 LEU HD21 H -8.838 -5.912 -1.129 1.00 . A A . 9 LEU HD21 1 1 3 1014 1 1 9 LEU HD22 H -8.519 -5.743 -2.853 1.00 . A A . 9 LEU HD22 1 1 3 1015 1 1 9 LEU HD23 H -8.403 -4.343 -1.793 1.00 . A A . 9 LEU HD23 1 1 3 1016 1 1 9 LEU HG H -6.483 -6.604 -2.177 1.00 . A A . 9 LEU HG 1 1 3 1017 1 1 9 LEU N N -6.973 -2.997 -0.542 1.00 . A A . 9 LEU N 1 1 3 1018 1 1 9 LEU O O -3.628 -2.317 -1.153 1.00 . A A . 9 LEU O 1 1 3 1019 1 1 10 HIS C C -3.827 0.154 -1.779 1.00 . A A . 10 HIS C 1 1 3 1020 1 1 10 HIS CA C -4.645 -0.443 -2.900 1.00 . A A . 10 HIS CA 1 1 3 1021 1 1 10 HIS CB C -5.607 0.614 -3.420 1.00 . A A . 10 HIS CB 1 1 3 1022 1 1 10 HIS CD2 C -6.909 -0.297 -5.515 1.00 . A A . 10 HIS CD2 1 1 3 1023 1 1 10 HIS CE1 C -5.595 0.471 -7.063 1.00 . A A . 10 HIS CE1 1 1 3 1024 1 1 10 HIS CG C -5.893 0.372 -4.879 1.00 . A A . 10 HIS CG 1 1 3 1025 1 1 10 HIS H H -6.323 -1.713 -2.578 1.00 . A A . 10 HIS H 1 1 3 1026 1 1 10 HIS HA H -3.997 -0.778 -3.693 1.00 . A A . 10 HIS HA 1 1 3 1027 1 1 10 HIS HB2 H -6.525 0.566 -2.854 1.00 . A A . 10 HIS HB2 1 1 3 1028 1 1 10 HIS HB3 H -5.159 1.589 -3.293 1.00 . A A . 10 HIS HB3 1 1 3 1029 1 1 10 HIS HD1 H -4.242 1.378 -5.757 1.00 . A A . 10 HIS HD1 1 1 3 1030 1 1 10 HIS HD2 H -7.732 -0.794 -5.024 1.00 . A A . 10 HIS HD2 1 1 3 1031 1 1 10 HIS HE1 H -5.164 0.707 -8.028 1.00 . A A . 10 HIS HE1 1 1 3 1032 1 1 10 HIS HE2 H -7.287 -0.631 -7.592 1.00 . A A . 10 HIS HE2 1 1 3 1033 1 1 10 HIS N N -5.385 -1.573 -2.344 1.00 . A A . 10 HIS N 1 1 3 1034 1 1 10 HIS ND1 N -5.065 0.852 -5.883 1.00 . A A . 10 HIS ND1 1 1 3 1035 1 1 10 HIS NE2 N -6.720 -0.235 -6.894 1.00 . A A . 10 HIS NE2 1 1 3 1036 1 1 10 HIS O O -2.687 0.578 -1.948 1.00 . A A . 10 HIS O 1 1 3 1037 1 1 11 HIS C C -2.403 0.175 0.686 1.00 . A A . 11 HIS C 1 1 3 1038 1 1 11 HIS CA C -3.859 0.579 0.611 1.00 . A A . 11 HIS CA 1 1 3 1039 1 1 11 HIS CB C -4.603 -0.118 1.733 1.00 . A A . 11 HIS CB 1 1 3 1040 1 1 11 HIS CD2 C -7.065 0.776 1.588 1.00 . A A . 11 HIS CD2 1 1 3 1041 1 1 11 HIS CE1 C -7.021 2.124 3.285 1.00 . A A . 11 HIS CE1 1 1 3 1042 1 1 11 HIS CG C -5.807 0.692 2.128 1.00 . A A . 11 HIS CG 1 1 3 1043 1 1 11 HIS H H -5.344 -0.272 -0.591 1.00 . A A . 11 HIS H 1 1 3 1044 1 1 11 HIS HA H -3.964 1.643 0.706 1.00 . A A . 11 HIS HA 1 1 3 1045 1 1 11 HIS HB2 H -4.925 -1.101 1.380 1.00 . A A . 11 HIS HB2 1 1 3 1046 1 1 11 HIS HB3 H -3.940 -0.238 2.574 1.00 . A A . 11 HIS HB3 1 1 3 1047 1 1 11 HIS HD1 H -5.034 1.742 3.807 1.00 . A A . 11 HIS HD1 1 1 3 1048 1 1 11 HIS HD2 H -7.405 0.232 0.723 1.00 . A A . 11 HIS HD2 1 1 3 1049 1 1 11 HIS HE1 H -7.309 2.846 4.039 1.00 . A A . 11 HIS HE1 1 1 3 1050 1 1 11 HIS HE2 H -8.768 1.942 2.149 1.00 . A A . 11 HIS HE2 1 1 3 1051 1 1 11 HIS N N -4.449 0.117 -0.622 1.00 . A A . 11 HIS N 1 1 3 1052 1 1 11 HIS ND1 N -5.799 1.559 3.208 1.00 . A A . 11 HIS ND1 1 1 3 1053 1 1 11 HIS NE2 N -7.832 1.679 2.318 1.00 . A A . 11 HIS NE2 1 1 3 1054 1 1 11 HIS O O -1.525 0.955 1.052 1.00 . A A . 11 HIS O 1 1 3 1055 1 1 12 LEU C C -0.053 -1.084 -0.811 1.00 . A A . 12 LEU C 1 1 3 1056 1 1 12 LEU CA C -0.843 -1.638 0.347 1.00 . A A . 12 LEU CA 1 1 3 1057 1 1 12 LEU CB C -0.921 -3.161 0.224 1.00 . A A . 12 LEU CB 1 1 3 1058 1 1 12 LEU CD1 C -0.181 -5.320 1.240 1.00 . A A . 12 LEU CD1 1 1 3 1059 1 1 12 LEU CD2 C 1.514 -3.607 0.603 1.00 . A A . 12 LEU CD2 1 1 3 1060 1 1 12 LEU CG C 0.103 -3.820 1.154 1.00 . A A . 12 LEU CG 1 1 3 1061 1 1 12 LEU H H -2.941 -1.620 0.037 1.00 . A A . 12 LEU H 1 1 3 1062 1 1 12 LEU HA H -0.357 -1.374 1.271 1.00 . A A . 12 LEU HA 1 1 3 1063 1 1 12 LEU HB2 H -1.914 -3.488 0.495 1.00 . A A . 12 LEU HB2 1 1 3 1064 1 1 12 LEU HB3 H -0.716 -3.449 -0.797 1.00 . A A . 12 LEU HB3 1 1 3 1065 1 1 12 LEU HD11 H -0.801 -5.520 2.103 1.00 . A A . 12 LEU HD11 1 1 3 1066 1 1 12 LEU HD12 H 0.750 -5.858 1.333 1.00 . A A . 12 LEU HD12 1 1 3 1067 1 1 12 LEU HD13 H -0.693 -5.641 0.346 1.00 . A A . 12 LEU HD13 1 1 3 1068 1 1 12 LEU HD21 H 1.549 -3.909 -0.434 1.00 . A A . 12 LEU HD21 1 1 3 1069 1 1 12 LEU HD22 H 2.214 -4.199 1.171 1.00 . A A . 12 LEU HD22 1 1 3 1070 1 1 12 LEU HD23 H 1.780 -2.563 0.683 1.00 . A A . 12 LEU HD23 1 1 3 1071 1 1 12 LEU HG H 0.028 -3.384 2.139 1.00 . A A . 12 LEU HG 1 1 3 1072 1 1 12 LEU N N -2.177 -1.070 0.331 1.00 . A A . 12 LEU N 1 1 3 1073 1 1 12 LEU O O 1.116 -0.731 -0.674 1.00 . A A . 12 LEU O 1 1 3 1074 1 1 13 ALA C C 0.553 0.872 -2.824 1.00 . A A . 13 ALA C 1 1 3 1075 1 1 13 ALA CA C -0.094 -0.463 -3.152 1.00 . A A . 13 ALA CA 1 1 3 1076 1 1 13 ALA CB C -1.132 -0.276 -4.266 1.00 . A A . 13 ALA CB 1 1 3 1077 1 1 13 ALA H H -1.662 -1.281 -1.957 1.00 . A A . 13 ALA H 1 1 3 1078 1 1 13 ALA HA H 0.667 -1.150 -3.484 1.00 . A A . 13 ALA HA 1 1 3 1079 1 1 13 ALA HB1 H -0.644 -0.348 -5.227 1.00 . A A . 13 ALA HB1 1 1 3 1080 1 1 13 ALA HB2 H -1.590 0.698 -4.170 1.00 . A A . 13 ALA HB2 1 1 3 1081 1 1 13 ALA HB3 H -1.891 -1.039 -4.190 1.00 . A A . 13 ALA HB3 1 1 3 1082 1 1 13 ALA N N -0.720 -0.996 -1.945 1.00 . A A . 13 ALA N 1 1 3 1083 1 1 13 ALA O O 1.569 1.259 -3.409 1.00 . A A . 13 ALA O 1 1 3 1084 1 1 14 HIS C C 1.692 2.646 -0.582 1.00 . A A . 14 HIS C 1 1 3 1085 1 1 14 HIS CA C 0.452 2.853 -1.422 1.00 . A A . 14 HIS CA 1 1 3 1086 1 1 14 HIS CB C -0.641 3.557 -0.627 1.00 . A A . 14 HIS CB 1 1 3 1087 1 1 14 HIS CD2 C -0.339 4.214 1.895 1.00 . A A . 14 HIS CD2 1 1 3 1088 1 1 14 HIS CE1 C 1.221 5.704 1.669 1.00 . A A . 14 HIS CE1 1 1 3 1089 1 1 14 HIS CG C -0.069 4.302 0.554 1.00 . A A . 14 HIS CG 1 1 3 1090 1 1 14 HIS H H -0.847 1.183 -1.447 1.00 . A A . 14 HIS H 1 1 3 1091 1 1 14 HIS HA H 0.706 3.452 -2.278 1.00 . A A . 14 HIS HA 1 1 3 1092 1 1 14 HIS HB2 H -1.135 4.238 -1.278 1.00 . A A . 14 HIS HB2 1 1 3 1093 1 1 14 HIS HB3 H -1.352 2.823 -0.276 1.00 . A A . 14 HIS HB3 1 1 3 1094 1 1 14 HIS HD1 H 1.346 5.561 -0.411 1.00 . A A . 14 HIS HD1 1 1 3 1095 1 1 14 HIS HD2 H -1.064 3.545 2.341 1.00 . A A . 14 HIS HD2 1 1 3 1096 1 1 14 HIS HE1 H 1.966 6.459 1.884 1.00 . A A . 14 HIS HE1 1 1 3 1097 1 1 14 HIS HE2 H 0.519 5.225 3.577 1.00 . A A . 14 HIS HE2 1 1 3 1098 1 1 14 HIS N N -0.048 1.562 -1.869 1.00 . A A . 14 HIS N 1 1 3 1099 1 1 14 HIS ND1 N 0.927 5.263 0.428 1.00 . A A . 14 HIS ND1 1 1 3 1100 1 1 14 HIS NE2 N 0.478 5.097 2.602 1.00 . A A . 14 HIS NE2 1 1 3 1101 1 1 14 HIS O O 2.757 3.216 -0.846 1.00 . A A . 14 HIS O 1 1 3 1102 1 1 15 LEU C C 3.783 0.994 0.301 1.00 . A A . 15 LEU C 1 1 3 1103 1 1 15 LEU CA C 2.705 1.459 1.229 1.00 . A A . 15 LEU CA 1 1 3 1104 1 1 15 LEU CB C 2.389 0.305 2.185 1.00 . A A . 15 LEU CB 1 1 3 1105 1 1 15 LEU CD1 C 0.944 2.100 3.193 1.00 . A A . 15 LEU CD1 1 1 3 1106 1 1 15 LEU CD2 C 0.630 -0.268 3.832 1.00 . A A . 15 LEU CD2 1 1 3 1107 1 1 15 LEU CG C 1.664 0.783 3.446 1.00 . A A . 15 LEU CG 1 1 3 1108 1 1 15 LEU H H 0.714 1.322 0.537 1.00 . A A . 15 LEU H 1 1 3 1109 1 1 15 LEU HA H 3.033 2.326 1.768 1.00 . A A . 15 LEU HA 1 1 3 1110 1 1 15 LEU HB2 H 1.766 -0.413 1.672 1.00 . A A . 15 LEU HB2 1 1 3 1111 1 1 15 LEU HB3 H 3.314 -0.175 2.471 1.00 . A A . 15 LEU HB3 1 1 3 1112 1 1 15 LEU HD11 H 0.267 1.981 2.362 1.00 . A A . 15 LEU HD11 1 1 3 1113 1 1 15 LEU HD12 H 1.663 2.873 2.970 1.00 . A A . 15 LEU HD12 1 1 3 1114 1 1 15 LEU HD13 H 0.385 2.372 4.076 1.00 . A A . 15 LEU HD13 1 1 3 1115 1 1 15 LEU HD21 H 0.293 -0.089 4.842 1.00 . A A . 15 LEU HD21 1 1 3 1116 1 1 15 LEU HD22 H 1.070 -1.250 3.767 1.00 . A A . 15 LEU HD22 1 1 3 1117 1 1 15 LEU HD23 H -0.212 -0.203 3.156 1.00 . A A . 15 LEU HD23 1 1 3 1118 1 1 15 LEU HG H 2.372 0.905 4.247 1.00 . A A . 15 LEU HG 1 1 3 1119 1 1 15 LEU N N 1.566 1.780 0.402 1.00 . A A . 15 LEU N 1 1 3 1120 1 1 15 LEU O O 4.963 1.280 0.470 1.00 . A A . 15 LEU O 1 1 3 1121 1 1 16 ALA C C 4.930 0.821 -2.434 1.00 . A A . 16 ALA C 1 1 3 1122 1 1 16 ALA CA C 4.213 -0.287 -1.695 1.00 . A A . 16 ALA CA 1 1 3 1123 1 1 16 ALA CB C 3.427 -1.146 -2.688 1.00 . A A . 16 ALA CB 1 1 3 1124 1 1 16 ALA H H 2.340 0.109 -0.750 1.00 . A A . 16 ALA H 1 1 3 1125 1 1 16 ALA HA H 4.940 -0.903 -1.201 1.00 . A A . 16 ALA HA 1 1 3 1126 1 1 16 ALA HB1 H 2.491 -1.447 -2.244 1.00 . A A . 16 ALA HB1 1 1 3 1127 1 1 16 ALA HB2 H 4.003 -2.027 -2.937 1.00 . A A . 16 ALA HB2 1 1 3 1128 1 1 16 ALA HB3 H 3.234 -0.578 -3.583 1.00 . A A . 16 ALA HB3 1 1 3 1129 1 1 16 ALA N N 3.325 0.267 -0.694 1.00 . A A . 16 ALA N 1 1 3 1130 1 1 16 ALA O O 6.071 0.658 -2.854 1.00 . A A . 16 ALA O 1 1 3 1131 1 1 17 LEU C C 6.086 3.536 -2.582 1.00 . A A . 17 LEU C 1 1 3 1132 1 1 17 LEU CA C 4.829 3.081 -3.283 1.00 . A A . 17 LEU CA 1 1 3 1133 1 1 17 LEU CB C 3.795 4.225 -3.396 1.00 . A A . 17 LEU CB 1 1 3 1134 1 1 17 LEU CD1 C 5.433 6.129 -3.508 1.00 . A A . 17 LEU CD1 1 1 3 1135 1 1 17 LEU CD2 C 3.129 6.513 -2.632 1.00 . A A . 17 LEU CD2 1 1 3 1136 1 1 17 LEU CG C 4.285 5.513 -2.707 1.00 . A A . 17 LEU CG 1 1 3 1137 1 1 17 LEU H H 3.343 2.005 -2.227 1.00 . A A . 17 LEU H 1 1 3 1138 1 1 17 LEU HA H 5.105 2.760 -4.268 1.00 . A A . 17 LEU HA 1 1 3 1139 1 1 17 LEU HB2 H 3.612 4.430 -4.438 1.00 . A A . 17 LEU HB2 1 1 3 1140 1 1 17 LEU HB3 H 2.873 3.912 -2.933 1.00 . A A . 17 LEU HB3 1 1 3 1141 1 1 17 LEU HD11 H 5.179 7.141 -3.785 1.00 . A A . 17 LEU HD11 1 1 3 1142 1 1 17 LEU HD12 H 5.606 5.545 -4.401 1.00 . A A . 17 LEU HD12 1 1 3 1143 1 1 17 LEU HD13 H 6.327 6.139 -2.904 1.00 . A A . 17 LEU HD13 1 1 3 1144 1 1 17 LEU HD21 H 3.390 7.317 -1.959 1.00 . A A . 17 LEU HD21 1 1 3 1145 1 1 17 LEU HD22 H 2.243 6.014 -2.266 1.00 . A A . 17 LEU HD22 1 1 3 1146 1 1 17 LEU HD23 H 2.935 6.915 -3.614 1.00 . A A . 17 LEU HD23 1 1 3 1147 1 1 17 LEU HG H 4.623 5.288 -1.707 1.00 . A A . 17 LEU HG 1 1 3 1148 1 1 17 LEU N N 4.250 1.944 -2.589 1.00 . A A . 17 LEU N 1 1 3 1149 1 1 17 LEU O O 7.127 3.723 -3.214 1.00 . A A . 17 LEU O 1 1 3 1150 1 1 18 HIS C C 8.079 2.938 -0.314 1.00 . A A . 18 HIS C 1 1 3 1151 1 1 18 HIS CA C 7.196 4.123 -0.560 1.00 . A A . 18 HIS CA 1 1 3 1152 1 1 18 HIS CB C 6.844 4.846 0.723 1.00 . A A . 18 HIS CB 1 1 3 1153 1 1 18 HIS CD2 C 4.755 3.830 1.934 1.00 . A A . 18 HIS CD2 1 1 3 1154 1 1 18 HIS CE1 C 5.792 2.745 3.495 1.00 . A A . 18 HIS CE1 1 1 3 1155 1 1 18 HIS CG C 6.098 3.996 1.708 1.00 . A A . 18 HIS CG 1 1 3 1156 1 1 18 HIS H H 5.154 3.526 -0.811 1.00 . A A . 18 HIS H 1 1 3 1157 1 1 18 HIS HA H 7.737 4.810 -1.192 1.00 . A A . 18 HIS HA 1 1 3 1158 1 1 18 HIS HB2 H 7.747 5.207 1.180 1.00 . A A . 18 HIS HB2 1 1 3 1159 1 1 18 HIS HB3 H 6.232 5.666 0.453 1.00 . A A . 18 HIS HB3 1 1 3 1160 1 1 18 HIS HD1 H 7.715 3.212 2.838 1.00 . A A . 18 HIS HD1 1 1 3 1161 1 1 18 HIS HD2 H 3.965 4.247 1.319 1.00 . A A . 18 HIS HD2 1 1 3 1162 1 1 18 HIS HE1 H 6.000 2.127 4.357 1.00 . A A . 18 HIS HE1 1 1 3 1163 1 1 18 HIS HE2 H 3.709 2.786 3.480 1.00 . A A . 18 HIS HE2 1 1 3 1164 1 1 18 HIS N N 6.007 3.700 -1.280 1.00 . A A . 18 HIS N 1 1 3 1165 1 1 18 HIS ND1 N 6.741 3.290 2.712 1.00 . A A . 18 HIS ND1 1 1 3 1166 1 1 18 HIS NE2 N 4.563 3.045 3.068 1.00 . A A . 18 HIS NE2 1 1 3 1167 1 1 18 HIS O O 9.293 2.993 -0.516 1.00 . A A . 18 HIS O 1 1 3 1168 1 1 19 LEU C C 9.005 0.369 -0.993 1.00 . A A . 19 LEU C 1 1 3 1169 1 1 19 LEU CA C 8.196 0.614 0.253 1.00 . A A . 19 LEU CA 1 1 3 1170 1 1 19 LEU CB C 7.262 -0.578 0.455 1.00 . A A . 19 LEU CB 1 1 3 1171 1 1 19 LEU CD1 C 6.988 0.265 2.774 1.00 . A A . 19 LEU CD1 1 1 3 1172 1 1 19 LEU CD2 C 6.130 -1.987 2.152 1.00 . A A . 19 LEU CD2 1 1 3 1173 1 1 19 LEU CG C 7.248 -0.973 1.922 1.00 . A A . 19 LEU CG 1 1 3 1174 1 1 19 LEU H H 6.473 1.874 0.157 1.00 . A A . 19 LEU H 1 1 3 1175 1 1 19 LEU HA H 8.853 0.713 1.099 1.00 . A A . 19 LEU HA 1 1 3 1176 1 1 19 LEU HB2 H 6.268 -0.315 0.140 1.00 . A A . 19 LEU HB2 1 1 3 1177 1 1 19 LEU HB3 H 7.614 -1.411 -0.136 1.00 . A A . 19 LEU HB3 1 1 3 1178 1 1 19 LEU HD11 H 6.494 -0.026 3.687 1.00 . A A . 19 LEU HD11 1 1 3 1179 1 1 19 LEU HD12 H 6.357 0.945 2.224 1.00 . A A . 19 LEU HD12 1 1 3 1180 1 1 19 LEU HD13 H 7.926 0.750 3.007 1.00 . A A . 19 LEU HD13 1 1 3 1181 1 1 19 LEU HD21 H 6.433 -2.949 1.772 1.00 . A A . 19 LEU HD21 1 1 3 1182 1 1 19 LEU HD22 H 5.239 -1.660 1.637 1.00 . A A . 19 LEU HD22 1 1 3 1183 1 1 19 LEU HD23 H 5.927 -2.063 3.210 1.00 . A A . 19 LEU HD23 1 1 3 1184 1 1 19 LEU HG H 8.198 -1.409 2.191 1.00 . A A . 19 LEU HG 1 1 3 1185 1 1 19 LEU N N 7.454 1.848 0.057 1.00 . A A . 19 LEU N 1 1 3 1186 1 1 19 LEU O O 10.105 -0.181 -0.953 1.00 . A A . 19 LEU O 1 1 3 1187 1 1 20 ALA C C 10.420 1.395 -3.356 1.00 . A A . 20 ALA C 1 1 3 1188 1 1 20 ALA CA C 9.117 0.637 -3.397 1.00 . A A . 20 ALA CA 1 1 3 1189 1 1 20 ALA CB C 8.259 1.153 -4.559 1.00 . A A . 20 ALA CB 1 1 3 1190 1 1 20 ALA H H 7.555 1.257 -2.057 1.00 . A A . 20 ALA H 1 1 3 1191 1 1 20 ALA HA H 9.325 -0.407 -3.549 1.00 . A A . 20 ALA HA 1 1 3 1192 1 1 20 ALA HB1 H 7.358 0.566 -4.633 1.00 . A A . 20 ALA HB1 1 1 3 1193 1 1 20 ALA HB2 H 8.816 1.070 -5.479 1.00 . A A . 20 ALA HB2 1 1 3 1194 1 1 20 ALA HB3 H 8.003 2.186 -4.392 1.00 . A A . 20 ALA HB3 1 1 3 1195 1 1 20 ALA N N 8.439 0.803 -2.112 1.00 . A A . 20 ALA N 1 1 3 1196 1 1 20 ALA O O 11.507 0.820 -3.478 1.00 . A A . 20 ALA O 1 1 3 1197 1 1 21 LEU C C 12.388 3.008 -2.004 1.00 . A A . 21 LEU C 1 1 3 1198 1 1 21 LEU CA C 11.445 3.557 -3.056 1.00 . A A . 21 LEU CA 1 1 3 1199 1 1 21 LEU CB C 11.004 4.963 -2.654 1.00 . A A . 21 LEU CB 1 1 3 1200 1 1 21 LEU CD1 C 9.424 6.828 -3.180 1.00 . A A . 21 LEU CD1 1 1 3 1201 1 1 21 LEU CD2 C 10.658 5.677 -5.016 1.00 . A A . 21 LEU CD2 1 1 3 1202 1 1 21 LEU CG C 9.975 5.488 -3.662 1.00 . A A . 21 LEU CG 1 1 3 1203 1 1 21 LEU H H 9.390 3.062 -3.044 1.00 . A A . 21 LEU H 1 1 3 1204 1 1 21 LEU HA H 11.950 3.592 -4.002 1.00 . A A . 21 LEU HA 1 1 3 1205 1 1 21 LEU HB2 H 10.563 4.929 -1.665 1.00 . A A . 21 LEU HB2 1 1 3 1206 1 1 21 LEU HB3 H 11.862 5.619 -2.643 1.00 . A A . 21 LEU HB3 1 1 3 1207 1 1 21 LEU HD11 H 8.997 7.362 -4.018 1.00 . A A . 21 LEU HD11 1 1 3 1208 1 1 21 LEU HD12 H 10.221 7.414 -2.749 1.00 . A A . 21 LEU HD12 1 1 3 1209 1 1 21 LEU HD13 H 8.660 6.656 -2.438 1.00 . A A . 21 LEU HD13 1 1 3 1210 1 1 21 LEU HD21 H 10.041 6.292 -5.649 1.00 . A A . 21 LEU HD21 1 1 3 1211 1 1 21 LEU HD22 H 10.810 4.716 -5.483 1.00 . A A . 21 LEU HD22 1 1 3 1212 1 1 21 LEU HD23 H 11.612 6.160 -4.869 1.00 . A A . 21 LEU HD23 1 1 3 1213 1 1 21 LEU HG H 9.163 4.783 -3.759 1.00 . A A . 21 LEU HG 1 1 3 1214 1 1 21 LEU N N 10.290 2.689 -3.153 1.00 . A A . 21 LEU N 1 1 3 1215 1 1 21 LEU O O 13.596 2.903 -2.214 1.00 . A A . 21 LEU O 1 1 3 1216 1 1 22 ALA C C 13.365 0.882 -0.224 1.00 . A A . 22 ALA C 1 1 3 1217 1 1 22 ALA CA C 12.568 2.092 0.238 1.00 . A A . 22 ALA CA 1 1 3 1218 1 1 22 ALA CB C 11.626 1.688 1.376 1.00 . A A . 22 ALA CB 1 1 3 1219 1 1 22 ALA H H 10.832 2.767 -0.788 1.00 . A A . 22 ALA H 1 1 3 1220 1 1 22 ALA HA H 13.251 2.841 0.600 1.00 . A A . 22 ALA HA 1 1 3 1221 1 1 22 ALA HB1 H 11.034 0.837 1.068 1.00 . A A . 22 ALA HB1 1 1 3 1222 1 1 22 ALA HB2 H 10.973 2.512 1.617 1.00 . A A . 22 ALA HB2 1 1 3 1223 1 1 22 ALA HB3 H 12.211 1.425 2.247 1.00 . A A . 22 ALA HB3 1 1 3 1224 1 1 22 ALA N N 11.805 2.651 -0.874 1.00 . A A . 22 ALA N 1 1 3 1225 1 1 22 ALA O O 14.545 0.740 0.105 1.00 . A A . 22 ALA O 1 1 3 1226 1 1 23 LEU C C 14.407 -0.808 -2.548 1.00 . A A . 23 LEU C 1 1 3 1227 1 1 23 LEU CA C 13.378 -1.185 -1.492 1.00 . A A . 23 LEU CA 1 1 3 1228 1 1 23 LEU CB C 12.350 -2.158 -2.100 1.00 . A A . 23 LEU CB 1 1 3 1229 1 1 23 LEU CD1 C 13.225 -3.903 -0.510 1.00 . A A . 23 LEU CD1 1 1 3 1230 1 1 23 LEU CD2 C 11.156 -2.612 0.058 1.00 . A A . 23 LEU CD2 1 1 3 1231 1 1 23 LEU CG C 11.964 -3.243 -1.079 1.00 . A A . 23 LEU CG 1 1 3 1232 1 1 23 LEU H H 11.775 0.190 -1.213 1.00 . A A . 23 LEU H 1 1 3 1233 1 1 23 LEU HA H 13.885 -1.667 -0.681 1.00 . A A . 23 LEU HA 1 1 3 1234 1 1 23 LEU HB2 H 11.463 -1.608 -2.385 1.00 . A A . 23 LEU HB2 1 1 3 1235 1 1 23 LEU HB3 H 12.772 -2.627 -2.977 1.00 . A A . 23 LEU HB3 1 1 3 1236 1 1 23 LEU HD11 H 13.014 -4.935 -0.272 1.00 . A A . 23 LEU HD11 1 1 3 1237 1 1 23 LEU HD12 H 13.531 -3.386 0.387 1.00 . A A . 23 LEU HD12 1 1 3 1238 1 1 23 LEU HD13 H 14.019 -3.858 -1.242 1.00 . A A . 23 LEU HD13 1 1 3 1239 1 1 23 LEU HD21 H 11.583 -1.654 0.314 1.00 . A A . 23 LEU HD21 1 1 3 1240 1 1 23 LEU HD22 H 11.179 -3.261 0.921 1.00 . A A . 23 LEU HD22 1 1 3 1241 1 1 23 LEU HD23 H 10.131 -2.475 -0.262 1.00 . A A . 23 LEU HD23 1 1 3 1242 1 1 23 LEU HG H 11.361 -3.994 -1.571 1.00 . A A . 23 LEU HG 1 1 3 1243 1 1 23 LEU N N 12.716 0.015 -0.987 1.00 . A A . 23 LEU N 1 1 3 1244 1 1 23 LEU O O 15.540 -1.292 -2.539 1.00 . A A . 23 LEU O 1 1 3 1245 1 1 24 LYS C C 15.958 1.440 -3.983 1.00 . A A . 24 LYS C 1 1 3 1246 1 1 24 LYS CA C 14.885 0.506 -4.526 1.00 . A A . 24 LYS CA 1 1 3 1247 1 1 24 LYS CB C 14.078 1.228 -5.608 1.00 . A A . 24 LYS CB 1 1 3 1248 1 1 24 LYS CD C 14.961 2.620 -7.510 1.00 . A A . 24 LYS CD 1 1 3 1249 1 1 24 LYS CE C 16.148 3.362 -6.888 1.00 . A A . 24 LYS CE 1 1 3 1250 1 1 24 LYS CG C 14.855 1.202 -6.929 1.00 . A A . 24 LYS CG 1 1 3 1251 1 1 24 LYS H H 13.084 0.411 -3.402 1.00 . A A . 24 LYS H 1 1 3 1252 1 1 24 LYS HA H 15.361 -0.356 -4.965 1.00 . A A . 24 LYS HA 1 1 3 1253 1 1 24 LYS HB2 H 13.128 0.728 -5.741 1.00 . A A . 24 LYS HB2 1 1 3 1254 1 1 24 LYS HB3 H 13.907 2.252 -5.310 1.00 . A A . 24 LYS HB3 1 1 3 1255 1 1 24 LYS HD2 H 15.101 2.558 -8.579 1.00 . A A . 24 LYS HD2 1 1 3 1256 1 1 24 LYS HD3 H 14.053 3.164 -7.302 1.00 . A A . 24 LYS HD3 1 1 3 1257 1 1 24 LYS HE2 H 16.373 4.238 -7.480 1.00 . A A . 24 LYS HE2 1 1 3 1258 1 1 24 LYS HE3 H 15.896 3.667 -5.883 1.00 . A A . 24 LYS HE3 1 1 3 1259 1 1 24 LYS HG2 H 15.845 0.806 -6.753 1.00 . A A . 24 LYS HG2 1 1 3 1260 1 1 24 LYS HG3 H 14.341 0.566 -7.631 1.00 . A A . 24 LYS HG3 1 1 3 1261 1 1 24 LYS HZ1 H 18.198 3.045 -6.980 1.00 . A A . 24 LYS HZ1 1 1 3 1262 1 1 24 LYS HZ2 H 17.279 1.770 -7.612 1.00 . A A . 24 LYS HZ2 1 1 3 1263 1 1 24 LYS HZ3 H 17.385 1.986 -5.927 1.00 . A A . 24 LYS HZ3 1 1 3 1264 1 1 24 LYS N N 14.000 0.062 -3.453 1.00 . A A . 24 LYS N 1 1 3 1265 1 1 24 LYS NZ N 17.341 2.474 -6.851 1.00 . A A . 24 LYS NZ 1 1 3 1266 1 1 24 LYS O O 16.980 1.675 -4.636 1.00 . A A . 24 LYS O 1 1 3 1267 1 1 25 LYS C C 16.870 4.107 -3.103 1.00 . A A . 25 LYS C 1 1 3 1268 1 1 25 LYS CA C 16.635 2.915 -2.173 1.00 . A A . 25 LYS CA 1 1 3 1269 1 1 25 LYS CB C 17.960 2.199 -1.825 1.00 . A A . 25 LYS CB 1 1 3 1270 1 1 25 LYS CD C 18.496 4.260 -0.440 1.00 . A A . 25 LYS CD 1 1 3 1271 1 1 25 LYS CE C 19.114 5.627 -0.750 1.00 . A A . 25 LYS CE 1 1 3 1272 1 1 25 LYS CG C 19.053 3.202 -1.412 1.00 . A A . 25 LYS CG 1 1 3 1273 1 1 25 LYS H H 14.867 1.774 -2.351 1.00 . A A . 25 LYS H 1 1 3 1274 1 1 25 LYS HA H 16.180 3.271 -1.262 1.00 . A A . 25 LYS HA 1 1 3 1275 1 1 25 LYS HB2 H 17.787 1.514 -1.009 1.00 . A A . 25 LYS HB2 1 1 3 1276 1 1 25 LYS HB3 H 18.302 1.643 -2.686 1.00 . A A . 25 LYS HB3 1 1 3 1277 1 1 25 LYS HD2 H 17.425 4.325 -0.531 1.00 . A A . 25 LYS HD2 1 1 3 1278 1 1 25 LYS HD3 H 18.750 3.981 0.575 1.00 . A A . 25 LYS HD3 1 1 3 1279 1 1 25 LYS HE2 H 18.669 6.375 -0.110 1.00 . A A . 25 LYS HE2 1 1 3 1280 1 1 25 LYS HE3 H 20.174 5.583 -0.568 1.00 . A A . 25 LYS HE3 1 1 3 1281 1 1 25 LYS HG2 H 19.854 2.663 -0.927 1.00 . A A . 25 LYS HG2 1 1 3 1282 1 1 25 LYS HG3 H 19.444 3.687 -2.290 1.00 . A A . 25 LYS HG3 1 1 3 1283 1 1 25 LYS HZ1 H 19.697 6.497 -2.550 1.00 . A A . 25 LYS HZ1 1 1 3 1284 1 1 25 LYS HZ2 H 18.030 6.612 -2.237 1.00 . A A . 25 LYS HZ2 1 1 3 1285 1 1 25 LYS HZ3 H 18.707 5.132 -2.745 1.00 . A A . 25 LYS HZ3 1 1 3 1286 1 1 25 LYS N N 15.709 1.986 -2.803 1.00 . A A . 25 LYS N 1 1 3 1287 1 1 25 LYS NZ N 18.871 5.992 -2.176 1.00 . A A . 25 LYS NZ 1 1 3 1288 1 1 25 LYS O O 17.932 4.250 -3.710 1.00 . A A . 25 LYS O 1 1 3 1289 1 1 26 ALA C C 16.512 7.325 -3.300 1.00 . A A . 26 ALA C 1 1 3 1290 1 1 26 ALA CA C 15.949 6.138 -4.068 1.00 . A A . 26 ALA CA 1 1 3 1291 1 1 26 ALA CB C 14.567 6.490 -4.613 1.00 . A A . 26 ALA CB 1 1 3 1292 1 1 26 ALA H H 15.040 4.796 -2.697 1.00 . A A . 26 ALA H 1 1 3 1293 1 1 26 ALA HA H 16.603 5.915 -4.896 1.00 . A A . 26 ALA HA 1 1 3 1294 1 1 26 ALA HB1 H 14.081 5.593 -4.971 1.00 . A A . 26 ALA HB1 1 1 3 1295 1 1 26 ALA HB2 H 14.670 7.188 -5.429 1.00 . A A . 26 ALA HB2 1 1 3 1296 1 1 26 ALA HB3 H 13.971 6.940 -3.831 1.00 . A A . 26 ALA HB3 1 1 3 1297 1 1 26 ALA N N 15.862 4.962 -3.207 1.00 . A A . 26 ALA N 1 1 3 1298 1 1 26 ALA O O 16.706 8.354 -3.908 1.00 . A A . 26 ALA O 1 1 3 1299 1 1 26 ALA OXT O 16.737 7.195 -2.115 1.00 . A A . 26 ALA OXT 1 1 4 1300 1 1 1 LYS C C -23.377 -6.172 3.039 1.00 . A A . 1 LYS C 1 1 4 1301 1 1 1 LYS CA C -24.286 -7.350 2.703 1.00 . A A . 1 LYS CA 1 1 4 1302 1 1 1 LYS CB C -24.237 -7.644 1.195 1.00 . A A . 1 LYS CB 1 1 4 1303 1 1 1 LYS CD C -24.656 -6.532 -1.011 1.00 . A A . 1 LYS CD 1 1 4 1304 1 1 1 LYS CE C -25.533 -5.524 -1.771 1.00 . A A . 1 LYS CE 1 1 4 1305 1 1 1 LYS CG C -25.142 -6.666 0.435 1.00 . A A . 1 LYS CG 1 1 4 1306 1 1 1 LYS H1 H -26.166 -7.894 3.405 1.00 . A A . 1 LYS H1 1 1 4 1307 1 1 1 LYS H2 H -26.186 -6.584 2.330 1.00 . A A . 1 LYS H2 1 1 4 1308 1 1 1 LYS H3 H -25.650 -6.370 3.922 1.00 . A A . 1 LYS H3 1 1 4 1309 1 1 1 LYS HA H -23.949 -8.221 3.245 1.00 . A A . 1 LYS HA 1 1 4 1310 1 1 1 LYS HB2 H -23.221 -7.541 0.841 1.00 . A A . 1 LYS HB2 1 1 4 1311 1 1 1 LYS HB3 H -24.578 -8.655 1.016 1.00 . A A . 1 LYS HB3 1 1 4 1312 1 1 1 LYS HD2 H -23.630 -6.192 -1.017 1.00 . A A . 1 LYS HD2 1 1 4 1313 1 1 1 LYS HD3 H -24.715 -7.493 -1.501 1.00 . A A . 1 LYS HD3 1 1 4 1314 1 1 1 LYS HE2 H -24.912 -4.734 -2.167 1.00 . A A . 1 LYS HE2 1 1 4 1315 1 1 1 LYS HE3 H -26.031 -6.026 -2.585 1.00 . A A . 1 LYS HE3 1 1 4 1316 1 1 1 LYS HG2 H -26.156 -7.038 0.441 1.00 . A A . 1 LYS HG2 1 1 4 1317 1 1 1 LYS HG3 H -25.110 -5.700 0.913 1.00 . A A . 1 LYS HG3 1 1 4 1318 1 1 1 LYS HZ1 H -27.160 -5.694 -0.482 1.00 . A A . 1 LYS HZ1 1 1 4 1319 1 1 1 LYS HZ2 H -27.132 -4.252 -1.370 1.00 . A A . 1 LYS HZ2 1 1 4 1320 1 1 1 LYS HZ3 H -26.072 -4.456 -0.061 1.00 . A A . 1 LYS HZ3 1 1 4 1321 1 1 1 LYS N N -25.677 -7.024 3.119 1.00 . A A . 1 LYS N 1 1 4 1322 1 1 1 LYS NZ N -26.550 -4.938 -0.852 1.00 . A A . 1 LYS NZ 1 1 4 1323 1 1 1 LYS O O -23.573 -5.056 2.544 1.00 . A A . 1 LYS O 1 1 4 1324 1 1 2 LYS C C -20.012 -5.834 3.989 1.00 . A A . 2 LYS C 1 1 4 1325 1 1 2 LYS CA C -21.437 -5.384 4.284 1.00 . A A . 2 LYS CA 1 1 4 1326 1 1 2 LYS CB C -21.569 -5.086 5.781 1.00 . A A . 2 LYS CB 1 1 4 1327 1 1 2 LYS CD C -23.184 -4.347 7.557 1.00 . A A . 2 LYS CD 1 1 4 1328 1 1 2 LYS CE C -23.235 -2.821 7.457 1.00 . A A . 2 LYS CE 1 1 4 1329 1 1 2 LYS CG C -23.050 -4.958 6.155 1.00 . A A . 2 LYS CG 1 1 4 1330 1 1 2 LYS H H -22.274 -7.330 4.247 1.00 . A A . 2 LYS H 1 1 4 1331 1 1 2 LYS HA H -21.646 -4.483 3.724 1.00 . A A . 2 LYS HA 1 1 4 1332 1 1 2 LYS HB2 H -21.120 -5.890 6.348 1.00 . A A . 2 LYS HB2 1 1 4 1333 1 1 2 LYS HB3 H -21.061 -4.159 6.006 1.00 . A A . 2 LYS HB3 1 1 4 1334 1 1 2 LYS HD2 H -24.092 -4.707 8.022 1.00 . A A . 2 LYS HD2 1 1 4 1335 1 1 2 LYS HD3 H -22.337 -4.636 8.160 1.00 . A A . 2 LYS HD3 1 1 4 1336 1 1 2 LYS HE2 H -23.486 -2.408 8.423 1.00 . A A . 2 LYS HE2 1 1 4 1337 1 1 2 LYS HE3 H -22.268 -2.450 7.149 1.00 . A A . 2 LYS HE3 1 1 4 1338 1 1 2 LYS HG2 H -23.549 -4.329 5.434 1.00 . A A . 2 LYS HG2 1 1 4 1339 1 1 2 LYS HG3 H -23.505 -5.936 6.150 1.00 . A A . 2 LYS HG3 1 1 4 1340 1 1 2 LYS HZ1 H -24.973 -3.167 6.359 1.00 . A A . 2 LYS HZ1 1 1 4 1341 1 1 2 LYS HZ2 H -23.808 -2.246 5.541 1.00 . A A . 2 LYS HZ2 1 1 4 1342 1 1 2 LYS HZ3 H -24.731 -1.543 6.783 1.00 . A A . 2 LYS HZ3 1 1 4 1343 1 1 2 LYS N N -22.382 -6.423 3.885 1.00 . A A . 2 LYS N 1 1 4 1344 1 1 2 LYS NZ N -24.264 -2.415 6.459 1.00 . A A . 2 LYS NZ 1 1 4 1345 1 1 2 LYS O O -19.799 -6.934 3.471 1.00 . A A . 2 LYS O 1 1 4 1346 1 1 3 ALA C C -17.417 -5.826 2.686 1.00 . A A . 3 ALA C 1 1 4 1347 1 1 3 ALA CA C -17.635 -5.302 4.103 1.00 . A A . 3 ALA CA 1 1 4 1348 1 1 3 ALA CB C -17.156 -6.340 5.122 1.00 . A A . 3 ALA CB 1 1 4 1349 1 1 3 ALA H H -19.282 -4.130 4.739 1.00 . A A . 3 ALA H 1 1 4 1350 1 1 3 ALA HA H -17.055 -4.401 4.231 1.00 . A A . 3 ALA HA 1 1 4 1351 1 1 3 ALA HB1 H -17.280 -5.948 6.122 1.00 . A A . 3 ALA HB1 1 1 4 1352 1 1 3 ALA HB2 H -16.112 -6.555 4.952 1.00 . A A . 3 ALA HB2 1 1 4 1353 1 1 3 ALA HB3 H -17.734 -7.249 5.013 1.00 . A A . 3 ALA HB3 1 1 4 1354 1 1 3 ALA N N -19.044 -4.986 4.327 1.00 . A A . 3 ALA N 1 1 4 1355 1 1 3 ALA O O -17.175 -7.022 2.478 1.00 . A A . 3 ALA O 1 1 4 1356 1 1 4 LEU C C -16.800 -4.111 -0.497 1.00 . A A . 4 LEU C 1 1 4 1357 1 1 4 LEU CA C -17.305 -5.299 0.314 1.00 . A A . 4 LEU CA 1 1 4 1358 1 1 4 LEU CB C -18.620 -5.822 -0.289 1.00 . A A . 4 LEU CB 1 1 4 1359 1 1 4 LEU CD1 C -19.541 -4.149 -1.916 1.00 . A A . 4 LEU CD1 1 1 4 1360 1 1 4 LEU CD2 C -21.038 -5.158 -0.182 1.00 . A A . 4 LEU CD2 1 1 4 1361 1 1 4 LEU CG C -19.615 -4.666 -0.475 1.00 . A A . 4 LEU CG 1 1 4 1362 1 1 4 LEU H H -17.693 -3.993 1.941 1.00 . A A . 4 LEU H 1 1 4 1363 1 1 4 LEU HA H -16.567 -6.089 0.268 1.00 . A A . 4 LEU HA 1 1 4 1364 1 1 4 LEU HB2 H -18.414 -6.279 -1.246 1.00 . A A . 4 LEU HB2 1 1 4 1365 1 1 4 LEU HB3 H -19.047 -6.560 0.373 1.00 . A A . 4 LEU HB3 1 1 4 1366 1 1 4 LEU HD11 H -20.515 -3.803 -2.225 1.00 . A A . 4 LEU HD11 1 1 4 1367 1 1 4 LEU HD12 H -19.218 -4.944 -2.573 1.00 . A A . 4 LEU HD12 1 1 4 1368 1 1 4 LEU HD13 H -18.839 -3.333 -1.967 1.00 . A A . 4 LEU HD13 1 1 4 1369 1 1 4 LEU HD21 H -21.562 -5.324 -1.112 1.00 . A A . 4 LEU HD21 1 1 4 1370 1 1 4 LEU HD22 H -21.560 -4.413 0.394 1.00 . A A . 4 LEU HD22 1 1 4 1371 1 1 4 LEU HD23 H -20.993 -6.082 0.379 1.00 . A A . 4 LEU HD23 1 1 4 1372 1 1 4 LEU HG H -19.367 -3.861 0.207 1.00 . A A . 4 LEU HG 1 1 4 1373 1 1 4 LEU N N -17.501 -4.926 1.712 1.00 . A A . 4 LEU N 1 1 4 1374 1 1 4 LEU O O -16.074 -4.281 -1.479 1.00 . A A . 4 LEU O 1 1 4 1375 1 1 5 LEU C C -15.375 -1.287 -0.367 1.00 . A A . 5 LEU C 1 1 4 1376 1 1 5 LEU CA C -16.788 -1.690 -0.778 1.00 . A A . 5 LEU CA 1 1 4 1377 1 1 5 LEU CB C -17.765 -0.554 -0.443 1.00 . A A . 5 LEU CB 1 1 4 1378 1 1 5 LEU CD1 C -19.330 -0.685 -2.395 1.00 . A A . 5 LEU CD1 1 1 4 1379 1 1 5 LEU CD2 C -18.745 1.536 -1.403 1.00 . A A . 5 LEU CD2 1 1 4 1380 1 1 5 LEU CG C -18.221 0.137 -1.732 1.00 . A A . 5 LEU CG 1 1 4 1381 1 1 5 LEU H H -17.777 -2.841 0.700 1.00 . A A . 5 LEU H 1 1 4 1382 1 1 5 LEU HA H -16.807 -1.865 -1.844 1.00 . A A . 5 LEU HA 1 1 4 1383 1 1 5 LEU HB2 H -18.624 -0.959 0.073 1.00 . A A . 5 LEU HB2 1 1 4 1384 1 1 5 LEU HB3 H -17.278 0.170 0.194 1.00 . A A . 5 LEU HB3 1 1 4 1385 1 1 5 LEU HD11 H -19.991 -0.027 -2.944 1.00 . A A . 5 LEU HD11 1 1 4 1386 1 1 5 LEU HD12 H -19.897 -1.211 -1.637 1.00 . A A . 5 LEU HD12 1 1 4 1387 1 1 5 LEU HD13 H -18.890 -1.398 -3.075 1.00 . A A . 5 LEU HD13 1 1 4 1388 1 1 5 LEU HD21 H -19.124 1.997 -2.300 1.00 . A A . 5 LEU HD21 1 1 4 1389 1 1 5 LEU HD22 H -17.940 2.136 -1.001 1.00 . A A . 5 LEU HD22 1 1 4 1390 1 1 5 LEU HD23 H -19.541 1.465 -0.673 1.00 . A A . 5 LEU HD23 1 1 4 1391 1 1 5 LEU HG H -17.381 0.218 -2.410 1.00 . A A . 5 LEU HG 1 1 4 1392 1 1 5 LEU N N -17.195 -2.908 -0.086 1.00 . A A . 5 LEU N 1 1 4 1393 1 1 5 LEU O O -14.655 -2.067 0.253 1.00 . A A . 5 LEU O 1 1 4 1394 1 1 6 ALA C C -12.578 -0.274 -1.132 1.00 . A A . 6 ALA C 1 1 4 1395 1 1 6 ALA CA C -13.676 0.470 -0.381 1.00 . A A . 6 ALA CA 1 1 4 1396 1 1 6 ALA CB C -13.421 0.359 1.122 1.00 . A A . 6 ALA CB 1 1 4 1397 1 1 6 ALA H H -15.631 0.509 -1.204 1.00 . A A . 6 ALA H 1 1 4 1398 1 1 6 ALA HA H -13.644 1.511 -0.659 1.00 . A A . 6 ALA HA 1 1 4 1399 1 1 6 ALA HB1 H -12.784 1.171 1.439 1.00 . A A . 6 ALA HB1 1 1 4 1400 1 1 6 ALA HB2 H -12.936 -0.584 1.334 1.00 . A A . 6 ALA HB2 1 1 4 1401 1 1 6 ALA HB3 H -14.360 0.410 1.654 1.00 . A A . 6 ALA HB3 1 1 4 1402 1 1 6 ALA N N -14.999 -0.060 -0.713 1.00 . A A . 6 ALA N 1 1 4 1403 1 1 6 ALA O O -12.848 -1.229 -1.862 1.00 . A A . 6 ALA O 1 1 4 1404 1 1 7 LEU C C -9.116 -0.773 -0.572 1.00 . A A . 7 LEU C 1 1 4 1405 1 1 7 LEU CA C -10.192 -0.442 -1.601 1.00 . A A . 7 LEU CA 1 1 4 1406 1 1 7 LEU CB C -9.630 0.512 -2.669 1.00 . A A . 7 LEU CB 1 1 4 1407 1 1 7 LEU CD1 C -8.834 -1.445 -4.027 1.00 . A A . 7 LEU CD1 1 1 4 1408 1 1 7 LEU CD2 C -11.104 -0.480 -4.438 1.00 . A A . 7 LEU CD2 1 1 4 1409 1 1 7 LEU CG C -9.659 -0.156 -4.052 1.00 . A A . 7 LEU CG 1 1 4 1410 1 1 7 LEU H H -11.194 0.944 -0.345 1.00 . A A . 7 LEU H 1 1 4 1411 1 1 7 LEU HA H -10.513 -1.356 -2.078 1.00 . A A . 7 LEU HA 1 1 4 1412 1 1 7 LEU HB2 H -10.230 1.410 -2.696 1.00 . A A . 7 LEU HB2 1 1 4 1413 1 1 7 LEU HB3 H -8.613 0.774 -2.420 1.00 . A A . 7 LEU HB3 1 1 4 1414 1 1 7 LEU HD11 H -8.074 -1.372 -3.265 1.00 . A A . 7 LEU HD11 1 1 4 1415 1 1 7 LEU HD12 H -8.368 -1.592 -4.989 1.00 . A A . 7 LEU HD12 1 1 4 1416 1 1 7 LEU HD13 H -9.481 -2.283 -3.810 1.00 . A A . 7 LEU HD13 1 1 4 1417 1 1 7 LEU HD21 H -11.738 0.359 -4.196 1.00 . A A . 7 LEU HD21 1 1 4 1418 1 1 7 LEU HD22 H -11.438 -1.349 -3.894 1.00 . A A . 7 LEU HD22 1 1 4 1419 1 1 7 LEU HD23 H -11.158 -0.677 -5.498 1.00 . A A . 7 LEU HD23 1 1 4 1420 1 1 7 LEU HG H -9.236 0.521 -4.784 1.00 . A A . 7 LEU HG 1 1 4 1421 1 1 7 LEU N N -11.340 0.176 -0.943 1.00 . A A . 7 LEU N 1 1 4 1422 1 1 7 LEU O O -8.207 0.021 -0.320 1.00 . A A . 7 LEU O 1 1 4 1423 1 1 8 ALA C C -6.933 -2.715 0.412 1.00 . A A . 8 ALA C 1 1 4 1424 1 1 8 ALA CA C -8.271 -2.379 1.038 1.00 . A A . 8 ALA CA 1 1 4 1425 1 1 8 ALA CB C -8.796 -3.613 1.746 1.00 . A A . 8 ALA CB 1 1 4 1426 1 1 8 ALA H H -9.979 -2.535 -0.211 1.00 . A A . 8 ALA H 1 1 4 1427 1 1 8 ALA HA H -8.134 -1.588 1.754 1.00 . A A . 8 ALA HA 1 1 4 1428 1 1 8 ALA HB1 H -9.595 -3.330 2.411 1.00 . A A . 8 ALA HB1 1 1 4 1429 1 1 8 ALA HB2 H -7.994 -4.069 2.305 1.00 . A A . 8 ALA HB2 1 1 4 1430 1 1 8 ALA HB3 H -9.167 -4.313 1.012 1.00 . A A . 8 ALA HB3 1 1 4 1431 1 1 8 ALA N N -9.230 -1.946 0.028 1.00 . A A . 8 ALA N 1 1 4 1432 1 1 8 ALA O O -5.923 -2.848 1.098 1.00 . A A . 8 ALA O 1 1 4 1433 1 1 9 LEU C C -4.841 -2.028 -1.819 1.00 . A A . 9 LEU C 1 1 4 1434 1 1 9 LEU CA C -5.757 -3.222 -1.645 1.00 . A A . 9 LEU CA 1 1 4 1435 1 1 9 LEU CB C -6.165 -3.700 -3.021 1.00 . A A . 9 LEU CB 1 1 4 1436 1 1 9 LEU CD1 C -6.546 -5.709 -4.454 1.00 . A A . 9 LEU CD1 1 1 4 1437 1 1 9 LEU CD2 C -4.525 -5.591 -3.004 1.00 . A A . 9 LEU CD2 1 1 4 1438 1 1 9 LEU CG C -6.006 -5.217 -3.114 1.00 . A A . 9 LEU CG 1 1 4 1439 1 1 9 LEU H H -7.810 -2.781 -1.355 1.00 . A A . 9 LEU H 1 1 4 1440 1 1 9 LEU HA H -5.228 -4.009 -1.143 1.00 . A A . 9 LEU HA 1 1 4 1441 1 1 9 LEU HB2 H -7.196 -3.427 -3.188 1.00 . A A . 9 LEU HB2 1 1 4 1442 1 1 9 LEU HB3 H -5.539 -3.221 -3.756 1.00 . A A . 9 LEU HB3 1 1 4 1443 1 1 9 LEU HD11 H -6.509 -6.788 -4.480 1.00 . A A . 9 LEU HD11 1 1 4 1444 1 1 9 LEU HD12 H -5.942 -5.309 -5.256 1.00 . A A . 9 LEU HD12 1 1 4 1445 1 1 9 LEU HD13 H -7.568 -5.382 -4.574 1.00 . A A . 9 LEU HD13 1 1 4 1446 1 1 9 LEU HD21 H -4.351 -6.097 -2.065 1.00 . A A . 9 LEU HD21 1 1 4 1447 1 1 9 LEU HD22 H -3.919 -4.700 -3.051 1.00 . A A . 9 LEU HD22 1 1 4 1448 1 1 9 LEU HD23 H -4.262 -6.250 -3.820 1.00 . A A . 9 LEU HD23 1 1 4 1449 1 1 9 LEU HG H -6.557 -5.683 -2.311 1.00 . A A . 9 LEU HG 1 1 4 1450 1 1 9 LEU N N -6.953 -2.876 -0.888 1.00 . A A . 9 LEU N 1 1 4 1451 1 1 9 LEU O O -3.729 -2.006 -1.299 1.00 . A A . 9 LEU O 1 1 4 1452 1 1 10 HIS C C -3.740 0.518 -1.609 1.00 . A A . 10 HIS C 1 1 4 1453 1 1 10 HIS CA C -4.544 0.174 -2.840 1.00 . A A . 10 HIS CA 1 1 4 1454 1 1 10 HIS CB C -5.481 1.338 -3.151 1.00 . A A . 10 HIS CB 1 1 4 1455 1 1 10 HIS CD2 C -5.883 0.500 -5.611 1.00 . A A . 10 HIS CD2 1 1 4 1456 1 1 10 HIS CE1 C -5.956 2.438 -6.584 1.00 . A A . 10 HIS CE1 1 1 4 1457 1 1 10 HIS CG C -5.697 1.448 -4.633 1.00 . A A . 10 HIS CG 1 1 4 1458 1 1 10 HIS H H -6.212 -1.145 -2.957 1.00 . A A . 10 HIS H 1 1 4 1459 1 1 10 HIS HA H -3.882 0.007 -3.677 1.00 . A A . 10 HIS HA 1 1 4 1460 1 1 10 HIS HB2 H -6.427 1.178 -2.660 1.00 . A A . 10 HIS HB2 1 1 4 1461 1 1 10 HIS HB3 H -5.038 2.251 -2.783 1.00 . A A . 10 HIS HB3 1 1 4 1462 1 1 10 HIS HD1 H -5.660 3.559 -4.849 1.00 . A A . 10 HIS HD1 1 1 4 1463 1 1 10 HIS HD2 H -5.897 -0.567 -5.446 1.00 . A A . 10 HIS HD2 1 1 4 1464 1 1 10 HIS HE1 H -6.037 3.214 -7.333 1.00 . A A . 10 HIS HE1 1 1 4 1465 1 1 10 HIS HE2 H -6.209 0.703 -7.714 1.00 . A A . 10 HIS HE2 1 1 4 1466 1 1 10 HIS N N -5.321 -1.045 -2.574 1.00 . A A . 10 HIS N 1 1 4 1467 1 1 10 HIS ND1 N -5.747 2.673 -5.277 1.00 . A A . 10 HIS ND1 1 1 4 1468 1 1 10 HIS NE2 N -6.049 1.129 -6.843 1.00 . A A . 10 HIS NE2 1 1 4 1469 1 1 10 HIS O O -2.558 0.863 -1.671 1.00 . A A . 10 HIS O 1 1 4 1470 1 1 11 HIS C C -2.462 0.046 0.904 1.00 . A A . 11 HIS C 1 1 4 1471 1 1 11 HIS CA C -3.869 0.602 0.820 1.00 . A A . 11 HIS CA 1 1 4 1472 1 1 11 HIS CB C -4.761 -0.142 1.798 1.00 . A A . 11 HIS CB 1 1 4 1473 1 1 11 HIS CD2 C -6.714 1.580 2.088 1.00 . A A . 11 HIS CD2 1 1 4 1474 1 1 11 HIS CE1 C -6.420 2.033 4.186 1.00 . A A . 11 HIS CE1 1 1 4 1475 1 1 11 HIS CG C -5.647 0.830 2.514 1.00 . A A . 11 HIS CG 1 1 4 1476 1 1 11 HIS H H -5.350 0.070 -0.564 1.00 . A A . 11 HIS H 1 1 4 1477 1 1 11 HIS HA H -3.867 1.653 1.052 1.00 . A A . 11 HIS HA 1 1 4 1478 1 1 11 HIS HB2 H -5.373 -0.851 1.237 1.00 . A A . 11 HIS HB2 1 1 4 1479 1 1 11 HIS HB3 H -4.149 -0.676 2.508 1.00 . A A . 11 HIS HB3 1 1 4 1480 1 1 11 HIS HD1 H -4.785 0.762 4.455 1.00 . A A . 11 HIS HD1 1 1 4 1481 1 1 11 HIS HD2 H -7.107 1.587 1.082 1.00 . A A . 11 HIS HD2 1 1 4 1482 1 1 11 HIS HE1 H -6.520 2.468 5.170 1.00 . A A . 11 HIS HE1 1 1 4 1483 1 1 11 HIS HE2 H -7.970 2.953 3.138 1.00 . A A . 11 HIS HE2 1 1 4 1484 1 1 11 HIS N N -4.424 0.377 -0.496 1.00 . A A . 11 HIS N 1 1 4 1485 1 1 11 HIS ND1 N -5.477 1.134 3.854 1.00 . A A . 11 HIS ND1 1 1 4 1486 1 1 11 HIS NE2 N -7.204 2.338 3.147 1.00 . A A . 11 HIS NE2 1 1 4 1487 1 1 11 HIS O O -1.535 0.684 1.401 1.00 . A A . 11 HIS O 1 1 4 1488 1 1 12 LEU C C -0.178 -1.269 -0.694 1.00 . A A . 12 LEU C 1 1 4 1489 1 1 12 LEU CA C -1.055 -1.845 0.395 1.00 . A A . 12 LEU CA 1 1 4 1490 1 1 12 LEU CB C -1.261 -3.346 0.141 1.00 . A A . 12 LEU CB 1 1 4 1491 1 1 12 LEU CD1 C -0.045 -3.919 2.253 1.00 . A A . 12 LEU CD1 1 1 4 1492 1 1 12 LEU CD2 C -2.521 -3.582 2.296 1.00 . A A . 12 LEU CD2 1 1 4 1493 1 1 12 LEU CG C -1.344 -4.107 1.468 1.00 . A A . 12 LEU CG 1 1 4 1494 1 1 12 LEU H H -3.124 -1.591 0.005 1.00 . A A . 12 LEU H 1 1 4 1495 1 1 12 LEU HA H -0.575 -1.708 1.348 1.00 . A A . 12 LEU HA 1 1 4 1496 1 1 12 LEU HB2 H -2.174 -3.491 -0.417 1.00 . A A . 12 LEU HB2 1 1 4 1497 1 1 12 LEU HB3 H -0.430 -3.729 -0.433 1.00 . A A . 12 LEU HB3 1 1 4 1498 1 1 12 LEU HD11 H -0.171 -3.123 2.971 1.00 . A A . 12 LEU HD11 1 1 4 1499 1 1 12 LEU HD12 H 0.755 -3.667 1.573 1.00 . A A . 12 LEU HD12 1 1 4 1500 1 1 12 LEU HD13 H 0.198 -4.836 2.769 1.00 . A A . 12 LEU HD13 1 1 4 1501 1 1 12 LEU HD21 H -2.470 -3.991 3.293 1.00 . A A . 12 LEU HD21 1 1 4 1502 1 1 12 LEU HD22 H -3.448 -3.885 1.835 1.00 . A A . 12 LEU HD22 1 1 4 1503 1 1 12 LEU HD23 H -2.477 -2.503 2.350 1.00 . A A . 12 LEU HD23 1 1 4 1504 1 1 12 LEU HG H -1.487 -5.160 1.267 1.00 . A A . 12 LEU HG 1 1 4 1505 1 1 12 LEU N N -2.333 -1.157 0.402 1.00 . A A . 12 LEU N 1 1 4 1506 1 1 12 LEU O O 1.000 -0.988 -0.483 1.00 . A A . 12 LEU O 1 1 4 1507 1 1 13 ALA C C 0.586 0.773 -2.661 1.00 . A A . 13 ALA C 1 1 4 1508 1 1 13 ALA CA C -0.052 -0.559 -3.007 1.00 . A A . 13 ALA CA 1 1 4 1509 1 1 13 ALA CB C -0.996 -0.389 -4.197 1.00 . A A . 13 ALA CB 1 1 4 1510 1 1 13 ALA H H -1.716 -1.341 -1.944 1.00 . A A . 13 ALA H 1 1 4 1511 1 1 13 ALA HA H 0.728 -1.249 -3.273 1.00 . A A . 13 ALA HA 1 1 4 1512 1 1 13 ALA HB1 H -0.423 -0.149 -5.080 1.00 . A A . 13 ALA HB1 1 1 4 1513 1 1 13 ALA HB2 H -1.693 0.411 -3.990 1.00 . A A . 13 ALA HB2 1 1 4 1514 1 1 13 ALA HB3 H -1.538 -1.309 -4.362 1.00 . A A . 13 ALA HB3 1 1 4 1515 1 1 13 ALA N N -0.772 -1.099 -1.858 1.00 . A A . 13 ALA N 1 1 4 1516 1 1 13 ALA O O 1.670 1.104 -3.145 1.00 . A A . 13 ALA O 1 1 4 1517 1 1 14 HIS C C 1.623 2.647 -0.516 1.00 . A A . 14 HIS C 1 1 4 1518 1 1 14 HIS CA C 0.410 2.829 -1.399 1.00 . A A . 14 HIS CA 1 1 4 1519 1 1 14 HIS CB C -0.687 3.579 -0.645 1.00 . A A . 14 HIS CB 1 1 4 1520 1 1 14 HIS CD2 C -0.749 3.560 1.985 1.00 . A A . 14 HIS CD2 1 1 4 1521 1 1 14 HIS CE1 C 0.949 4.851 2.356 1.00 . A A . 14 HIS CE1 1 1 4 1522 1 1 14 HIS CG C -0.256 3.926 0.757 1.00 . A A . 14 HIS CG 1 1 4 1523 1 1 14 HIS H H -0.950 1.203 -1.473 1.00 . A A . 14 HIS H 1 1 4 1524 1 1 14 HIS HA H 0.691 3.397 -2.268 1.00 . A A . 14 HIS HA 1 1 4 1525 1 1 14 HIS HB2 H -0.896 4.472 -1.179 1.00 . A A . 14 HIS HB2 1 1 4 1526 1 1 14 HIS HB3 H -1.578 2.968 -0.606 1.00 . A A . 14 HIS HB3 1 1 4 1527 1 1 14 HIS HD1 H 1.404 5.190 0.353 1.00 . A A . 14 HIS HD1 1 1 4 1528 1 1 14 HIS HD2 H -1.601 2.914 2.146 1.00 . A A . 14 HIS HD2 1 1 4 1529 1 1 14 HIS HE1 H 1.710 5.434 2.858 1.00 . A A . 14 HIS HE1 1 1 4 1530 1 1 14 HIS HE2 H -0.117 4.060 3.963 1.00 . A A . 14 HIS HE2 1 1 4 1531 1 1 14 HIS N N -0.092 1.529 -1.821 1.00 . A A . 14 HIS N 1 1 4 1532 1 1 14 HIS ND1 N 0.829 4.752 1.020 1.00 . A A . 14 HIS ND1 1 1 4 1533 1 1 14 HIS NE2 N 0.011 4.144 2.992 1.00 . A A . 14 HIS NE2 1 1 4 1534 1 1 14 HIS O O 2.707 3.170 -0.780 1.00 . A A . 14 HIS O 1 1 4 1535 1 1 15 LEU C C 3.596 0.953 0.649 1.00 . A A . 15 LEU C 1 1 4 1536 1 1 15 LEU CA C 2.495 1.581 1.439 1.00 . A A . 15 LEU CA 1 1 4 1537 1 1 15 LEU CB C 1.968 0.586 2.469 1.00 . A A . 15 LEU CB 1 1 4 1538 1 1 15 LEU CD1 C 3.632 0.929 4.273 1.00 . A A . 15 LEU CD1 1 1 4 1539 1 1 15 LEU CD2 C 2.621 -1.320 3.949 1.00 . A A . 15 LEU CD2 1 1 4 1540 1 1 15 LEU CG C 3.120 -0.057 3.241 1.00 . A A . 15 LEU CG 1 1 4 1541 1 1 15 LEU H H 0.549 1.472 0.653 1.00 . A A . 15 LEU H 1 1 4 1542 1 1 15 LEU HA H 2.854 2.481 1.910 1.00 . A A . 15 LEU HA 1 1 4 1543 1 1 15 LEU HB2 H 1.313 1.097 3.154 1.00 . A A . 15 LEU HB2 1 1 4 1544 1 1 15 LEU HB3 H 1.412 -0.187 1.952 1.00 . A A . 15 LEU HB3 1 1 4 1545 1 1 15 LEU HD11 H 3.044 1.835 4.229 1.00 . A A . 15 LEU HD11 1 1 4 1546 1 1 15 LEU HD12 H 4.664 1.158 4.066 1.00 . A A . 15 LEU HD12 1 1 4 1547 1 1 15 LEU HD13 H 3.548 0.495 5.253 1.00 . A A . 15 LEU HD13 1 1 4 1548 1 1 15 LEU HD21 H 2.081 -1.038 4.841 1.00 . A A . 15 LEU HD21 1 1 4 1549 1 1 15 LEU HD22 H 3.466 -1.936 4.222 1.00 . A A . 15 LEU HD22 1 1 4 1550 1 1 15 LEU HD23 H 1.970 -1.875 3.291 1.00 . A A . 15 LEU HD23 1 1 4 1551 1 1 15 LEU HG H 3.918 -0.316 2.561 1.00 . A A . 15 LEU HG 1 1 4 1552 1 1 15 LEU N N 1.428 1.875 0.519 1.00 . A A . 15 LEU N 1 1 4 1553 1 1 15 LEU O O 4.783 1.212 0.850 1.00 . A A . 15 LEU O 1 1 4 1554 1 1 16 ALA C C 4.760 0.391 -2.069 1.00 . A A . 16 ALA C 1 1 4 1555 1 1 16 ALA CA C 4.061 -0.576 -1.136 1.00 . A A . 16 ALA CA 1 1 4 1556 1 1 16 ALA CB C 3.301 -1.619 -1.955 1.00 . A A . 16 ALA CB 1 1 4 1557 1 1 16 ALA H H 2.171 0.022 -0.342 1.00 . A A . 16 ALA H 1 1 4 1558 1 1 16 ALA HA H 4.798 -1.074 -0.535 1.00 . A A . 16 ALA HA 1 1 4 1559 1 1 16 ALA HB1 H 3.998 -2.167 -2.571 1.00 . A A . 16 ALA HB1 1 1 4 1560 1 1 16 ALA HB2 H 2.577 -1.125 -2.582 1.00 . A A . 16 ALA HB2 1 1 4 1561 1 1 16 ALA HB3 H 2.797 -2.302 -1.288 1.00 . A A . 16 ALA HB3 1 1 4 1562 1 1 16 ALA N N 3.154 0.136 -0.260 1.00 . A A . 16 ALA N 1 1 4 1563 1 1 16 ALA O O 5.909 0.183 -2.453 1.00 . A A . 16 ALA O 1 1 4 1564 1 1 17 LEU C C 5.886 3.016 -2.785 1.00 . A A . 17 LEU C 1 1 4 1565 1 1 17 LEU CA C 4.603 2.440 -3.337 1.00 . A A . 17 LEU CA 1 1 4 1566 1 1 17 LEU CB C 3.559 3.548 -3.603 1.00 . A A . 17 LEU CB 1 1 4 1567 1 1 17 LEU CD1 C 3.633 5.802 -4.700 1.00 . A A . 17 LEU CD1 1 1 4 1568 1 1 17 LEU CD2 C 3.854 5.639 -2.224 1.00 . A A . 17 LEU CD2 1 1 4 1569 1 1 17 LEU CG C 4.192 4.955 -3.555 1.00 . A A . 17 LEU CG 1 1 4 1570 1 1 17 LEU H H 3.143 1.548 -2.096 1.00 . A A . 17 LEU H 1 1 4 1571 1 1 17 LEU HA H 4.838 1.956 -4.263 1.00 . A A . 17 LEU HA 1 1 4 1572 1 1 17 LEU HB2 H 3.130 3.391 -4.578 1.00 . A A . 17 LEU HB2 1 1 4 1573 1 1 17 LEU HB3 H 2.779 3.483 -2.863 1.00 . A A . 17 LEU HB3 1 1 4 1574 1 1 17 LEU HD11 H 3.970 5.397 -5.642 1.00 . A A . 17 LEU HD11 1 1 4 1575 1 1 17 LEU HD12 H 3.985 6.819 -4.602 1.00 . A A . 17 LEU HD12 1 1 4 1576 1 1 17 LEU HD13 H 2.554 5.791 -4.667 1.00 . A A . 17 LEU HD13 1 1 4 1577 1 1 17 LEU HD21 H 2.813 5.924 -2.219 1.00 . A A . 17 LEU HD21 1 1 4 1578 1 1 17 LEU HD22 H 4.467 6.521 -2.109 1.00 . A A . 17 LEU HD22 1 1 4 1579 1 1 17 LEU HD23 H 4.045 4.963 -1.407 1.00 . A A . 17 LEU HD23 1 1 4 1580 1 1 17 LEU HG H 5.261 4.881 -3.660 1.00 . A A . 17 LEU HG 1 1 4 1581 1 1 17 LEU N N 4.055 1.444 -2.435 1.00 . A A . 17 LEU N 1 1 4 1582 1 1 17 LEU O O 6.902 3.066 -3.485 1.00 . A A . 17 LEU O 1 1 4 1583 1 1 18 HIS C C 7.992 2.885 -0.578 1.00 . A A . 18 HIS C 1 1 4 1584 1 1 18 HIS CA C 7.076 4.004 -0.967 1.00 . A A . 18 HIS CA 1 1 4 1585 1 1 18 HIS CB C 6.761 4.890 0.208 1.00 . A A . 18 HIS CB 1 1 4 1586 1 1 18 HIS CD2 C 4.981 3.801 1.753 1.00 . A A . 18 HIS CD2 1 1 4 1587 1 1 18 HIS CE1 C 6.316 2.978 3.251 1.00 . A A . 18 HIS CE1 1 1 4 1588 1 1 18 HIS CG C 6.254 4.101 1.362 1.00 . A A . 18 HIS CG 1 1 4 1589 1 1 18 HIS H H 5.025 3.371 -1.004 1.00 . A A . 18 HIS H 1 1 4 1590 1 1 18 HIS HA H 7.569 4.596 -1.725 1.00 . A A . 18 HIS HA 1 1 4 1591 1 1 18 HIS HB2 H 7.647 5.430 0.496 1.00 . A A . 18 HIS HB2 1 1 4 1592 1 1 18 HIS HB3 H 6.007 5.571 -0.097 1.00 . A A . 18 HIS HB3 1 1 4 1593 1 1 18 HIS HD1 H 8.078 3.592 2.322 1.00 . A A . 18 HIS HD1 1 1 4 1594 1 1 18 HIS HD2 H 4.084 4.066 1.203 1.00 . A A . 18 HIS HD2 1 1 4 1595 1 1 18 HIS HE1 H 6.693 2.491 4.140 1.00 . A A . 18 HIS HE1 1 1 4 1596 1 1 18 HIS HE2 H 4.252 2.760 3.464 1.00 . A A . 18 HIS HE2 1 1 4 1597 1 1 18 HIS N N 5.859 3.444 -1.541 1.00 . A A . 18 HIS N 1 1 4 1598 1 1 18 HIS ND1 N 7.094 3.564 2.325 1.00 . A A . 18 HIS ND1 1 1 4 1599 1 1 18 HIS NE2 N 5.018 3.092 2.948 1.00 . A A . 18 HIS NE2 1 1 4 1600 1 1 18 HIS O O 9.204 2.938 -0.814 1.00 . A A . 18 HIS O 1 1 4 1601 1 1 19 LEU C C 9.003 0.306 -0.879 1.00 . A A . 19 LEU C 1 1 4 1602 1 1 19 LEU CA C 8.176 0.673 0.329 1.00 . A A . 19 LEU CA 1 1 4 1603 1 1 19 LEU CB C 7.266 -0.508 0.676 1.00 . A A . 19 LEU CB 1 1 4 1604 1 1 19 LEU CD1 C 9.040 -1.096 2.351 1.00 . A A . 19 LEU CD1 1 1 4 1605 1 1 19 LEU CD2 C 6.935 0.044 3.084 1.00 . A A . 19 LEU CD2 1 1 4 1606 1 1 19 LEU CG C 7.531 -0.970 2.105 1.00 . A A . 19 LEU CG 1 1 4 1607 1 1 19 LEU H H 6.427 1.869 0.100 1.00 . A A . 19 LEU H 1 1 4 1608 1 1 19 LEU HA H 8.824 0.900 1.160 1.00 . A A . 19 LEU HA 1 1 4 1609 1 1 19 LEU HB2 H 6.239 -0.209 0.579 1.00 . A A . 19 LEU HB2 1 1 4 1610 1 1 19 LEU HB3 H 7.463 -1.325 -0.004 1.00 . A A . 19 LEU HB3 1 1 4 1611 1 1 19 LEU HD11 H 9.223 -1.900 3.048 1.00 . A A . 19 LEU HD11 1 1 4 1612 1 1 19 LEU HD12 H 9.416 -0.171 2.765 1.00 . A A . 19 LEU HD12 1 1 4 1613 1 1 19 LEU HD13 H 9.549 -1.305 1.420 1.00 . A A . 19 LEU HD13 1 1 4 1614 1 1 19 LEU HD21 H 6.223 0.670 2.568 1.00 . A A . 19 LEU HD21 1 1 4 1615 1 1 19 LEU HD22 H 7.722 0.660 3.494 1.00 . A A . 19 LEU HD22 1 1 4 1616 1 1 19 LEU HD23 H 6.435 -0.482 3.883 1.00 . A A . 19 LEU HD23 1 1 4 1617 1 1 19 LEU HG H 7.064 -1.928 2.251 1.00 . A A . 19 LEU HG 1 1 4 1618 1 1 19 LEU N N 7.401 1.848 -0.027 1.00 . A A . 19 LEU N 1 1 4 1619 1 1 19 LEU O O 10.140 -0.154 -0.773 1.00 . A A . 19 LEU O 1 1 4 1620 1 1 20 ALA C C 10.331 1.135 -3.366 1.00 . A A . 20 ALA C 1 1 4 1621 1 1 20 ALA CA C 9.081 0.292 -3.300 1.00 . A A . 20 ALA CA 1 1 4 1622 1 1 20 ALA CB C 8.177 0.637 -4.482 1.00 . A A . 20 ALA CB 1 1 4 1623 1 1 20 ALA H H 7.500 0.961 -2.023 1.00 . A A . 20 ALA H 1 1 4 1624 1 1 20 ALA HA H 9.352 -0.746 -3.345 1.00 . A A . 20 ALA HA 1 1 4 1625 1 1 20 ALA HB1 H 8.251 1.692 -4.696 1.00 . A A . 20 ALA HB1 1 1 4 1626 1 1 20 ALA HB2 H 7.155 0.390 -4.243 1.00 . A A . 20 ALA HB2 1 1 4 1627 1 1 20 ALA HB3 H 8.490 0.075 -5.348 1.00 . A A . 20 ALA HB3 1 1 4 1628 1 1 20 ALA N N 8.408 0.561 -2.035 1.00 . A A . 20 ALA N 1 1 4 1629 1 1 20 ALA O O 11.445 0.628 -3.496 1.00 . A A . 20 ALA O 1 1 4 1630 1 1 21 LEU C C 12.260 2.922 -2.228 1.00 . A A . 21 LEU C 1 1 4 1631 1 1 21 LEU CA C 11.235 3.365 -3.258 1.00 . A A . 21 LEU CA 1 1 4 1632 1 1 21 LEU CB C 10.737 4.774 -2.913 1.00 . A A . 21 LEU CB 1 1 4 1633 1 1 21 LEU CD1 C 9.299 4.704 -4.964 1.00 . A A . 21 LEU CD1 1 1 4 1634 1 1 21 LEU CD2 C 9.741 6.883 -3.821 1.00 . A A . 21 LEU CD2 1 1 4 1635 1 1 21 LEU CG C 10.339 5.521 -4.191 1.00 . A A . 21 LEU CG 1 1 4 1636 1 1 21 LEU H H 9.209 2.754 -3.132 1.00 . A A . 21 LEU H 1 1 4 1637 1 1 21 LEU HA H 11.691 3.371 -4.229 1.00 . A A . 21 LEU HA 1 1 4 1638 1 1 21 LEU HB2 H 9.882 4.700 -2.256 1.00 . A A . 21 LEU HB2 1 1 4 1639 1 1 21 LEU HB3 H 11.523 5.318 -2.410 1.00 . A A . 21 LEU HB3 1 1 4 1640 1 1 21 LEU HD11 H 8.987 5.252 -5.838 1.00 . A A . 21 LEU HD11 1 1 4 1641 1 1 21 LEU HD12 H 8.444 4.521 -4.333 1.00 . A A . 21 LEU HD12 1 1 4 1642 1 1 21 LEU HD13 H 9.731 3.763 -5.267 1.00 . A A . 21 LEU HD13 1 1 4 1643 1 1 21 LEU HD21 H 9.438 7.402 -4.719 1.00 . A A . 21 LEU HD21 1 1 4 1644 1 1 21 LEU HD22 H 10.478 7.475 -3.296 1.00 . A A . 21 LEU HD22 1 1 4 1645 1 1 21 LEU HD23 H 8.881 6.734 -3.183 1.00 . A A . 21 LEU HD23 1 1 4 1646 1 1 21 LEU HG H 11.212 5.666 -4.810 1.00 . A A . 21 LEU HG 1 1 4 1647 1 1 21 LEU N N 10.128 2.429 -3.247 1.00 . A A . 21 LEU N 1 1 4 1648 1 1 21 LEU O O 13.464 2.921 -2.482 1.00 . A A . 21 LEU O 1 1 4 1649 1 1 22 ALA C C 13.556 0.983 -0.449 1.00 . A A . 22 ALA C 1 1 4 1650 1 1 22 ALA CA C 12.610 2.076 0.025 1.00 . A A . 22 ALA CA 1 1 4 1651 1 1 22 ALA CB C 11.755 1.550 1.183 1.00 . A A . 22 ALA CB 1 1 4 1652 1 1 22 ALA H H 10.779 2.553 -0.945 1.00 . A A . 22 ALA H 1 1 4 1653 1 1 22 ALA HA H 13.192 2.908 0.374 1.00 . A A . 22 ALA HA 1 1 4 1654 1 1 22 ALA HB1 H 11.724 0.472 1.147 1.00 . A A . 22 ALA HB1 1 1 4 1655 1 1 22 ALA HB2 H 10.753 1.943 1.098 1.00 . A A . 22 ALA HB2 1 1 4 1656 1 1 22 ALA HB3 H 12.187 1.865 2.119 1.00 . A A . 22 ALA HB3 1 1 4 1657 1 1 22 ALA N N 11.755 2.534 -1.066 1.00 . A A . 22 ALA N 1 1 4 1658 1 1 22 ALA O O 14.732 0.965 -0.079 1.00 . A A . 22 ALA O 1 1 4 1659 1 1 23 LEU C C 15.008 -0.437 -2.603 1.00 . A A . 23 LEU C 1 1 4 1660 1 1 23 LEU CA C 13.863 -1.016 -1.787 1.00 . A A . 23 LEU CA 1 1 4 1661 1 1 23 LEU CB C 13.026 -1.954 -2.672 1.00 . A A . 23 LEU CB 1 1 4 1662 1 1 23 LEU CD1 C 11.419 -2.728 -0.920 1.00 . A A . 23 LEU CD1 1 1 4 1663 1 1 23 LEU CD2 C 12.047 -4.249 -2.798 1.00 . A A . 23 LEU CD2 1 1 4 1664 1 1 23 LEU CG C 12.550 -3.157 -1.851 1.00 . A A . 23 LEU CG 1 1 4 1665 1 1 23 LEU H H 12.098 0.146 -1.524 1.00 . A A . 23 LEU H 1 1 4 1666 1 1 23 LEU HA H 14.270 -1.573 -0.963 1.00 . A A . 23 LEU HA 1 1 4 1667 1 1 23 LEU HB2 H 12.170 -1.419 -3.054 1.00 . A A . 23 LEU HB2 1 1 4 1668 1 1 23 LEU HB3 H 13.628 -2.303 -3.497 1.00 . A A . 23 LEU HB3 1 1 4 1669 1 1 23 LEU HD11 H 10.560 -2.445 -1.508 1.00 . A A . 23 LEU HD11 1 1 4 1670 1 1 23 LEU HD12 H 11.740 -1.887 -0.325 1.00 . A A . 23 LEU HD12 1 1 4 1671 1 1 23 LEU HD13 H 11.156 -3.550 -0.270 1.00 . A A . 23 LEU HD13 1 1 4 1672 1 1 23 LEU HD21 H 12.676 -4.279 -3.676 1.00 . A A . 23 LEU HD21 1 1 4 1673 1 1 23 LEU HD22 H 11.032 -4.033 -3.091 1.00 . A A . 23 LEU HD22 1 1 4 1674 1 1 23 LEU HD23 H 12.085 -5.203 -2.297 1.00 . A A . 23 LEU HD23 1 1 4 1675 1 1 23 LEU HG H 13.370 -3.541 -1.265 1.00 . A A . 23 LEU HG 1 1 4 1676 1 1 23 LEU N N 13.042 0.076 -1.266 1.00 . A A . 23 LEU N 1 1 4 1677 1 1 23 LEU O O 16.177 -0.793 -2.422 1.00 . A A . 23 LEU O 1 1 4 1678 1 1 24 LYS C C 16.207 2.348 -3.626 1.00 . A A . 24 LYS C 1 1 4 1679 1 1 24 LYS CA C 15.633 1.134 -4.343 1.00 . A A . 24 LYS CA 1 1 4 1680 1 1 24 LYS CB C 14.977 1.566 -5.660 1.00 . A A . 24 LYS CB 1 1 4 1681 1 1 24 LYS CD C 13.171 0.248 -6.815 1.00 . A A . 24 LYS CD 1 1 4 1682 1 1 24 LYS CE C 12.807 1.235 -7.928 1.00 . A A . 24 LYS CE 1 1 4 1683 1 1 24 LYS CG C 14.674 0.327 -6.513 1.00 . A A . 24 LYS CG 1 1 4 1684 1 1 24 LYS H H 13.702 0.707 -3.567 1.00 . A A . 24 LYS H 1 1 4 1685 1 1 24 LYS HA H 16.434 0.448 -4.563 1.00 . A A . 24 LYS HA 1 1 4 1686 1 1 24 LYS HB2 H 14.059 2.098 -5.448 1.00 . A A . 24 LYS HB2 1 1 4 1687 1 1 24 LYS HB3 H 15.651 2.216 -6.198 1.00 . A A . 24 LYS HB3 1 1 4 1688 1 1 24 LYS HD2 H 12.918 -0.754 -7.130 1.00 . A A . 24 LYS HD2 1 1 4 1689 1 1 24 LYS HD3 H 12.611 0.495 -5.925 1.00 . A A . 24 LYS HD3 1 1 4 1690 1 1 24 LYS HE2 H 11.821 1.004 -8.301 1.00 . A A . 24 LYS HE2 1 1 4 1691 1 1 24 LYS HE3 H 12.816 2.240 -7.532 1.00 . A A . 24 LYS HE3 1 1 4 1692 1 1 24 LYS HG2 H 15.227 0.389 -7.440 1.00 . A A . 24 LYS HG2 1 1 4 1693 1 1 24 LYS HG3 H 14.978 -0.563 -5.978 1.00 . A A . 24 LYS HG3 1 1 4 1694 1 1 24 LYS HZ1 H 13.294 1.242 -9.945 1.00 . A A . 24 LYS HZ1 1 1 4 1695 1 1 24 LYS HZ2 H 14.251 0.203 -9.014 1.00 . A A . 24 LYS HZ2 1 1 4 1696 1 1 24 LYS HZ3 H 14.509 1.878 -8.942 1.00 . A A . 24 LYS HZ3 1 1 4 1697 1 1 24 LYS N N 14.651 0.470 -3.493 1.00 . A A . 24 LYS N 1 1 4 1698 1 1 24 LYS NZ N 13.789 1.133 -9.038 1.00 . A A . 24 LYS NZ 1 1 4 1699 1 1 24 LYS O O 17.208 2.252 -2.917 1.00 . A A . 24 LYS O 1 1 4 1700 1 1 25 LYS C C 14.774 5.390 -2.502 1.00 . A A . 25 LYS C 1 1 4 1701 1 1 25 LYS CA C 15.974 4.716 -3.150 1.00 . A A . 25 LYS CA 1 1 4 1702 1 1 25 LYS CB C 16.620 5.664 -4.170 1.00 . A A . 25 LYS CB 1 1 4 1703 1 1 25 LYS CD C 15.502 7.584 -5.377 1.00 . A A . 25 LYS CD 1 1 4 1704 1 1 25 LYS CE C 14.852 8.178 -4.118 1.00 . A A . 25 LYS CE 1 1 4 1705 1 1 25 LYS CG C 15.600 6.053 -5.261 1.00 . A A . 25 LYS CG 1 1 4 1706 1 1 25 LYS H H 14.746 3.484 -4.353 1.00 . A A . 25 LYS H 1 1 4 1707 1 1 25 LYS HA H 16.698 4.476 -2.384 1.00 . A A . 25 LYS HA 1 1 4 1708 1 1 25 LYS HB2 H 16.963 6.555 -3.662 1.00 . A A . 25 LYS HB2 1 1 4 1709 1 1 25 LYS HB3 H 17.463 5.170 -4.632 1.00 . A A . 25 LYS HB3 1 1 4 1710 1 1 25 LYS HD2 H 16.496 7.992 -5.493 1.00 . A A . 25 LYS HD2 1 1 4 1711 1 1 25 LYS HD3 H 14.908 7.841 -6.242 1.00 . A A . 25 LYS HD3 1 1 4 1712 1 1 25 LYS HE2 H 15.445 7.919 -3.255 1.00 . A A . 25 LYS HE2 1 1 4 1713 1 1 25 LYS HE3 H 14.807 9.255 -4.210 1.00 . A A . 25 LYS HE3 1 1 4 1714 1 1 25 LYS HG2 H 15.922 5.647 -6.208 1.00 . A A . 25 LYS HG2 1 1 4 1715 1 1 25 LYS HG3 H 14.631 5.649 -5.014 1.00 . A A . 25 LYS HG3 1 1 4 1716 1 1 25 LYS HZ1 H 12.890 7.885 -4.771 1.00 . A A . 25 LYS HZ1 1 1 4 1717 1 1 25 LYS HZ2 H 13.047 8.036 -3.079 1.00 . A A . 25 LYS HZ2 1 1 4 1718 1 1 25 LYS HZ3 H 13.522 6.597 -3.855 1.00 . A A . 25 LYS HZ3 1 1 4 1719 1 1 25 LYS N N 15.547 3.481 -3.797 1.00 . A A . 25 LYS N 1 1 4 1720 1 1 25 LYS NZ N 13.475 7.635 -3.951 1.00 . A A . 25 LYS NZ 1 1 4 1721 1 1 25 LYS O O 13.703 5.481 -3.112 1.00 . A A . 25 LYS O 1 1 4 1722 1 1 26 ALA C C 13.748 7.969 -1.058 1.00 . A A . 26 ALA C 1 1 4 1723 1 1 26 ALA CA C 13.866 6.530 -0.572 1.00 . A A . 26 ALA CA 1 1 4 1724 1 1 26 ALA CB C 14.117 6.507 0.941 1.00 . A A . 26 ALA CB 1 1 4 1725 1 1 26 ALA H H 15.821 5.764 -0.841 1.00 . A A . 26 ALA H 1 1 4 1726 1 1 26 ALA HA H 12.943 6.008 -0.778 1.00 . A A . 26 ALA HA 1 1 4 1727 1 1 26 ALA HB1 H 15.148 6.260 1.133 1.00 . A A . 26 ALA HB1 1 1 4 1728 1 1 26 ALA HB2 H 13.478 5.764 1.398 1.00 . A A . 26 ALA HB2 1 1 4 1729 1 1 26 ALA HB3 H 13.896 7.478 1.358 1.00 . A A . 26 ALA HB3 1 1 4 1730 1 1 26 ALA N N 14.949 5.864 -1.276 1.00 . A A . 26 ALA N 1 1 4 1731 1 1 26 ALA O O 12.759 8.281 -1.689 1.00 . A A . 26 ALA O 1 1 4 1732 1 1 26 ALA OXT O 14.651 8.737 -0.796 1.00 . A A . 26 ALA OXT 1 1 5 1733 1 1 1 LYS C C -19.893 -1.084 -9.787 1.00 . A A . 1 LYS C 1 1 5 1734 1 1 1 LYS CA C -21.406 -1.037 -9.608 1.00 . A A . 1 LYS CA 1 1 5 1735 1 1 1 LYS CB C -21.752 -0.592 -8.177 1.00 . A A . 1 LYS CB 1 1 5 1736 1 1 1 LYS CD C -23.883 0.197 -7.110 1.00 . A A . 1 LYS CD 1 1 5 1737 1 1 1 LYS CE C -25.016 -0.338 -6.221 1.00 . A A . 1 LYS CE 1 1 5 1738 1 1 1 LYS CG C -23.207 -0.962 -7.850 1.00 . A A . 1 LYS CG 1 1 5 1739 1 1 1 LYS H1 H -22.629 -2.651 -9.120 1.00 . A A . 1 LYS H1 1 1 5 1740 1 1 1 LYS H2 H -21.175 -3.087 -9.876 1.00 . A A . 1 LYS H2 1 1 5 1741 1 1 1 LYS H3 H -22.439 -2.411 -10.785 1.00 . A A . 1 LYS H3 1 1 5 1742 1 1 1 LYS HA H -21.829 -0.339 -10.313 1.00 . A A . 1 LYS HA 1 1 5 1743 1 1 1 LYS HB2 H -21.089 -1.083 -7.477 1.00 . A A . 1 LYS HB2 1 1 5 1744 1 1 1 LYS HB3 H -21.628 0.479 -8.094 1.00 . A A . 1 LYS HB3 1 1 5 1745 1 1 1 LYS HD2 H -23.157 0.712 -6.497 1.00 . A A . 1 LYS HD2 1 1 5 1746 1 1 1 LYS HD3 H -24.294 0.887 -7.832 1.00 . A A . 1 LYS HD3 1 1 5 1747 1 1 1 LYS HE2 H -25.405 0.466 -5.613 1.00 . A A . 1 LYS HE2 1 1 5 1748 1 1 1 LYS HE3 H -25.807 -0.732 -6.842 1.00 . A A . 1 LYS HE3 1 1 5 1749 1 1 1 LYS HG2 H -23.743 -1.161 -8.767 1.00 . A A . 1 LYS HG2 1 1 5 1750 1 1 1 LYS HG3 H -23.220 -1.842 -7.225 1.00 . A A . 1 LYS HG3 1 1 5 1751 1 1 1 LYS HZ1 H -24.467 -2.315 -5.860 1.00 . A A . 1 LYS HZ1 1 1 5 1752 1 1 1 LYS HZ2 H -25.111 -1.523 -4.508 1.00 . A A . 1 LYS HZ2 1 1 5 1753 1 1 1 LYS HZ3 H -23.532 -1.176 -5.016 1.00 . A A . 1 LYS HZ3 1 1 5 1754 1 1 1 LYS N N -21.955 -2.398 -9.864 1.00 . A A . 1 LYS N 1 1 5 1755 1 1 1 LYS NZ N -24.491 -1.418 -5.337 1.00 . A A . 1 LYS NZ 1 1 5 1756 1 1 1 LYS O O -19.341 -2.107 -10.195 1.00 . A A . 1 LYS O 1 1 5 1757 1 1 2 LYS C C -17.140 -0.373 -8.282 1.00 . A A . 2 LYS C 1 1 5 1758 1 1 2 LYS CA C -17.778 0.086 -9.589 1.00 . A A . 2 LYS CA 1 1 5 1759 1 1 2 LYS CB C -17.342 1.525 -9.905 1.00 . A A . 2 LYS CB 1 1 5 1760 1 1 2 LYS CD C -15.935 2.952 -11.406 1.00 . A A . 2 LYS CD 1 1 5 1761 1 1 2 LYS CE C -14.443 3.044 -11.748 1.00 . A A . 2 LYS CE 1 1 5 1762 1 1 2 LYS CG C -16.285 1.514 -11.013 1.00 . A A . 2 LYS CG 1 1 5 1763 1 1 2 LYS H H -19.721 0.800 -9.144 1.00 . A A . 2 LYS H 1 1 5 1764 1 1 2 LYS HA H -17.459 -0.564 -10.389 1.00 . A A . 2 LYS HA 1 1 5 1765 1 1 2 LYS HB2 H -18.198 2.098 -10.231 1.00 . A A . 2 LYS HB2 1 1 5 1766 1 1 2 LYS HB3 H -16.924 1.977 -9.017 1.00 . A A . 2 LYS HB3 1 1 5 1767 1 1 2 LYS HD2 H -16.521 3.241 -12.271 1.00 . A A . 2 LYS HD2 1 1 5 1768 1 1 2 LYS HD3 H -16.157 3.618 -10.583 1.00 . A A . 2 LYS HD3 1 1 5 1769 1 1 2 LYS HE2 H -14.143 2.163 -12.296 1.00 . A A . 2 LYS HE2 1 1 5 1770 1 1 2 LYS HE3 H -14.265 3.921 -12.352 1.00 . A A . 2 LYS HE3 1 1 5 1771 1 1 2 LYS HG2 H -15.400 1.011 -10.660 1.00 . A A . 2 LYS HG2 1 1 5 1772 1 1 2 LYS HG3 H -16.675 0.992 -11.874 1.00 . A A . 2 LYS HG3 1 1 5 1773 1 1 2 LYS HZ1 H -12.662 3.376 -10.723 1.00 . A A . 2 LYS HZ1 1 1 5 1774 1 1 2 LYS HZ2 H -13.668 2.225 -9.997 1.00 . A A . 2 LYS HZ2 1 1 5 1775 1 1 2 LYS HZ3 H -14.048 3.872 -9.881 1.00 . A A . 2 LYS HZ3 1 1 5 1776 1 1 2 LYS N N -19.228 0.019 -9.471 1.00 . A A . 2 LYS N 1 1 5 1777 1 1 2 LYS NZ N -13.648 3.135 -10.493 1.00 . A A . 2 LYS NZ 1 1 5 1778 1 1 2 LYS O O -17.815 -0.944 -7.424 1.00 . A A . 2 LYS O 1 1 5 1779 1 1 3 ALA C C -15.026 0.743 -6.015 1.00 . A A . 3 ALA C 1 1 5 1780 1 1 3 ALA CA C -15.138 -0.478 -6.916 1.00 . A A . 3 ALA CA 1 1 5 1781 1 1 3 ALA CB C -13.739 -1.003 -7.259 1.00 . A A . 3 ALA CB 1 1 5 1782 1 1 3 ALA H H -15.372 0.362 -8.848 1.00 . A A . 3 ALA H 1 1 5 1783 1 1 3 ALA HA H -15.691 -1.250 -6.402 1.00 . A A . 3 ALA HA 1 1 5 1784 1 1 3 ALA HB1 H -13.825 -1.865 -7.904 1.00 . A A . 3 ALA HB1 1 1 5 1785 1 1 3 ALA HB2 H -13.227 -1.284 -6.351 1.00 . A A . 3 ALA HB2 1 1 5 1786 1 1 3 ALA HB3 H -13.179 -0.232 -7.765 1.00 . A A . 3 ALA HB3 1 1 5 1787 1 1 3 ALA N N -15.851 -0.108 -8.133 1.00 . A A . 3 ALA N 1 1 5 1788 1 1 3 ALA O O -15.658 1.771 -6.275 1.00 . A A . 3 ALA O 1 1 5 1789 1 1 4 LEU C C -12.938 2.669 -4.607 1.00 . A A . 4 LEU C 1 1 5 1790 1 1 4 LEU CA C -14.026 1.764 -4.064 1.00 . A A . 4 LEU CA 1 1 5 1791 1 1 4 LEU CB C -13.619 1.266 -2.674 1.00 . A A . 4 LEU CB 1 1 5 1792 1 1 4 LEU CD1 C -15.736 -0.071 -2.605 1.00 . A A . 4 LEU CD1 1 1 5 1793 1 1 4 LEU CD2 C -14.442 0.366 -0.500 1.00 . A A . 4 LEU CD2 1 1 5 1794 1 1 4 LEU CG C -14.868 0.943 -1.853 1.00 . A A . 4 LEU CG 1 1 5 1795 1 1 4 LEU H H -13.727 -0.193 -4.824 1.00 . A A . 4 LEU H 1 1 5 1796 1 1 4 LEU HA H -14.948 2.323 -3.987 1.00 . A A . 4 LEU HA 1 1 5 1797 1 1 4 LEU HB2 H -13.011 0.377 -2.771 1.00 . A A . 4 LEU HB2 1 1 5 1798 1 1 4 LEU HB3 H -13.051 2.038 -2.172 1.00 . A A . 4 LEU HB3 1 1 5 1799 1 1 4 LEU HD11 H -16.324 0.446 -3.350 1.00 . A A . 4 LEU HD11 1 1 5 1800 1 1 4 LEU HD12 H -16.394 -0.565 -1.910 1.00 . A A . 4 LEU HD12 1 1 5 1801 1 1 4 LEU HD13 H -15.104 -0.801 -3.085 1.00 . A A . 4 LEU HD13 1 1 5 1802 1 1 4 LEU HD21 H -14.524 -0.708 -0.522 1.00 . A A . 4 LEU HD21 1 1 5 1803 1 1 4 LEU HD22 H -15.083 0.758 0.278 1.00 . A A . 4 LEU HD22 1 1 5 1804 1 1 4 LEU HD23 H -13.416 0.646 -0.296 1.00 . A A . 4 LEU HD23 1 1 5 1805 1 1 4 LEU HG H -15.436 1.847 -1.695 1.00 . A A . 4 LEU HG 1 1 5 1806 1 1 4 LEU N N -14.216 0.641 -4.974 1.00 . A A . 4 LEU N 1 1 5 1807 1 1 4 LEU O O -12.249 2.310 -5.562 1.00 . A A . 4 LEU O 1 1 5 1808 1 1 5 LEU C C -10.386 4.008 -4.333 1.00 . A A . 5 LEU C 1 1 5 1809 1 1 5 LEU CA C -11.716 4.738 -4.435 1.00 . A A . 5 LEU CA 1 1 5 1810 1 1 5 LEU CB C -11.696 6.007 -3.581 1.00 . A A . 5 LEU CB 1 1 5 1811 1 1 5 LEU CD1 C -13.391 7.265 -4.934 1.00 . A A . 5 LEU CD1 1 1 5 1812 1 1 5 LEU CD2 C -11.619 8.503 -3.686 1.00 . A A . 5 LEU CD2 1 1 5 1813 1 1 5 LEU CG C -11.927 7.231 -4.477 1.00 . A A . 5 LEU CG 1 1 5 1814 1 1 5 LEU H H -13.324 4.060 -3.221 1.00 . A A . 5 LEU H 1 1 5 1815 1 1 5 LEU HA H -11.896 5.002 -5.467 1.00 . A A . 5 LEU HA 1 1 5 1816 1 1 5 LEU HB2 H -12.478 5.953 -2.839 1.00 . A A . 5 LEU HB2 1 1 5 1817 1 1 5 LEU HB3 H -10.737 6.096 -3.089 1.00 . A A . 5 LEU HB3 1 1 5 1818 1 1 5 LEU HD11 H -13.934 7.969 -4.327 1.00 . A A . 5 LEU HD11 1 1 5 1819 1 1 5 LEU HD12 H -13.828 6.284 -4.822 1.00 . A A . 5 LEU HD12 1 1 5 1820 1 1 5 LEU HD13 H -13.444 7.567 -5.970 1.00 . A A . 5 LEU HD13 1 1 5 1821 1 1 5 LEU HD21 H -12.453 8.732 -3.043 1.00 . A A . 5 LEU HD21 1 1 5 1822 1 1 5 LEU HD22 H -11.461 9.325 -4.370 1.00 . A A . 5 LEU HD22 1 1 5 1823 1 1 5 LEU HD23 H -10.732 8.356 -3.090 1.00 . A A . 5 LEU HD23 1 1 5 1824 1 1 5 LEU HG H -11.280 7.174 -5.342 1.00 . A A . 5 LEU HG 1 1 5 1825 1 1 5 LEU N N -12.762 3.829 -3.990 1.00 . A A . 5 LEU N 1 1 5 1826 1 1 5 LEU O O -10.184 3.218 -3.406 1.00 . A A . 5 LEU O 1 1 5 1827 1 1 6 ALA C C -8.487 2.047 -5.277 1.00 . A A . 6 ALA C 1 1 5 1828 1 1 6 ALA CA C -8.214 3.546 -5.300 1.00 . A A . 6 ALA CA 1 1 5 1829 1 1 6 ALA CB C -7.373 3.954 -4.082 1.00 . A A . 6 ALA CB 1 1 5 1830 1 1 6 ALA H H -9.720 4.859 -6.022 1.00 . A A . 6 ALA H 1 1 5 1831 1 1 6 ALA HA H -7.678 3.797 -6.205 1.00 . A A . 6 ALA HA 1 1 5 1832 1 1 6 ALA HB1 H -6.784 4.827 -4.326 1.00 . A A . 6 ALA HB1 1 1 5 1833 1 1 6 ALA HB2 H -6.714 3.143 -3.811 1.00 . A A . 6 ALA HB2 1 1 5 1834 1 1 6 ALA HB3 H -8.025 4.181 -3.252 1.00 . A A . 6 ALA HB3 1 1 5 1835 1 1 6 ALA N N -9.498 4.239 -5.293 1.00 . A A . 6 ALA N 1 1 5 1836 1 1 6 ALA O O -8.730 1.449 -6.322 1.00 . A A . 6 ALA O 1 1 5 1837 1 1 7 LEU C C -8.370 -0.407 -2.507 1.00 . A A . 7 LEU C 1 1 5 1838 1 1 7 LEU CA C -8.789 0.042 -3.900 1.00 . A A . 7 LEU CA 1 1 5 1839 1 1 7 LEU CB C -8.061 -0.824 -4.946 1.00 . A A . 7 LEU CB 1 1 5 1840 1 1 7 LEU CD1 C -9.729 -2.665 -4.528 1.00 . A A . 7 LEU CD1 1 1 5 1841 1 1 7 LEU CD2 C -10.095 -1.058 -6.409 1.00 . A A . 7 LEU CD2 1 1 5 1842 1 1 7 LEU CG C -9.038 -1.817 -5.600 1.00 . A A . 7 LEU CG 1 1 5 1843 1 1 7 LEU H H -8.329 2.022 -3.285 1.00 . A A . 7 LEU H 1 1 5 1844 1 1 7 LEU HA H -9.853 -0.101 -4.002 1.00 . A A . 7 LEU HA 1 1 5 1845 1 1 7 LEU HB2 H -7.634 -0.193 -5.707 1.00 . A A . 7 LEU HB2 1 1 5 1846 1 1 7 LEU HB3 H -7.271 -1.377 -4.462 1.00 . A A . 7 LEU HB3 1 1 5 1847 1 1 7 LEU HD11 H -10.620 -2.164 -4.186 1.00 . A A . 7 LEU HD11 1 1 5 1848 1 1 7 LEU HD12 H -9.059 -2.817 -3.698 1.00 . A A . 7 LEU HD12 1 1 5 1849 1 1 7 LEU HD13 H -9.997 -3.623 -4.952 1.00 . A A . 7 LEU HD13 1 1 5 1850 1 1 7 LEU HD21 H -10.583 -0.330 -5.779 1.00 . A A . 7 LEU HD21 1 1 5 1851 1 1 7 LEU HD22 H -10.826 -1.757 -6.786 1.00 . A A . 7 LEU HD22 1 1 5 1852 1 1 7 LEU HD23 H -9.621 -0.552 -7.238 1.00 . A A . 7 LEU HD23 1 1 5 1853 1 1 7 LEU HG H -8.485 -2.472 -6.261 1.00 . A A . 7 LEU HG 1 1 5 1854 1 1 7 LEU N N -8.496 1.467 -4.079 1.00 . A A . 7 LEU N 1 1 5 1855 1 1 7 LEU O O -7.320 -0.006 -2.006 1.00 . A A . 7 LEU O 1 1 5 1856 1 1 8 ALA C C -7.438 -2.275 -0.528 1.00 . A A . 8 ALA C 1 1 5 1857 1 1 8 ALA CA C -8.866 -1.760 -0.556 1.00 . A A . 8 ALA CA 1 1 5 1858 1 1 8 ALA CB C -9.817 -2.898 -0.190 1.00 . A A . 8 ALA CB 1 1 5 1859 1 1 8 ALA H H -10.006 -1.550 -2.333 1.00 . A A . 8 ALA H 1 1 5 1860 1 1 8 ALA HA H -8.967 -0.965 0.166 1.00 . A A . 8 ALA HA 1 1 5 1861 1 1 8 ALA HB1 H -10.068 -3.454 -1.079 1.00 . A A . 8 ALA HB1 1 1 5 1862 1 1 8 ALA HB2 H -10.712 -2.491 0.247 1.00 . A A . 8 ALA HB2 1 1 5 1863 1 1 8 ALA HB3 H -9.336 -3.554 0.519 1.00 . A A . 8 ALA HB3 1 1 5 1864 1 1 8 ALA N N -9.183 -1.253 -1.886 1.00 . A A . 8 ALA N 1 1 5 1865 1 1 8 ALA O O -6.798 -2.310 0.517 1.00 . A A . 8 ALA O 1 1 5 1866 1 1 9 LEU C C -4.620 -2.047 -1.924 1.00 . A A . 9 LEU C 1 1 5 1867 1 1 9 LEU CA C -5.600 -3.188 -1.819 1.00 . A A . 9 LEU CA 1 1 5 1868 1 1 9 LEU CB C -5.458 -4.018 -3.077 1.00 . A A . 9 LEU CB 1 1 5 1869 1 1 9 LEU CD1 C -6.493 -5.767 -4.533 1.00 . A A . 9 LEU CD1 1 1 5 1870 1 1 9 LEU CD2 C -7.001 -5.719 -2.082 1.00 . A A . 9 LEU CD2 1 1 5 1871 1 1 9 LEU CG C -6.714 -4.861 -3.318 1.00 . A A . 9 LEU CG 1 1 5 1872 1 1 9 LEU H H -7.530 -2.624 -2.480 1.00 . A A . 9 LEU H 1 1 5 1873 1 1 9 LEU HA H -5.360 -3.790 -0.963 1.00 . A A . 9 LEU HA 1 1 5 1874 1 1 9 LEU HB2 H -5.306 -3.350 -3.909 1.00 . A A . 9 LEU HB2 1 1 5 1875 1 1 9 LEU HB3 H -4.600 -4.663 -2.973 1.00 . A A . 9 LEU HB3 1 1 5 1876 1 1 9 LEU HD11 H -5.688 -6.460 -4.330 1.00 . A A . 9 LEU HD11 1 1 5 1877 1 1 9 LEU HD12 H -6.242 -5.166 -5.394 1.00 . A A . 9 LEU HD12 1 1 5 1878 1 1 9 LEU HD13 H -7.399 -6.320 -4.737 1.00 . A A . 9 LEU HD13 1 1 5 1879 1 1 9 LEU HD21 H -7.336 -5.088 -1.270 1.00 . A A . 9 LEU HD21 1 1 5 1880 1 1 9 LEU HD22 H -6.099 -6.235 -1.787 1.00 . A A . 9 LEU HD22 1 1 5 1881 1 1 9 LEU HD23 H -7.769 -6.438 -2.316 1.00 . A A . 9 LEU HD23 1 1 5 1882 1 1 9 LEU HG H -7.551 -4.209 -3.509 1.00 . A A . 9 LEU HG 1 1 5 1883 1 1 9 LEU N N -6.958 -2.677 -1.690 1.00 . A A . 9 LEU N 1 1 5 1884 1 1 9 LEU O O -3.622 -2.001 -1.208 1.00 . A A . 9 LEU O 1 1 5 1885 1 1 10 HIS C C -3.482 0.458 -1.748 1.00 . A A . 10 HIS C 1 1 5 1886 1 1 10 HIS CA C -4.081 0.042 -3.067 1.00 . A A . 10 HIS CA 1 1 5 1887 1 1 10 HIS CB C -4.923 1.193 -3.597 1.00 . A A . 10 HIS CB 1 1 5 1888 1 1 10 HIS CD2 C -5.166 0.216 -6.022 1.00 . A A . 10 HIS CD2 1 1 5 1889 1 1 10 HIS CE1 C -4.715 2.027 -7.126 1.00 . A A . 10 HIS CE1 1 1 5 1890 1 1 10 HIS CG C -4.913 1.198 -5.097 1.00 . A A . 10 HIS CG 1 1 5 1891 1 1 10 HIS H H -5.737 -1.257 -3.367 1.00 . A A . 10 HIS H 1 1 5 1892 1 1 10 HIS HA H -3.299 -0.196 -3.768 1.00 . A A . 10 HIS HA 1 1 5 1893 1 1 10 HIS HB2 H -5.933 1.084 -3.245 1.00 . A A . 10 HIS HB2 1 1 5 1894 1 1 10 HIS HB3 H -4.517 2.121 -3.229 1.00 . A A . 10 HIS HB3 1 1 5 1895 1 1 10 HIS HD1 H -4.411 3.226 -5.447 1.00 . A A . 10 HIS HD1 1 1 5 1896 1 1 10 HIS HD2 H -5.421 -0.807 -5.789 1.00 . A A . 10 HIS HD2 1 1 5 1897 1 1 10 HIS HE1 H -4.539 2.729 -7.929 1.00 . A A . 10 HIS HE1 1 1 5 1898 1 1 10 HIS HE2 H -5.170 0.270 -8.161 1.00 . A A . 10 HIS HE2 1 1 5 1899 1 1 10 HIS N N -4.924 -1.132 -2.838 1.00 . A A . 10 HIS N 1 1 5 1900 1 1 10 HIS ND1 N -4.629 2.340 -5.820 1.00 . A A . 10 HIS ND1 1 1 5 1901 1 1 10 HIS NE2 N -5.043 0.742 -7.306 1.00 . A A . 10 HIS NE2 1 1 5 1902 1 1 10 HIS O O -2.304 0.788 -1.643 1.00 . A A . 10 HIS O 1 1 5 1903 1 1 11 HIS C C -2.565 0.214 0.910 1.00 . A A . 11 HIS C 1 1 5 1904 1 1 11 HIS CA C -3.974 0.686 0.621 1.00 . A A . 11 HIS CA 1 1 5 1905 1 1 11 HIS CB C -4.936 -0.092 1.510 1.00 . A A . 11 HIS CB 1 1 5 1906 1 1 11 HIS CD2 C -7.235 1.176 1.346 1.00 . A A . 11 HIS CD2 1 1 5 1907 1 1 11 HIS CE1 C -7.180 2.169 3.270 1.00 . A A . 11 HIS CE1 1 1 5 1908 1 1 11 HIS CG C -6.058 0.806 1.952 1.00 . A A . 11 HIS CG 1 1 5 1909 1 1 11 HIS H H -5.241 0.077 -0.936 1.00 . A A . 11 HIS H 1 1 5 1910 1 1 11 HIS HA H -4.065 1.739 0.812 1.00 . A A . 11 HIS HA 1 1 5 1911 1 1 11 HIS HB2 H -5.331 -0.930 0.938 1.00 . A A . 11 HIS HB2 1 1 5 1912 1 1 11 HIS HB3 H -4.407 -0.466 2.370 1.00 . A A . 11 HIS HB3 1 1 5 1913 1 1 11 HIS HD1 H -5.321 1.419 3.850 1.00 . A A . 11 HIS HD1 1 1 5 1914 1 1 11 HIS HD2 H -7.556 0.860 0.367 1.00 . A A . 11 HIS HD2 1 1 5 1915 1 1 11 HIS HE1 H -7.445 2.781 4.122 1.00 . A A . 11 HIS HE1 1 1 5 1916 1 1 11 HIS HE2 H -8.810 2.457 2.005 1.00 . A A . 11 HIS HE2 1 1 5 1917 1 1 11 HIS N N -4.332 0.383 -0.748 1.00 . A A . 11 HIS N 1 1 5 1918 1 1 11 HIS ND1 N -6.045 1.453 3.178 1.00 . A A . 11 HIS ND1 1 1 5 1919 1 1 11 HIS NE2 N -7.942 2.034 2.182 1.00 . A A . 11 HIS NE2 1 1 5 1920 1 1 11 HIS O O -1.722 0.938 1.450 1.00 . A A . 11 HIS O 1 1 5 1921 1 1 12 LEU C C -0.119 -1.239 -0.400 1.00 . A A . 12 LEU C 1 1 5 1922 1 1 12 LEU CA C -1.036 -1.640 0.725 1.00 . A A . 12 LEU CA 1 1 5 1923 1 1 12 LEU CB C -1.178 -3.166 0.765 1.00 . A A . 12 LEU CB 1 1 5 1924 1 1 12 LEU CD1 C -0.654 -3.170 3.230 1.00 . A A . 12 LEU CD1 1 1 5 1925 1 1 12 LEU CD2 C -3.028 -3.023 2.457 1.00 . A A . 12 LEU CD2 1 1 5 1926 1 1 12 LEU CG C -1.650 -3.620 2.155 1.00 . A A . 12 LEU CG 1 1 5 1927 1 1 12 LEU H H -3.057 -1.514 0.080 1.00 . A A . 12 LEU H 1 1 5 1928 1 1 12 LEU HA H -0.620 -1.291 1.655 1.00 . A A . 12 LEU HA 1 1 5 1929 1 1 12 LEU HB2 H -1.899 -3.475 0.023 1.00 . A A . 12 LEU HB2 1 1 5 1930 1 1 12 LEU HB3 H -0.223 -3.619 0.544 1.00 . A A . 12 LEU HB3 1 1 5 1931 1 1 12 LEU HD11 H -0.861 -2.150 3.511 1.00 . A A . 12 LEU HD11 1 1 5 1932 1 1 12 LEU HD12 H 0.354 -3.244 2.842 1.00 . A A . 12 LEU HD12 1 1 5 1933 1 1 12 LEU HD13 H -0.753 -3.804 4.095 1.00 . A A . 12 LEU HD13 1 1 5 1934 1 1 12 LEU HD21 H -3.563 -3.678 3.128 1.00 . A A . 12 LEU HD21 1 1 5 1935 1 1 12 LEU HD22 H -3.587 -2.920 1.538 1.00 . A A . 12 LEU HD22 1 1 5 1936 1 1 12 LEU HD23 H -2.910 -2.052 2.919 1.00 . A A . 12 LEU HD23 1 1 5 1937 1 1 12 LEU HG H -1.719 -4.697 2.169 1.00 . A A . 12 LEU HG 1 1 5 1938 1 1 12 LEU N N -2.332 -1.017 0.525 1.00 . A A . 12 LEU N 1 1 5 1939 1 1 12 LEU O O 1.025 -0.843 -0.174 1.00 . A A . 12 LEU O 1 1 5 1940 1 1 13 ALA C C 0.732 0.449 -2.525 1.00 . A A . 13 ALA C 1 1 5 1941 1 1 13 ALA CA C 0.137 -0.924 -2.780 1.00 . A A . 13 ALA CA 1 1 5 1942 1 1 13 ALA CB C -0.748 -0.879 -4.028 1.00 . A A . 13 ALA CB 1 1 5 1943 1 1 13 ALA H H -1.568 -1.611 -1.709 1.00 . A A . 13 ALA H 1 1 5 1944 1 1 13 ALA HA H 0.932 -1.636 -2.931 1.00 . A A . 13 ALA HA 1 1 5 1945 1 1 13 ALA HB1 H -0.127 -0.927 -4.910 1.00 . A A . 13 ALA HB1 1 1 5 1946 1 1 13 ALA HB2 H -1.311 0.043 -4.038 1.00 . A A . 13 ALA HB2 1 1 5 1947 1 1 13 ALA HB3 H -1.427 -1.718 -4.022 1.00 . A A . 13 ALA HB3 1 1 5 1948 1 1 13 ALA N N -0.640 -1.313 -1.610 1.00 . A A . 13 ALA N 1 1 5 1949 1 1 13 ALA O O 1.805 0.790 -3.021 1.00 . A A . 13 ALA O 1 1 5 1950 1 1 14 HIS C C 1.631 2.456 -0.434 1.00 . A A . 14 HIS C 1 1 5 1951 1 1 14 HIS CA C 0.430 2.553 -1.346 1.00 . A A . 14 HIS CA 1 1 5 1952 1 1 14 HIS CB C -0.727 3.244 -0.642 1.00 . A A . 14 HIS CB 1 1 5 1953 1 1 14 HIS CD2 C -0.361 4.454 1.651 1.00 . A A . 14 HIS CD2 1 1 5 1954 1 1 14 HIS CE1 C 0.777 6.158 0.947 1.00 . A A . 14 HIS CE1 1 1 5 1955 1 1 14 HIS CG C -0.228 4.309 0.294 1.00 . A A . 14 HIS CG 1 1 5 1956 1 1 14 HIS H H -0.830 0.862 -1.364 1.00 . A A . 14 HIS H 1 1 5 1957 1 1 14 HIS HA H 0.697 3.107 -2.225 1.00 . A A . 14 HIS HA 1 1 5 1958 1 1 14 HIS HB2 H -1.357 3.683 -1.381 1.00 . A A . 14 HIS HB2 1 1 5 1959 1 1 14 HIS HB3 H -1.292 2.513 -0.085 1.00 . A A . 14 HIS HB3 1 1 5 1960 1 1 14 HIS HD1 H 0.777 5.593 -1.062 1.00 . A A . 14 HIS HD1 1 1 5 1961 1 1 14 HIS HD2 H -0.880 3.758 2.303 1.00 . A A . 14 HIS HD2 1 1 5 1962 1 1 14 HIS HE1 H 1.330 7.086 0.917 1.00 . A A . 14 HIS HE1 1 1 5 1963 1 1 14 HIS HE2 H 0.349 5.968 2.983 1.00 . A A . 14 HIS HE2 1 1 5 1964 1 1 14 HIS N N 0.014 1.216 -1.723 1.00 . A A . 14 HIS N 1 1 5 1965 1 1 14 HIS ND1 N 0.503 5.404 -0.137 1.00 . A A . 14 HIS ND1 1 1 5 1966 1 1 14 HIS NE2 N 0.275 5.622 2.064 1.00 . A A . 14 HIS NE2 1 1 5 1967 1 1 14 HIS O O 2.698 3.007 -0.712 1.00 . A A . 14 HIS O 1 1 5 1968 1 1 15 LEU C C 3.689 0.907 0.721 1.00 . A A . 15 LEU C 1 1 5 1969 1 1 15 LEU CA C 2.580 1.495 1.539 1.00 . A A . 15 LEU CA 1 1 5 1970 1 1 15 LEU CB C 2.205 0.486 2.627 1.00 . A A . 15 LEU CB 1 1 5 1971 1 1 15 LEU CD1 C 1.140 2.606 3.492 1.00 . A A . 15 LEU CD1 1 1 5 1972 1 1 15 LEU CD2 C 0.209 0.380 4.107 1.00 . A A . 15 LEU CD2 1 1 5 1973 1 1 15 LEU CG C 1.492 1.153 3.809 1.00 . A A . 15 LEU CG 1 1 5 1974 1 1 15 LEU H H 0.612 1.254 0.786 1.00 . A A . 15 LEU H 1 1 5 1975 1 1 15 LEU HA H 2.900 2.428 1.965 1.00 . A A . 15 LEU HA 1 1 5 1976 1 1 15 LEU HB2 H 1.557 -0.263 2.197 1.00 . A A . 15 LEU HB2 1 1 5 1977 1 1 15 LEU HB3 H 3.106 0.007 2.980 1.00 . A A . 15 LEU HB3 1 1 5 1978 1 1 15 LEU HD11 H 0.733 2.665 2.498 1.00 . A A . 15 LEU HD11 1 1 5 1979 1 1 15 LEU HD12 H 2.027 3.216 3.556 1.00 . A A . 15 LEU HD12 1 1 5 1980 1 1 15 LEU HD13 H 0.408 2.962 4.202 1.00 . A A . 15 LEU HD13 1 1 5 1981 1 1 15 LEU HD21 H 0.458 -0.608 4.466 1.00 . A A . 15 LEU HD21 1 1 5 1982 1 1 15 LEU HD22 H -0.380 0.299 3.206 1.00 . A A . 15 LEU HD22 1 1 5 1983 1 1 15 LEU HD23 H -0.357 0.904 4.862 1.00 . A A . 15 LEU HD23 1 1 5 1984 1 1 15 LEU HG H 2.136 1.123 4.670 1.00 . A A . 15 LEU HG 1 1 5 1985 1 1 15 LEU N N 1.469 1.705 0.633 1.00 . A A . 15 LEU N 1 1 5 1986 1 1 15 LEU O O 4.869 1.185 0.915 1.00 . A A . 15 LEU O 1 1 5 1987 1 1 16 ALA C C 4.860 0.437 -2.012 1.00 . A A . 16 ALA C 1 1 5 1988 1 1 16 ALA CA C 4.179 -0.578 -1.112 1.00 . A A . 16 ALA CA 1 1 5 1989 1 1 16 ALA CB C 3.432 -1.603 -1.969 1.00 . A A . 16 ALA CB 1 1 5 1990 1 1 16 ALA H H 2.281 -0.055 -0.292 1.00 . A A . 16 ALA H 1 1 5 1991 1 1 16 ALA HA H 4.923 -1.086 -0.528 1.00 . A A . 16 ALA HA 1 1 5 1992 1 1 16 ALA HB1 H 3.042 -1.118 -2.850 1.00 . A A . 16 ALA HB1 1 1 5 1993 1 1 16 ALA HB2 H 2.621 -2.025 -1.398 1.00 . A A . 16 ALA HB2 1 1 5 1994 1 1 16 ALA HB3 H 4.113 -2.387 -2.261 1.00 . A A . 16 ALA HB3 1 1 5 1995 1 1 16 ALA N N 3.261 0.091 -0.212 1.00 . A A . 16 ALA N 1 1 5 1996 1 1 16 ALA O O 6.004 0.250 -2.423 1.00 . A A . 16 ALA O 1 1 5 1997 1 1 17 LEU C C 5.919 3.146 -2.581 1.00 . A A . 17 LEU C 1 1 5 1998 1 1 17 LEU CA C 4.662 2.558 -3.175 1.00 . A A . 17 LEU CA 1 1 5 1999 1 1 17 LEU CB C 3.590 3.647 -3.409 1.00 . A A . 17 LEU CB 1 1 5 2000 1 1 17 LEU CD1 C 3.643 5.969 -4.351 1.00 . A A . 17 LEU CD1 1 1 5 2001 1 1 17 LEU CD2 C 3.719 5.647 -1.882 1.00 . A A . 17 LEU CD2 1 1 5 2002 1 1 17 LEU CG C 4.162 5.069 -3.232 1.00 . A A . 17 LEU CG 1 1 5 2003 1 1 17 LEU H H 3.232 1.585 -1.952 1.00 . A A . 17 LEU H 1 1 5 2004 1 1 17 LEU HA H 4.925 2.121 -4.119 1.00 . A A . 17 LEU HA 1 1 5 2005 1 1 17 LEU HB2 H 3.210 3.545 -4.410 1.00 . A A . 17 LEU HB2 1 1 5 2006 1 1 17 LEU HB3 H 2.779 3.503 -2.716 1.00 . A A . 17 LEU HB3 1 1 5 2007 1 1 17 LEU HD11 H 3.928 5.555 -5.306 1.00 . A A . 17 LEU HD11 1 1 5 2008 1 1 17 LEU HD12 H 4.071 6.954 -4.245 1.00 . A A . 17 LEU HD12 1 1 5 2009 1 1 17 LEU HD13 H 2.567 6.034 -4.291 1.00 . A A . 17 LEU HD13 1 1 5 2010 1 1 17 LEU HD21 H 2.654 5.807 -1.893 1.00 . A A . 17 LEU HD21 1 1 5 2011 1 1 17 LEU HD22 H 4.223 6.587 -1.710 1.00 . A A . 17 LEU HD22 1 1 5 2012 1 1 17 LEU HD23 H 3.970 4.959 -1.091 1.00 . A A . 17 LEU HD23 1 1 5 2013 1 1 17 LEU HG H 5.240 5.043 -3.280 1.00 . A A . 17 LEU HG 1 1 5 2014 1 1 17 LEU N N 4.140 1.506 -2.313 1.00 . A A . 17 LEU N 1 1 5 2015 1 1 17 LEU O O 6.948 3.230 -3.251 1.00 . A A . 17 LEU O 1 1 5 2016 1 1 18 HIS C C 7.996 2.994 -0.411 1.00 . A A . 18 HIS C 1 1 5 2017 1 1 18 HIS CA C 7.044 4.110 -0.713 1.00 . A A . 18 HIS CA 1 1 5 2018 1 1 18 HIS CB C 6.697 4.887 0.535 1.00 . A A . 18 HIS CB 1 1 5 2019 1 1 18 HIS CD2 C 4.998 3.553 1.973 1.00 . A A . 18 HIS CD2 1 1 5 2020 1 1 18 HIS CE1 C 6.383 2.692 3.401 1.00 . A A . 18 HIS CE1 1 1 5 2021 1 1 18 HIS CG C 6.246 3.978 1.625 1.00 . A A . 18 HIS CG 1 1 5 2022 1 1 18 HIS H H 5.011 3.448 -0.817 1.00 . A A . 18 HIS H 1 1 5 2023 1 1 18 HIS HA H 7.512 4.776 -1.420 1.00 . A A . 18 HIS HA 1 1 5 2024 1 1 18 HIS HB2 H 7.557 5.442 0.863 1.00 . A A . 18 HIS HB2 1 1 5 2025 1 1 18 HIS HB3 H 5.906 5.556 0.293 1.00 . A A . 18 HIS HB3 1 1 5 2026 1 1 18 HIS HD1 H 8.098 3.545 2.568 1.00 . A A . 18 HIS HD1 1 1 5 2027 1 1 18 HIS HD2 H 4.088 3.807 1.440 1.00 . A A . 18 HIS HD2 1 1 5 2028 1 1 18 HIS HE1 H 6.798 2.131 4.227 1.00 . A A . 18 HIS HE1 1 1 5 2029 1 1 18 HIS HE2 H 4.340 2.302 3.578 1.00 . A A . 18 HIS HE2 1 1 5 2030 1 1 18 HIS N N 5.855 3.546 -1.328 1.00 . A A . 18 HIS N 1 1 5 2031 1 1 18 HIS ND1 N 7.119 3.421 2.543 1.00 . A A . 18 HIS ND1 1 1 5 2032 1 1 18 HIS NE2 N 5.080 2.736 3.100 1.00 . A A . 18 HIS NE2 1 1 5 2033 1 1 18 HIS O O 9.201 3.094 -0.655 1.00 . A A . 18 HIS O 1 1 5 2034 1 1 19 LEU C C 9.065 0.469 -0.884 1.00 . A A . 19 LEU C 1 1 5 2035 1 1 19 LEU CA C 8.231 0.727 0.347 1.00 . A A . 19 LEU CA 1 1 5 2036 1 1 19 LEU CB C 7.342 -0.490 0.597 1.00 . A A . 19 LEU CB 1 1 5 2037 1 1 19 LEU CD1 C 9.184 -1.229 2.128 1.00 . A A . 19 LEU CD1 1 1 5 2038 1 1 19 LEU CD2 C 7.082 -0.251 3.065 1.00 . A A . 19 LEU CD2 1 1 5 2039 1 1 19 LEU CG C 7.666 -1.116 1.948 1.00 . A A . 19 LEU CG 1 1 5 2040 1 1 19 LEU H H 6.460 1.892 0.207 1.00 . A A . 19 LEU H 1 1 5 2041 1 1 19 LEU HA H 8.871 0.905 1.196 1.00 . A A . 19 LEU HA 1 1 5 2042 1 1 19 LEU HB2 H 6.312 -0.188 0.583 1.00 . A A . 19 LEU HB2 1 1 5 2043 1 1 19 LEU HB3 H 7.508 -1.222 -0.181 1.00 . A A . 19 LEU HB3 1 1 5 2044 1 1 19 LEU HD11 H 9.544 -0.380 2.690 1.00 . A A . 19 LEU HD11 1 1 5 2045 1 1 19 LEU HD12 H 9.664 -1.251 1.161 1.00 . A A . 19 LEU HD12 1 1 5 2046 1 1 19 LEU HD13 H 9.413 -2.136 2.663 1.00 . A A . 19 LEU HD13 1 1 5 2047 1 1 19 LEU HD21 H 7.016 -0.830 3.973 1.00 . A A . 19 LEU HD21 1 1 5 2048 1 1 19 LEU HD22 H 6.096 0.091 2.781 1.00 . A A . 19 LEU HD22 1 1 5 2049 1 1 19 LEU HD23 H 7.725 0.602 3.227 1.00 . A A . 19 LEU HD23 1 1 5 2050 1 1 19 LEU HG H 7.230 -2.098 1.988 1.00 . A A . 19 LEU HG 1 1 5 2051 1 1 19 LEU N N 7.434 1.905 0.073 1.00 . A A . 19 LEU N 1 1 5 2052 1 1 19 LEU O O 10.202 0.003 -0.812 1.00 . A A . 19 LEU O 1 1 5 2053 1 1 20 ALA C C 10.376 1.512 -3.316 1.00 . A A . 20 ALA C 1 1 5 2054 1 1 20 ALA CA C 9.134 0.652 -3.301 1.00 . A A . 20 ALA CA 1 1 5 2055 1 1 20 ALA CB C 8.212 1.069 -4.450 1.00 . A A . 20 ALA CB 1 1 5 2056 1 1 20 ALA H H 7.556 1.196 -1.965 1.00 . A A . 20 ALA H 1 1 5 2057 1 1 20 ALA HA H 9.416 -0.376 -3.428 1.00 . A A . 20 ALA HA 1 1 5 2058 1 1 20 ALA HB1 H 8.427 2.090 -4.732 1.00 . A A . 20 ALA HB1 1 1 5 2059 1 1 20 ALA HB2 H 7.182 0.991 -4.139 1.00 . A A . 20 ALA HB2 1 1 5 2060 1 1 20 ALA HB3 H 8.382 0.420 -5.295 1.00 . A A . 20 ALA HB3 1 1 5 2061 1 1 20 ALA N N 8.467 0.809 -2.012 1.00 . A A . 20 ALA N 1 1 5 2062 1 1 20 ALA O O 11.494 1.017 -3.461 1.00 . A A . 20 ALA O 1 1 5 2063 1 1 21 LEU C C 12.338 3.214 -2.152 1.00 . A A . 21 LEU C 1 1 5 2064 1 1 21 LEU CA C 11.277 3.744 -3.104 1.00 . A A . 21 LEU CA 1 1 5 2065 1 1 21 LEU CB C 10.792 5.122 -2.636 1.00 . A A . 21 LEU CB 1 1 5 2066 1 1 21 LEU CD1 C 9.226 5.236 -4.587 1.00 . A A . 21 LEU CD1 1 1 5 2067 1 1 21 LEU CD2 C 9.814 7.313 -3.332 1.00 . A A . 21 LEU CD2 1 1 5 2068 1 1 21 LEU CG C 10.340 5.963 -3.836 1.00 . A A . 21 LEU CG 1 1 5 2069 1 1 21 LEU H H 9.249 3.123 -3.016 1.00 . A A . 21 LEU H 1 1 5 2070 1 1 21 LEU HA H 11.702 3.829 -4.090 1.00 . A A . 21 LEU HA 1 1 5 2071 1 1 21 LEU HB2 H 9.962 5.000 -1.956 1.00 . A A . 21 LEU HB2 1 1 5 2072 1 1 21 LEU HB3 H 11.599 5.632 -2.129 1.00 . A A . 21 LEU HB3 1 1 5 2073 1 1 21 LEU HD11 H 8.796 5.899 -5.321 1.00 . A A . 21 LEU HD11 1 1 5 2074 1 1 21 LEU HD12 H 8.460 4.931 -3.889 1.00 . A A . 21 LEU HD12 1 1 5 2075 1 1 21 LEU HD13 H 9.633 4.365 -5.082 1.00 . A A . 21 LEU HD13 1 1 5 2076 1 1 21 LEU HD21 H 8.977 7.148 -2.668 1.00 . A A . 21 LEU HD21 1 1 5 2077 1 1 21 LEU HD22 H 9.492 7.914 -4.170 1.00 . A A . 21 LEU HD22 1 1 5 2078 1 1 21 LEU HD23 H 10.596 7.830 -2.799 1.00 . A A . 21 LEU HD23 1 1 5 2079 1 1 21 LEU HG H 11.174 6.126 -4.503 1.00 . A A . 21 LEU HG 1 1 5 2080 1 1 21 LEU N N 10.168 2.804 -3.140 1.00 . A A . 21 LEU N 1 1 5 2081 1 1 21 LEU O O 13.529 3.189 -2.469 1.00 . A A . 21 LEU O 1 1 5 2082 1 1 22 ALA C C 13.445 0.957 -0.564 1.00 . A A . 22 ALA C 1 1 5 2083 1 1 22 ALA CA C 12.783 2.201 0.010 1.00 . A A . 22 ALA CA 1 1 5 2084 1 1 22 ALA CB C 12.010 1.842 1.287 1.00 . A A . 22 ALA CB 1 1 5 2085 1 1 22 ALA H H 10.917 2.801 -0.815 1.00 . A A . 22 ALA H 1 1 5 2086 1 1 22 ALA HA H 13.543 2.925 0.246 1.00 . A A . 22 ALA HA 1 1 5 2087 1 1 22 ALA HB1 H 11.503 0.899 1.148 1.00 . A A . 22 ALA HB1 1 1 5 2088 1 1 22 ALA HB2 H 11.285 2.613 1.498 1.00 . A A . 22 ALA HB2 1 1 5 2089 1 1 22 ALA HB3 H 12.700 1.762 2.112 1.00 . A A . 22 ALA HB3 1 1 5 2090 1 1 22 ALA N N 11.882 2.766 -0.990 1.00 . A A . 22 ALA N 1 1 5 2091 1 1 22 ALA O O 14.645 0.733 -0.384 1.00 . A A . 22 ALA O 1 1 5 2092 1 1 23 LEU C C 14.225 -0.686 -2.910 1.00 . A A . 23 LEU C 1 1 5 2093 1 1 23 LEU CA C 13.149 -1.050 -1.902 1.00 . A A . 23 LEU CA 1 1 5 2094 1 1 23 LEU CB C 12.006 -1.782 -2.617 1.00 . A A . 23 LEU CB 1 1 5 2095 1 1 23 LEU CD1 C 10.868 -3.980 -2.964 1.00 . A A . 23 LEU CD1 1 1 5 2096 1 1 23 LEU CD2 C 13.348 -3.907 -2.711 1.00 . A A . 23 LEU CD2 1 1 5 2097 1 1 23 LEU CG C 12.028 -3.273 -2.261 1.00 . A A . 23 LEU CG 1 1 5 2098 1 1 23 LEU H H 11.709 0.413 -1.383 1.00 . A A . 23 LEU H 1 1 5 2099 1 1 23 LEU HA H 13.570 -1.694 -1.151 1.00 . A A . 23 LEU HA 1 1 5 2100 1 1 23 LEU HB2 H 11.061 -1.357 -2.314 1.00 . A A . 23 LEU HB2 1 1 5 2101 1 1 23 LEU HB3 H 12.119 -1.668 -3.686 1.00 . A A . 23 LEU HB3 1 1 5 2102 1 1 23 LEU HD11 H 11.054 -5.042 -2.981 1.00 . A A . 23 LEU HD11 1 1 5 2103 1 1 23 LEU HD12 H 10.779 -3.614 -3.978 1.00 . A A . 23 LEU HD12 1 1 5 2104 1 1 23 LEU HD13 H 9.950 -3.784 -2.429 1.00 . A A . 23 LEU HD13 1 1 5 2105 1 1 23 LEU HD21 H 14.121 -3.671 -1.996 1.00 . A A . 23 LEU HD21 1 1 5 2106 1 1 23 LEU HD22 H 13.628 -3.521 -3.679 1.00 . A A . 23 LEU HD22 1 1 5 2107 1 1 23 LEU HD23 H 13.228 -4.981 -2.772 1.00 . A A . 23 LEU HD23 1 1 5 2108 1 1 23 LEU HG H 11.919 -3.390 -1.193 1.00 . A A . 23 LEU HG 1 1 5 2109 1 1 23 LEU N N 12.652 0.165 -1.272 1.00 . A A . 23 LEU N 1 1 5 2110 1 1 23 LEU O O 15.291 -1.301 -2.956 1.00 . A A . 23 LEU O 1 1 5 2111 1 1 24 LYS C C 16.182 1.174 -4.050 1.00 . A A . 24 LYS C 1 1 5 2112 1 1 24 LYS CA C 14.865 0.800 -4.717 1.00 . A A . 24 LYS CA 1 1 5 2113 1 1 24 LYS CB C 14.273 2.017 -5.441 1.00 . A A . 24 LYS CB 1 1 5 2114 1 1 24 LYS CD C 15.506 3.711 -6.825 1.00 . A A . 24 LYS CD 1 1 5 2115 1 1 24 LYS CE C 16.866 3.845 -6.126 1.00 . A A . 24 LYS CE 1 1 5 2116 1 1 24 LYS CG C 15.018 2.258 -6.760 1.00 . A A . 24 LYS CG 1 1 5 2117 1 1 24 LYS H H 13.062 0.772 -3.605 1.00 . A A . 24 LYS H 1 1 5 2118 1 1 24 LYS HA H 15.040 0.014 -5.430 1.00 . A A . 24 LYS HA 1 1 5 2119 1 1 24 LYS HB2 H 13.228 1.833 -5.649 1.00 . A A . 24 LYS HB2 1 1 5 2120 1 1 24 LYS HB3 H 14.365 2.887 -4.811 1.00 . A A . 24 LYS HB3 1 1 5 2121 1 1 24 LYS HD2 H 15.602 4.008 -7.860 1.00 . A A . 24 LYS HD2 1 1 5 2122 1 1 24 LYS HD3 H 14.787 4.356 -6.337 1.00 . A A . 24 LYS HD3 1 1 5 2123 1 1 24 LYS HE2 H 17.324 4.782 -6.407 1.00 . A A . 24 LYS HE2 1 1 5 2124 1 1 24 LYS HE3 H 16.727 3.826 -5.057 1.00 . A A . 24 LYS HE3 1 1 5 2125 1 1 24 LYS HG2 H 15.859 1.585 -6.827 1.00 . A A . 24 LYS HG2 1 1 5 2126 1 1 24 LYS HG3 H 14.348 2.073 -7.587 1.00 . A A . 24 LYS HG3 1 1 5 2127 1 1 24 LYS HZ1 H 17.674 1.942 -5.843 1.00 . A A . 24 LYS HZ1 1 1 5 2128 1 1 24 LYS HZ2 H 18.738 3.049 -6.572 1.00 . A A . 24 LYS HZ2 1 1 5 2129 1 1 24 LYS HZ3 H 17.466 2.379 -7.476 1.00 . A A . 24 LYS HZ3 1 1 5 2130 1 1 24 LYS N N 13.930 0.328 -3.707 1.00 . A A . 24 LYS N 1 1 5 2131 1 1 24 LYS NZ N 17.751 2.720 -6.536 1.00 . A A . 24 LYS NZ 1 1 5 2132 1 1 24 LYS O O 17.259 1.001 -4.631 1.00 . A A . 24 LYS O 1 1 5 2133 1 1 25 LYS C C 16.771 2.879 -0.813 1.00 . A A . 25 LYS C 1 1 5 2134 1 1 25 LYS CA C 17.229 2.080 -2.023 1.00 . A A . 25 LYS CA 1 1 5 2135 1 1 25 LYS CB C 18.218 2.934 -2.833 1.00 . A A . 25 LYS CB 1 1 5 2136 1 1 25 LYS CD C 20.481 3.837 -2.231 1.00 . A A . 25 LYS CD 1 1 5 2137 1 1 25 LYS CE C 20.249 4.374 -0.812 1.00 . A A . 25 LYS CE 1 1 5 2138 1 1 25 LYS CG C 19.659 2.563 -2.445 1.00 . A A . 25 LYS CG 1 1 5 2139 1 1 25 LYS H H 15.174 1.773 -2.438 1.00 . A A . 25 LYS H 1 1 5 2140 1 1 25 LYS HA H 17.737 1.188 -1.676 1.00 . A A . 25 LYS HA 1 1 5 2141 1 1 25 LYS HB2 H 18.074 2.762 -3.886 1.00 . A A . 25 LYS HB2 1 1 5 2142 1 1 25 LYS HB3 H 18.049 3.979 -2.616 1.00 . A A . 25 LYS HB3 1 1 5 2143 1 1 25 LYS HD2 H 21.530 3.614 -2.372 1.00 . A A . 25 LYS HD2 1 1 5 2144 1 1 25 LYS HD3 H 20.176 4.581 -2.951 1.00 . A A . 25 LYS HD3 1 1 5 2145 1 1 25 LYS HE2 H 20.728 5.337 -0.704 1.00 . A A . 25 LYS HE2 1 1 5 2146 1 1 25 LYS HE3 H 19.189 4.483 -0.638 1.00 . A A . 25 LYS HE3 1 1 5 2147 1 1 25 LYS HG2 H 19.650 1.983 -1.533 1.00 . A A . 25 LYS HG2 1 1 5 2148 1 1 25 LYS HG3 H 20.106 1.980 -3.235 1.00 . A A . 25 LYS HG3 1 1 5 2149 1 1 25 LYS HZ1 H 20.978 2.497 -0.270 1.00 . A A . 25 LYS HZ1 1 1 5 2150 1 1 25 LYS HZ2 H 20.149 3.304 0.982 1.00 . A A . 25 LYS HZ2 1 1 5 2151 1 1 25 LYS HZ3 H 21.722 3.787 0.538 1.00 . A A . 25 LYS HZ3 1 1 5 2152 1 1 25 LYS N N 16.072 1.678 -2.823 1.00 . A A . 25 LYS N 1 1 5 2153 1 1 25 LYS NZ N 20.819 3.419 0.180 1.00 . A A . 25 LYS NZ 1 1 5 2154 1 1 25 LYS O O 15.906 3.751 -0.929 1.00 . A A . 25 LYS O 1 1 5 2155 1 1 26 ALA C C 18.269 3.919 2.160 1.00 . A A . 26 ALA C 1 1 5 2156 1 1 26 ALA CA C 17.017 3.299 1.559 1.00 . A A . 26 ALA CA 1 1 5 2157 1 1 26 ALA CB C 16.382 2.344 2.569 1.00 . A A . 26 ALA CB 1 1 5 2158 1 1 26 ALA H H 18.050 1.893 0.362 1.00 . A A . 26 ALA H 1 1 5 2159 1 1 26 ALA HA H 16.312 4.082 1.323 1.00 . A A . 26 ALA HA 1 1 5 2160 1 1 26 ALA HB1 H 16.491 2.751 3.563 1.00 . A A . 26 ALA HB1 1 1 5 2161 1 1 26 ALA HB2 H 16.876 1.382 2.520 1.00 . A A . 26 ALA HB2 1 1 5 2162 1 1 26 ALA HB3 H 15.336 2.225 2.343 1.00 . A A . 26 ALA HB3 1 1 5 2163 1 1 26 ALA N N 17.361 2.590 0.336 1.00 . A A . 26 ALA N 1 1 5 2164 1 1 26 ALA O O 19.311 3.298 2.075 1.00 . A A . 26 ALA O 1 1 5 2165 1 1 26 ALA OXT O 18.171 5.006 2.689 1.00 . A A . 26 ALA OXT 1 1 6 2166 1 1 1 LYS C C -18.538 12.163 2.726 1.00 . A A . 1 LYS C 1 1 6 2167 1 1 1 LYS CA C -19.643 13.113 2.283 1.00 . A A . 1 LYS CA 1 1 6 2168 1 1 1 LYS CB C -20.483 13.550 3.492 1.00 . A A . 1 LYS CB 1 1 6 2169 1 1 1 LYS CD C -22.173 12.783 5.200 1.00 . A A . 1 LYS CD 1 1 6 2170 1 1 1 LYS CE C -21.751 12.360 6.612 1.00 . A A . 1 LYS CE 1 1 6 2171 1 1 1 LYS CG C -21.119 12.327 4.178 1.00 . A A . 1 LYS CG 1 1 6 2172 1 1 1 LYS H1 H -20.118 11.506 1.049 1.00 . A A . 1 LYS H1 1 1 6 2173 1 1 1 LYS H2 H -20.552 13.016 0.417 1.00 . A A . 1 LYS H2 1 1 6 2174 1 1 1 LYS H3 H -21.465 12.322 1.668 1.00 . A A . 1 LYS H3 1 1 6 2175 1 1 1 LYS HA H -19.198 13.985 1.829 1.00 . A A . 1 LYS HA 1 1 6 2176 1 1 1 LYS HB2 H -19.844 14.064 4.194 1.00 . A A . 1 LYS HB2 1 1 6 2177 1 1 1 LYS HB3 H -21.260 14.220 3.159 1.00 . A A . 1 LYS HB3 1 1 6 2178 1 1 1 LYS HD2 H -22.274 13.860 5.162 1.00 . A A . 1 LYS HD2 1 1 6 2179 1 1 1 LYS HD3 H -23.124 12.327 4.961 1.00 . A A . 1 LYS HD3 1 1 6 2180 1 1 1 LYS HE2 H -22.571 12.529 7.298 1.00 . A A . 1 LYS HE2 1 1 6 2181 1 1 1 LYS HE3 H -21.495 11.310 6.617 1.00 . A A . 1 LYS HE3 1 1 6 2182 1 1 1 LYS HG2 H -21.593 11.701 3.436 1.00 . A A . 1 LYS HG2 1 1 6 2183 1 1 1 LYS HG3 H -20.352 11.760 4.687 1.00 . A A . 1 LYS HG3 1 1 6 2184 1 1 1 LYS HZ1 H -19.818 13.083 6.335 1.00 . A A . 1 LYS HZ1 1 1 6 2185 1 1 1 LYS HZ2 H -20.230 12.812 7.957 1.00 . A A . 1 LYS HZ2 1 1 6 2186 1 1 1 LYS HZ3 H -20.847 14.160 7.141 1.00 . A A . 1 LYS HZ3 1 1 6 2187 1 1 1 LYS N N -20.511 12.438 1.280 1.00 . A A . 1 LYS N 1 1 6 2188 1 1 1 LYS NZ N -20.576 13.163 7.041 1.00 . A A . 1 LYS NZ 1 1 6 2189 1 1 1 LYS O O -17.401 12.579 2.958 1.00 . A A . 1 LYS O 1 1 6 2190 1 1 2 LYS C C -18.161 8.587 2.502 1.00 . A A . 2 LYS C 1 1 6 2191 1 1 2 LYS CA C -17.905 9.882 3.260 1.00 . A A . 2 LYS CA 1 1 6 2192 1 1 2 LYS CB C -18.017 9.628 4.773 1.00 . A A . 2 LYS CB 1 1 6 2193 1 1 2 LYS CD C -15.774 8.566 5.175 1.00 . A A . 2 LYS CD 1 1 6 2194 1 1 2 LYS CE C -14.375 8.774 5.777 1.00 . A A . 2 LYS CE 1 1 6 2195 1 1 2 LYS CG C -16.644 9.805 5.432 1.00 . A A . 2 LYS CG 1 1 6 2196 1 1 2 LYS H H -19.798 10.613 2.646 1.00 . A A . 2 LYS H 1 1 6 2197 1 1 2 LYS HA H -16.910 10.238 3.033 1.00 . A A . 2 LYS HA 1 1 6 2198 1 1 2 LYS HB2 H -18.715 10.332 5.206 1.00 . A A . 2 LYS HB2 1 1 6 2199 1 1 2 LYS HB3 H -18.373 8.623 4.945 1.00 . A A . 2 LYS HB3 1 1 6 2200 1 1 2 LYS HD2 H -16.236 7.698 5.625 1.00 . A A . 2 LYS HD2 1 1 6 2201 1 1 2 LYS HD3 H -15.683 8.410 4.109 1.00 . A A . 2 LYS HD3 1 1 6 2202 1 1 2 LYS HE2 H -13.930 7.814 5.993 1.00 . A A . 2 LYS HE2 1 1 6 2203 1 1 2 LYS HE3 H -13.752 9.305 5.069 1.00 . A A . 2 LYS HE3 1 1 6 2204 1 1 2 LYS HG2 H -16.161 10.675 5.017 1.00 . A A . 2 LYS HG2 1 1 6 2205 1 1 2 LYS HG3 H -16.771 9.939 6.498 1.00 . A A . 2 LYS HG3 1 1 6 2206 1 1 2 LYS HZ1 H -14.719 10.552 6.814 1.00 . A A . 2 LYS HZ1 1 1 6 2207 1 1 2 LYS HZ2 H -13.567 9.545 7.539 1.00 . A A . 2 LYS HZ2 1 1 6 2208 1 1 2 LYS HZ3 H -15.216 9.161 7.645 1.00 . A A . 2 LYS HZ3 1 1 6 2209 1 1 2 LYS N N -18.876 10.888 2.845 1.00 . A A . 2 LYS N 1 1 6 2210 1 1 2 LYS NZ N -14.478 9.566 7.038 1.00 . A A . 2 LYS NZ 1 1 6 2211 1 1 2 LYS O O -19.303 8.138 2.413 1.00 . A A . 2 LYS O 1 1 6 2212 1 1 3 ALA C C -17.261 5.559 2.174 1.00 . A A . 3 ALA C 1 1 6 2213 1 1 3 ALA CA C -17.247 6.743 1.213 1.00 . A A . 3 ALA CA 1 1 6 2214 1 1 3 ALA CB C -16.086 6.586 0.227 1.00 . A A . 3 ALA CB 1 1 6 2215 1 1 3 ALA H H -16.215 8.389 2.061 1.00 . A A . 3 ALA H 1 1 6 2216 1 1 3 ALA HA H -18.178 6.762 0.664 1.00 . A A . 3 ALA HA 1 1 6 2217 1 1 3 ALA HB1 H -15.511 5.706 0.482 1.00 . A A . 3 ALA HB1 1 1 6 2218 1 1 3 ALA HB2 H -15.449 7.455 0.283 1.00 . A A . 3 ALA HB2 1 1 6 2219 1 1 3 ALA HB3 H -16.471 6.482 -0.775 1.00 . A A . 3 ALA HB3 1 1 6 2220 1 1 3 ALA N N -17.104 7.989 1.960 1.00 . A A . 3 ALA N 1 1 6 2221 1 1 3 ALA O O -16.628 5.603 3.231 1.00 . A A . 3 ALA O 1 1 6 2222 1 1 4 LEU C C -17.080 2.257 2.080 1.00 . A A . 4 LEU C 1 1 6 2223 1 1 4 LEU CA C -18.047 3.301 2.620 1.00 . A A . 4 LEU CA 1 1 6 2224 1 1 4 LEU CB C -19.477 2.740 2.622 1.00 . A A . 4 LEU CB 1 1 6 2225 1 1 4 LEU CD1 C -21.366 1.954 4.066 1.00 . A A . 4 LEU CD1 1 1 6 2226 1 1 4 LEU CD2 C -19.014 1.333 4.644 1.00 . A A . 4 LEU CD2 1 1 6 2227 1 1 4 LEU CG C -19.912 2.435 4.063 1.00 . A A . 4 LEU CG 1 1 6 2228 1 1 4 LEU H H -18.444 4.520 0.935 1.00 . A A . 4 LEU H 1 1 6 2229 1 1 4 LEU HA H -17.763 3.554 3.630 1.00 . A A . 4 LEU HA 1 1 6 2230 1 1 4 LEU HB2 H -20.147 3.467 2.186 1.00 . A A . 4 LEU HB2 1 1 6 2231 1 1 4 LEU HB3 H -19.510 1.829 2.040 1.00 . A A . 4 LEU HB3 1 1 6 2232 1 1 4 LEU HD11 H -21.441 1.044 3.490 1.00 . A A . 4 LEU HD11 1 1 6 2233 1 1 4 LEU HD12 H -22.003 2.711 3.629 1.00 . A A . 4 LEU HD12 1 1 6 2234 1 1 4 LEU HD13 H -21.679 1.758 5.082 1.00 . A A . 4 LEU HD13 1 1 6 2235 1 1 4 LEU HD21 H -18.020 1.719 4.805 1.00 . A A . 4 LEU HD21 1 1 6 2236 1 1 4 LEU HD22 H -18.970 0.503 3.956 1.00 . A A . 4 LEU HD22 1 1 6 2237 1 1 4 LEU HD23 H -19.421 0.993 5.586 1.00 . A A . 4 LEU HD23 1 1 6 2238 1 1 4 LEU HG H -19.828 3.331 4.663 1.00 . A A . 4 LEU HG 1 1 6 2239 1 1 4 LEU N N -17.971 4.500 1.794 1.00 . A A . 4 LEU N 1 1 6 2240 1 1 4 LEU O O -16.055 1.971 2.697 1.00 . A A . 4 LEU O 1 1 6 2241 1 1 5 LEU C C -15.767 1.377 -0.856 1.00 . A A . 5 LEU C 1 1 6 2242 1 1 5 LEU CA C -16.550 0.715 0.272 1.00 . A A . 5 LEU CA 1 1 6 2243 1 1 5 LEU CB C -17.397 -0.430 -0.295 1.00 . A A . 5 LEU CB 1 1 6 2244 1 1 5 LEU CD1 C -16.644 -2.813 -0.096 1.00 . A A . 5 LEU CD1 1 1 6 2245 1 1 5 LEU CD2 C -16.846 -1.763 -2.341 1.00 . A A . 5 LEU CD2 1 1 6 2246 1 1 5 LEU CG C -16.475 -1.512 -0.880 1.00 . A A . 5 LEU CG 1 1 6 2247 1 1 5 LEU H H -18.226 1.996 0.462 1.00 . A A . 5 LEU H 1 1 6 2248 1 1 5 LEU HA H -15.860 0.317 1.003 1.00 . A A . 5 LEU HA 1 1 6 2249 1 1 5 LEU HB2 H -18.000 -0.854 0.495 1.00 . A A . 5 LEU HB2 1 1 6 2250 1 1 5 LEU HB3 H -18.045 -0.046 -1.073 1.00 . A A . 5 LEU HB3 1 1 6 2251 1 1 5 LEU HD11 H -16.303 -3.645 -0.694 1.00 . A A . 5 LEU HD11 1 1 6 2252 1 1 5 LEU HD12 H -17.687 -2.949 0.148 1.00 . A A . 5 LEU HD12 1 1 6 2253 1 1 5 LEU HD13 H -16.065 -2.762 0.815 1.00 . A A . 5 LEU HD13 1 1 6 2254 1 1 5 LEU HD21 H -17.906 -1.940 -2.416 1.00 . A A . 5 LEU HD21 1 1 6 2255 1 1 5 LEU HD22 H -16.314 -2.628 -2.704 1.00 . A A . 5 LEU HD22 1 1 6 2256 1 1 5 LEU HD23 H -16.581 -0.903 -2.935 1.00 . A A . 5 LEU HD23 1 1 6 2257 1 1 5 LEU HG H -15.448 -1.181 -0.816 1.00 . A A . 5 LEU HG 1 1 6 2258 1 1 5 LEU N N -17.404 1.710 0.911 1.00 . A A . 5 LEU N 1 1 6 2259 1 1 5 LEU O O -16.352 1.799 -1.857 1.00 . A A . 5 LEU O 1 1 6 2260 1 1 6 ALA C C -12.343 1.306 -1.921 1.00 . A A . 6 ALA C 1 1 6 2261 1 1 6 ALA CA C -13.619 2.113 -1.709 1.00 . A A . 6 ALA CA 1 1 6 2262 1 1 6 ALA CB C -13.263 3.539 -1.277 1.00 . A A . 6 ALA CB 1 1 6 2263 1 1 6 ALA H H -14.042 1.138 0.127 1.00 . A A . 6 ALA H 1 1 6 2264 1 1 6 ALA HA H -14.166 2.156 -2.640 1.00 . A A . 6 ALA HA 1 1 6 2265 1 1 6 ALA HB1 H -13.985 3.887 -0.553 1.00 . A A . 6 ALA HB1 1 1 6 2266 1 1 6 ALA HB2 H -13.278 4.190 -2.139 1.00 . A A . 6 ALA HB2 1 1 6 2267 1 1 6 ALA HB3 H -12.276 3.549 -0.837 1.00 . A A . 6 ALA HB3 1 1 6 2268 1 1 6 ALA N N -14.457 1.483 -0.692 1.00 . A A . 6 ALA N 1 1 6 2269 1 1 6 ALA O O -12.328 0.089 -1.729 1.00 . A A . 6 ALA O 1 1 6 2270 1 1 7 LEU C C -9.341 1.023 -1.185 1.00 . A A . 7 LEU C 1 1 6 2271 1 1 7 LEU CA C -9.995 1.325 -2.530 1.00 . A A . 7 LEU CA 1 1 6 2272 1 1 7 LEU CB C -9.077 2.217 -3.369 1.00 . A A . 7 LEU CB 1 1 6 2273 1 1 7 LEU CD1 C -8.848 0.846 -5.457 1.00 . A A . 7 LEU CD1 1 1 6 2274 1 1 7 LEU CD2 C -10.965 2.100 -5.041 1.00 . A A . 7 LEU CD2 1 1 6 2275 1 1 7 LEU CG C -9.441 2.123 -4.859 1.00 . A A . 7 LEU CG 1 1 6 2276 1 1 7 LEU H H -11.343 2.959 -2.442 1.00 . A A . 7 LEU H 1 1 6 2277 1 1 7 LEU HA H -10.163 0.399 -3.058 1.00 . A A . 7 LEU HA 1 1 6 2278 1 1 7 LEU HB2 H -9.177 3.241 -3.041 1.00 . A A . 7 LEU HB2 1 1 6 2279 1 1 7 LEU HB3 H -8.057 1.902 -3.234 1.00 . A A . 7 LEU HB3 1 1 6 2280 1 1 7 LEU HD11 H -7.793 0.797 -5.230 1.00 . A A . 7 LEU HD11 1 1 6 2281 1 1 7 LEU HD12 H -8.982 0.858 -6.527 1.00 . A A . 7 LEU HD12 1 1 6 2282 1 1 7 LEU HD13 H -9.348 -0.017 -5.041 1.00 . A A . 7 LEU HD13 1 1 6 2283 1 1 7 LEU HD21 H -11.370 1.187 -4.625 1.00 . A A . 7 LEU HD21 1 1 6 2284 1 1 7 LEU HD22 H -11.197 2.149 -6.094 1.00 . A A . 7 LEU HD22 1 1 6 2285 1 1 7 LEU HD23 H -11.400 2.950 -4.539 1.00 . A A . 7 LEU HD23 1 1 6 2286 1 1 7 LEU HG H -9.031 2.981 -5.376 1.00 . A A . 7 LEU HG 1 1 6 2287 1 1 7 LEU N N -11.274 1.990 -2.309 1.00 . A A . 7 LEU N 1 1 6 2288 1 1 7 LEU O O -8.843 1.924 -0.514 1.00 . A A . 7 LEU O 1 1 6 2289 1 1 8 ALA C C -7.516 -1.465 0.303 1.00 . A A . 8 ALA C 1 1 6 2290 1 1 8 ALA CA C -8.788 -0.654 0.499 1.00 . A A . 8 ALA CA 1 1 6 2291 1 1 8 ALA CB C -9.797 -1.498 1.261 1.00 . A A . 8 ALA CB 1 1 6 2292 1 1 8 ALA H H -9.791 -0.914 -1.361 1.00 . A A . 8 ALA H 1 1 6 2293 1 1 8 ALA HA H -8.554 0.224 1.079 1.00 . A A . 8 ALA HA 1 1 6 2294 1 1 8 ALA HB1 H -10.686 -0.915 1.446 1.00 . A A . 8 ALA HB1 1 1 6 2295 1 1 8 ALA HB2 H -9.365 -1.810 2.201 1.00 . A A . 8 ALA HB2 1 1 6 2296 1 1 8 ALA HB3 H -10.052 -2.370 0.674 1.00 . A A . 8 ALA HB3 1 1 6 2297 1 1 8 ALA N N -9.363 -0.242 -0.787 1.00 . A A . 8 ALA N 1 1 6 2298 1 1 8 ALA O O -6.706 -1.608 1.218 1.00 . A A . 8 ALA O 1 1 6 2299 1 1 9 LEU C C -5.040 -1.979 -1.651 1.00 . A A . 9 LEU C 1 1 6 2300 1 1 9 LEU CA C -6.207 -2.833 -1.211 1.00 . A A . 9 LEU CA 1 1 6 2301 1 1 9 LEU CB C -6.555 -3.753 -2.351 1.00 . A A . 9 LEU CB 1 1 6 2302 1 1 9 LEU CD1 C -8.330 -4.755 -0.878 1.00 . A A . 9 LEU CD1 1 1 6 2303 1 1 9 LEU CD2 C -7.673 -5.867 -3.017 1.00 . A A . 9 LEU CD2 1 1 6 2304 1 1 9 LEU CG C -7.165 -5.054 -1.829 1.00 . A A . 9 LEU CG 1 1 6 2305 1 1 9 LEU H H -8.068 -1.877 -1.551 1.00 . A A . 9 LEU H 1 1 6 2306 1 1 9 LEU HA H -5.918 -3.417 -0.359 1.00 . A A . 9 LEU HA 1 1 6 2307 1 1 9 LEU HB2 H -7.257 -3.251 -2.995 1.00 . A A . 9 LEU HB2 1 1 6 2308 1 1 9 LEU HB3 H -5.654 -3.972 -2.901 1.00 . A A . 9 LEU HB3 1 1 6 2309 1 1 9 LEU HD11 H -8.987 -4.025 -1.324 1.00 . A A . 9 LEU HD11 1 1 6 2310 1 1 9 LEU HD12 H -7.945 -4.373 0.055 1.00 . A A . 9 LEU HD12 1 1 6 2311 1 1 9 LEU HD13 H -8.880 -5.664 -0.690 1.00 . A A . 9 LEU HD13 1 1 6 2312 1 1 9 LEU HD21 H -6.833 -6.192 -3.613 1.00 . A A . 9 LEU HD21 1 1 6 2313 1 1 9 LEU HD22 H -8.326 -5.254 -3.619 1.00 . A A . 9 LEU HD22 1 1 6 2314 1 1 9 LEU HD23 H -8.215 -6.727 -2.659 1.00 . A A . 9 LEU HD23 1 1 6 2315 1 1 9 LEU HG H -6.408 -5.620 -1.303 1.00 . A A . 9 LEU HG 1 1 6 2316 1 1 9 LEU N N -7.369 -2.013 -0.881 1.00 . A A . 9 LEU N 1 1 6 2317 1 1 9 LEU O O -3.952 -2.049 -1.086 1.00 . A A . 9 LEU O 1 1 6 2318 1 1 10 HIS C C -3.528 0.337 -2.016 1.00 . A A . 10 HIS C 1 1 6 2319 1 1 10 HIS CA C -4.212 -0.316 -3.189 1.00 . A A . 10 HIS CA 1 1 6 2320 1 1 10 HIS CB C -4.792 0.742 -4.113 1.00 . A A . 10 HIS CB 1 1 6 2321 1 1 10 HIS CD2 C -5.893 2.386 -2.363 1.00 . A A . 10 HIS CD2 1 1 6 2322 1 1 10 HIS CE1 C -4.723 4.155 -2.807 1.00 . A A . 10 HIS CE1 1 1 6 2323 1 1 10 HIS CG C -5.019 2.041 -3.369 1.00 . A A . 10 HIS CG 1 1 6 2324 1 1 10 HIS H H -6.156 -1.187 -3.097 1.00 . A A . 10 HIS H 1 1 6 2325 1 1 10 HIS HA H -3.495 -0.913 -3.732 1.00 . A A . 10 HIS HA 1 1 6 2326 1 1 10 HIS HB2 H -4.101 0.907 -4.919 1.00 . A A . 10 HIS HB2 1 1 6 2327 1 1 10 HIS HB3 H -5.725 0.384 -4.502 1.00 . A A . 10 HIS HB3 1 1 6 2328 1 1 10 HIS HD1 H -3.556 3.269 -4.300 1.00 . A A . 10 HIS HD1 1 1 6 2329 1 1 10 HIS HD2 H -6.612 1.719 -1.906 1.00 . A A . 10 HIS HD2 1 1 6 2330 1 1 10 HIS HE1 H -4.334 5.164 -2.792 1.00 . A A . 10 HIS HE1 1 1 6 2331 1 1 10 HIS HE2 H -6.189 4.233 -1.322 1.00 . A A . 10 HIS HE2 1 1 6 2332 1 1 10 HIS N N -5.268 -1.184 -2.678 1.00 . A A . 10 HIS N 1 1 6 2333 1 1 10 HIS ND1 N -4.281 3.185 -3.636 1.00 . A A . 10 HIS ND1 1 1 6 2334 1 1 10 HIS NE2 N -5.705 3.720 -2.013 1.00 . A A . 10 HIS NE2 1 1 6 2335 1 1 10 HIS O O -2.331 0.598 -2.013 1.00 . A A . 10 HIS O 1 1 6 2336 1 1 11 HIS C C -2.577 0.458 0.645 1.00 . A A . 11 HIS C 1 1 6 2337 1 1 11 HIS CA C -3.878 1.116 0.243 1.00 . A A . 11 HIS CA 1 1 6 2338 1 1 11 HIS CB C -4.935 0.810 1.289 1.00 . A A . 11 HIS CB 1 1 6 2339 1 1 11 HIS CD2 C -6.489 2.902 0.994 1.00 . A A . 11 HIS CD2 1 1 6 2340 1 1 11 HIS CE1 C -6.182 3.809 2.938 1.00 . A A . 11 HIS CE1 1 1 6 2341 1 1 11 HIS CG C -5.632 2.083 1.682 1.00 . A A . 11 HIS CG 1 1 6 2342 1 1 11 HIS H H -5.272 0.280 -1.084 1.00 . A A . 11 HIS H 1 1 6 2343 1 1 11 HIS HA H -3.749 2.180 0.147 1.00 . A A . 11 HIS HA 1 1 6 2344 1 1 11 HIS HB2 H -5.652 0.109 0.859 1.00 . A A . 11 HIS HB2 1 1 6 2345 1 1 11 HIS HB3 H -4.465 0.362 2.151 1.00 . A A . 11 HIS HB3 1 1 6 2346 1 1 11 HIS HD1 H -4.890 2.338 3.651 1.00 . A A . 11 HIS HD1 1 1 6 2347 1 1 11 HIS HD2 H -6.842 2.727 -0.014 1.00 . A A . 11 HIS HD2 1 1 6 2348 1 1 11 HIS HE1 H -6.231 4.490 3.777 1.00 . A A . 11 HIS HE1 1 1 6 2349 1 1 11 HIS HE2 H -7.431 4.739 1.545 1.00 . A A . 11 HIS HE2 1 1 6 2350 1 1 11 HIS N N -4.333 0.548 -0.999 1.00 . A A . 11 HIS N 1 1 6 2351 1 1 11 HIS ND1 N -5.449 2.678 2.921 1.00 . A A . 11 HIS ND1 1 1 6 2352 1 1 11 HIS NE2 N -6.837 3.992 1.786 1.00 . A A . 11 HIS NE2 1 1 6 2353 1 1 11 HIS O O -1.690 1.076 1.235 1.00 . A A . 11 HIS O 1 1 6 2354 1 1 12 LEU C C -0.274 -1.312 -0.498 1.00 . A A . 12 LEU C 1 1 6 2355 1 1 12 LEU CA C -1.288 -1.585 0.580 1.00 . A A . 12 LEU CA 1 1 6 2356 1 1 12 LEU CB C -1.614 -3.080 0.625 1.00 . A A . 12 LEU CB 1 1 6 2357 1 1 12 LEU CD1 C -3.717 -3.005 2.000 1.00 . A A . 12 LEU CD1 1 1 6 2358 1 1 12 LEU CD2 C -2.156 -4.936 2.231 1.00 . A A . 12 LEU CD2 1 1 6 2359 1 1 12 LEU CG C -2.244 -3.428 1.983 1.00 . A A . 12 LEU CG 1 1 6 2360 1 1 12 LEU H H -3.224 -1.217 -0.221 1.00 . A A . 12 LEU H 1 1 6 2361 1 1 12 LEU HA H -0.887 -1.273 1.530 1.00 . A A . 12 LEU HA 1 1 6 2362 1 1 12 LEU HB2 H -2.305 -3.318 -0.169 1.00 . A A . 12 LEU HB2 1 1 6 2363 1 1 12 LEU HB3 H -0.705 -3.648 0.492 1.00 . A A . 12 LEU HB3 1 1 6 2364 1 1 12 LEU HD11 H -4.207 -3.441 2.859 1.00 . A A . 12 LEU HD11 1 1 6 2365 1 1 12 LEU HD12 H -4.202 -3.348 1.098 1.00 . A A . 12 LEU HD12 1 1 6 2366 1 1 12 LEU HD13 H -3.781 -1.930 2.057 1.00 . A A . 12 LEU HD13 1 1 6 2367 1 1 12 LEU HD21 H -2.728 -5.462 1.478 1.00 . A A . 12 LEU HD21 1 1 6 2368 1 1 12 LEU HD22 H -2.558 -5.159 3.209 1.00 . A A . 12 LEU HD22 1 1 6 2369 1 1 12 LEU HD23 H -1.125 -5.251 2.186 1.00 . A A . 12 LEU HD23 1 1 6 2370 1 1 12 LEU HG H -1.714 -2.904 2.766 1.00 . A A . 12 LEU HG 1 1 6 2371 1 1 12 LEU N N -2.477 -0.808 0.287 1.00 . A A . 12 LEU N 1 1 6 2372 1 1 12 LEU O O 0.903 -1.082 -0.228 1.00 . A A . 12 LEU O 1 1 6 2373 1 1 13 ALA C C 0.754 0.342 -2.595 1.00 . A A . 13 ALA C 1 1 6 2374 1 1 13 ALA CA C 0.078 -0.990 -2.864 1.00 . A A . 13 ALA CA 1 1 6 2375 1 1 13 ALA CB C -0.743 -0.906 -4.158 1.00 . A A . 13 ALA CB 1 1 6 2376 1 1 13 ALA H H -1.740 -1.448 -1.841 1.00 . A A . 13 ALA H 1 1 6 2377 1 1 13 ALA HA H 0.827 -1.759 -2.962 1.00 . A A . 13 ALA HA 1 1 6 2378 1 1 13 ALA HB1 H -1.246 -1.846 -4.327 1.00 . A A . 13 ALA HB1 1 1 6 2379 1 1 13 ALA HB2 H -0.080 -0.700 -4.987 1.00 . A A . 13 ALA HB2 1 1 6 2380 1 1 13 ALA HB3 H -1.470 -0.115 -4.075 1.00 . A A . 13 ALA HB3 1 1 6 2381 1 1 13 ALA N N -0.772 -1.292 -1.720 1.00 . A A . 13 ALA N 1 1 6 2382 1 1 13 ALA O O 1.879 0.592 -3.015 1.00 . A A . 13 ALA O 1 1 6 2383 1 1 14 HIS C C 1.704 2.315 -0.531 1.00 . A A . 14 HIS C 1 1 6 2384 1 1 14 HIS CA C 0.545 2.486 -1.484 1.00 . A A . 14 HIS CA 1 1 6 2385 1 1 14 HIS CB C -0.575 3.290 -0.835 1.00 . A A . 14 HIS CB 1 1 6 2386 1 1 14 HIS CD2 C -0.582 4.207 1.626 1.00 . A A . 14 HIS CD2 1 1 6 2387 1 1 14 HIS CE1 C 1.238 5.381 1.543 1.00 . A A . 14 HIS CE1 1 1 6 2388 1 1 14 HIS CG C -0.075 4.062 0.358 1.00 . A A . 14 HIS CG 1 1 6 2389 1 1 14 HIS H H -0.849 0.898 -1.553 1.00 . A A . 14 HIS H 1 1 6 2390 1 1 14 HIS HA H 0.886 2.998 -2.362 1.00 . A A . 14 HIS HA 1 1 6 2391 1 1 14 HIS HB2 H -0.959 3.967 -1.559 1.00 . A A . 14 HIS HB2 1 1 6 2392 1 1 14 HIS HB3 H -1.359 2.618 -0.523 1.00 . A A . 14 HIS HB3 1 1 6 2393 1 1 14 HIS HD1 H 1.705 4.910 -0.433 1.00 . A A . 14 HIS HD1 1 1 6 2394 1 1 14 HIS HD2 H -1.478 3.723 1.997 1.00 . A A . 14 HIS HD2 1 1 6 2395 1 1 14 HIS HE1 H 2.063 6.023 1.818 1.00 . A A . 14 HIS HE1 1 1 6 2396 1 1 14 HIS HE2 H 0.118 5.329 3.306 1.00 . A A . 14 HIS HE2 1 1 6 2397 1 1 14 HIS N N 0.042 1.180 -1.861 1.00 . A A . 14 HIS N 1 1 6 2398 1 1 14 HIS ND1 N 1.091 4.815 0.328 1.00 . A A . 14 HIS ND1 1 1 6 2399 1 1 14 HIS NE2 N 0.245 5.042 2.372 1.00 . A A . 14 HIS NE2 1 1 6 2400 1 1 14 HIS O O 2.795 2.847 -0.744 1.00 . A A . 14 HIS O 1 1 6 2401 1 1 15 LEU C C 3.646 0.625 0.693 1.00 . A A . 15 LEU C 1 1 6 2402 1 1 15 LEU CA C 2.528 1.255 1.461 1.00 . A A . 15 LEU CA 1 1 6 2403 1 1 15 LEU CB C 2.050 0.257 2.519 1.00 . A A . 15 LEU CB 1 1 6 2404 1 1 15 LEU CD1 C 1.367 2.475 3.538 1.00 . A A . 15 LEU CD1 1 1 6 2405 1 1 15 LEU CD2 C -0.069 0.460 3.830 1.00 . A A . 15 LEU CD2 1 1 6 2406 1 1 15 LEU CG C 1.373 0.955 3.711 1.00 . A A . 15 LEU CG 1 1 6 2407 1 1 15 LEU H H 0.597 1.110 0.603 1.00 . A A . 15 LEU H 1 1 6 2408 1 1 15 LEU HA H 2.868 2.167 1.913 1.00 . A A . 15 LEU HA 1 1 6 2409 1 1 15 LEU HB2 H 1.349 -0.427 2.064 1.00 . A A . 15 LEU HB2 1 1 6 2410 1 1 15 LEU HB3 H 2.901 -0.303 2.876 1.00 . A A . 15 LEU HB3 1 1 6 2411 1 1 15 LEU HD11 H 0.671 2.910 4.239 1.00 . A A . 15 LEU HD11 1 1 6 2412 1 1 15 LEU HD12 H 1.064 2.723 2.533 1.00 . A A . 15 LEU HD12 1 1 6 2413 1 1 15 LEU HD13 H 2.357 2.866 3.727 1.00 . A A . 15 LEU HD13 1 1 6 2414 1 1 15 LEU HD21 H -0.457 0.240 2.849 1.00 . A A . 15 LEU HD21 1 1 6 2415 1 1 15 LEU HD22 H -0.676 1.224 4.294 1.00 . A A . 15 LEU HD22 1 1 6 2416 1 1 15 LEU HD23 H -0.095 -0.437 4.436 1.00 . A A . 15 LEU HD23 1 1 6 2417 1 1 15 LEU HG H 1.909 0.702 4.609 1.00 . A A . 15 LEU HG 1 1 6 2418 1 1 15 LEU N N 1.473 1.531 0.503 1.00 . A A . 15 LEU N 1 1 6 2419 1 1 15 LEU O O 4.826 0.808 0.974 1.00 . A A . 15 LEU O 1 1 6 2420 1 1 16 ALA C C 4.901 0.224 -2.022 1.00 . A A . 16 ALA C 1 1 6 2421 1 1 16 ALA CA C 4.180 -0.794 -1.161 1.00 . A A . 16 ALA CA 1 1 6 2422 1 1 16 ALA CB C 3.458 -1.810 -2.044 1.00 . A A . 16 ALA CB 1 1 6 2423 1 1 16 ALA H H 2.254 -0.189 -0.452 1.00 . A A . 16 ALA H 1 1 6 2424 1 1 16 ALA HA H 4.902 -1.305 -0.550 1.00 . A A . 16 ALA HA 1 1 6 2425 1 1 16 ALA HB1 H 3.133 -1.328 -2.956 1.00 . A A . 16 ALA HB1 1 1 6 2426 1 1 16 ALA HB2 H 2.602 -2.200 -1.517 1.00 . A A . 16 ALA HB2 1 1 6 2427 1 1 16 ALA HB3 H 4.131 -2.616 -2.286 1.00 . A A . 16 ALA HB3 1 1 6 2428 1 1 16 ALA N N 3.234 -0.114 -0.297 1.00 . A A . 16 ALA N 1 1 6 2429 1 1 16 ALA O O 6.044 0.017 -2.429 1.00 . A A . 16 ALA O 1 1 6 2430 1 1 17 LEU C C 6.014 2.956 -2.502 1.00 . A A . 17 LEU C 1 1 6 2431 1 1 17 LEU CA C 4.760 2.380 -3.125 1.00 . A A . 17 LEU CA 1 1 6 2432 1 1 17 LEU CB C 3.688 3.463 -3.353 1.00 . A A . 17 LEU CB 1 1 6 2433 1 1 17 LEU CD1 C 5.238 5.457 -3.364 1.00 . A A . 17 LEU CD1 1 1 6 2434 1 1 17 LEU CD2 C 2.830 5.732 -2.753 1.00 . A A . 17 LEU CD2 1 1 6 2435 1 1 17 LEU CG C 4.041 4.796 -2.667 1.00 . A A . 17 LEU CG 1 1 6 2436 1 1 17 LEU H H 3.302 1.403 -1.949 1.00 . A A . 17 LEU H 1 1 6 2437 1 1 17 LEU HA H 5.032 1.960 -4.072 1.00 . A A . 17 LEU HA 1 1 6 2438 1 1 17 LEU HB2 H 3.581 3.633 -4.409 1.00 . A A . 17 LEU HB2 1 1 6 2439 1 1 17 LEU HB3 H 2.751 3.106 -2.958 1.00 . A A . 17 LEU HB3 1 1 6 2440 1 1 17 LEU HD11 H 6.047 5.572 -2.658 1.00 . A A . 17 LEU HD11 1 1 6 2441 1 1 17 LEU HD12 H 4.946 6.429 -3.736 1.00 . A A . 17 LEU HD12 1 1 6 2442 1 1 17 LEU HD13 H 5.566 4.840 -4.184 1.00 . A A . 17 LEU HD13 1 1 6 2443 1 1 17 LEU HD21 H 3.082 6.688 -2.313 1.00 . A A . 17 LEU HD21 1 1 6 2444 1 1 17 LEU HD22 H 1.999 5.297 -2.219 1.00 . A A . 17 LEU HD22 1 1 6 2445 1 1 17 LEU HD23 H 2.555 5.877 -3.785 1.00 . A A . 17 LEU HD23 1 1 6 2446 1 1 17 LEU HG H 4.278 4.617 -1.628 1.00 . A A . 17 LEU HG 1 1 6 2447 1 1 17 LEU N N 4.211 1.316 -2.301 1.00 . A A . 17 LEU N 1 1 6 2448 1 1 17 LEU O O 7.051 3.056 -3.159 1.00 . A A . 17 LEU O 1 1 6 2449 1 1 18 HIS C C 8.071 2.780 -0.313 1.00 . A A . 18 HIS C 1 1 6 2450 1 1 18 HIS CA C 7.097 3.886 -0.580 1.00 . A A . 18 HIS CA 1 1 6 2451 1 1 18 HIS CB C 6.705 4.584 0.701 1.00 . A A . 18 HIS CB 1 1 6 2452 1 1 18 HIS CD2 C 4.874 3.238 1.956 1.00 . A A . 18 HIS CD2 1 1 6 2453 1 1 18 HIS CE1 C 6.143 2.163 3.347 1.00 . A A . 18 HIS CE1 1 1 6 2454 1 1 18 HIS CG C 6.158 3.610 1.692 1.00 . A A . 18 HIS CG 1 1 6 2455 1 1 18 HIS H H 5.077 3.219 -0.756 1.00 . A A . 18 HIS H 1 1 6 2456 1 1 18 HIS HA H 7.563 4.599 -1.238 1.00 . A A . 18 HIS HA 1 1 6 2457 1 1 18 HIS HB2 H 7.562 5.086 1.114 1.00 . A A . 18 HIS HB2 1 1 6 2458 1 1 18 HIS HB3 H 5.952 5.291 0.468 1.00 . A A . 18 HIS HB3 1 1 6 2459 1 1 18 HIS HD1 H 7.938 2.954 2.644 1.00 . A A . 18 HIS HD1 1 1 6 2460 1 1 18 HIS HD2 H 4.006 3.579 1.399 1.00 . A A . 18 HIS HD2 1 1 6 2461 1 1 18 HIS HE1 H 6.490 1.504 4.134 1.00 . A A . 18 HIS HE1 1 1 6 2462 1 1 18 HIS HE2 H 4.079 1.875 3.403 1.00 . A A . 18 HIS HE2 1 1 6 2463 1 1 18 HIS N N 5.928 3.328 -1.243 1.00 . A A . 18 HIS N 1 1 6 2464 1 1 18 HIS ND1 N 6.956 2.915 2.584 1.00 . A A . 18 HIS ND1 1 1 6 2465 1 1 18 HIS NE2 N 4.860 2.317 3.005 1.00 . A A . 18 HIS NE2 1 1 6 2466 1 1 18 HIS O O 9.274 2.918 -0.540 1.00 . A A . 18 HIS O 1 1 6 2467 1 1 19 LEU C C 9.196 0.280 -0.884 1.00 . A A . 19 LEU C 1 1 6 2468 1 1 19 LEU CA C 8.356 0.494 0.359 1.00 . A A . 19 LEU CA 1 1 6 2469 1 1 19 LEU CB C 7.486 -0.744 0.583 1.00 . A A . 19 LEU CB 1 1 6 2470 1 1 19 LEU CD1 C 9.398 -1.508 2.010 1.00 . A A . 19 LEU CD1 1 1 6 2471 1 1 19 LEU CD2 C 7.291 -0.676 3.068 1.00 . A A . 19 LEU CD2 1 1 6 2472 1 1 19 LEU CG C 7.873 -1.444 1.882 1.00 . A A . 19 LEU CG 1 1 6 2473 1 1 19 LEU H H 6.554 1.626 0.250 1.00 . A A . 19 LEU H 1 1 6 2474 1 1 19 LEU HA H 8.992 0.662 1.211 1.00 . A A . 19 LEU HA 1 1 6 2475 1 1 19 LEU HB2 H 6.450 -0.454 0.629 1.00 . A A . 19 LEU HB2 1 1 6 2476 1 1 19 LEU HB3 H 7.624 -1.428 -0.241 1.00 . A A . 19 LEU HB3 1 1 6 2477 1 1 19 LEU HD11 H 9.677 -2.378 2.581 1.00 . A A . 19 LEU HD11 1 1 6 2478 1 1 19 LEU HD12 H 9.754 -0.618 2.510 1.00 . A A . 19 LEU HD12 1 1 6 2479 1 1 19 LEU HD13 H 9.839 -1.566 1.027 1.00 . A A . 19 LEU HD13 1 1 6 2480 1 1 19 LEU HD21 H 7.959 0.131 3.337 1.00 . A A . 19 LEU HD21 1 1 6 2481 1 1 19 LEU HD22 H 7.177 -1.345 3.908 1.00 . A A . 19 LEU HD22 1 1 6 2482 1 1 19 LEU HD23 H 6.325 -0.272 2.797 1.00 . A A . 19 LEU HD23 1 1 6 2483 1 1 19 LEU HG H 7.472 -2.444 1.869 1.00 . A A . 19 LEU HG 1 1 6 2484 1 1 19 LEU N N 7.531 1.663 0.122 1.00 . A A . 19 LEU N 1 1 6 2485 1 1 19 LEU O O 10.346 -0.159 -0.827 1.00 . A A . 19 LEU O 1 1 6 2486 1 1 20 ALA C C 10.475 1.437 -3.291 1.00 . A A . 20 ALA C 1 1 6 2487 1 1 20 ALA CA C 9.275 0.522 -3.301 1.00 . A A . 20 ALA CA 1 1 6 2488 1 1 20 ALA CB C 8.338 0.919 -4.445 1.00 . A A . 20 ALA CB 1 1 6 2489 1 1 20 ALA H H 7.677 1.005 -1.958 1.00 . A A . 20 ALA H 1 1 6 2490 1 1 20 ALA HA H 9.605 -0.491 -3.445 1.00 . A A . 20 ALA HA 1 1 6 2491 1 1 20 ALA HB1 H 8.636 0.404 -5.348 1.00 . A A . 20 ALA HB1 1 1 6 2492 1 1 20 ALA HB2 H 8.395 1.986 -4.607 1.00 . A A . 20 ALA HB2 1 1 6 2493 1 1 20 ALA HB3 H 7.326 0.647 -4.192 1.00 . A A . 20 ALA HB3 1 1 6 2494 1 1 20 ALA N N 8.595 0.635 -2.011 1.00 . A A . 20 ALA N 1 1 6 2495 1 1 20 ALA O O 11.622 1.001 -3.424 1.00 . A A . 20 ALA O 1 1 6 2496 1 1 21 LEU C C 12.311 3.235 -2.069 1.00 . A A . 21 LEU C 1 1 6 2497 1 1 21 LEU CA C 11.245 3.717 -3.032 1.00 . A A . 21 LEU CA 1 1 6 2498 1 1 21 LEU CB C 10.680 5.046 -2.526 1.00 . A A . 21 LEU CB 1 1 6 2499 1 1 21 LEU CD1 C 8.886 6.759 -2.815 1.00 . A A . 21 LEU CD1 1 1 6 2500 1 1 21 LEU CD2 C 9.949 5.721 -4.821 1.00 . A A . 21 LEU CD2 1 1 6 2501 1 1 21 LEU CG C 9.487 5.473 -3.383 1.00 . A A . 21 LEU CG 1 1 6 2502 1 1 21 LEU H H 9.262 2.978 -2.989 1.00 . A A . 21 LEU H 1 1 6 2503 1 1 21 LEU HA H 11.678 3.855 -4.008 1.00 . A A . 21 LEU HA 1 1 6 2504 1 1 21 LEU HB2 H 10.359 4.925 -1.501 1.00 . A A . 21 LEU HB2 1 1 6 2505 1 1 21 LEU HB3 H 11.448 5.802 -2.575 1.00 . A A . 21 LEU HB3 1 1 6 2506 1 1 21 LEU HD11 H 9.646 7.315 -2.290 1.00 . A A . 21 LEU HD11 1 1 6 2507 1 1 21 LEU HD12 H 8.088 6.511 -2.135 1.00 . A A . 21 LEU HD12 1 1 6 2508 1 1 21 LEU HD13 H 8.496 7.358 -3.623 1.00 . A A . 21 LEU HD13 1 1 6 2509 1 1 21 LEU HD21 H 10.090 4.774 -5.321 1.00 . A A . 21 LEU HD21 1 1 6 2510 1 1 21 LEU HD22 H 10.879 6.266 -4.814 1.00 . A A . 21 LEU HD22 1 1 6 2511 1 1 21 LEU HD23 H 9.199 6.294 -5.344 1.00 . A A . 21 LEU HD23 1 1 6 2512 1 1 21 LEU HG H 8.739 4.696 -3.373 1.00 . A A . 21 LEU HG 1 1 6 2513 1 1 21 LEU N N 10.194 2.715 -3.103 1.00 . A A . 21 LEU N 1 1 6 2514 1 1 21 LEU O O 13.506 3.260 -2.363 1.00 . A A . 21 LEU O 1 1 6 2515 1 1 22 ALA C C 13.637 1.203 -0.500 1.00 . A A . 22 ALA C 1 1 6 2516 1 1 22 ALA CA C 12.738 2.263 0.112 1.00 . A A . 22 ALA CA 1 1 6 2517 1 1 22 ALA CB C 11.929 1.658 1.265 1.00 . A A . 22 ALA CB 1 1 6 2518 1 1 22 ALA H H 10.875 2.786 -0.765 1.00 . A A . 22 ALA H 1 1 6 2519 1 1 22 ALA HA H 13.342 3.067 0.487 1.00 . A A . 22 ALA HA 1 1 6 2520 1 1 22 ALA HB1 H 10.965 2.142 1.325 1.00 . A A . 22 ALA HB1 1 1 6 2521 1 1 22 ALA HB2 H 12.461 1.802 2.193 1.00 . A A . 22 ALA HB2 1 1 6 2522 1 1 22 ALA HB3 H 11.790 0.602 1.090 1.00 . A A . 22 ALA HB3 1 1 6 2523 1 1 22 ALA N N 11.847 2.781 -0.915 1.00 . A A . 22 ALA N 1 1 6 2524 1 1 22 ALA O O 14.860 1.278 -0.409 1.00 . A A . 22 ALA O 1 1 6 2525 1 1 23 LEU C C 14.640 -0.273 -2.883 1.00 . A A . 23 LEU C 1 1 6 2526 1 1 23 LEU CA C 13.752 -0.844 -1.792 1.00 . A A . 23 LEU CA 1 1 6 2527 1 1 23 LEU CB C 12.778 -1.860 -2.410 1.00 . A A . 23 LEU CB 1 1 6 2528 1 1 23 LEU CD1 C 14.159 -3.744 -1.518 1.00 . A A . 23 LEU CD1 1 1 6 2529 1 1 23 LEU CD2 C 12.268 -2.849 -0.160 1.00 . A A . 23 LEU CD2 1 1 6 2530 1 1 23 LEU CG C 12.753 -3.149 -1.579 1.00 . A A . 23 LEU CG 1 1 6 2531 1 1 23 LEU H H 12.033 0.243 -1.182 1.00 . A A . 23 LEU H 1 1 6 2532 1 1 23 LEU HA H 14.368 -1.339 -1.067 1.00 . A A . 23 LEU HA 1 1 6 2533 1 1 23 LEU HB2 H 11.786 -1.437 -2.445 1.00 . A A . 23 LEU HB2 1 1 6 2534 1 1 23 LEU HB3 H 13.099 -2.095 -3.416 1.00 . A A . 23 LEU HB3 1 1 6 2535 1 1 23 LEU HD11 H 14.795 -3.236 -2.226 1.00 . A A . 23 LEU HD11 1 1 6 2536 1 1 23 LEU HD12 H 14.118 -4.795 -1.761 1.00 . A A . 23 LEU HD12 1 1 6 2537 1 1 23 LEU HD13 H 14.562 -3.619 -0.522 1.00 . A A . 23 LEU HD13 1 1 6 2538 1 1 23 LEU HD21 H 12.224 -3.770 0.403 1.00 . A A . 23 LEU HD21 1 1 6 2539 1 1 23 LEU HD22 H 11.286 -2.408 -0.200 1.00 . A A . 23 LEU HD22 1 1 6 2540 1 1 23 LEU HD23 H 12.950 -2.167 0.323 1.00 . A A . 23 LEU HD23 1 1 6 2541 1 1 23 LEU HG H 12.084 -3.860 -2.046 1.00 . A A . 23 LEU HG 1 1 6 2542 1 1 23 LEU N N 13.014 0.231 -1.141 1.00 . A A . 23 LEU N 1 1 6 2543 1 1 23 LEU O O 15.821 -0.599 -2.979 1.00 . A A . 23 LEU O 1 1 6 2544 1 1 24 LYS C C 15.963 1.998 -4.278 1.00 . A A . 24 LYS C 1 1 6 2545 1 1 24 LYS CA C 14.776 1.204 -4.806 1.00 . A A . 24 LYS CA 1 1 6 2546 1 1 24 LYS CB C 13.846 2.132 -5.598 1.00 . A A . 24 LYS CB 1 1 6 2547 1 1 24 LYS CD C 14.431 3.558 -7.572 1.00 . A A . 24 LYS CD 1 1 6 2548 1 1 24 LYS CE C 15.714 4.158 -6.970 1.00 . A A . 24 LYS CE 1 1 6 2549 1 1 24 LYS CG C 14.242 2.124 -7.078 1.00 . A A . 24 LYS CG 1 1 6 2550 1 1 24 LYS H H 13.100 0.788 -3.567 1.00 . A A . 24 LYS H 1 1 6 2551 1 1 24 LYS HA H 15.142 0.433 -5.460 1.00 . A A . 24 LYS HA 1 1 6 2552 1 1 24 LYS HB2 H 12.828 1.790 -5.496 1.00 . A A . 24 LYS HB2 1 1 6 2553 1 1 24 LYS HB3 H 13.923 3.139 -5.209 1.00 . A A . 24 LYS HB3 1 1 6 2554 1 1 24 LYS HD2 H 14.506 3.557 -8.649 1.00 . A A . 24 LYS HD2 1 1 6 2555 1 1 24 LYS HD3 H 13.581 4.157 -7.271 1.00 . A A . 24 LYS HD3 1 1 6 2556 1 1 24 LYS HE2 H 15.965 5.063 -7.499 1.00 . A A . 24 LYS HE2 1 1 6 2557 1 1 24 LYS HE3 H 15.549 4.391 -5.927 1.00 . A A . 24 LYS HE3 1 1 6 2558 1 1 24 LYS HG2 H 15.165 1.578 -7.201 1.00 . A A . 24 LYS HG2 1 1 6 2559 1 1 24 LYS HG3 H 13.465 1.647 -7.656 1.00 . A A . 24 LYS HG3 1 1 6 2560 1 1 24 LYS HZ1 H 16.758 2.652 -7.972 1.00 . A A . 24 LYS HZ1 1 1 6 2561 1 1 24 LYS HZ2 H 16.830 2.530 -6.279 1.00 . A A . 24 LYS HZ2 1 1 6 2562 1 1 24 LYS HZ3 H 17.757 3.707 -7.086 1.00 . A A . 24 LYS HZ3 1 1 6 2563 1 1 24 LYS N N 14.050 0.579 -3.706 1.00 . A A . 24 LYS N 1 1 6 2564 1 1 24 LYS NZ N 16.843 3.187 -7.089 1.00 . A A . 24 LYS NZ 1 1 6 2565 1 1 24 LYS O O 16.965 2.170 -4.971 1.00 . A A . 24 LYS O 1 1 6 2566 1 1 25 LYS C C 17.209 4.530 -3.225 1.00 . A A . 25 LYS C 1 1 6 2567 1 1 25 LYS CA C 16.895 3.270 -2.418 1.00 . A A . 25 LYS CA 1 1 6 2568 1 1 25 LYS CB C 18.161 2.420 -2.245 1.00 . A A . 25 LYS CB 1 1 6 2569 1 1 25 LYS CD C 19.224 1.204 -0.318 1.00 . A A . 25 LYS CD 1 1 6 2570 1 1 25 LYS CE C 19.330 2.303 0.746 1.00 . A A . 25 LYS CE 1 1 6 2571 1 1 25 LYS CG C 17.937 1.383 -1.134 1.00 . A A . 25 LYS CG 1 1 6 2572 1 1 25 LYS H H 15.008 2.319 -2.556 1.00 . A A . 25 LYS H 1 1 6 2573 1 1 25 LYS HA H 16.552 3.574 -1.441 1.00 . A A . 25 LYS HA 1 1 6 2574 1 1 25 LYS HB2 H 18.384 1.914 -3.173 1.00 . A A . 25 LYS HB2 1 1 6 2575 1 1 25 LYS HB3 H 18.989 3.061 -1.978 1.00 . A A . 25 LYS HB3 1 1 6 2576 1 1 25 LYS HD2 H 19.209 0.237 0.166 1.00 . A A . 25 LYS HD2 1 1 6 2577 1 1 25 LYS HD3 H 20.079 1.259 -0.975 1.00 . A A . 25 LYS HD3 1 1 6 2578 1 1 25 LYS HE2 H 20.217 2.137 1.345 1.00 . A A . 25 LYS HE2 1 1 6 2579 1 1 25 LYS HE3 H 19.401 3.266 0.263 1.00 . A A . 25 LYS HE3 1 1 6 2580 1 1 25 LYS HG2 H 17.144 1.718 -0.483 1.00 . A A . 25 LYS HG2 1 1 6 2581 1 1 25 LYS HG3 H 17.662 0.439 -1.578 1.00 . A A . 25 LYS HG3 1 1 6 2582 1 1 25 LYS HZ1 H 17.597 1.388 1.460 1.00 . A A . 25 LYS HZ1 1 1 6 2583 1 1 25 LYS HZ2 H 17.517 3.084 1.410 1.00 . A A . 25 LYS HZ2 1 1 6 2584 1 1 25 LYS HZ3 H 18.425 2.310 2.621 1.00 . A A . 25 LYS HZ3 1 1 6 2585 1 1 25 LYS N N 15.836 2.485 -3.053 1.00 . A A . 25 LYS N 1 1 6 2586 1 1 25 LYS NZ N 18.127 2.268 1.621 1.00 . A A . 25 LYS NZ 1 1 6 2587 1 1 25 LYS O O 16.456 5.506 -3.174 1.00 . A A . 25 LYS O 1 1 6 2588 1 1 26 ALA C C 18.583 5.366 -6.250 1.00 . A A . 26 ALA C 1 1 6 2589 1 1 26 ALA CA C 18.705 5.674 -4.764 1.00 . A A . 26 ALA CA 1 1 6 2590 1 1 26 ALA CB C 20.146 6.081 -4.453 1.00 . A A . 26 ALA CB 1 1 6 2591 1 1 26 ALA H H 18.879 3.715 -3.969 1.00 . A A . 26 ALA H 1 1 6 2592 1 1 26 ALA HA H 18.050 6.501 -4.521 1.00 . A A . 26 ALA HA 1 1 6 2593 1 1 26 ALA HB1 H 20.482 5.574 -3.560 1.00 . A A . 26 ALA HB1 1 1 6 2594 1 1 26 ALA HB2 H 20.189 7.150 -4.302 1.00 . A A . 26 ALA HB2 1 1 6 2595 1 1 26 ALA HB3 H 20.782 5.811 -5.285 1.00 . A A . 26 ALA HB3 1 1 6 2596 1 1 26 ALA N N 18.317 4.515 -3.963 1.00 . A A . 26 ALA N 1 1 6 2597 1 1 26 ALA O O 18.087 6.207 -6.969 1.00 . A A . 26 ALA O 1 1 6 2598 1 1 26 ALA OXT O 18.978 4.288 -6.647 1.00 . A A . 26 ALA OXT 1 1 7 2599 1 1 1 LYS C C -24.802 -3.629 -4.741 1.00 . A A . 1 LYS C 1 1 7 2600 1 1 1 LYS CA C -26.015 -4.532 -4.543 1.00 . A A . 1 LYS CA 1 1 7 2601 1 1 1 LYS CB C -27.083 -3.778 -3.743 1.00 . A A . 1 LYS CB 1 1 7 2602 1 1 1 LYS CD C -29.362 -3.938 -2.720 1.00 . A A . 1 LYS CD 1 1 7 2603 1 1 1 LYS CE C -30.213 -4.809 -1.798 1.00 . A A . 1 LYS CE 1 1 7 2604 1 1 1 LYS CG C -28.168 -4.745 -3.242 1.00 . A A . 1 LYS CG 1 1 7 2605 1 1 1 LYS H1 H -26.405 -6.187 -3.357 1.00 . A A . 1 LYS H1 1 1 7 2606 1 1 1 LYS H2 H -24.893 -5.470 -3.075 1.00 . A A . 1 LYS H2 1 1 7 2607 1 1 1 LYS H3 H -25.146 -6.410 -4.465 1.00 . A A . 1 LYS H3 1 1 7 2608 1 1 1 LYS HA H -26.416 -4.817 -5.504 1.00 . A A . 1 LYS HA 1 1 7 2609 1 1 1 LYS HB2 H -26.617 -3.290 -2.901 1.00 . A A . 1 LYS HB2 1 1 7 2610 1 1 1 LYS HB3 H -27.537 -3.033 -4.379 1.00 . A A . 1 LYS HB3 1 1 7 2611 1 1 1 LYS HD2 H -29.002 -3.080 -2.169 1.00 . A A . 1 LYS HD2 1 1 7 2612 1 1 1 LYS HD3 H -29.963 -3.603 -3.555 1.00 . A A . 1 LYS HD3 1 1 7 2613 1 1 1 LYS HE2 H -29.572 -5.446 -1.207 1.00 . A A . 1 LYS HE2 1 1 7 2614 1 1 1 LYS HE3 H -30.798 -4.181 -1.145 1.00 . A A . 1 LYS HE3 1 1 7 2615 1 1 1 LYS HG2 H -28.489 -5.381 -4.054 1.00 . A A . 1 LYS HG2 1 1 7 2616 1 1 1 LYS HG3 H -27.773 -5.354 -2.441 1.00 . A A . 1 LYS HG3 1 1 7 2617 1 1 1 LYS HZ1 H -30.606 -6.492 -2.943 1.00 . A A . 1 LYS HZ1 1 1 7 2618 1 1 1 LYS HZ2 H -31.457 -5.110 -3.434 1.00 . A A . 1 LYS HZ2 1 1 7 2619 1 1 1 LYS HZ3 H -31.933 -5.941 -2.036 1.00 . A A . 1 LYS HZ3 1 1 7 2620 1 1 1 LYS N N -25.584 -5.741 -3.803 1.00 . A A . 1 LYS N 1 1 7 2621 1 1 1 LYS NZ N -31.119 -5.651 -2.614 1.00 . A A . 1 LYS NZ 1 1 7 2622 1 1 1 LYS O O -24.104 -3.296 -3.777 1.00 . A A . 1 LYS O 1 1 7 2623 1 1 2 LYS C C -22.107 -3.050 -5.974 1.00 . A A . 2 LYS C 1 1 7 2624 1 1 2 LYS CA C -23.428 -2.374 -6.325 1.00 . A A . 2 LYS CA 1 1 7 2625 1 1 2 LYS CB C -23.529 -1.042 -5.575 1.00 . A A . 2 LYS CB 1 1 7 2626 1 1 2 LYS CD C -24.408 1.243 -6.128 1.00 . A A . 2 LYS CD 1 1 7 2627 1 1 2 LYS CE C -23.959 1.744 -4.750 1.00 . A A . 2 LYS CE 1 1 7 2628 1 1 2 LYS CG C -24.747 -0.255 -6.073 1.00 . A A . 2 LYS CG 1 1 7 2629 1 1 2 LYS H H -25.150 -3.544 -6.705 1.00 . A A . 2 LYS H 1 1 7 2630 1 1 2 LYS HA H -23.446 -2.182 -7.385 1.00 . A A . 2 LYS HA 1 1 7 2631 1 1 2 LYS HB2 H -23.628 -1.232 -4.516 1.00 . A A . 2 LYS HB2 1 1 7 2632 1 1 2 LYS HB3 H -22.632 -0.465 -5.751 1.00 . A A . 2 LYS HB3 1 1 7 2633 1 1 2 LYS HD2 H -23.613 1.406 -6.840 1.00 . A A . 2 LYS HD2 1 1 7 2634 1 1 2 LYS HD3 H -25.280 1.790 -6.439 1.00 . A A . 2 LYS HD3 1 1 7 2635 1 1 2 LYS HE2 H -22.945 1.422 -4.558 1.00 . A A . 2 LYS HE2 1 1 7 2636 1 1 2 LYS HE3 H -24.003 2.824 -4.732 1.00 . A A . 2 LYS HE3 1 1 7 2637 1 1 2 LYS HG2 H -25.012 -0.598 -7.064 1.00 . A A . 2 LYS HG2 1 1 7 2638 1 1 2 LYS HG3 H -25.577 -0.413 -5.404 1.00 . A A . 2 LYS HG3 1 1 7 2639 1 1 2 LYS HZ1 H -25.777 1.682 -3.749 1.00 . A A . 2 LYS HZ1 1 1 7 2640 1 1 2 LYS HZ2 H -24.436 1.353 -2.763 1.00 . A A . 2 LYS HZ2 1 1 7 2641 1 1 2 LYS HZ3 H -24.994 0.182 -3.851 1.00 . A A . 2 LYS HZ3 1 1 7 2642 1 1 2 LYS N N -24.556 -3.243 -5.988 1.00 . A A . 2 LYS N 1 1 7 2643 1 1 2 LYS NZ N -24.859 1.200 -3.702 1.00 . A A . 2 LYS NZ 1 1 7 2644 1 1 2 LYS O O -22.082 -4.092 -5.316 1.00 . A A . 2 LYS O 1 1 7 2645 1 1 3 ALA C C -19.321 -2.627 -4.682 1.00 . A A . 3 ALA C 1 1 7 2646 1 1 3 ALA CA C -19.691 -2.975 -6.113 1.00 . A A . 3 ALA CA 1 1 7 2647 1 1 3 ALA CB C -18.656 -2.387 -7.081 1.00 . A A . 3 ALA CB 1 1 7 2648 1 1 3 ALA H H -21.089 -1.605 -6.909 1.00 . A A . 3 ALA H 1 1 7 2649 1 1 3 ALA HA H -19.709 -4.048 -6.222 1.00 . A A . 3 ALA HA 1 1 7 2650 1 1 3 ALA HB1 H -19.155 -2.046 -7.975 1.00 . A A . 3 ALA HB1 1 1 7 2651 1 1 3 ALA HB2 H -17.932 -3.147 -7.339 1.00 . A A . 3 ALA HB2 1 1 7 2652 1 1 3 ALA HB3 H -18.149 -1.556 -6.612 1.00 . A A . 3 ALA HB3 1 1 7 2653 1 1 3 ALA N N -21.010 -2.438 -6.403 1.00 . A A . 3 ALA N 1 1 7 2654 1 1 3 ALA O O -18.815 -1.533 -4.408 1.00 . A A . 3 ALA O 1 1 7 2655 1 1 4 LEU C C -17.786 -3.164 -2.173 1.00 . A A . 4 LEU C 1 1 7 2656 1 1 4 LEU CA C -19.288 -3.322 -2.363 1.00 . A A . 4 LEU CA 1 1 7 2657 1 1 4 LEU CB C -19.804 -4.484 -1.506 1.00 . A A . 4 LEU CB 1 1 7 2658 1 1 4 LEU CD1 C -21.801 -5.905 -1.036 1.00 . A A . 4 LEU CD1 1 1 7 2659 1 1 4 LEU CD2 C -22.044 -3.427 -1.115 1.00 . A A . 4 LEU CD2 1 1 7 2660 1 1 4 LEU CG C -21.313 -4.632 -1.717 1.00 . A A . 4 LEU CG 1 1 7 2661 1 1 4 LEU H H -20.002 -4.396 -4.043 1.00 . A A . 4 LEU H 1 1 7 2662 1 1 4 LEU HA H -19.776 -2.412 -2.046 1.00 . A A . 4 LEU HA 1 1 7 2663 1 1 4 LEU HB2 H -19.304 -5.396 -1.796 1.00 . A A . 4 LEU HB2 1 1 7 2664 1 1 4 LEU HB3 H -19.606 -4.279 -0.462 1.00 . A A . 4 LEU HB3 1 1 7 2665 1 1 4 LEU HD11 H -21.294 -6.759 -1.463 1.00 . A A . 4 LEU HD11 1 1 7 2666 1 1 4 LEU HD12 H -22.864 -6.005 -1.187 1.00 . A A . 4 LEU HD12 1 1 7 2667 1 1 4 LEU HD13 H -21.588 -5.854 0.021 1.00 . A A . 4 LEU HD13 1 1 7 2668 1 1 4 LEU HD21 H -22.052 -2.618 -1.827 1.00 . A A . 4 LEU HD21 1 1 7 2669 1 1 4 LEU HD22 H -21.541 -3.112 -0.211 1.00 . A A . 4 LEU HD22 1 1 7 2670 1 1 4 LEU HD23 H -23.060 -3.706 -0.878 1.00 . A A . 4 LEU HD23 1 1 7 2671 1 1 4 LEU HG H -21.523 -4.690 -2.775 1.00 . A A . 4 LEU HG 1 1 7 2672 1 1 4 LEU N N -19.588 -3.551 -3.769 1.00 . A A . 4 LEU N 1 1 7 2673 1 1 4 LEU O O -17.060 -2.861 -3.124 1.00 . A A . 4 LEU O 1 1 7 2674 1 1 5 LEU C C -15.515 -1.756 -0.711 1.00 . A A . 5 LEU C 1 1 7 2675 1 1 5 LEU CA C -15.906 -3.227 -0.645 1.00 . A A . 5 LEU CA 1 1 7 2676 1 1 5 LEU CB C -15.055 -4.035 -1.636 1.00 . A A . 5 LEU CB 1 1 7 2677 1 1 5 LEU CD1 C -14.938 -6.182 -0.363 1.00 . A A . 5 LEU CD1 1 1 7 2678 1 1 5 LEU CD2 C -13.024 -5.486 -1.808 1.00 . A A . 5 LEU CD2 1 1 7 2679 1 1 5 LEU CG C -14.130 -4.989 -0.872 1.00 . A A . 5 LEU CG 1 1 7 2680 1 1 5 LEU H H -17.951 -3.597 -0.232 1.00 . A A . 5 LEU H 1 1 7 2681 1 1 5 LEU HA H -15.727 -3.595 0.354 1.00 . A A . 5 LEU HA 1 1 7 2682 1 1 5 LEU HB2 H -15.701 -4.607 -2.287 1.00 . A A . 5 LEU HB2 1 1 7 2683 1 1 5 LEU HB3 H -14.458 -3.357 -2.231 1.00 . A A . 5 LEU HB3 1 1 7 2684 1 1 5 LEU HD11 H -15.345 -6.725 -1.203 1.00 . A A . 5 LEU HD11 1 1 7 2685 1 1 5 LEU HD12 H -15.743 -5.828 0.262 1.00 . A A . 5 LEU HD12 1 1 7 2686 1 1 5 LEU HD13 H -14.297 -6.834 0.208 1.00 . A A . 5 LEU HD13 1 1 7 2687 1 1 5 LEU HD21 H -12.312 -4.695 -1.973 1.00 . A A . 5 LEU HD21 1 1 7 2688 1 1 5 LEU HD22 H -13.455 -5.786 -2.753 1.00 . A A . 5 LEU HD22 1 1 7 2689 1 1 5 LEU HD23 H -12.523 -6.332 -1.358 1.00 . A A . 5 LEU HD23 1 1 7 2690 1 1 5 LEU HG H -13.685 -4.472 -0.030 1.00 . A A . 5 LEU HG 1 1 7 2691 1 1 5 LEU N N -17.325 -3.364 -0.950 1.00 . A A . 5 LEU N 1 1 7 2692 1 1 5 LEU O O -16.281 -0.926 -1.213 1.00 . A A . 5 LEU O 1 1 7 2693 1 1 6 ALA C C -12.368 -0.010 -0.464 1.00 . A A . 6 ALA C 1 1 7 2694 1 1 6 ALA CA C -13.869 -0.053 -0.219 1.00 . A A . 6 ALA CA 1 1 7 2695 1 1 6 ALA CB C -14.194 0.612 1.122 1.00 . A A . 6 ALA CB 1 1 7 2696 1 1 6 ALA H H -13.766 -2.129 0.183 1.00 . A A . 6 ALA H 1 1 7 2697 1 1 6 ALA HA H -14.371 0.489 -1.009 1.00 . A A . 6 ALA HA 1 1 7 2698 1 1 6 ALA HB1 H -13.284 0.746 1.691 1.00 . A A . 6 ALA HB1 1 1 7 2699 1 1 6 ALA HB2 H -14.874 -0.014 1.678 1.00 . A A . 6 ALA HB2 1 1 7 2700 1 1 6 ALA HB3 H -14.651 1.572 0.945 1.00 . A A . 6 ALA HB3 1 1 7 2701 1 1 6 ALA N N -14.336 -1.431 -0.206 1.00 . A A . 6 ALA N 1 1 7 2702 1 1 6 ALA O O -11.797 -0.947 -1.018 1.00 . A A . 6 ALA O 1 1 7 2703 1 1 7 LEU C C -9.576 0.360 0.836 1.00 . A A . 7 LEU C 1 1 7 2704 1 1 7 LEU CA C -10.292 1.197 -0.217 1.00 . A A . 7 LEU CA 1 1 7 2705 1 1 7 LEU CB C -9.868 2.665 -0.099 1.00 . A A . 7 LEU CB 1 1 7 2706 1 1 7 LEU CD1 C -8.408 4.428 -1.094 1.00 . A A . 7 LEU CD1 1 1 7 2707 1 1 7 LEU CD2 C -8.077 2.071 -1.787 1.00 . A A . 7 LEU CD2 1 1 7 2708 1 1 7 LEU CG C -9.123 3.112 -1.368 1.00 . A A . 7 LEU CG 1 1 7 2709 1 1 7 LEU H H -12.229 1.786 0.404 1.00 . A A . 7 LEU H 1 1 7 2710 1 1 7 LEU HA H -10.030 0.834 -1.198 1.00 . A A . 7 LEU HA 1 1 7 2711 1 1 7 LEU HB2 H -10.747 3.278 0.028 1.00 . A A . 7 LEU HB2 1 1 7 2712 1 1 7 LEU HB3 H -9.223 2.789 0.758 1.00 . A A . 7 LEU HB3 1 1 7 2713 1 1 7 LEU HD11 H -8.138 4.891 -2.030 1.00 . A A . 7 LEU HD11 1 1 7 2714 1 1 7 LEU HD12 H -7.515 4.238 -0.515 1.00 . A A . 7 LEU HD12 1 1 7 2715 1 1 7 LEU HD13 H -9.062 5.086 -0.541 1.00 . A A . 7 LEU HD13 1 1 7 2716 1 1 7 LEU HD21 H -7.247 2.574 -2.263 1.00 . A A . 7 LEU HD21 1 1 7 2717 1 1 7 LEU HD22 H -8.523 1.378 -2.485 1.00 . A A . 7 LEU HD22 1 1 7 2718 1 1 7 LEU HD23 H -7.724 1.537 -0.920 1.00 . A A . 7 LEU HD23 1 1 7 2719 1 1 7 LEU HG H -9.835 3.251 -2.170 1.00 . A A . 7 LEU HG 1 1 7 2720 1 1 7 LEU N N -11.730 1.071 -0.041 1.00 . A A . 7 LEU N 1 1 7 2721 1 1 7 LEU O O -9.961 0.359 2.005 1.00 . A A . 7 LEU O 1 1 7 2722 1 1 8 ALA C C -6.669 -1.927 0.600 1.00 . A A . 8 ALA C 1 1 7 2723 1 1 8 ALA CA C -7.777 -1.201 1.335 1.00 . A A . 8 ALA CA 1 1 7 2724 1 1 8 ALA CB C -8.699 -2.230 2.003 1.00 . A A . 8 ALA CB 1 1 7 2725 1 1 8 ALA H H -8.285 -0.313 -0.532 1.00 . A A . 8 ALA H 1 1 7 2726 1 1 8 ALA HA H -7.339 -0.581 2.095 1.00 . A A . 8 ALA HA 1 1 7 2727 1 1 8 ALA HB1 H -8.112 -3.066 2.353 1.00 . A A . 8 ALA HB1 1 1 7 2728 1 1 8 ALA HB2 H -9.432 -2.579 1.290 1.00 . A A . 8 ALA HB2 1 1 7 2729 1 1 8 ALA HB3 H -9.203 -1.770 2.838 1.00 . A A . 8 ALA HB3 1 1 7 2730 1 1 8 ALA N N -8.542 -0.356 0.413 1.00 . A A . 8 ALA N 1 1 7 2731 1 1 8 ALA O O -5.610 -2.202 1.154 1.00 . A A . 8 ALA O 1 1 7 2732 1 1 9 LEU C C -4.868 -1.949 -1.916 1.00 . A A . 9 LEU C 1 1 7 2733 1 1 9 LEU CA C -5.952 -2.906 -1.483 1.00 . A A . 9 LEU CA 1 1 7 2734 1 1 9 LEU CB C -6.651 -3.461 -2.709 1.00 . A A . 9 LEU CB 1 1 7 2735 1 1 9 LEU CD1 C -6.695 -5.330 -4.375 1.00 . A A . 9 LEU CD1 1 1 7 2736 1 1 9 LEU CD2 C -4.504 -4.566 -3.452 1.00 . A A . 9 LEU CD2 1 1 7 2737 1 1 9 LEU CG C -5.992 -4.780 -3.134 1.00 . A A . 9 LEU CG 1 1 7 2738 1 1 9 LEU H H -7.792 -1.969 -1.034 1.00 . A A . 9 LEU H 1 1 7 2739 1 1 9 LEU HA H -5.511 -3.712 -0.928 1.00 . A A . 9 LEU HA 1 1 7 2740 1 1 9 LEU HB2 H -7.688 -3.632 -2.461 1.00 . A A . 9 LEU HB2 1 1 7 2741 1 1 9 LEU HB3 H -6.584 -2.740 -3.510 1.00 . A A . 9 LEU HB3 1 1 7 2742 1 1 9 LEU HD11 H -6.592 -6.406 -4.394 1.00 . A A . 9 LEU HD11 1 1 7 2743 1 1 9 LEU HD12 H -6.249 -4.909 -5.263 1.00 . A A . 9 LEU HD12 1 1 7 2744 1 1 9 LEU HD13 H -7.743 -5.071 -4.339 1.00 . A A . 9 LEU HD13 1 1 7 2745 1 1 9 LEU HD21 H -4.141 -5.395 -4.044 1.00 . A A . 9 LEU HD21 1 1 7 2746 1 1 9 LEU HD22 H -3.941 -4.512 -2.530 1.00 . A A . 9 LEU HD22 1 1 7 2747 1 1 9 LEU HD23 H -4.378 -3.646 -4.005 1.00 . A A . 9 LEU HD23 1 1 7 2748 1 1 9 LEU HG H -6.087 -5.496 -2.330 1.00 . A A . 9 LEU HG 1 1 7 2749 1 1 9 LEU N N -6.924 -2.221 -0.653 1.00 . A A . 9 LEU N 1 1 7 2750 1 1 9 LEU O O -3.700 -2.114 -1.571 1.00 . A A . 9 LEU O 1 1 7 2751 1 1 10 HIS C C -3.582 0.569 -1.915 1.00 . A A . 10 HIS C 1 1 7 2752 1 1 10 HIS CA C -4.321 0.065 -3.125 1.00 . A A . 10 HIS CA 1 1 7 2753 1 1 10 HIS CB C -5.040 1.224 -3.798 1.00 . A A . 10 HIS CB 1 1 7 2754 1 1 10 HIS CD2 C -6.698 0.548 -5.722 1.00 . A A . 10 HIS CD2 1 1 7 2755 1 1 10 HIS CE1 C -5.243 0.284 -7.309 1.00 . A A . 10 HIS CE1 1 1 7 2756 1 1 10 HIS CG C -5.465 0.821 -5.183 1.00 . A A . 10 HIS CG 1 1 7 2757 1 1 10 HIS H H -6.222 -0.852 -2.880 1.00 . A A . 10 HIS H 1 1 7 2758 1 1 10 HIS HA H -3.625 -0.387 -3.814 1.00 . A A . 10 HIS HA 1 1 7 2759 1 1 10 HIS HB2 H -5.907 1.496 -3.215 1.00 . A A . 10 HIS HB2 1 1 7 2760 1 1 10 HIS HB3 H -4.368 2.064 -3.853 1.00 . A A . 10 HIS HB3 1 1 7 2761 1 1 10 HIS HD1 H -3.579 0.772 -6.151 1.00 . A A . 10 HIS HD1 1 1 7 2762 1 1 10 HIS HD2 H -7.637 0.591 -5.185 1.00 . A A . 10 HIS HD2 1 1 7 2763 1 1 10 HIS HE1 H -4.788 0.071 -8.269 1.00 . A A . 10 HIS HE1 1 1 7 2764 1 1 10 HIS HE2 H -7.273 -0.024 -7.701 1.00 . A A . 10 HIS HE2 1 1 7 2765 1 1 10 HIS N N -5.271 -0.934 -2.663 1.00 . A A . 10 HIS N 1 1 7 2766 1 1 10 HIS ND1 N -4.553 0.648 -6.211 1.00 . A A . 10 HIS ND1 1 1 7 2767 1 1 10 HIS NE2 N -6.557 0.210 -7.065 1.00 . A A . 10 HIS NE2 1 1 7 2768 1 1 10 HIS O O -2.375 0.784 -1.922 1.00 . A A . 10 HIS O 1 1 7 2769 1 1 11 HIS C C -2.522 0.457 0.700 1.00 . A A . 11 HIS C 1 1 7 2770 1 1 11 HIS CA C -3.859 1.118 0.427 1.00 . A A . 11 HIS CA 1 1 7 2771 1 1 11 HIS CB C -4.857 0.652 1.473 1.00 . A A . 11 HIS CB 1 1 7 2772 1 1 11 HIS CD2 C -6.836 2.331 1.830 1.00 . A A . 11 HIS CD2 1 1 7 2773 1 1 11 HIS CE1 C -5.909 3.619 3.308 1.00 . A A . 11 HIS CE1 1 1 7 2774 1 1 11 HIS CG C -5.579 1.832 2.059 1.00 . A A . 11 HIS CG 1 1 7 2775 1 1 11 HIS H H -5.301 0.469 -0.950 1.00 . A A . 11 HIS H 1 1 7 2776 1 1 11 HIS HA H -3.761 2.188 0.461 1.00 . A A . 11 HIS HA 1 1 7 2777 1 1 11 HIS HB2 H -5.571 -0.016 0.995 1.00 . A A . 11 HIS HB2 1 1 7 2778 1 1 11 HIS HB3 H -4.332 0.119 2.253 1.00 . A A . 11 HIS HB3 1 1 7 2779 1 1 11 HIS HD1 H -4.101 2.580 3.386 1.00 . A A . 11 HIS HD1 1 1 7 2780 1 1 11 HIS HD2 H -7.555 1.903 1.148 1.00 . A A . 11 HIS HD2 1 1 7 2781 1 1 11 HIS HE1 H -5.738 4.413 4.024 1.00 . A A . 11 HIS HE1 1 1 7 2782 1 1 11 HIS HE2 H -7.850 4.025 2.656 1.00 . A A . 11 HIS HE2 1 1 7 2783 1 1 11 HIS N N -4.355 0.698 -0.860 1.00 . A A . 11 HIS N 1 1 7 2784 1 1 11 HIS ND1 N -5.002 2.666 3.005 1.00 . A A . 11 HIS ND1 1 1 7 2785 1 1 11 HIS NE2 N -7.044 3.461 2.619 1.00 . A A . 11 HIS NE2 1 1 7 2786 1 1 11 HIS O O -1.586 1.080 1.198 1.00 . A A . 11 HIS O 1 1 7 2787 1 1 12 LEU C C -0.270 -1.260 -0.558 1.00 . A A . 12 LEU C 1 1 7 2788 1 1 12 LEU CA C -1.244 -1.590 0.548 1.00 . A A . 12 LEU CA 1 1 7 2789 1 1 12 LEU CB C -1.565 -3.087 0.522 1.00 . A A . 12 LEU CB 1 1 7 2790 1 1 12 LEU CD1 C -3.251 -4.761 1.298 1.00 . A A . 12 LEU CD1 1 1 7 2791 1 1 12 LEU CD2 C -1.879 -3.512 2.969 1.00 . A A . 12 LEU CD2 1 1 7 2792 1 1 12 LEU CG C -2.587 -3.421 1.614 1.00 . A A . 12 LEU CG 1 1 7 2793 1 1 12 LEU H H -3.247 -1.237 -0.052 1.00 . A A . 12 LEU H 1 1 7 2794 1 1 12 LEU HA H -0.806 -1.331 1.498 1.00 . A A . 12 LEU HA 1 1 7 2795 1 1 12 LEU HB2 H -1.974 -3.344 -0.445 1.00 . A A . 12 LEU HB2 1 1 7 2796 1 1 12 LEU HB3 H -0.660 -3.651 0.691 1.00 . A A . 12 LEU HB3 1 1 7 2797 1 1 12 LEU HD11 H -3.847 -5.074 2.141 1.00 . A A . 12 LEU HD11 1 1 7 2798 1 1 12 LEU HD12 H -2.489 -5.503 1.103 1.00 . A A . 12 LEU HD12 1 1 7 2799 1 1 12 LEU HD13 H -3.882 -4.656 0.429 1.00 . A A . 12 LEU HD13 1 1 7 2800 1 1 12 LEU HD21 H -2.520 -4.018 3.675 1.00 . A A . 12 LEU HD21 1 1 7 2801 1 1 12 LEU HD22 H -1.660 -2.518 3.327 1.00 . A A . 12 LEU HD22 1 1 7 2802 1 1 12 LEU HD23 H -0.958 -4.066 2.859 1.00 . A A . 12 LEU HD23 1 1 7 2803 1 1 12 LEU HG H -3.341 -2.648 1.652 1.00 . A A . 12 LEU HG 1 1 7 2804 1 1 12 LEU N N -2.458 -0.814 0.355 1.00 . A A . 12 LEU N 1 1 7 2805 1 1 12 LEU O O 0.898 -0.956 -0.315 1.00 . A A . 12 LEU O 1 1 7 2806 1 1 13 ALA C C 0.721 0.370 -2.675 1.00 . A A . 13 ALA C 1 1 7 2807 1 1 13 ALA CA C 0.029 -0.959 -2.938 1.00 . A A . 13 ALA CA 1 1 7 2808 1 1 13 ALA CB C -0.851 -0.850 -4.186 1.00 . A A . 13 ALA CB 1 1 7 2809 1 1 13 ALA H H -1.733 -1.512 -1.872 1.00 . A A . 13 ALA H 1 1 7 2810 1 1 13 ALA HA H 0.773 -1.725 -3.085 1.00 . A A . 13 ALA HA 1 1 7 2811 1 1 13 ALA HB1 H -1.399 0.080 -4.158 1.00 . A A . 13 ALA HB1 1 1 7 2812 1 1 13 ALA HB2 H -1.546 -1.676 -4.211 1.00 . A A . 13 ALA HB2 1 1 7 2813 1 1 13 ALA HB3 H -0.231 -0.878 -5.069 1.00 . A A . 13 ALA HB3 1 1 7 2814 1 1 13 ALA N N -0.781 -1.291 -1.771 1.00 . A A . 13 ALA N 1 1 7 2815 1 1 13 ALA O O 1.841 0.618 -3.117 1.00 . A A . 13 ALA O 1 1 7 2816 1 1 14 HIS C C 1.681 2.345 -0.586 1.00 . A A . 14 HIS C 1 1 7 2817 1 1 14 HIS CA C 0.526 2.512 -1.550 1.00 . A A . 14 HIS CA 1 1 7 2818 1 1 14 HIS CB C -0.607 3.306 -0.914 1.00 . A A . 14 HIS CB 1 1 7 2819 1 1 14 HIS CD2 C -0.478 4.307 1.499 1.00 . A A . 14 HIS CD2 1 1 7 2820 1 1 14 HIS CE1 C 1.132 5.721 1.180 1.00 . A A . 14 HIS CE1 1 1 7 2821 1 1 14 HIS CG C -0.098 4.188 0.187 1.00 . A A . 14 HIS CG 1 1 7 2822 1 1 14 HIS H H -0.860 0.924 -1.602 1.00 . A A . 14 HIS H 1 1 7 2823 1 1 14 HIS HA H 0.872 3.026 -2.428 1.00 . A A . 14 HIS HA 1 1 7 2824 1 1 14 HIS HB2 H -1.058 3.902 -1.670 1.00 . A A . 14 HIS HB2 1 1 7 2825 1 1 14 HIS HB3 H -1.339 2.623 -0.516 1.00 . A A . 14 HIS HB3 1 1 7 2826 1 1 14 HIS HD1 H 1.433 5.250 -0.830 1.00 . A A . 14 HIS HD1 1 1 7 2827 1 1 14 HIS HD2 H -1.249 3.715 1.976 1.00 . A A . 14 HIS HD2 1 1 7 2828 1 1 14 HIS HE1 H 1.881 6.483 1.342 1.00 . A A . 14 HIS HE1 1 1 7 2829 1 1 14 HIS HE2 H 0.247 5.565 3.066 1.00 . A A . 14 HIS HE2 1 1 7 2830 1 1 14 HIS N N 0.024 1.205 -1.924 1.00 . A A . 14 HIS N 1 1 7 2831 1 1 14 HIS ND1 N 0.931 5.097 0.003 1.00 . A A . 14 HIS ND1 1 1 7 2832 1 1 14 HIS NE2 N 0.299 5.274 2.127 1.00 . A A . 14 HIS NE2 1 1 7 2833 1 1 14 HIS O O 2.779 2.861 -0.802 1.00 . A A . 14 HIS O 1 1 7 2834 1 1 15 LEU C C 3.615 0.671 0.630 1.00 . A A . 15 LEU C 1 1 7 2835 1 1 15 LEU CA C 2.495 1.295 1.408 1.00 . A A . 15 LEU CA 1 1 7 2836 1 1 15 LEU CB C 2.021 0.273 2.445 1.00 . A A . 15 LEU CB 1 1 7 2837 1 1 15 LEU CD1 C 0.755 2.320 3.217 1.00 . A A . 15 LEU CD1 1 1 7 2838 1 1 15 LEU CD2 C 0.024 0.048 3.921 1.00 . A A . 15 LEU CD2 1 1 7 2839 1 1 15 LEU CG C 1.237 0.923 3.598 1.00 . A A . 15 LEU CG 1 1 7 2840 1 1 15 LEU H H 0.569 1.155 0.547 1.00 . A A . 15 LEU H 1 1 7 2841 1 1 15 LEU HA H 2.833 2.201 1.875 1.00 . A A . 15 LEU HA 1 1 7 2842 1 1 15 LEU HB2 H 1.386 -0.449 1.952 1.00 . A A . 15 LEU HB2 1 1 7 2843 1 1 15 LEU HB3 H 2.882 -0.240 2.846 1.00 . A A . 15 LEU HB3 1 1 7 2844 1 1 15 LEU HD11 H 0.297 2.282 2.245 1.00 . A A . 15 LEU HD11 1 1 7 2845 1 1 15 LEU HD12 H 1.595 3.002 3.201 1.00 . A A . 15 LEU HD12 1 1 7 2846 1 1 15 LEU HD13 H 0.031 2.660 3.943 1.00 . A A . 15 LEU HD13 1 1 7 2847 1 1 15 LEU HD21 H 0.298 -0.993 3.832 1.00 . A A . 15 LEU HD21 1 1 7 2848 1 1 15 LEU HD22 H -0.776 0.270 3.228 1.00 . A A . 15 LEU HD22 1 1 7 2849 1 1 15 LEU HD23 H -0.308 0.247 4.927 1.00 . A A . 15 LEU HD23 1 1 7 2850 1 1 15 LEU HG H 1.871 0.989 4.465 1.00 . A A . 15 LEU HG 1 1 7 2851 1 1 15 LEU N N 1.444 1.574 0.452 1.00 . A A . 15 LEU N 1 1 7 2852 1 1 15 LEU O O 4.798 0.883 0.891 1.00 . A A . 15 LEU O 1 1 7 2853 1 1 16 ALA C C 4.894 0.201 -2.049 1.00 . A A . 16 ALA C 1 1 7 2854 1 1 16 ALA CA C 4.129 -0.797 -1.204 1.00 . A A . 16 ALA CA 1 1 7 2855 1 1 16 ALA CB C 3.386 -1.784 -2.109 1.00 . A A . 16 ALA CB 1 1 7 2856 1 1 16 ALA H H 2.215 -0.197 -0.477 1.00 . A A . 16 ALA H 1 1 7 2857 1 1 16 ALA HA H 4.825 -1.340 -0.590 1.00 . A A . 16 ALA HA 1 1 7 2858 1 1 16 ALA HB1 H 4.044 -2.600 -2.366 1.00 . A A . 16 ALA HB1 1 1 7 2859 1 1 16 ALA HB2 H 3.070 -1.277 -3.010 1.00 . A A . 16 ALA HB2 1 1 7 2860 1 1 16 ALA HB3 H 2.523 -2.168 -1.588 1.00 . A A . 16 ALA HB3 1 1 7 2861 1 1 16 ALA N N 3.197 -0.102 -0.343 1.00 . A A . 16 ALA N 1 1 7 2862 1 1 16 ALA O O 6.062 -0.006 -2.373 1.00 . A A . 16 ALA O 1 1 7 2863 1 1 17 LEU C C 6.066 2.864 -2.537 1.00 . A A . 17 LEU C 1 1 7 2864 1 1 17 LEU CA C 4.832 2.313 -3.213 1.00 . A A . 17 LEU CA 1 1 7 2865 1 1 17 LEU CB C 3.806 3.423 -3.511 1.00 . A A . 17 LEU CB 1 1 7 2866 1 1 17 LEU CD1 C 3.963 5.734 -4.470 1.00 . A A . 17 LEU CD1 1 1 7 2867 1 1 17 LEU CD2 C 3.895 5.427 -2.001 1.00 . A A . 17 LEU CD2 1 1 7 2868 1 1 17 LEU CG C 4.403 4.832 -3.318 1.00 . A A . 17 LEU CG 1 1 7 2869 1 1 17 LEU H H 3.295 1.380 -2.106 1.00 . A A . 17 LEU H 1 1 7 2870 1 1 17 LEU HA H 5.139 1.867 -4.138 1.00 . A A . 17 LEU HA 1 1 7 2871 1 1 17 LEU HB2 H 3.471 3.319 -4.530 1.00 . A A . 17 LEU HB2 1 1 7 2872 1 1 17 LEU HB3 H 2.961 3.306 -2.851 1.00 . A A . 17 LEU HB3 1 1 7 2873 1 1 17 LEU HD11 H 4.349 6.731 -4.317 1.00 . A A . 17 LEU HD11 1 1 7 2874 1 1 17 LEU HD12 H 2.886 5.770 -4.510 1.00 . A A . 17 LEU HD12 1 1 7 2875 1 1 17 LEU HD13 H 4.345 5.338 -5.400 1.00 . A A . 17 LEU HD13 1 1 7 2876 1 1 17 LEU HD21 H 4.120 4.754 -1.191 1.00 . A A . 17 LEU HD21 1 1 7 2877 1 1 17 LEU HD22 H 2.827 5.572 -2.060 1.00 . A A . 17 LEU HD22 1 1 7 2878 1 1 17 LEU HD23 H 4.378 6.377 -1.826 1.00 . A A . 17 LEU HD23 1 1 7 2879 1 1 17 LEU HG H 5.482 4.785 -3.303 1.00 . A A . 17 LEU HG 1 1 7 2880 1 1 17 LEU N N 4.223 1.281 -2.398 1.00 . A A . 17 LEU N 1 1 7 2881 1 1 17 LEU O O 7.133 2.936 -3.151 1.00 . A A . 17 LEU O 1 1 7 2882 1 1 18 HIS C C 8.019 2.644 -0.230 1.00 . A A . 18 HIS C 1 1 7 2883 1 1 18 HIS CA C 7.111 3.776 -0.599 1.00 . A A . 18 HIS CA 1 1 7 2884 1 1 18 HIS CB C 6.716 4.601 0.606 1.00 . A A . 18 HIS CB 1 1 7 2885 1 1 18 HIS CD2 C 4.895 3.332 1.963 1.00 . A A . 18 HIS CD2 1 1 7 2886 1 1 18 HIS CE1 C 6.120 2.684 3.629 1.00 . A A . 18 HIS CE1 1 1 7 2887 1 1 18 HIS CG C 6.165 3.764 1.713 1.00 . A A . 18 HIS CG 1 1 7 2888 1 1 18 HIS H H 5.075 3.160 -0.820 1.00 . A A . 18 HIS H 1 1 7 2889 1 1 18 HIS HA H 7.640 4.417 -1.289 1.00 . A A . 18 HIS HA 1 1 7 2890 1 1 18 HIS HB2 H 7.573 5.144 0.961 1.00 . A A . 18 HIS HB2 1 1 7 2891 1 1 18 HIS HB3 H 5.965 5.283 0.289 1.00 . A A . 18 HIS HB3 1 1 7 2892 1 1 18 HIS HD1 H 7.900 3.495 2.906 1.00 . A A . 18 HIS HD1 1 1 7 2893 1 1 18 HIS HD2 H 4.046 3.494 1.306 1.00 . A A . 18 HIS HD2 1 1 7 2894 1 1 18 HIS HE1 H 6.447 2.223 4.547 1.00 . A A . 18 HIS HE1 1 1 7 2895 1 1 18 HIS HE2 H 4.083 2.244 3.611 1.00 . A A . 18 HIS HE2 1 1 7 2896 1 1 18 HIS N N 5.945 3.246 -1.283 1.00 . A A . 18 HIS N 1 1 7 2897 1 1 18 HIS ND1 N 6.937 3.339 2.782 1.00 . A A . 18 HIS ND1 1 1 7 2898 1 1 18 HIS NE2 N 4.862 2.652 3.177 1.00 . A A . 18 HIS NE2 1 1 7 2899 1 1 18 HIS O O 9.236 2.717 -0.412 1.00 . A A . 18 HIS O 1 1 7 2900 1 1 19 LEU C C 9.058 0.070 -0.651 1.00 . A A . 19 LEU C 1 1 7 2901 1 1 19 LEU CA C 8.181 0.376 0.545 1.00 . A A . 19 LEU CA 1 1 7 2902 1 1 19 LEU CB C 7.259 -0.823 0.782 1.00 . A A . 19 LEU CB 1 1 7 2903 1 1 19 LEU CD1 C 8.660 -1.450 2.752 1.00 . A A . 19 LEU CD1 1 1 7 2904 1 1 19 LEU CD2 C 6.611 -0.056 3.064 1.00 . A A . 19 LEU CD2 1 1 7 2905 1 1 19 LEU CG C 7.236 -1.196 2.259 1.00 . A A . 19 LEU CG 1 1 7 2906 1 1 19 LEU H H 6.431 1.573 0.304 1.00 . A A . 19 LEU H 1 1 7 2907 1 1 19 LEU HA H 8.792 0.554 1.413 1.00 . A A . 19 LEU HA 1 1 7 2908 1 1 19 LEU HB2 H 6.262 -0.578 0.463 1.00 . A A . 19 LEU HB2 1 1 7 2909 1 1 19 LEU HB3 H 7.618 -1.666 0.208 1.00 . A A . 19 LEU HB3 1 1 7 2910 1 1 19 LEU HD11 H 9.032 -0.566 3.245 1.00 . A A . 19 LEU HD11 1 1 7 2911 1 1 19 LEU HD12 H 9.295 -1.687 1.910 1.00 . A A . 19 LEU HD12 1 1 7 2912 1 1 19 LEU HD13 H 8.658 -2.275 3.447 1.00 . A A . 19 LEU HD13 1 1 7 2913 1 1 19 LEU HD21 H 7.274 0.228 3.870 1.00 . A A . 19 LEU HD21 1 1 7 2914 1 1 19 LEU HD22 H 5.664 -0.379 3.471 1.00 . A A . 19 LEU HD22 1 1 7 2915 1 1 19 LEU HD23 H 6.450 0.793 2.417 1.00 . A A . 19 LEU HD23 1 1 7 2916 1 1 19 LEU HG H 6.650 -2.087 2.380 1.00 . A A . 19 LEU HG 1 1 7 2917 1 1 19 LEU N N 7.412 1.570 0.224 1.00 . A A . 19 LEU N 1 1 7 2918 1 1 19 LEU O O 10.180 -0.425 -0.530 1.00 . A A . 19 LEU O 1 1 7 2919 1 1 20 ALA C C 10.398 1.137 -3.151 1.00 . A A . 20 ALA C 1 1 7 2920 1 1 20 ALA CA C 9.228 0.179 -3.070 1.00 . A A . 20 ALA CA 1 1 7 2921 1 1 20 ALA CB C 8.301 0.406 -4.263 1.00 . A A . 20 ALA CB 1 1 7 2922 1 1 20 ALA H H 7.612 0.808 -1.813 1.00 . A A . 20 ALA H 1 1 7 2923 1 1 20 ALA HA H 9.596 -0.829 -3.095 1.00 . A A . 20 ALA HA 1 1 7 2924 1 1 20 ALA HB1 H 8.092 -0.538 -4.741 1.00 . A A . 20 ALA HB1 1 1 7 2925 1 1 20 ALA HB2 H 8.778 1.068 -4.970 1.00 . A A . 20 ALA HB2 1 1 7 2926 1 1 20 ALA HB3 H 7.379 0.848 -3.924 1.00 . A A . 20 ALA HB3 1 1 7 2927 1 1 20 ALA N N 8.516 0.397 -1.812 1.00 . A A . 20 ALA N 1 1 7 2928 1 1 20 ALA O O 11.557 0.728 -3.237 1.00 . A A . 20 ALA O 1 1 7 2929 1 1 21 LEU C C 12.171 3.141 -2.152 1.00 . A A . 21 LEU C 1 1 7 2930 1 1 21 LEU CA C 11.085 3.459 -3.159 1.00 . A A . 21 LEU CA 1 1 7 2931 1 1 21 LEU CB C 10.462 4.821 -2.835 1.00 . A A . 21 LEU CB 1 1 7 2932 1 1 21 LEU CD1 C 11.291 5.854 -4.967 1.00 . A A . 21 LEU CD1 1 1 7 2933 1 1 21 LEU CD2 C 9.113 4.626 -4.946 1.00 . A A . 21 LEU CD2 1 1 7 2934 1 1 21 LEU CG C 10.048 5.530 -4.133 1.00 . A A . 21 LEU CG 1 1 7 2935 1 1 21 LEU H H 9.125 2.659 -3.033 1.00 . A A . 21 LEU H 1 1 7 2936 1 1 21 LEU HA H 11.515 3.488 -4.141 1.00 . A A . 21 LEU HA 1 1 7 2937 1 1 21 LEU HB2 H 9.592 4.678 -2.209 1.00 . A A . 21 LEU HB2 1 1 7 2938 1 1 21 LEU HB3 H 11.182 5.431 -2.309 1.00 . A A . 21 LEU HB3 1 1 7 2939 1 1 21 LEU HD11 H 11.520 5.019 -5.615 1.00 . A A . 21 LEU HD11 1 1 7 2940 1 1 21 LEU HD12 H 12.128 6.042 -4.312 1.00 . A A . 21 LEU HD12 1 1 7 2941 1 1 21 LEU HD13 H 11.097 6.731 -5.566 1.00 . A A . 21 LEU HD13 1 1 7 2942 1 1 21 LEU HD21 H 8.212 4.439 -4.379 1.00 . A A . 21 LEU HD21 1 1 7 2943 1 1 21 LEU HD22 H 9.608 3.689 -5.159 1.00 . A A . 21 LEU HD22 1 1 7 2944 1 1 21 LEU HD23 H 8.856 5.114 -5.872 1.00 . A A . 21 LEU HD23 1 1 7 2945 1 1 21 LEU HG H 9.535 6.451 -3.889 1.00 . A A . 21 LEU HG 1 1 7 2946 1 1 21 LEU N N 10.071 2.416 -3.111 1.00 . A A . 21 LEU N 1 1 7 2947 1 1 21 LEU O O 13.362 3.256 -2.441 1.00 . A A . 21 LEU O 1 1 7 2948 1 1 22 ALA C C 13.704 1.385 -0.455 1.00 . A A . 22 ALA C 1 1 7 2949 1 1 22 ALA CA C 12.673 2.357 0.092 1.00 . A A . 22 ALA CA 1 1 7 2950 1 1 22 ALA CB C 11.928 1.711 1.270 1.00 . A A . 22 ALA CB 1 1 7 2951 1 1 22 ALA H H 10.774 2.638 -0.823 1.00 . A A . 22 ALA H 1 1 7 2952 1 1 22 ALA HA H 13.175 3.242 0.436 1.00 . A A . 22 ALA HA 1 1 7 2953 1 1 22 ALA HB1 H 12.480 0.849 1.617 1.00 . A A . 22 ALA HB1 1 1 7 2954 1 1 22 ALA HB2 H 10.946 1.399 0.952 1.00 . A A . 22 ALA HB2 1 1 7 2955 1 1 22 ALA HB3 H 11.836 2.423 2.074 1.00 . A A . 22 ALA HB3 1 1 7 2956 1 1 22 ALA N N 11.740 2.719 -0.971 1.00 . A A . 22 ALA N 1 1 7 2957 1 1 22 ALA O O 14.911 1.566 -0.278 1.00 . A A . 22 ALA O 1 1 7 2958 1 1 23 LEU C C 14.847 0.017 -2.876 1.00 . A A . 23 LEU C 1 1 7 2959 1 1 23 LEU CA C 14.076 -0.629 -1.748 1.00 . A A . 23 LEU CA 1 1 7 2960 1 1 23 LEU CB C 13.241 -1.782 -2.309 1.00 . A A . 23 LEU CB 1 1 7 2961 1 1 23 LEU CD1 C 12.011 -3.029 -0.526 1.00 . A A . 23 LEU CD1 1 1 7 2962 1 1 23 LEU CD2 C 13.409 -4.272 -2.174 1.00 . A A . 23 LEU CD2 1 1 7 2963 1 1 23 LEU CG C 13.291 -2.982 -1.359 1.00 . A A . 23 LEU CG 1 1 7 2964 1 1 23 LEU H H 12.237 0.306 -1.256 1.00 . A A . 23 LEU H 1 1 7 2965 1 1 23 LEU HA H 14.765 -1.002 -1.016 1.00 . A A . 23 LEU HA 1 1 7 2966 1 1 23 LEU HB2 H 12.217 -1.457 -2.429 1.00 . A A . 23 LEU HB2 1 1 7 2967 1 1 23 LEU HB3 H 13.636 -2.071 -3.271 1.00 . A A . 23 LEU HB3 1 1 7 2968 1 1 23 LEU HD11 H 12.069 -3.850 0.171 1.00 . A A . 23 LEU HD11 1 1 7 2969 1 1 23 LEU HD12 H 11.161 -3.172 -1.180 1.00 . A A . 23 LEU HD12 1 1 7 2970 1 1 23 LEU HD13 H 11.897 -2.104 0.014 1.00 . A A . 23 LEU HD13 1 1 7 2971 1 1 23 LEU HD21 H 13.462 -5.116 -1.505 1.00 . A A . 23 LEU HD21 1 1 7 2972 1 1 23 LEU HD22 H 14.305 -4.233 -2.778 1.00 . A A . 23 LEU HD22 1 1 7 2973 1 1 23 LEU HD23 H 12.545 -4.374 -2.817 1.00 . A A . 23 LEU HD23 1 1 7 2974 1 1 23 LEU HG H 14.145 -2.890 -0.702 1.00 . A A . 23 LEU HG 1 1 7 2975 1 1 23 LEU N N 13.208 0.370 -1.141 1.00 . A A . 23 LEU N 1 1 7 2976 1 1 23 LEU O O 16.074 -0.086 -2.963 1.00 . A A . 23 LEU O 1 1 7 2977 1 1 24 LYS C C 15.822 2.285 -4.415 1.00 . A A . 24 LYS C 1 1 7 2978 1 1 24 LYS CA C 14.698 1.372 -4.883 1.00 . A A . 24 LYS CA 1 1 7 2979 1 1 24 LYS CB C 13.636 2.200 -5.621 1.00 . A A . 24 LYS CB 1 1 7 2980 1 1 24 LYS CD C 13.939 3.826 -7.514 1.00 . A A . 24 LYS CD 1 1 7 2981 1 1 24 LYS CE C 15.265 4.535 -7.201 1.00 . A A . 24 LYS CE 1 1 7 2982 1 1 24 LYS CG C 14.025 2.351 -7.096 1.00 . A A . 24 LYS CG 1 1 7 2983 1 1 24 LYS H H 13.133 0.721 -3.601 1.00 . A A . 24 LYS H 1 1 7 2984 1 1 24 LYS HA H 15.105 0.638 -5.556 1.00 . A A . 24 LYS HA 1 1 7 2985 1 1 24 LYS HB2 H 12.679 1.698 -5.552 1.00 . A A . 24 LYS HB2 1 1 7 2986 1 1 24 LYS HB3 H 13.562 3.175 -5.166 1.00 . A A . 24 LYS HB3 1 1 7 2987 1 1 24 LYS HD2 H 13.738 3.888 -8.575 1.00 . A A . 24 LYS HD2 1 1 7 2988 1 1 24 LYS HD3 H 13.137 4.311 -6.973 1.00 . A A . 24 LYS HD3 1 1 7 2989 1 1 24 LYS HE2 H 15.242 5.534 -7.609 1.00 . A A . 24 LYS HE2 1 1 7 2990 1 1 24 LYS HE3 H 15.398 4.589 -6.131 1.00 . A A . 24 LYS HE3 1 1 7 2991 1 1 24 LYS HG2 H 15.033 1.996 -7.240 1.00 . A A . 24 LYS HG2 1 1 7 2992 1 1 24 LYS HG3 H 13.351 1.766 -7.704 1.00 . A A . 24 LYS HG3 1 1 7 2993 1 1 24 LYS HZ1 H 16.157 3.501 -8.777 1.00 . A A . 24 LYS HZ1 1 1 7 2994 1 1 24 LYS HZ2 H 16.605 2.933 -7.240 1.00 . A A . 24 LYS HZ2 1 1 7 2995 1 1 24 LYS HZ3 H 17.253 4.393 -7.829 1.00 . A A . 24 LYS HZ3 1 1 7 2996 1 1 24 LYS N N 14.106 0.686 -3.741 1.00 . A A . 24 LYS N 1 1 7 2997 1 1 24 LYS NZ N 16.399 3.783 -7.806 1.00 . A A . 24 LYS NZ 1 1 7 2998 1 1 24 LYS O O 16.838 2.434 -5.094 1.00 . A A . 24 LYS O 1 1 7 2999 1 1 25 LYS C C 17.077 4.818 -3.693 1.00 . A A . 25 LYS C 1 1 7 3000 1 1 25 LYS CA C 16.615 3.784 -2.670 1.00 . A A . 25 LYS CA 1 1 7 3001 1 1 25 LYS CB C 17.807 2.968 -2.157 1.00 . A A . 25 LYS CB 1 1 7 3002 1 1 25 LYS CD C 20.255 3.403 -1.759 1.00 . A A . 25 LYS CD 1 1 7 3003 1 1 25 LYS CE C 20.889 2.823 -0.492 1.00 . A A . 25 LYS CE 1 1 7 3004 1 1 25 LYS CG C 18.824 3.884 -1.458 1.00 . A A . 25 LYS CG 1 1 7 3005 1 1 25 LYS H H 14.784 2.718 -2.767 1.00 . A A . 25 LYS H 1 1 7 3006 1 1 25 LYS HA H 16.165 4.300 -1.836 1.00 . A A . 25 LYS HA 1 1 7 3007 1 1 25 LYS HB2 H 17.448 2.231 -1.457 1.00 . A A . 25 LYS HB2 1 1 7 3008 1 1 25 LYS HB3 H 18.282 2.469 -2.989 1.00 . A A . 25 LYS HB3 1 1 7 3009 1 1 25 LYS HD2 H 20.229 2.643 -2.529 1.00 . A A . 25 LYS HD2 1 1 7 3010 1 1 25 LYS HD3 H 20.848 4.238 -2.102 1.00 . A A . 25 LYS HD3 1 1 7 3011 1 1 25 LYS HE2 H 21.784 2.280 -0.754 1.00 . A A . 25 LYS HE2 1 1 7 3012 1 1 25 LYS HE3 H 21.143 3.628 0.181 1.00 . A A . 25 LYS HE3 1 1 7 3013 1 1 25 LYS HG2 H 18.705 4.898 -1.816 1.00 . A A . 25 LYS HG2 1 1 7 3014 1 1 25 LYS HG3 H 18.654 3.862 -0.392 1.00 . A A . 25 LYS HG3 1 1 7 3015 1 1 25 LYS HZ1 H 19.921 2.105 1.200 1.00 . A A . 25 LYS HZ1 1 1 7 3016 1 1 25 LYS HZ2 H 20.234 0.915 0.035 1.00 . A A . 25 LYS HZ2 1 1 7 3017 1 1 25 LYS HZ3 H 18.975 2.030 -0.204 1.00 . A A . 25 LYS HZ3 1 1 7 3018 1 1 25 LYS N N 15.624 2.887 -3.252 1.00 . A A . 25 LYS N 1 1 7 3019 1 1 25 LYS NZ N 19.933 1.900 0.182 1.00 . A A . 25 LYS NZ 1 1 7 3020 1 1 25 LYS O O 16.454 5.872 -3.844 1.00 . A A . 25 LYS O 1 1 7 3021 1 1 26 ALA C C 19.043 4.645 -6.667 1.00 . A A . 26 ALA C 1 1 7 3022 1 1 26 ALA CA C 18.704 5.416 -5.400 1.00 . A A . 26 ALA CA 1 1 7 3023 1 1 26 ALA CB C 19.968 6.105 -4.877 1.00 . A A . 26 ALA CB 1 1 7 3024 1 1 26 ALA H H 18.613 3.654 -4.231 1.00 . A A . 26 ALA H 1 1 7 3025 1 1 26 ALA HA H 17.964 6.169 -5.628 1.00 . A A . 26 ALA HA 1 1 7 3026 1 1 26 ALA HB1 H 19.793 6.475 -3.879 1.00 . A A . 26 ALA HB1 1 1 7 3027 1 1 26 ALA HB2 H 20.219 6.929 -5.527 1.00 . A A . 26 ALA HB2 1 1 7 3028 1 1 26 ALA HB3 H 20.784 5.397 -4.861 1.00 . A A . 26 ALA HB3 1 1 7 3029 1 1 26 ALA N N 18.164 4.511 -4.393 1.00 . A A . 26 ALA N 1 1 7 3030 1 1 26 ALA O O 18.509 4.980 -7.703 1.00 . A A . 26 ALA O 1 1 7 3031 1 1 26 ALA OXT O 19.823 3.718 -6.580 1.00 . A A . 26 ALA OXT 1 1 8 3032 1 1 1 LYS C C -20.838 -6.037 -2.527 1.00 . A A . 1 LYS C 1 1 8 3033 1 1 1 LYS CA C -20.643 -7.366 -1.800 1.00 . A A . 1 LYS CA 1 1 8 3034 1 1 1 LYS CB C -21.352 -7.338 -0.435 1.00 . A A . 1 LYS CB 1 1 8 3035 1 1 1 LYS CD C -23.548 -6.976 0.718 1.00 . A A . 1 LYS CD 1 1 8 3036 1 1 1 LYS CE C -25.019 -6.606 0.511 1.00 . A A . 1 LYS CE 1 1 8 3037 1 1 1 LYS CG C -22.866 -7.177 -0.638 1.00 . A A . 1 LYS CG 1 1 8 3038 1 1 1 LYS H1 H -18.807 -6.959 -0.903 1.00 . A A . 1 LYS H1 1 1 8 3039 1 1 1 LYS H2 H -18.692 -7.485 -2.511 1.00 . A A . 1 LYS H2 1 1 8 3040 1 1 1 LYS H3 H -19.043 -8.591 -1.276 1.00 . A A . 1 LYS H3 1 1 8 3041 1 1 1 LYS HA H -21.063 -8.156 -2.401 1.00 . A A . 1 LYS HA 1 1 8 3042 1 1 1 LYS HB2 H -21.162 -8.265 0.084 1.00 . A A . 1 LYS HB2 1 1 8 3043 1 1 1 LYS HB3 H -20.981 -6.515 0.155 1.00 . A A . 1 LYS HB3 1 1 8 3044 1 1 1 LYS HD2 H -23.488 -7.890 1.291 1.00 . A A . 1 LYS HD2 1 1 8 3045 1 1 1 LYS HD3 H -23.054 -6.180 1.256 1.00 . A A . 1 LYS HD3 1 1 8 3046 1 1 1 LYS HE2 H -25.602 -6.982 1.338 1.00 . A A . 1 LYS HE2 1 1 8 3047 1 1 1 LYS HE3 H -25.113 -5.531 0.461 1.00 . A A . 1 LYS HE3 1 1 8 3048 1 1 1 LYS HG2 H -23.061 -6.320 -1.268 1.00 . A A . 1 LYS HG2 1 1 8 3049 1 1 1 LYS HG3 H -23.264 -8.066 -1.107 1.00 . A A . 1 LYS HG3 1 1 8 3050 1 1 1 LYS HZ1 H -25.183 -6.640 -1.567 1.00 . A A . 1 LYS HZ1 1 1 8 3051 1 1 1 LYS HZ2 H -26.552 -7.233 -0.755 1.00 . A A . 1 LYS HZ2 1 1 8 3052 1 1 1 LYS HZ3 H -25.149 -8.177 -0.852 1.00 . A A . 1 LYS HZ3 1 1 8 3053 1 1 1 LYS N N -19.188 -7.619 -1.606 1.00 . A A . 1 LYS N 1 1 8 3054 1 1 1 LYS NZ N -25.511 -7.208 -0.761 1.00 . A A . 1 LYS NZ 1 1 8 3055 1 1 1 LYS O O -20.732 -5.970 -3.756 1.00 . A A . 1 LYS O 1 1 8 3056 1 1 2 LYS C C -20.016 -2.983 -2.617 1.00 . A A . 2 LYS C 1 1 8 3057 1 1 2 LYS CA C -21.349 -3.674 -2.372 1.00 . A A . 2 LYS CA 1 1 8 3058 1 1 2 LYS CB C -22.217 -2.807 -1.454 1.00 . A A . 2 LYS CB 1 1 8 3059 1 1 2 LYS CD C -23.297 -1.627 -3.385 1.00 . A A . 2 LYS CD 1 1 8 3060 1 1 2 LYS CE C -24.575 -0.874 -3.777 1.00 . A A . 2 LYS CE 1 1 8 3061 1 1 2 LYS CG C -23.548 -2.487 -2.139 1.00 . A A . 2 LYS CG 1 1 8 3062 1 1 2 LYS H H -21.210 -5.088 -0.804 1.00 . A A . 2 LYS H 1 1 8 3063 1 1 2 LYS HA H -21.854 -3.802 -3.318 1.00 . A A . 2 LYS HA 1 1 8 3064 1 1 2 LYS HB2 H -22.408 -3.337 -0.535 1.00 . A A . 2 LYS HB2 1 1 8 3065 1 1 2 LYS HB3 H -21.699 -1.883 -1.235 1.00 . A A . 2 LYS HB3 1 1 8 3066 1 1 2 LYS HD2 H -22.512 -0.912 -3.177 1.00 . A A . 2 LYS HD2 1 1 8 3067 1 1 2 LYS HD3 H -22.995 -2.262 -4.203 1.00 . A A . 2 LYS HD3 1 1 8 3068 1 1 2 LYS HE2 H -24.498 0.154 -3.457 1.00 . A A . 2 LYS HE2 1 1 8 3069 1 1 2 LYS HE3 H -24.694 -0.906 -4.851 1.00 . A A . 2 LYS HE3 1 1 8 3070 1 1 2 LYS HG2 H -24.039 -3.407 -2.426 1.00 . A A . 2 LYS HG2 1 1 8 3071 1 1 2 LYS HG3 H -24.178 -1.945 -1.452 1.00 . A A . 2 LYS HG3 1 1 8 3072 1 1 2 LYS HZ1 H -25.732 -2.531 -3.274 1.00 . A A . 2 LYS HZ1 1 1 8 3073 1 1 2 LYS HZ2 H -26.625 -1.121 -3.550 1.00 . A A . 2 LYS HZ2 1 1 8 3074 1 1 2 LYS HZ3 H -25.748 -1.297 -2.112 1.00 . A A . 2 LYS HZ3 1 1 8 3075 1 1 2 LYS N N -21.132 -4.983 -1.774 1.00 . A A . 2 LYS N 1 1 8 3076 1 1 2 LYS NZ N -25.757 -1.505 -3.130 1.00 . A A . 2 LYS NZ 1 1 8 3077 1 1 2 LYS O O -19.120 -3.047 -1.777 1.00 . A A . 2 LYS O 1 1 8 3078 1 1 3 ALA C C -17.514 -2.576 -4.286 1.00 . A A . 3 ALA C 1 1 8 3079 1 1 3 ALA CA C -18.682 -1.607 -4.139 1.00 . A A . 3 ALA CA 1 1 8 3080 1 1 3 ALA CB C -18.334 -0.549 -3.088 1.00 . A A . 3 ALA CB 1 1 8 3081 1 1 3 ALA H H -20.666 -2.315 -4.388 1.00 . A A . 3 ALA H 1 1 8 3082 1 1 3 ALA HA H -18.843 -1.114 -5.086 1.00 . A A . 3 ALA HA 1 1 8 3083 1 1 3 ALA HB1 H -18.673 0.418 -3.426 1.00 . A A . 3 ALA HB1 1 1 8 3084 1 1 3 ALA HB2 H -17.264 -0.523 -2.943 1.00 . A A . 3 ALA HB2 1 1 8 3085 1 1 3 ALA HB3 H -18.813 -0.793 -2.152 1.00 . A A . 3 ALA HB3 1 1 8 3086 1 1 3 ALA N N -19.905 -2.322 -3.769 1.00 . A A . 3 ALA N 1 1 8 3087 1 1 3 ALA O O -17.152 -3.278 -3.340 1.00 . A A . 3 ALA O 1 1 8 3088 1 1 4 LEU C C -14.611 -3.067 -4.847 1.00 . A A . 4 LEU C 1 1 8 3089 1 1 4 LEU CA C -15.785 -3.495 -5.708 1.00 . A A . 4 LEU CA 1 1 8 3090 1 1 4 LEU CB C -15.377 -3.481 -7.182 1.00 . A A . 4 LEU CB 1 1 8 3091 1 1 4 LEU CD1 C -13.757 -1.569 -7.392 1.00 . A A . 4 LEU CD1 1 1 8 3092 1 1 4 LEU CD2 C -15.444 -1.986 -9.171 1.00 . A A . 4 LEU CD2 1 1 8 3093 1 1 4 LEU CG C -15.187 -2.038 -7.667 1.00 . A A . 4 LEU CG 1 1 8 3094 1 1 4 LEU H H -17.238 -2.026 -6.189 1.00 . A A . 4 LEU H 1 1 8 3095 1 1 4 LEU HA H -16.071 -4.501 -5.434 1.00 . A A . 4 LEU HA 1 1 8 3096 1 1 4 LEU HB2 H -14.452 -4.028 -7.302 1.00 . A A . 4 LEU HB2 1 1 8 3097 1 1 4 LEU HB3 H -16.150 -3.958 -7.766 1.00 . A A . 4 LEU HB3 1 1 8 3098 1 1 4 LEU HD11 H -13.631 -1.385 -6.336 1.00 . A A . 4 LEU HD11 1 1 8 3099 1 1 4 LEU HD12 H -13.571 -0.657 -7.940 1.00 . A A . 4 LEU HD12 1 1 8 3100 1 1 4 LEU HD13 H -13.058 -2.330 -7.713 1.00 . A A . 4 LEU HD13 1 1 8 3101 1 1 4 LEU HD21 H -14.538 -2.243 -9.700 1.00 . A A . 4 LEU HD21 1 1 8 3102 1 1 4 LEU HD22 H -15.753 -0.990 -9.449 1.00 . A A . 4 LEU HD22 1 1 8 3103 1 1 4 LEU HD23 H -16.223 -2.689 -9.428 1.00 . A A . 4 LEU HD23 1 1 8 3104 1 1 4 LEU HG H -15.883 -1.387 -7.160 1.00 . A A . 4 LEU HG 1 1 8 3105 1 1 4 LEU N N -16.919 -2.608 -5.471 1.00 . A A . 4 LEU N 1 1 8 3106 1 1 4 LEU O O -14.715 -2.114 -4.075 1.00 . A A . 4 LEU O 1 1 8 3107 1 1 5 LEU C C -11.417 -2.460 -4.934 1.00 . A A . 5 LEU C 1 1 8 3108 1 1 5 LEU CA C -12.329 -3.425 -4.193 1.00 . A A . 5 LEU CA 1 1 8 3109 1 1 5 LEU CB C -11.544 -4.679 -3.823 1.00 . A A . 5 LEU CB 1 1 8 3110 1 1 5 LEU CD1 C -12.004 -4.817 -1.364 1.00 . A A . 5 LEU CD1 1 1 8 3111 1 1 5 LEU CD2 C -9.757 -5.443 -2.243 1.00 . A A . 5 LEU CD2 1 1 8 3112 1 1 5 LEU CG C -10.946 -4.500 -2.423 1.00 . A A . 5 LEU CG 1 1 8 3113 1 1 5 LEU H H -13.464 -4.509 -5.622 1.00 . A A . 5 LEU H 1 1 8 3114 1 1 5 LEU HA H -12.664 -2.948 -3.284 1.00 . A A . 5 LEU HA 1 1 8 3115 1 1 5 LEU HB2 H -12.206 -5.537 -3.833 1.00 . A A . 5 LEU HB2 1 1 8 3116 1 1 5 LEU HB3 H -10.751 -4.825 -4.538 1.00 . A A . 5 LEU HB3 1 1 8 3117 1 1 5 LEU HD11 H -12.790 -4.079 -1.408 1.00 . A A . 5 LEU HD11 1 1 8 3118 1 1 5 LEU HD12 H -11.549 -4.799 -0.386 1.00 . A A . 5 LEU HD12 1 1 8 3119 1 1 5 LEU HD13 H -12.419 -5.796 -1.547 1.00 . A A . 5 LEU HD13 1 1 8 3120 1 1 5 LEU HD21 H -8.934 -4.901 -1.804 1.00 . A A . 5 LEU HD21 1 1 8 3121 1 1 5 LEU HD22 H -9.456 -5.835 -3.200 1.00 . A A . 5 LEU HD22 1 1 8 3122 1 1 5 LEU HD23 H -10.037 -6.255 -1.592 1.00 . A A . 5 LEU HD23 1 1 8 3123 1 1 5 LEU HG H -10.614 -3.480 -2.299 1.00 . A A . 5 LEU HG 1 1 8 3124 1 1 5 LEU N N -13.497 -3.762 -4.984 1.00 . A A . 5 LEU N 1 1 8 3125 1 1 5 LEU O O -10.946 -2.746 -6.038 1.00 . A A . 5 LEU O 1 1 8 3126 1 1 6 ALA C C -9.343 0.162 -3.747 1.00 . A A . 6 ALA C 1 1 8 3127 1 1 6 ALA CA C -10.293 -0.298 -4.840 1.00 . A A . 6 ALA CA 1 1 8 3128 1 1 6 ALA CB C -11.125 0.884 -5.340 1.00 . A A . 6 ALA CB 1 1 8 3129 1 1 6 ALA H H -11.564 -1.192 -3.407 1.00 . A A . 6 ALA H 1 1 8 3130 1 1 6 ALA HA H -9.722 -0.707 -5.662 1.00 . A A . 6 ALA HA 1 1 8 3131 1 1 6 ALA HB1 H -10.478 1.729 -5.530 1.00 . A A . 6 ALA HB1 1 1 8 3132 1 1 6 ALA HB2 H -11.855 1.151 -4.589 1.00 . A A . 6 ALA HB2 1 1 8 3133 1 1 6 ALA HB3 H -11.634 0.605 -6.251 1.00 . A A . 6 ALA HB3 1 1 8 3134 1 1 6 ALA N N -11.165 -1.328 -4.294 1.00 . A A . 6 ALA N 1 1 8 3135 1 1 6 ALA O O -8.152 -0.147 -3.769 1.00 . A A . 6 ALA O 1 1 8 3136 1 1 7 LEU C C -8.820 0.106 -0.746 1.00 . A A . 7 LEU C 1 1 8 3137 1 1 7 LEU CA C -9.075 1.308 -1.645 1.00 . A A . 7 LEU CA 1 1 8 3138 1 1 7 LEU CB C -9.761 2.439 -0.862 1.00 . A A . 7 LEU CB 1 1 8 3139 1 1 7 LEU CD1 C -11.254 1.017 0.568 1.00 . A A . 7 LEU CD1 1 1 8 3140 1 1 7 LEU CD2 C -11.951 3.329 -0.072 1.00 . A A . 7 LEU CD2 1 1 8 3141 1 1 7 LEU CG C -11.215 2.073 -0.541 1.00 . A A . 7 LEU CG 1 1 8 3142 1 1 7 LEU H H -10.849 1.050 -2.772 1.00 . A A . 7 LEU H 1 1 8 3143 1 1 7 LEU HA H -8.129 1.667 -2.028 1.00 . A A . 7 LEU HA 1 1 8 3144 1 1 7 LEU HB2 H -9.222 2.607 0.061 1.00 . A A . 7 LEU HB2 1 1 8 3145 1 1 7 LEU HB3 H -9.742 3.344 -1.452 1.00 . A A . 7 LEU HB3 1 1 8 3146 1 1 7 LEU HD11 H -11.236 0.030 0.127 1.00 . A A . 7 LEU HD11 1 1 8 3147 1 1 7 LEU HD12 H -12.158 1.136 1.146 1.00 . A A . 7 LEU HD12 1 1 8 3148 1 1 7 LEU HD13 H -10.399 1.139 1.213 1.00 . A A . 7 LEU HD13 1 1 8 3149 1 1 7 LEU HD21 H -13.012 3.126 -0.019 1.00 . A A . 7 LEU HD21 1 1 8 3150 1 1 7 LEU HD22 H -11.772 4.134 -0.770 1.00 . A A . 7 LEU HD22 1 1 8 3151 1 1 7 LEU HD23 H -11.590 3.613 0.906 1.00 . A A . 7 LEU HD23 1 1 8 3152 1 1 7 LEU HG H -11.693 1.686 -1.426 1.00 . A A . 7 LEU HG 1 1 8 3153 1 1 7 LEU N N -9.889 0.864 -2.762 1.00 . A A . 7 LEU N 1 1 8 3154 1 1 7 LEU O O -9.268 -0.996 -1.051 1.00 . A A . 7 LEU O 1 1 8 3155 1 1 8 ALA C C -6.782 -1.749 0.567 1.00 . A A . 8 ALA C 1 1 8 3156 1 1 8 ALA CA C -7.750 -0.797 1.245 1.00 . A A . 8 ALA CA 1 1 8 3157 1 1 8 ALA CB C -9.010 -1.553 1.675 1.00 . A A . 8 ALA CB 1 1 8 3158 1 1 8 ALA H H -7.724 1.190 0.511 1.00 . A A . 8 ALA H 1 1 8 3159 1 1 8 ALA HA H -7.273 -0.386 2.113 1.00 . A A . 8 ALA HA 1 1 8 3160 1 1 8 ALA HB1 H -9.268 -2.287 0.924 1.00 . A A . 8 ALA HB1 1 1 8 3161 1 1 8 ALA HB2 H -9.827 -0.858 1.793 1.00 . A A . 8 ALA HB2 1 1 8 3162 1 1 8 ALA HB3 H -8.824 -2.053 2.615 1.00 . A A . 8 ALA HB3 1 1 8 3163 1 1 8 ALA N N -8.079 0.301 0.333 1.00 . A A . 8 ALA N 1 1 8 3164 1 1 8 ALA O O -5.928 -2.361 1.207 1.00 . A A . 8 ALA O 1 1 8 3165 1 1 9 LEU C C -4.890 -1.818 -2.029 1.00 . A A . 9 LEU C 1 1 8 3166 1 1 9 LEU CA C -6.047 -2.660 -1.551 1.00 . A A . 9 LEU CA 1 1 8 3167 1 1 9 LEU CB C -6.829 -3.188 -2.751 1.00 . A A . 9 LEU CB 1 1 8 3168 1 1 9 LEU CD1 C -7.076 -5.077 -4.383 1.00 . A A . 9 LEU CD1 1 1 8 3169 1 1 9 LEU CD2 C -4.806 -4.410 -3.604 1.00 . A A . 9 LEU CD2 1 1 8 3170 1 1 9 LEU CG C -6.275 -4.551 -3.189 1.00 . A A . 9 LEU CG 1 1 8 3171 1 1 9 LEU H H -7.602 -1.285 -1.171 1.00 . A A . 9 LEU H 1 1 8 3172 1 1 9 LEU HA H -5.679 -3.480 -0.965 1.00 . A A . 9 LEU HA 1 1 8 3173 1 1 9 LEU HB2 H -7.866 -3.291 -2.474 1.00 . A A . 9 LEU HB2 1 1 8 3174 1 1 9 LEU HB3 H -6.744 -2.486 -3.563 1.00 . A A . 9 LEU HB3 1 1 8 3175 1 1 9 LEU HD11 H -6.591 -4.777 -5.299 1.00 . A A . 9 LEU HD11 1 1 8 3176 1 1 9 LEU HD12 H -8.076 -4.671 -4.356 1.00 . A A . 9 LEU HD12 1 1 8 3177 1 1 9 LEU HD13 H -7.122 -6.155 -4.340 1.00 . A A . 9 LEU HD13 1 1 8 3178 1 1 9 LEU HD21 H -4.498 -5.290 -4.150 1.00 . A A . 9 LEU HD21 1 1 8 3179 1 1 9 LEU HD22 H -4.191 -4.303 -2.723 1.00 . A A . 9 LEU HD22 1 1 8 3180 1 1 9 LEU HD23 H -4.687 -3.541 -4.235 1.00 . A A . 9 LEU HD23 1 1 8 3181 1 1 9 LEU HG H -6.355 -5.251 -2.370 1.00 . A A . 9 LEU HG 1 1 8 3182 1 1 9 LEU N N -6.911 -1.826 -0.738 1.00 . A A . 9 LEU N 1 1 8 3183 1 1 9 LEU O O -3.734 -2.067 -1.691 1.00 . A A . 9 LEU O 1 1 8 3184 1 1 10 HIS C C -3.471 0.630 -2.037 1.00 . A A . 10 HIS C 1 1 8 3185 1 1 10 HIS CA C -4.203 0.140 -3.257 1.00 . A A . 10 HIS CA 1 1 8 3186 1 1 10 HIS CB C -4.842 1.326 -3.979 1.00 . A A . 10 HIS CB 1 1 8 3187 1 1 10 HIS CD2 C -5.985 0.067 -5.981 1.00 . A A . 10 HIS CD2 1 1 8 3188 1 1 10 HIS CE1 C -4.963 1.067 -7.606 1.00 . A A . 10 HIS CE1 1 1 8 3189 1 1 10 HIS CG C -5.121 0.969 -5.411 1.00 . A A . 10 HIS CG 1 1 8 3190 1 1 10 HIS H H -6.173 -0.611 -2.965 1.00 . A A . 10 HIS H 1 1 8 3191 1 1 10 HIS HA H -3.523 -0.377 -3.915 1.00 . A A . 10 HIS HA 1 1 8 3192 1 1 10 HIS HB2 H -5.769 1.590 -3.487 1.00 . A A . 10 HIS HB2 1 1 8 3193 1 1 10 HIS HB3 H -4.164 2.164 -3.938 1.00 . A A . 10 HIS HB3 1 1 8 3194 1 1 10 HIS HD1 H -3.793 2.298 -6.397 1.00 . A A . 10 HIS HD1 1 1 8 3195 1 1 10 HIS HD2 H -6.650 -0.589 -5.434 1.00 . A A . 10 HIS HD2 1 1 8 3196 1 1 10 HIS HE1 H -4.653 1.372 -8.597 1.00 . A A . 10 HIS HE1 1 1 8 3197 1 1 10 HIS HE2 H -6.383 -0.401 -8.025 1.00 . A A . 10 HIS HE2 1 1 8 3198 1 1 10 HIS N N -5.225 -0.778 -2.777 1.00 . A A . 10 HIS N 1 1 8 3199 1 1 10 HIS ND1 N -4.478 1.597 -6.467 1.00 . A A . 10 HIS ND1 1 1 8 3200 1 1 10 HIS NE2 N -5.884 0.130 -7.366 1.00 . A A . 10 HIS NE2 1 1 8 3201 1 1 10 HIS O O -2.258 0.819 -2.024 1.00 . A A . 10 HIS O 1 1 8 3202 1 1 11 HIS C C -2.506 0.457 0.648 1.00 . A A . 11 HIS C 1 1 8 3203 1 1 11 HIS CA C -3.788 1.186 0.303 1.00 . A A . 11 HIS CA 1 1 8 3204 1 1 11 HIS CB C -4.850 0.805 1.321 1.00 . A A . 11 HIS CB 1 1 8 3205 1 1 11 HIS CD2 C -6.080 3.101 0.946 1.00 . A A . 11 HIS CD2 1 1 8 3206 1 1 11 HIS CE1 C -6.911 3.337 2.932 1.00 . A A . 11 HIS CE1 1 1 8 3207 1 1 11 HIS CG C -5.685 2.005 1.678 1.00 . A A . 11 HIS CG 1 1 8 3208 1 1 11 HIS H H -5.212 0.563 -1.102 1.00 . A A . 11 HIS H 1 1 8 3209 1 1 11 HIS HA H -3.625 2.247 0.322 1.00 . A A . 11 HIS HA 1 1 8 3210 1 1 11 HIS HB2 H -5.485 0.039 0.889 1.00 . A A . 11 HIS HB2 1 1 8 3211 1 1 11 HIS HB3 H -4.367 0.412 2.199 1.00 . A A . 11 HIS HB3 1 1 8 3212 1 1 11 HIS HD1 H -6.127 1.569 3.708 1.00 . A A . 11 HIS HD1 1 1 8 3213 1 1 11 HIS HD2 H -5.831 3.281 -0.089 1.00 . A A . 11 HIS HD2 1 1 8 3214 1 1 11 HIS HE1 H -7.451 3.726 3.785 1.00 . A A . 11 HIS HE1 1 1 8 3215 1 1 11 HIS HE2 H -7.250 4.802 1.491 1.00 . A A . 11 HIS HE2 1 1 8 3216 1 1 11 HIS N N -4.262 0.772 -0.994 1.00 . A A . 11 HIS N 1 1 8 3217 1 1 11 HIS ND1 N -6.225 2.180 2.942 1.00 . A A . 11 HIS ND1 1 1 8 3218 1 1 11 HIS NE2 N -6.852 3.941 1.743 1.00 . A A . 11 HIS NE2 1 1 8 3219 1 1 11 HIS O O -1.576 1.024 1.220 1.00 . A A . 11 HIS O 1 1 8 3220 1 1 12 LEU C C -0.285 -1.364 -0.518 1.00 . A A . 12 LEU C 1 1 8 3221 1 1 12 LEU CA C -1.313 -1.634 0.547 1.00 . A A . 12 LEU CA 1 1 8 3222 1 1 12 LEU CB C -1.694 -3.112 0.518 1.00 . A A . 12 LEU CB 1 1 8 3223 1 1 12 LEU CD1 C -3.572 -4.632 1.165 1.00 . A A . 12 LEU CD1 1 1 8 3224 1 1 12 LEU CD2 C -2.103 -3.629 2.931 1.00 . A A . 12 LEU CD2 1 1 8 3225 1 1 12 LEU CG C -2.770 -3.392 1.569 1.00 . A A . 12 LEU CG 1 1 8 3226 1 1 12 LEU H H -3.256 -1.190 -0.174 1.00 . A A . 12 LEU H 1 1 8 3227 1 1 12 LEU HA H -0.907 -1.379 1.512 1.00 . A A . 12 LEU HA 1 1 8 3228 1 1 12 LEU HB2 H -2.076 -3.360 -0.464 1.00 . A A . 12 LEU HB2 1 1 8 3229 1 1 12 LEU HB3 H -0.821 -3.710 0.726 1.00 . A A . 12 LEU HB3 1 1 8 3230 1 1 12 LEU HD11 H -3.938 -4.513 0.157 1.00 . A A . 12 LEU HD11 1 1 8 3231 1 1 12 LEU HD12 H -4.409 -4.754 1.840 1.00 . A A . 12 LEU HD12 1 1 8 3232 1 1 12 LEU HD13 H -2.940 -5.504 1.215 1.00 . A A . 12 LEU HD13 1 1 8 3233 1 1 12 LEU HD21 H -2.853 -3.585 3.710 1.00 . A A . 12 LEU HD21 1 1 8 3234 1 1 12 LEU HD22 H -1.357 -2.868 3.105 1.00 . A A . 12 LEU HD22 1 1 8 3235 1 1 12 LEU HD23 H -1.636 -4.600 2.941 1.00 . A A . 12 LEU HD23 1 1 8 3236 1 1 12 LEU HG H -3.438 -2.544 1.637 1.00 . A A . 12 LEU HG 1 1 8 3237 1 1 12 LEU N N -2.477 -0.808 0.288 1.00 . A A . 12 LEU N 1 1 8 3238 1 1 12 LEU O O 0.894 -1.147 -0.237 1.00 . A A . 12 LEU O 1 1 8 3239 1 1 13 ALA C C 0.829 0.240 -2.609 1.00 . A A . 13 ALA C 1 1 8 3240 1 1 13 ALA CA C 0.106 -1.068 -2.883 1.00 . A A . 13 ALA CA 1 1 8 3241 1 1 13 ALA CB C -0.716 -0.947 -4.169 1.00 . A A . 13 ALA CB 1 1 8 3242 1 1 13 ALA H H -1.723 -1.504 -1.875 1.00 . A A . 13 ALA H 1 1 8 3243 1 1 13 ALA HA H 0.827 -1.864 -2.988 1.00 . A A . 13 ALA HA 1 1 8 3244 1 1 13 ALA HB1 H -1.006 0.085 -4.316 1.00 . A A . 13 ALA HB1 1 1 8 3245 1 1 13 ALA HB2 H -1.601 -1.563 -4.095 1.00 . A A . 13 ALA HB2 1 1 8 3246 1 1 13 ALA HB3 H -0.121 -1.276 -5.010 1.00 . A A . 13 ALA HB3 1 1 8 3247 1 1 13 ALA N N -0.761 -1.349 -1.745 1.00 . A A . 13 ALA N 1 1 8 3248 1 1 13 ALA O O 1.983 0.434 -2.987 1.00 . A A . 13 ALA O 1 1 8 3249 1 1 14 HIS C C 1.780 2.226 -0.555 1.00 . A A . 14 HIS C 1 1 8 3250 1 1 14 HIS CA C 0.646 2.412 -1.537 1.00 . A A . 14 HIS CA 1 1 8 3251 1 1 14 HIS CB C -0.480 3.226 -0.911 1.00 . A A . 14 HIS CB 1 1 8 3252 1 1 14 HIS CD2 C -0.411 4.222 1.511 1.00 . A A . 14 HIS CD2 1 1 8 3253 1 1 14 HIS CE1 C 1.273 5.556 1.261 1.00 . A A . 14 HIS CE1 1 1 8 3254 1 1 14 HIS CG C 0.019 4.083 0.218 1.00 . A A . 14 HIS CG 1 1 8 3255 1 1 14 HIS H H -0.791 0.873 -1.647 1.00 . A A . 14 HIS H 1 1 8 3256 1 1 14 HIS HA H 1.010 2.920 -2.406 1.00 . A A . 14 HIS HA 1 1 8 3257 1 1 14 HIS HB2 H -0.902 3.845 -1.665 1.00 . A A . 14 HIS HB2 1 1 8 3258 1 1 14 HIS HB3 H -1.240 2.556 -0.540 1.00 . A A . 14 HIS HB3 1 1 8 3259 1 1 14 HIS HD1 H 1.624 5.089 -0.735 1.00 . A A . 14 HIS HD1 1 1 8 3260 1 1 14 HIS HD2 H -1.237 3.681 1.953 1.00 . A A . 14 HIS HD2 1 1 8 3261 1 1 14 HIS HE1 H 2.042 6.284 1.456 1.00 . A A . 14 HIS HE1 1 1 8 3262 1 1 14 HIS HE2 H 0.300 5.455 3.099 1.00 . A A . 14 HIS HE2 1 1 8 3263 1 1 14 HIS N N 0.122 1.116 -1.918 1.00 . A A . 14 HIS N 1 1 8 3264 1 1 14 HIS ND1 N 1.095 4.941 0.081 1.00 . A A . 14 HIS ND1 1 1 8 3265 1 1 14 HIS NE2 N 0.383 5.153 2.169 1.00 . A A . 14 HIS NE2 1 1 8 3266 1 1 14 HIS O O 2.880 2.741 -0.748 1.00 . A A . 14 HIS O 1 1 8 3267 1 1 15 LEU C C 3.672 0.536 0.713 1.00 . A A . 15 LEU C 1 1 8 3268 1 1 15 LEU CA C 2.543 1.166 1.457 1.00 . A A . 15 LEU CA 1 1 8 3269 1 1 15 LEU CB C 2.052 0.160 2.495 1.00 . A A . 15 LEU CB 1 1 8 3270 1 1 15 LEU CD1 C 0.703 2.176 3.185 1.00 . A A . 15 LEU CD1 1 1 8 3271 1 1 15 LEU CD2 C 0.179 -0.074 4.092 1.00 . A A . 15 LEU CD2 1 1 8 3272 1 1 15 LEU CG C 1.305 0.845 3.639 1.00 . A A . 15 LEU CG 1 1 8 3273 1 1 15 LEU H H 0.632 1.039 0.562 1.00 . A A . 15 LEU H 1 1 8 3274 1 1 15 LEU HA H 2.870 2.074 1.927 1.00 . A A . 15 LEU HA 1 1 8 3275 1 1 15 LEU HB2 H 1.394 -0.548 2.012 1.00 . A A . 15 LEU HB2 1 1 8 3276 1 1 15 LEU HB3 H 2.904 -0.372 2.897 1.00 . A A . 15 LEU HB3 1 1 8 3277 1 1 15 LEU HD11 H 0.188 2.032 2.247 1.00 . A A . 15 LEU HD11 1 1 8 3278 1 1 15 LEU HD12 H 1.486 2.905 3.059 1.00 . A A . 15 LEU HD12 1 1 8 3279 1 1 15 LEU HD13 H 0.002 2.527 3.930 1.00 . A A . 15 LEU HD13 1 1 8 3280 1 1 15 LEU HD21 H 0.577 -1.060 4.286 1.00 . A A . 15 LEU HD21 1 1 8 3281 1 1 15 LEU HD22 H -0.566 -0.134 3.311 1.00 . A A . 15 LEU HD22 1 1 8 3282 1 1 15 LEU HD23 H -0.266 0.322 4.989 1.00 . A A . 15 LEU HD23 1 1 8 3283 1 1 15 LEU HG H 1.982 1.016 4.459 1.00 . A A . 15 LEU HG 1 1 8 3284 1 1 15 LEU N N 1.516 1.452 0.480 1.00 . A A . 15 LEU N 1 1 8 3285 1 1 15 LEU O O 4.848 0.747 0.997 1.00 . A A . 15 LEU O 1 1 8 3286 1 1 16 ALA C C 4.983 0.064 -1.948 1.00 . A A . 16 ALA C 1 1 8 3287 1 1 16 ALA CA C 4.214 -0.940 -1.106 1.00 . A A . 16 ALA CA 1 1 8 3288 1 1 16 ALA CB C 3.487 -1.928 -2.024 1.00 . A A . 16 ALA CB 1 1 8 3289 1 1 16 ALA H H 2.284 -0.334 -0.415 1.00 . A A . 16 ALA H 1 1 8 3290 1 1 16 ALA HA H 4.904 -1.480 -0.483 1.00 . A A . 16 ALA HA 1 1 8 3291 1 1 16 ALA HB1 H 3.369 -1.487 -3.004 1.00 . A A . 16 ALA HB1 1 1 8 3292 1 1 16 ALA HB2 H 2.515 -2.153 -1.610 1.00 . A A . 16 ALA HB2 1 1 8 3293 1 1 16 ALA HB3 H 4.063 -2.838 -2.104 1.00 . A A . 16 ALA HB3 1 1 8 3294 1 1 16 ALA N N 3.265 -0.241 -0.262 1.00 . A A . 16 ALA N 1 1 8 3295 1 1 16 ALA O O 6.140 -0.160 -2.294 1.00 . A A . 16 ALA O 1 1 8 3296 1 1 17 LEU C C 6.150 2.783 -2.403 1.00 . A A . 17 LEU C 1 1 8 3297 1 1 17 LEU CA C 4.917 2.216 -3.082 1.00 . A A . 17 LEU CA 1 1 8 3298 1 1 17 LEU CB C 3.870 3.310 -3.370 1.00 . A A . 17 LEU CB 1 1 8 3299 1 1 17 LEU CD1 C 5.439 5.286 -3.585 1.00 . A A . 17 LEU CD1 1 1 8 3300 1 1 17 LEU CD2 C 3.078 5.605 -2.808 1.00 . A A . 17 LEU CD2 1 1 8 3301 1 1 17 LEU CG C 4.285 4.667 -2.778 1.00 . A A . 17 LEU CG 1 1 8 3302 1 1 17 LEU H H 3.394 1.264 -1.960 1.00 . A A . 17 LEU H 1 1 8 3303 1 1 17 LEU HA H 5.226 1.785 -4.012 1.00 . A A . 17 LEU HA 1 1 8 3304 1 1 17 LEU HB2 H 3.742 3.409 -4.436 1.00 . A A . 17 LEU HB2 1 1 8 3305 1 1 17 LEU HB3 H 2.931 3.016 -2.931 1.00 . A A . 17 LEU HB3 1 1 8 3306 1 1 17 LEU HD11 H 5.076 6.134 -4.152 1.00 . A A . 17 LEU HD11 1 1 8 3307 1 1 17 LEU HD12 H 5.849 4.550 -4.262 1.00 . A A . 17 LEU HD12 1 1 8 3308 1 1 17 LEU HD13 H 6.209 5.618 -2.904 1.00 . A A . 17 LEU HD13 1 1 8 3309 1 1 17 LEU HD21 H 3.089 6.183 -3.718 1.00 . A A . 17 LEU HD21 1 1 8 3310 1 1 17 LEU HD22 H 3.123 6.269 -1.960 1.00 . A A . 17 LEU HD22 1 1 8 3311 1 1 17 LEU HD23 H 2.168 5.022 -2.762 1.00 . A A . 17 LEU HD23 1 1 8 3312 1 1 17 LEU HG H 4.594 4.531 -1.756 1.00 . A A . 17 LEU HG 1 1 8 3313 1 1 17 LEU N N 4.319 1.163 -2.271 1.00 . A A . 17 LEU N 1 1 8 3314 1 1 17 LEU O O 7.213 2.891 -3.018 1.00 . A A . 17 LEU O 1 1 8 3315 1 1 18 HIS C C 8.104 2.528 -0.099 1.00 . A A . 18 HIS C 1 1 8 3316 1 1 18 HIS CA C 7.182 3.661 -0.434 1.00 . A A . 18 HIS CA 1 1 8 3317 1 1 18 HIS CB C 6.788 4.443 0.799 1.00 . A A . 18 HIS CB 1 1 8 3318 1 1 18 HIS CD2 C 4.769 3.311 2.002 1.00 . A A . 18 HIS CD2 1 1 8 3319 1 1 18 HIS CE1 C 5.828 2.454 3.685 1.00 . A A . 18 HIS CE1 1 1 8 3320 1 1 18 HIS CG C 6.093 3.604 1.825 1.00 . A A . 18 HIS CG 1 1 8 3321 1 1 18 HIS H H 5.161 3.014 -0.679 1.00 . A A . 18 HIS H 1 1 8 3322 1 1 18 HIS HA H 7.704 4.322 -1.104 1.00 . A A . 18 HIS HA 1 1 8 3323 1 1 18 HIS HB2 H 7.668 4.886 1.233 1.00 . A A . 18 HIS HB2 1 1 8 3324 1 1 18 HIS HB3 H 6.126 5.211 0.488 1.00 . A A . 18 HIS HB3 1 1 8 3325 1 1 18 HIS HD1 H 7.731 3.052 3.064 1.00 . A A . 18 HIS HD1 1 1 8 3326 1 1 18 HIS HD2 H 3.978 3.585 1.315 1.00 . A A . 18 HIS HD2 1 1 8 3327 1 1 18 HIS HE1 H 6.054 1.928 4.604 1.00 . A A . 18 HIS HE1 1 1 8 3328 1 1 18 HIS HE2 H 3.758 2.275 3.578 1.00 . A A . 18 HIS HE2 1 1 8 3329 1 1 18 HIS N N 6.026 3.131 -1.137 1.00 . A A . 18 HIS N 1 1 8 3330 1 1 18 HIS ND1 N 6.756 3.043 2.905 1.00 . A A . 18 HIS ND1 1 1 8 3331 1 1 18 HIS NE2 N 4.600 2.592 3.184 1.00 . A A . 18 HIS NE2 1 1 8 3332 1 1 18 HIS O O 9.311 2.612 -0.301 1.00 . A A . 18 HIS O 1 1 8 3333 1 1 19 LEU C C 9.148 -0.024 -0.613 1.00 . A A . 19 LEU C 1 1 8 3334 1 1 19 LEU CA C 8.306 0.248 0.616 1.00 . A A . 19 LEU CA 1 1 8 3335 1 1 19 LEU CB C 7.403 -0.959 0.857 1.00 . A A . 19 LEU CB 1 1 8 3336 1 1 19 LEU CD1 C 7.251 -0.034 3.172 1.00 . A A . 19 LEU CD1 1 1 8 3337 1 1 19 LEU CD2 C 6.191 -2.225 2.624 1.00 . A A . 19 LEU CD2 1 1 8 3338 1 1 19 LEU CG C 7.382 -1.311 2.342 1.00 . A A . 19 LEU CG 1 1 8 3339 1 1 19 LEU H H 6.535 1.435 0.431 1.00 . A A . 19 LEU H 1 1 8 3340 1 1 19 LEU HA H 8.941 0.415 1.470 1.00 . A A . 19 LEU HA 1 1 8 3341 1 1 19 LEU HB2 H 6.404 -0.733 0.526 1.00 . A A . 19 LEU HB2 1 1 8 3342 1 1 19 LEU HB3 H 7.783 -1.800 0.299 1.00 . A A . 19 LEU HB3 1 1 8 3343 1 1 19 LEU HD11 H 8.223 0.259 3.533 1.00 . A A . 19 LEU HD11 1 1 8 3344 1 1 19 LEU HD12 H 6.593 -0.213 4.009 1.00 . A A . 19 LEU HD12 1 1 8 3345 1 1 19 LEU HD13 H 6.843 0.755 2.557 1.00 . A A . 19 LEU HD13 1 1 8 3346 1 1 19 LEU HD21 H 6.466 -3.247 2.416 1.00 . A A . 19 LEU HD21 1 1 8 3347 1 1 19 LEU HD22 H 5.362 -1.940 1.992 1.00 . A A . 19 LEU HD22 1 1 8 3348 1 1 19 LEU HD23 H 5.902 -2.131 3.659 1.00 . A A . 19 LEU HD23 1 1 8 3349 1 1 19 LEU HG H 8.299 -1.819 2.600 1.00 . A A . 19 LEU HG 1 1 8 3350 1 1 19 LEU N N 7.516 1.441 0.338 1.00 . A A . 19 LEU N 1 1 8 3351 1 1 19 LEU O O 10.269 -0.517 -0.537 1.00 . A A . 19 LEU O 1 1 8 3352 1 1 20 ALA C C 10.327 1.200 -3.180 1.00 . A A . 20 ALA C 1 1 8 3353 1 1 20 ALA CA C 9.235 0.168 -3.039 1.00 . A A . 20 ALA CA 1 1 8 3354 1 1 20 ALA CB C 8.232 0.324 -4.190 1.00 . A A . 20 ALA CB 1 1 8 3355 1 1 20 ALA H H 7.666 0.747 -1.709 1.00 . A A . 20 ALA H 1 1 8 3356 1 1 20 ALA HA H 9.674 -0.812 -3.087 1.00 . A A . 20 ALA HA 1 1 8 3357 1 1 20 ALA HB1 H 7.938 -0.650 -4.548 1.00 . A A . 20 ALA HB1 1 1 8 3358 1 1 20 ALA HB2 H 8.687 0.881 -4.994 1.00 . A A . 20 ALA HB2 1 1 8 3359 1 1 20 ALA HB3 H 7.362 0.856 -3.837 1.00 . A A . 20 ALA HB3 1 1 8 3360 1 1 20 ALA N N 8.568 0.336 -1.750 1.00 . A A . 20 ALA N 1 1 8 3361 1 1 20 ALA O O 11.503 0.872 -3.318 1.00 . A A . 20 ALA O 1 1 8 3362 1 1 21 LEU C C 11.993 3.353 -2.243 1.00 . A A . 21 LEU C 1 1 8 3363 1 1 21 LEU CA C 10.866 3.557 -3.237 1.00 . A A . 21 LEU CA 1 1 8 3364 1 1 21 LEU CB C 10.165 4.892 -2.951 1.00 . A A . 21 LEU CB 1 1 8 3365 1 1 21 LEU CD1 C 11.280 5.946 -4.920 1.00 . A A . 21 LEU CD1 1 1 8 3366 1 1 21 LEU CD2 C 9.073 4.816 -5.207 1.00 . A A . 21 LEU CD2 1 1 8 3367 1 1 21 LEU CG C 9.934 5.655 -4.260 1.00 . A A . 21 LEU CG 1 1 8 3368 1 1 21 LEU H H 8.964 2.637 -3.016 1.00 . A A . 21 LEU H 1 1 8 3369 1 1 21 LEU HA H 11.275 3.571 -4.228 1.00 . A A . 21 LEU HA 1 1 8 3370 1 1 21 LEU HB2 H 9.217 4.708 -2.474 1.00 . A A . 21 LEU HB2 1 1 8 3371 1 1 21 LEU HB3 H 10.786 5.488 -2.296 1.00 . A A . 21 LEU HB3 1 1 8 3372 1 1 21 LEU HD11 H 11.206 6.851 -5.503 1.00 . A A . 21 LEU HD11 1 1 8 3373 1 1 21 LEU HD12 H 11.548 5.122 -5.564 1.00 . A A . 21 LEU HD12 1 1 8 3374 1 1 21 LEU HD13 H 12.035 6.070 -4.156 1.00 . A A . 21 LEU HD13 1 1 8 3375 1 1 21 LEU HD21 H 9.699 4.107 -5.724 1.00 . A A . 21 LEU HD21 1 1 8 3376 1 1 21 LEU HD22 H 8.592 5.465 -5.925 1.00 . A A . 21 LEU HD22 1 1 8 3377 1 1 21 LEU HD23 H 8.321 4.287 -4.640 1.00 . A A . 21 LEU HD23 1 1 8 3378 1 1 21 LEU HG H 9.429 6.588 -4.045 1.00 . A A . 21 LEU HG 1 1 8 3379 1 1 21 LEU N N 9.920 2.455 -3.131 1.00 . A A . 21 LEU N 1 1 8 3380 1 1 21 LEU O O 13.164 3.532 -2.566 1.00 . A A . 21 LEU O 1 1 8 3381 1 1 22 ALA C C 13.594 1.659 -0.454 1.00 . A A . 22 ALA C 1 1 8 3382 1 1 22 ALA CA C 12.600 2.713 0.008 1.00 . A A . 22 ALA CA 1 1 8 3383 1 1 22 ALA CB C 11.905 2.232 1.281 1.00 . A A . 22 ALA CB 1 1 8 3384 1 1 22 ALA H H 10.665 2.827 -0.858 1.00 . A A . 22 ALA H 1 1 8 3385 1 1 22 ALA HA H 13.129 3.625 0.219 1.00 . A A . 22 ALA HA 1 1 8 3386 1 1 22 ALA HB1 H 12.643 2.066 2.053 1.00 . A A . 22 ALA HB1 1 1 8 3387 1 1 22 ALA HB2 H 11.382 1.309 1.078 1.00 . A A . 22 ALA HB2 1 1 8 3388 1 1 22 ALA HB3 H 11.202 2.982 1.607 1.00 . A A . 22 ALA HB3 1 1 8 3389 1 1 22 ALA N N 11.622 2.960 -1.040 1.00 . A A . 22 ALA N 1 1 8 3390 1 1 22 ALA O O 14.798 1.768 -0.213 1.00 . A A . 22 ALA O 1 1 8 3391 1 1 23 LEU C C 14.668 0.079 -2.868 1.00 . A A . 23 LEU C 1 1 8 3392 1 1 23 LEU CA C 13.901 -0.425 -1.665 1.00 . A A . 23 LEU CA 1 1 8 3393 1 1 23 LEU CB C 13.032 -1.614 -2.089 1.00 . A A . 23 LEU CB 1 1 8 3394 1 1 23 LEU CD1 C 11.410 -3.299 -1.215 1.00 . A A . 23 LEU CD1 1 1 8 3395 1 1 23 LEU CD2 C 13.775 -3.290 -0.382 1.00 . A A . 23 LEU CD2 1 1 8 3396 1 1 23 LEU CG C 12.606 -2.413 -0.852 1.00 . A A . 23 LEU CG 1 1 8 3397 1 1 23 LEU H H 12.109 0.640 -1.301 1.00 . A A . 23 LEU H 1 1 8 3398 1 1 23 LEU HA H 14.596 -0.744 -0.911 1.00 . A A . 23 LEU HA 1 1 8 3399 1 1 23 LEU HB2 H 12.155 -1.252 -2.607 1.00 . A A . 23 LEU HB2 1 1 8 3400 1 1 23 LEU HB3 H 13.599 -2.252 -2.750 1.00 . A A . 23 LEU HB3 1 1 8 3401 1 1 23 LEU HD11 H 11.113 -3.876 -0.349 1.00 . A A . 23 LEU HD11 1 1 8 3402 1 1 23 LEU HD12 H 11.689 -3.970 -2.016 1.00 . A A . 23 LEU HD12 1 1 8 3403 1 1 23 LEU HD13 H 10.586 -2.676 -1.537 1.00 . A A . 23 LEU HD13 1 1 8 3404 1 1 23 LEU HD21 H 14.330 -3.644 -1.239 1.00 . A A . 23 LEU HD21 1 1 8 3405 1 1 23 LEU HD22 H 13.395 -4.135 0.171 1.00 . A A . 23 LEU HD22 1 1 8 3406 1 1 23 LEU HD23 H 14.429 -2.710 0.255 1.00 . A A . 23 LEU HD23 1 1 8 3407 1 1 23 LEU HG H 12.321 -1.732 -0.061 1.00 . A A . 23 LEU HG 1 1 8 3408 1 1 23 LEU N N 13.073 0.652 -1.137 1.00 . A A . 23 LEU N 1 1 8 3409 1 1 23 LEU O O 15.897 0.017 -2.916 1.00 . A A . 23 LEU O 1 1 8 3410 1 1 24 LYS C C 15.527 2.209 -4.699 1.00 . A A . 24 LYS C 1 1 8 3411 1 1 24 LYS CA C 14.514 1.127 -5.048 1.00 . A A . 24 LYS CA 1 1 8 3412 1 1 24 LYS CB C 13.412 1.729 -5.936 1.00 . A A . 24 LYS CB 1 1 8 3413 1 1 24 LYS CD C 15.032 1.956 -7.873 1.00 . A A . 24 LYS CD 1 1 8 3414 1 1 24 LYS CE C 15.054 3.489 -7.772 1.00 . A A . 24 LYS CE 1 1 8 3415 1 1 24 LYS CG C 13.666 1.413 -7.419 1.00 . A A . 24 LYS CG 1 1 8 3416 1 1 24 LYS H H 12.950 0.611 -3.709 1.00 . A A . 24 LYS H 1 1 8 3417 1 1 24 LYS HA H 15.008 0.335 -5.581 1.00 . A A . 24 LYS HA 1 1 8 3418 1 1 24 LYS HB2 H 12.457 1.312 -5.647 1.00 . A A . 24 LYS HB2 1 1 8 3419 1 1 24 LYS HB3 H 13.387 2.801 -5.798 1.00 . A A . 24 LYS HB3 1 1 8 3420 1 1 24 LYS HD2 H 15.810 1.536 -7.255 1.00 . A A . 24 LYS HD2 1 1 8 3421 1 1 24 LYS HD3 H 15.204 1.664 -8.901 1.00 . A A . 24 LYS HD3 1 1 8 3422 1 1 24 LYS HE2 H 15.057 3.915 -8.764 1.00 . A A . 24 LYS HE2 1 1 8 3423 1 1 24 LYS HE3 H 14.177 3.831 -7.243 1.00 . A A . 24 LYS HE3 1 1 8 3424 1 1 24 LYS HG2 H 13.639 0.344 -7.567 1.00 . A A . 24 LYS HG2 1 1 8 3425 1 1 24 LYS HG3 H 12.888 1.871 -8.014 1.00 . A A . 24 LYS HG3 1 1 8 3426 1 1 24 LYS HZ1 H 16.045 4.715 -6.394 1.00 . A A . 24 LYS HZ1 1 1 8 3427 1 1 24 LYS HZ2 H 16.999 4.241 -7.718 1.00 . A A . 24 LYS HZ2 1 1 8 3428 1 1 24 LYS HZ3 H 16.656 3.125 -6.481 1.00 . A A . 24 LYS HZ3 1 1 8 3429 1 1 24 LYS N N 13.924 0.590 -3.829 1.00 . A A . 24 LYS N 1 1 8 3430 1 1 24 LYS NZ N 16.279 3.924 -7.041 1.00 . A A . 24 LYS NZ 1 1 8 3431 1 1 24 LYS O O 16.566 2.335 -5.348 1.00 . A A . 24 LYS O 1 1 8 3432 1 1 25 LYS C C 15.661 5.348 -4.018 1.00 . A A . 25 LYS C 1 1 8 3433 1 1 25 LYS CA C 16.018 4.098 -3.228 1.00 . A A . 25 LYS CA 1 1 8 3434 1 1 25 LYS CB C 17.516 3.796 -3.389 1.00 . A A . 25 LYS CB 1 1 8 3435 1 1 25 LYS CD C 19.454 5.390 -3.535 1.00 . A A . 25 LYS CD 1 1 8 3436 1 1 25 LYS CE C 18.971 6.649 -4.264 1.00 . A A . 25 LYS CE 1 1 8 3437 1 1 25 LYS CG C 18.337 4.854 -2.634 1.00 . A A . 25 LYS CG 1 1 8 3438 1 1 25 LYS H H 14.327 2.827 -3.238 1.00 . A A . 25 LYS H 1 1 8 3439 1 1 25 LYS HA H 15.810 4.274 -2.183 1.00 . A A . 25 LYS HA 1 1 8 3440 1 1 25 LYS HB2 H 17.733 2.817 -2.985 1.00 . A A . 25 LYS HB2 1 1 8 3441 1 1 25 LYS HB3 H 17.778 3.820 -4.435 1.00 . A A . 25 LYS HB3 1 1 8 3442 1 1 25 LYS HD2 H 20.318 5.630 -2.932 1.00 . A A . 25 LYS HD2 1 1 8 3443 1 1 25 LYS HD3 H 19.725 4.634 -4.262 1.00 . A A . 25 LYS HD3 1 1 8 3444 1 1 25 LYS HE2 H 19.700 6.936 -5.008 1.00 . A A . 25 LYS HE2 1 1 8 3445 1 1 25 LYS HE3 H 18.028 6.443 -4.749 1.00 . A A . 25 LYS HE3 1 1 8 3446 1 1 25 LYS HG2 H 17.692 5.670 -2.341 1.00 . A A . 25 LYS HG2 1 1 8 3447 1 1 25 LYS HG3 H 18.773 4.409 -1.753 1.00 . A A . 25 LYS HG3 1 1 8 3448 1 1 25 LYS HZ1 H 19.425 8.549 -3.547 1.00 . A A . 25 LYS HZ1 1 1 8 3449 1 1 25 LYS HZ2 H 19.032 7.436 -2.331 1.00 . A A . 25 LYS HZ2 1 1 8 3450 1 1 25 LYS HZ3 H 17.800 8.099 -3.313 1.00 . A A . 25 LYS HZ3 1 1 8 3451 1 1 25 LYS N N 15.188 2.990 -3.685 1.00 . A A . 25 LYS N 1 1 8 3452 1 1 25 LYS NZ N 18.796 7.762 -3.289 1.00 . A A . 25 LYS NZ 1 1 8 3453 1 1 25 LYS O O 15.971 5.453 -5.208 1.00 . A A . 25 LYS O 1 1 8 3454 1 1 26 ALA C C 15.821 8.405 -4.209 1.00 . A A . 26 ALA C 1 1 8 3455 1 1 26 ALA CA C 14.599 7.522 -4.005 1.00 . A A . 26 ALA CA 1 1 8 3456 1 1 26 ALA CB C 13.567 8.256 -3.144 1.00 . A A . 26 ALA CB 1 1 8 3457 1 1 26 ALA H H 14.772 6.139 -2.414 1.00 . A A . 26 ALA H 1 1 8 3458 1 1 26 ALA HA H 14.157 7.297 -4.964 1.00 . A A . 26 ALA HA 1 1 8 3459 1 1 26 ALA HB1 H 12.827 8.719 -3.782 1.00 . A A . 26 ALA HB1 1 1 8 3460 1 1 26 ALA HB2 H 14.060 9.015 -2.558 1.00 . A A . 26 ALA HB2 1 1 8 3461 1 1 26 ALA HB3 H 13.083 7.548 -2.483 1.00 . A A . 26 ALA HB3 1 1 8 3462 1 1 26 ALA N N 14.999 6.285 -3.356 1.00 . A A . 26 ALA N 1 1 8 3463 1 1 26 ALA O O 16.047 8.834 -5.318 1.00 . A A . 26 ALA O 1 1 8 3464 1 1 26 ALA OXT O 16.513 8.647 -3.242 1.00 . A A . 26 ALA OXT 1 1 9 3465 1 1 1 LYS C C -24.197 -1.893 -0.112 1.00 . A A . 1 LYS C 1 1 9 3466 1 1 1 LYS CA C -25.708 -1.798 0.042 1.00 . A A . 1 LYS CA 1 1 9 3467 1 1 1 LYS CB C -26.067 -1.321 1.457 1.00 . A A . 1 LYS CB 1 1 9 3468 1 1 1 LYS CD C -27.421 0.789 1.688 1.00 . A A . 1 LYS CD 1 1 9 3469 1 1 1 LYS CE C -28.190 1.163 2.964 1.00 . A A . 1 LYS CE 1 1 9 3470 1 1 1 LYS CG C -27.487 -0.730 1.468 1.00 . A A . 1 LYS CG 1 1 9 3471 1 1 1 LYS H1 H -25.784 -3.619 -0.954 1.00 . A A . 1 LYS H1 1 1 9 3472 1 1 1 LYS H2 H -27.298 -3.031 -0.463 1.00 . A A . 1 LYS H2 1 1 9 3473 1 1 1 LYS H3 H -26.238 -3.707 0.670 1.00 . A A . 1 LYS H3 1 1 9 3474 1 1 1 LYS HA H -26.100 -1.100 -0.682 1.00 . A A . 1 LYS HA 1 1 9 3475 1 1 1 LYS HB2 H -26.023 -2.156 2.140 1.00 . A A . 1 LYS HB2 1 1 9 3476 1 1 1 LYS HB3 H -25.361 -0.566 1.771 1.00 . A A . 1 LYS HB3 1 1 9 3477 1 1 1 LYS HD2 H -26.390 1.097 1.785 1.00 . A A . 1 LYS HD2 1 1 9 3478 1 1 1 LYS HD3 H -27.865 1.294 0.843 1.00 . A A . 1 LYS HD3 1 1 9 3479 1 1 1 LYS HE2 H -27.655 0.798 3.828 1.00 . A A . 1 LYS HE2 1 1 9 3480 1 1 1 LYS HE3 H -28.279 2.238 3.027 1.00 . A A . 1 LYS HE3 1 1 9 3481 1 1 1 LYS HG2 H -27.968 -0.933 0.521 1.00 . A A . 1 LYS HG2 1 1 9 3482 1 1 1 LYS HG3 H -28.056 -1.183 2.265 1.00 . A A . 1 LYS HG3 1 1 9 3483 1 1 1 LYS HZ1 H -29.822 0.362 1.946 1.00 . A A . 1 LYS HZ1 1 1 9 3484 1 1 1 LYS HZ2 H -30.234 1.214 3.354 1.00 . A A . 1 LYS HZ2 1 1 9 3485 1 1 1 LYS HZ3 H -29.554 -0.333 3.473 1.00 . A A . 1 LYS HZ3 1 1 9 3486 1 1 1 LYS N N -26.302 -3.141 -0.194 1.00 . A A . 1 LYS N 1 1 9 3487 1 1 1 LYS NZ N -29.552 0.555 2.930 1.00 . A A . 1 LYS NZ 1 1 9 3488 1 1 1 LYS O O -23.498 -2.334 0.805 1.00 . A A . 1 LYS O 1 1 9 3489 1 1 2 LYS C C -21.602 -0.241 -1.110 1.00 . A A . 2 LYS C 1 1 9 3490 1 1 2 LYS CA C -22.267 -1.540 -1.535 1.00 . A A . 2 LYS CA 1 1 9 3491 1 1 2 LYS CB C -22.015 -1.776 -3.028 1.00 . A A . 2 LYS CB 1 1 9 3492 1 1 2 LYS CD C -19.607 -2.490 -3.122 1.00 . A A . 2 LYS CD 1 1 9 3493 1 1 2 LYS CE C -19.104 -2.121 -4.524 1.00 . A A . 2 LYS CE 1 1 9 3494 1 1 2 LYS CG C -21.064 -2.964 -3.216 1.00 . A A . 2 LYS CG 1 1 9 3495 1 1 2 LYS H H -24.304 -1.151 -1.966 1.00 . A A . 2 LYS H 1 1 9 3496 1 1 2 LYS HA H -21.837 -2.353 -0.971 1.00 . A A . 2 LYS HA 1 1 9 3497 1 1 2 LYS HB2 H -22.951 -1.983 -3.520 1.00 . A A . 2 LYS HB2 1 1 9 3498 1 1 2 LYS HB3 H -21.570 -0.892 -3.463 1.00 . A A . 2 LYS HB3 1 1 9 3499 1 1 2 LYS HD2 H -19.548 -1.626 -2.474 1.00 . A A . 2 LYS HD2 1 1 9 3500 1 1 2 LYS HD3 H -18.993 -3.284 -2.720 1.00 . A A . 2 LYS HD3 1 1 9 3501 1 1 2 LYS HE2 H -18.967 -3.022 -5.104 1.00 . A A . 2 LYS HE2 1 1 9 3502 1 1 2 LYS HE3 H -19.833 -1.488 -5.016 1.00 . A A . 2 LYS HE3 1 1 9 3503 1 1 2 LYS HG2 H -21.252 -3.704 -2.450 1.00 . A A . 2 LYS HG2 1 1 9 3504 1 1 2 LYS HG3 H -21.232 -3.402 -4.187 1.00 . A A . 2 LYS HG3 1 1 9 3505 1 1 2 LYS HZ1 H -17.600 -0.924 -5.328 1.00 . A A . 2 LYS HZ1 1 1 9 3506 1 1 2 LYS HZ2 H -17.049 -2.070 -4.204 1.00 . A A . 2 LYS HZ2 1 1 9 3507 1 1 2 LYS HZ3 H -17.863 -0.679 -3.666 1.00 . A A . 2 LYS HZ3 1 1 9 3508 1 1 2 LYS N N -23.698 -1.486 -1.272 1.00 . A A . 2 LYS N 1 1 9 3509 1 1 2 LYS NZ N -17.807 -1.395 -4.420 1.00 . A A . 2 LYS NZ 1 1 9 3510 1 1 2 LYS O O -22.097 0.852 -1.411 1.00 . A A . 2 LYS O 1 1 9 3511 1 1 3 ALA C C -18.837 1.310 -1.075 1.00 . A A . 3 ALA C 1 1 9 3512 1 1 3 ALA CA C -19.750 0.815 0.034 1.00 . A A . 3 ALA CA 1 1 9 3513 1 1 3 ALA CB C -18.917 0.484 1.268 1.00 . A A . 3 ALA CB 1 1 9 3514 1 1 3 ALA H H -20.133 -1.255 -0.209 1.00 . A A . 3 ALA H 1 1 9 3515 1 1 3 ALA HA H -20.454 1.593 0.283 1.00 . A A . 3 ALA HA 1 1 9 3516 1 1 3 ALA HB1 H -18.950 1.317 1.952 1.00 . A A . 3 ALA HB1 1 1 9 3517 1 1 3 ALA HB2 H -17.894 0.300 0.977 1.00 . A A . 3 ALA HB2 1 1 9 3518 1 1 3 ALA HB3 H -19.317 -0.394 1.751 1.00 . A A . 3 ALA HB3 1 1 9 3519 1 1 3 ALA N N -20.479 -0.359 -0.417 1.00 . A A . 3 ALA N 1 1 9 3520 1 1 3 ALA O O -18.310 0.514 -1.856 1.00 . A A . 3 ALA O 1 1 9 3521 1 1 4 LEU C C -16.333 2.767 -1.905 1.00 . A A . 4 LEU C 1 1 9 3522 1 1 4 LEU CA C -17.771 3.195 -2.158 1.00 . A A . 4 LEU CA 1 1 9 3523 1 1 4 LEU CB C -17.868 4.724 -2.132 1.00 . A A . 4 LEU CB 1 1 9 3524 1 1 4 LEU CD1 C -19.451 6.650 -2.269 1.00 . A A . 4 LEU CD1 1 1 9 3525 1 1 4 LEU CD2 C -19.501 4.866 -4.007 1.00 . A A . 4 LEU CD2 1 1 9 3526 1 1 4 LEU CG C -19.282 5.154 -2.525 1.00 . A A . 4 LEU CG 1 1 9 3527 1 1 4 LEU H H -19.075 3.207 -0.483 1.00 . A A . 4 LEU H 1 1 9 3528 1 1 4 LEU HA H -18.083 2.837 -3.127 1.00 . A A . 4 LEU HA 1 1 9 3529 1 1 4 LEU HB2 H -17.648 5.084 -1.138 1.00 . A A . 4 LEU HB2 1 1 9 3530 1 1 4 LEU HB3 H -17.159 5.142 -2.831 1.00 . A A . 4 LEU HB3 1 1 9 3531 1 1 4 LEU HD11 H -20.295 7.015 -2.835 1.00 . A A . 4 LEU HD11 1 1 9 3532 1 1 4 LEU HD12 H -18.558 7.173 -2.579 1.00 . A A . 4 LEU HD12 1 1 9 3533 1 1 4 LEU HD13 H -19.621 6.817 -1.217 1.00 . A A . 4 LEU HD13 1 1 9 3534 1 1 4 LEU HD21 H -18.593 5.073 -4.552 1.00 . A A . 4 LEU HD21 1 1 9 3535 1 1 4 LEU HD22 H -20.294 5.491 -4.383 1.00 . A A . 4 LEU HD22 1 1 9 3536 1 1 4 LEU HD23 H -19.768 3.827 -4.135 1.00 . A A . 4 LEU HD23 1 1 9 3537 1 1 4 LEU HG H -20.002 4.605 -1.937 1.00 . A A . 4 LEU HG 1 1 9 3538 1 1 4 LEU N N -18.637 2.619 -1.136 1.00 . A A . 4 LEU N 1 1 9 3539 1 1 4 LEU O O -15.842 1.819 -2.516 1.00 . A A . 4 LEU O 1 1 9 3540 1 1 5 LEU C C -13.506 2.542 -1.763 1.00 . A A . 5 LEU C 1 1 9 3541 1 1 5 LEU CA C -14.293 3.181 -0.615 1.00 . A A . 5 LEU CA 1 1 9 3542 1 1 5 LEU CB C -14.275 2.242 0.596 1.00 . A A . 5 LEU CB 1 1 9 3543 1 1 5 LEU CD1 C -15.352 4.131 1.879 1.00 . A A . 5 LEU CD1 1 1 9 3544 1 1 5 LEU CD2 C -14.477 2.127 3.093 1.00 . A A . 5 LEU CD2 1 1 9 3545 1 1 5 LEU CG C -14.253 3.060 1.898 1.00 . A A . 5 LEU CG 1 1 9 3546 1 1 5 LEU H H -16.156 4.206 -0.547 1.00 . A A . 5 LEU H 1 1 9 3547 1 1 5 LEU HA H -13.810 4.107 -0.338 1.00 . A A . 5 LEU HA 1 1 9 3548 1 1 5 LEU HB2 H -15.155 1.612 0.579 1.00 . A A . 5 LEU HB2 1 1 9 3549 1 1 5 LEU HB3 H -13.390 1.623 0.552 1.00 . A A . 5 LEU HB3 1 1 9 3550 1 1 5 LEU HD11 H -15.586 4.421 2.895 1.00 . A A . 5 LEU HD11 1 1 9 3551 1 1 5 LEU HD12 H -16.238 3.740 1.409 1.00 . A A . 5 LEU HD12 1 1 9 3552 1 1 5 LEU HD13 H -15.002 4.993 1.332 1.00 . A A . 5 LEU HD13 1 1 9 3553 1 1 5 LEU HD21 H -15.503 1.789 3.102 1.00 . A A . 5 LEU HD21 1 1 9 3554 1 1 5 LEU HD22 H -14.265 2.659 4.010 1.00 . A A . 5 LEU HD22 1 1 9 3555 1 1 5 LEU HD23 H -13.816 1.272 3.013 1.00 . A A . 5 LEU HD23 1 1 9 3556 1 1 5 LEU HG H -13.291 3.541 1.998 1.00 . A A . 5 LEU HG 1 1 9 3557 1 1 5 LEU N N -15.683 3.471 -0.993 1.00 . A A . 5 LEU N 1 1 9 3558 1 1 5 LEU O O -12.864 3.239 -2.553 1.00 . A A . 5 LEU O 1 1 9 3559 1 1 6 ALA C C -11.335 0.605 -2.691 1.00 . A A . 6 ALA C 1 1 9 3560 1 1 6 ALA CA C -12.842 0.462 -2.867 1.00 . A A . 6 ALA CA 1 1 9 3561 1 1 6 ALA CB C -13.253 0.938 -4.264 1.00 . A A . 6 ALA CB 1 1 9 3562 1 1 6 ALA H H -14.073 0.723 -1.163 1.00 . A A . 6 ALA H 1 1 9 3563 1 1 6 ALA HA H -13.101 -0.581 -2.768 1.00 . A A . 6 ALA HA 1 1 9 3564 1 1 6 ALA HB1 H -12.735 0.352 -5.009 1.00 . A A . 6 ALA HB1 1 1 9 3565 1 1 6 ALA HB2 H -12.994 1.978 -4.384 1.00 . A A . 6 ALA HB2 1 1 9 3566 1 1 6 ALA HB3 H -14.318 0.815 -4.388 1.00 . A A . 6 ALA HB3 1 1 9 3567 1 1 6 ALA N N -13.552 1.214 -1.832 1.00 . A A . 6 ALA N 1 1 9 3568 1 1 6 ALA O O -10.610 -0.391 -2.613 1.00 . A A . 6 ALA O 1 1 9 3569 1 1 7 LEU C C -9.025 1.739 -1.040 1.00 . A A . 7 LEU C 1 1 9 3570 1 1 7 LEU CA C -9.450 2.114 -2.453 1.00 . A A . 7 LEU CA 1 1 9 3571 1 1 7 LEU CB C -9.150 3.595 -2.728 1.00 . A A . 7 LEU CB 1 1 9 3572 1 1 7 LEU CD1 C -7.635 3.126 -4.667 1.00 . A A . 7 LEU CD1 1 1 9 3573 1 1 7 LEU CD2 C -10.102 3.197 -5.021 1.00 . A A . 7 LEU CD2 1 1 9 3574 1 1 7 LEU CG C -8.935 3.806 -4.235 1.00 . A A . 7 LEU CG 1 1 9 3575 1 1 7 LEU H H -11.501 2.597 -2.691 1.00 . A A . 7 LEU H 1 1 9 3576 1 1 7 LEU HA H -8.893 1.509 -3.153 1.00 . A A . 7 LEU HA 1 1 9 3577 1 1 7 LEU HB2 H -9.980 4.201 -2.389 1.00 . A A . 7 LEU HB2 1 1 9 3578 1 1 7 LEU HB3 H -8.255 3.885 -2.197 1.00 . A A . 7 LEU HB3 1 1 9 3579 1 1 7 LEU HD11 H -6.886 3.265 -3.903 1.00 . A A . 7 LEU HD11 1 1 9 3580 1 1 7 LEU HD12 H -7.292 3.562 -5.594 1.00 . A A . 7 LEU HD12 1 1 9 3581 1 1 7 LEU HD13 H -7.812 2.073 -4.807 1.00 . A A . 7 LEU HD13 1 1 9 3582 1 1 7 LEU HD21 H -10.114 3.604 -6.024 1.00 . A A . 7 LEU HD21 1 1 9 3583 1 1 7 LEU HD22 H -11.032 3.429 -4.523 1.00 . A A . 7 LEU HD22 1 1 9 3584 1 1 7 LEU HD23 H -9.980 2.126 -5.071 1.00 . A A . 7 LEU HD23 1 1 9 3585 1 1 7 LEU HG H -8.872 4.866 -4.446 1.00 . A A . 7 LEU HG 1 1 9 3586 1 1 7 LEU N N -10.871 1.845 -2.628 1.00 . A A . 7 LEU N 1 1 9 3587 1 1 7 LEU O O -8.626 2.589 -0.241 1.00 . A A . 7 LEU O 1 1 9 3588 1 1 8 ALA C C -7.593 -1.033 0.423 1.00 . A A . 8 ALA C 1 1 9 3589 1 1 8 ALA CA C -8.767 -0.080 0.562 1.00 . A A . 8 ALA CA 1 1 9 3590 1 1 8 ALA CB C -9.949 -0.840 1.158 1.00 . A A . 8 ALA CB 1 1 9 3591 1 1 8 ALA H H -9.464 -0.157 -1.444 1.00 . A A . 8 ALA H 1 1 9 3592 1 1 8 ALA HA H -8.495 0.730 1.221 1.00 . A A . 8 ALA HA 1 1 9 3593 1 1 8 ALA HB1 H -10.520 -0.181 1.792 1.00 . A A . 8 ALA HB1 1 1 9 3594 1 1 8 ALA HB2 H -9.581 -1.673 1.738 1.00 . A A . 8 ALA HB2 1 1 9 3595 1 1 8 ALA HB3 H -10.579 -1.207 0.359 1.00 . A A . 8 ALA HB3 1 1 9 3596 1 1 8 ALA N N -9.129 0.453 -0.749 1.00 . A A . 8 ALA N 1 1 9 3597 1 1 8 ALA O O -6.861 -1.292 1.378 1.00 . A A . 8 ALA O 1 1 9 3598 1 1 9 LEU C C -5.148 -1.764 -1.594 1.00 . A A . 9 LEU C 1 1 9 3599 1 1 9 LEU CA C -6.362 -2.501 -1.074 1.00 . A A . 9 LEU CA 1 1 9 3600 1 1 9 LEU CB C -6.814 -3.490 -2.130 1.00 . A A . 9 LEU CB 1 1 9 3601 1 1 9 LEU CD1 C -8.711 -4.924 -2.928 1.00 . A A . 9 LEU CD1 1 1 9 3602 1 1 9 LEU CD2 C -8.538 -4.326 -0.514 1.00 . A A . 9 LEU CD2 1 1 9 3603 1 1 9 LEU CG C -8.300 -3.830 -1.940 1.00 . A A . 9 LEU CG 1 1 9 3604 1 1 9 LEU H H -8.070 -1.314 -1.482 1.00 . A A . 9 LEU H 1 1 9 3605 1 1 9 LEU HA H -6.097 -3.033 -0.181 1.00 . A A . 9 LEU HA 1 1 9 3606 1 1 9 LEU HB2 H -6.665 -3.045 -3.104 1.00 . A A . 9 LEU HB2 1 1 9 3607 1 1 9 LEU HB3 H -6.221 -4.383 -2.047 1.00 . A A . 9 LEU HB3 1 1 9 3608 1 1 9 LEU HD11 H -9.161 -4.471 -3.797 1.00 . A A . 9 LEU HD11 1 1 9 3609 1 1 9 LEU HD12 H -9.423 -5.581 -2.459 1.00 . A A . 9 LEU HD12 1 1 9 3610 1 1 9 LEU HD13 H -7.841 -5.491 -3.225 1.00 . A A . 9 LEU HD13 1 1 9 3611 1 1 9 LEU HD21 H -9.470 -4.869 -0.474 1.00 . A A . 9 LEU HD21 1 1 9 3612 1 1 9 LEU HD22 H -8.584 -3.481 0.158 1.00 . A A . 9 LEU HD22 1 1 9 3613 1 1 9 LEU HD23 H -7.730 -4.976 -0.216 1.00 . A A . 9 LEU HD23 1 1 9 3614 1 1 9 LEU HG H -8.896 -2.946 -2.119 1.00 . A A . 9 LEU HG 1 1 9 3615 1 1 9 LEU N N -7.437 -1.558 -0.778 1.00 . A A . 9 LEU N 1 1 9 3616 1 1 9 LEU O O -4.039 -1.911 -1.080 1.00 . A A . 9 LEU O 1 1 9 3617 1 1 10 HIS C C -3.471 0.377 -2.048 1.00 . A A . 10 HIS C 1 1 9 3618 1 1 10 HIS CA C -4.296 -0.158 -3.192 1.00 . A A . 10 HIS CA 1 1 9 3619 1 1 10 HIS CB C -4.869 1.008 -3.979 1.00 . A A . 10 HIS CB 1 1 9 3620 1 1 10 HIS CD2 C -6.038 0.178 -6.174 1.00 . A A . 10 HIS CD2 1 1 9 3621 1 1 10 HIS CE1 C -4.356 0.387 -7.525 1.00 . A A . 10 HIS CE1 1 1 9 3622 1 1 10 HIS CG C -4.986 0.644 -5.430 1.00 . A A . 10 HIS CG 1 1 9 3623 1 1 10 HIS H H -6.286 -0.881 -2.967 1.00 . A A . 10 HIS H 1 1 9 3624 1 1 10 HIS HA H -3.682 -0.775 -3.832 1.00 . A A . 10 HIS HA 1 1 9 3625 1 1 10 HIS HB2 H -5.845 1.251 -3.588 1.00 . A A . 10 HIS HB2 1 1 9 3626 1 1 10 HIS HB3 H -4.220 1.863 -3.872 1.00 . A A . 10 HIS HB3 1 1 9 3627 1 1 10 HIS HD1 H -3.009 1.073 -6.086 1.00 . A A . 10 HIS HD1 1 1 9 3628 1 1 10 HIS HD2 H -7.026 -0.034 -5.788 1.00 . A A . 10 HIS HD2 1 1 9 3629 1 1 10 HIS HE1 H -3.741 0.387 -8.416 1.00 . A A . 10 HIS HE1 1 1 9 3630 1 1 10 HIS HE2 H -6.192 -0.309 -8.250 1.00 . A A . 10 HIS HE2 1 1 9 3631 1 1 10 HIS N N -5.376 -0.956 -2.614 1.00 . A A . 10 HIS N 1 1 9 3632 1 1 10 HIS ND1 N -3.923 0.768 -6.311 1.00 . A A . 10 HIS ND1 1 1 9 3633 1 1 10 HIS NE2 N -5.643 0.014 -7.498 1.00 . A A . 10 HIS NE2 1 1 9 3634 1 1 10 HIS O O -2.255 0.502 -2.120 1.00 . A A . 10 HIS O 1 1 9 3635 1 1 11 HIS C C -2.306 0.364 0.516 1.00 . A A . 11 HIS C 1 1 9 3636 1 1 11 HIS CA C -3.598 1.110 0.260 1.00 . A A . 11 HIS CA 1 1 9 3637 1 1 11 HIS CB C -4.572 0.780 1.382 1.00 . A A . 11 HIS CB 1 1 9 3638 1 1 11 HIS CD2 C -5.963 3.005 1.153 1.00 . A A . 11 HIS CD2 1 1 9 3639 1 1 11 HIS CE1 C -6.051 3.544 3.250 1.00 . A A . 11 HIS CE1 1 1 9 3640 1 1 11 HIS CG C -5.288 2.027 1.840 1.00 . A A . 11 HIS CG 1 1 9 3641 1 1 11 HIS H H -5.149 0.476 -1.002 1.00 . A A . 11 HIS H 1 1 9 3642 1 1 11 HIS HA H -3.422 2.170 0.220 1.00 . A A . 11 HIS HA 1 1 9 3643 1 1 11 HIS HB2 H -5.295 0.053 1.009 1.00 . A A . 11 HIS HB2 1 1 9 3644 1 1 11 HIS HB3 H -4.026 0.344 2.205 1.00 . A A . 11 HIS HB3 1 1 9 3645 1 1 11 HIS HD1 H -4.974 1.895 3.940 1.00 . A A . 11 HIS HD1 1 1 9 3646 1 1 11 HIS HD2 H -6.102 3.030 0.081 1.00 . A A . 11 HIS HD2 1 1 9 3647 1 1 11 HIS HE1 H -6.266 4.064 4.168 1.00 . A A . 11 HIS HE1 1 1 9 3648 1 1 11 HIS HE2 H -6.939 4.779 1.830 1.00 . A A . 11 HIS HE2 1 1 9 3649 1 1 11 HIS N N -4.185 0.643 -0.974 1.00 . A A . 11 HIS N 1 1 9 3650 1 1 11 HIS ND1 N -5.359 2.391 3.180 1.00 . A A . 11 HIS ND1 1 1 9 3651 1 1 11 HIS NE2 N -6.438 3.964 2.043 1.00 . A A . 11 HIS NE2 1 1 9 3652 1 1 11 HIS O O -1.274 0.942 0.856 1.00 . A A . 11 HIS O 1 1 9 3653 1 1 12 LEU C C -0.246 -1.509 -0.559 1.00 . A A . 12 LEU C 1 1 9 3654 1 1 12 LEU CA C -1.262 -1.815 0.507 1.00 . A A . 12 LEU CA 1 1 9 3655 1 1 12 LEU CB C -1.705 -3.275 0.387 1.00 . A A . 12 LEU CB 1 1 9 3656 1 1 12 LEU CD1 C -3.576 -4.871 0.895 1.00 . A A . 12 LEU CD1 1 1 9 3657 1 1 12 LEU CD2 C -2.520 -3.564 2.750 1.00 . A A . 12 LEU CD2 1 1 9 3658 1 1 12 LEU CG C -2.936 -3.529 1.271 1.00 . A A . 12 LEU CG 1 1 9 3659 1 1 12 LEU H H -3.255 -1.301 0.019 1.00 . A A . 12 LEU H 1 1 9 3660 1 1 12 LEU HA H -0.828 -1.649 1.477 1.00 . A A . 12 LEU HA 1 1 9 3661 1 1 12 LEU HB2 H -1.952 -3.486 -0.646 1.00 . A A . 12 LEU HB2 1 1 9 3662 1 1 12 LEU HB3 H -0.898 -3.920 0.698 1.00 . A A . 12 LEU HB3 1 1 9 3663 1 1 12 LEU HD11 H -3.081 -5.671 1.430 1.00 . A A . 12 LEU HD11 1 1 9 3664 1 1 12 LEU HD12 H -3.478 -5.033 -0.167 1.00 . A A . 12 LEU HD12 1 1 9 3665 1 1 12 LEU HD13 H -4.626 -4.856 1.160 1.00 . A A . 12 LEU HD13 1 1 9 3666 1 1 12 LEU HD21 H -3.339 -3.948 3.345 1.00 . A A . 12 LEU HD21 1 1 9 3667 1 1 12 LEU HD22 H -2.270 -2.567 3.082 1.00 . A A . 12 LEU HD22 1 1 9 3668 1 1 12 LEU HD23 H -1.664 -4.208 2.869 1.00 . A A . 12 LEU HD23 1 1 9 3669 1 1 12 LEU HG H -3.656 -2.738 1.118 1.00 . A A . 12 LEU HG 1 1 9 3670 1 1 12 LEU N N -2.395 -0.932 0.322 1.00 . A A . 12 LEU N 1 1 9 3671 1 1 12 LEU O O 0.936 -1.292 -0.284 1.00 . A A . 12 LEU O 1 1 9 3672 1 1 13 ALA C C 0.794 0.191 -2.661 1.00 . A A . 13 ALA C 1 1 9 3673 1 1 13 ALA CA C 0.108 -1.139 -2.917 1.00 . A A . 13 ALA CA 1 1 9 3674 1 1 13 ALA CB C -0.721 -1.056 -4.199 1.00 . A A . 13 ALA CB 1 1 9 3675 1 1 13 ALA H H -1.708 -1.610 -1.902 1.00 . A A . 13 ALA H 1 1 9 3676 1 1 13 ALA HA H 0.857 -1.909 -3.025 1.00 . A A . 13 ALA HA 1 1 9 3677 1 1 13 ALA HB1 H -1.345 -0.176 -4.166 1.00 . A A . 13 ALA HB1 1 1 9 3678 1 1 13 ALA HB2 H -1.340 -1.934 -4.286 1.00 . A A . 13 ALA HB2 1 1 9 3679 1 1 13 ALA HB3 H -0.060 -0.994 -5.050 1.00 . A A . 13 ALA HB3 1 1 9 3680 1 1 13 ALA N N -0.741 -1.458 -1.778 1.00 . A A . 13 ALA N 1 1 9 3681 1 1 13 ALA O O 1.914 0.437 -3.113 1.00 . A A . 13 ALA O 1 1 9 3682 1 1 14 HIS C C 1.739 2.210 -0.556 1.00 . A A . 14 HIS C 1 1 9 3683 1 1 14 HIS CA C 0.617 2.355 -1.567 1.00 . A A . 14 HIS CA 1 1 9 3684 1 1 14 HIS CB C -0.528 3.212 -1.031 1.00 . A A . 14 HIS CB 1 1 9 3685 1 1 14 HIS CD2 C -0.611 3.944 1.490 1.00 . A A . 14 HIS CD2 1 1 9 3686 1 1 14 HIS CE1 C 0.997 5.395 1.453 1.00 . A A . 14 HIS CE1 1 1 9 3687 1 1 14 HIS CG C -0.124 3.968 0.207 1.00 . A A . 14 HIS CG 1 1 9 3688 1 1 14 HIS H H -0.781 0.770 -1.589 1.00 . A A . 14 HIS H 1 1 9 3689 1 1 14 HIS HA H 1.012 2.819 -2.453 1.00 . A A . 14 HIS HA 1 1 9 3690 1 1 14 HIS HB2 H -0.803 3.905 -1.792 1.00 . A A . 14 HIS HB2 1 1 9 3691 1 1 14 HIS HB3 H -1.373 2.580 -0.808 1.00 . A A . 14 HIS HB3 1 1 9 3692 1 1 14 HIS HD1 H 1.444 5.166 -0.569 1.00 . A A . 14 HIS HD1 1 1 9 3693 1 1 14 HIS HD2 H -1.417 3.315 1.838 1.00 . A A . 14 HIS HD2 1 1 9 3694 1 1 14 HIS HE1 H 1.715 6.146 1.752 1.00 . A A . 14 HIS HE1 1 1 9 3695 1 1 14 HIS HE2 H -0.033 5.040 3.232 1.00 . A A . 14 HIS HE2 1 1 9 3696 1 1 14 HIS N N 0.104 1.040 -1.915 1.00 . A A . 14 HIS N 1 1 9 3697 1 1 14 HIS ND1 N 0.899 4.901 0.205 1.00 . A A . 14 HIS ND1 1 1 9 3698 1 1 14 HIS NE2 N 0.098 4.849 2.276 1.00 . A A . 14 HIS NE2 1 1 9 3699 1 1 14 HIS O O 2.830 2.751 -0.727 1.00 . A A . 14 HIS O 1 1 9 3700 1 1 15 LEU C C 3.666 0.554 0.717 1.00 . A A . 15 LEU C 1 1 9 3701 1 1 15 LEU CA C 2.517 1.166 1.458 1.00 . A A . 15 LEU CA 1 1 9 3702 1 1 15 LEU CB C 2.029 0.155 2.495 1.00 . A A . 15 LEU CB 1 1 9 3703 1 1 15 LEU CD1 C 1.235 2.344 3.500 1.00 . A A . 15 LEU CD1 1 1 9 3704 1 1 15 LEU CD2 C -0.093 0.253 3.794 1.00 . A A . 15 LEU CD2 1 1 9 3705 1 1 15 LEU CG C 1.319 0.826 3.679 1.00 . A A . 15 LEU CG 1 1 9 3706 1 1 15 LEU H H 0.617 0.986 0.535 1.00 . A A . 15 LEU H 1 1 9 3707 1 1 15 LEU HA H 2.835 2.083 1.922 1.00 . A A . 15 LEU HA 1 1 9 3708 1 1 15 LEU HB2 H 1.343 -0.529 2.015 1.00 . A A . 15 LEU HB2 1 1 9 3709 1 1 15 LEU HB3 H 2.878 -0.408 2.861 1.00 . A A . 15 LEU HB3 1 1 9 3710 1 1 15 LEU HD11 H 0.492 2.741 4.176 1.00 . A A . 15 LEU HD11 1 1 9 3711 1 1 15 LEU HD12 H 0.955 2.574 2.485 1.00 . A A . 15 LEU HD12 1 1 9 3712 1 1 15 LEU HD13 H 2.194 2.790 3.720 1.00 . A A . 15 LEU HD13 1 1 9 3713 1 1 15 LEU HD21 H -0.576 0.656 4.669 1.00 . A A . 15 LEU HD21 1 1 9 3714 1 1 15 LEU HD22 H -0.039 -0.822 3.874 1.00 . A A . 15 LEU HD22 1 1 9 3715 1 1 15 LEU HD23 H -0.658 0.519 2.914 1.00 . A A . 15 LEU HD23 1 1 9 3716 1 1 15 LEU HG H 1.865 0.606 4.579 1.00 . A A . 15 LEU HG 1 1 9 3717 1 1 15 LEU N N 1.487 1.427 0.470 1.00 . A A . 15 LEU N 1 1 9 3718 1 1 15 LEU O O 4.836 0.748 1.036 1.00 . A A . 15 LEU O 1 1 9 3719 1 1 16 ALA C C 4.970 0.171 -1.998 1.00 . A A . 16 ALA C 1 1 9 3720 1 1 16 ALA CA C 4.255 -0.854 -1.137 1.00 . A A . 16 ALA CA 1 1 9 3721 1 1 16 ALA CB C 3.565 -1.888 -2.027 1.00 . A A . 16 ALA CB 1 1 9 3722 1 1 16 ALA H H 2.313 -0.265 -0.467 1.00 . A A . 16 ALA H 1 1 9 3723 1 1 16 ALA HA H 4.977 -1.349 -0.513 1.00 . A A . 16 ALA HA 1 1 9 3724 1 1 16 ALA HB1 H 2.689 -2.271 -1.520 1.00 . A A . 16 ALA HB1 1 1 9 3725 1 1 16 ALA HB2 H 4.245 -2.700 -2.230 1.00 . A A . 16 ALA HB2 1 1 9 3726 1 1 16 ALA HB3 H 3.271 -1.423 -2.954 1.00 . A A . 16 ALA HB3 1 1 9 3727 1 1 16 ALA N N 3.285 -0.184 -0.291 1.00 . A A . 16 ALA N 1 1 9 3728 1 1 16 ALA O O 6.136 0.003 -2.348 1.00 . A A . 16 ALA O 1 1 9 3729 1 1 17 LEU C C 6.039 2.899 -2.512 1.00 . A A . 17 LEU C 1 1 9 3730 1 1 17 LEU CA C 4.814 2.293 -3.166 1.00 . A A . 17 LEU CA 1 1 9 3731 1 1 17 LEU CB C 3.740 3.364 -3.442 1.00 . A A . 17 LEU CB 1 1 9 3732 1 1 17 LEU CD1 C 3.729 5.682 -4.381 1.00 . A A . 17 LEU CD1 1 1 9 3733 1 1 17 LEU CD2 C 3.843 5.349 -1.914 1.00 . A A . 17 LEU CD2 1 1 9 3734 1 1 17 LEU CG C 4.288 4.791 -3.268 1.00 . A A . 17 LEU CG 1 1 9 3735 1 1 17 LEU H H 3.333 1.301 -2.022 1.00 . A A . 17 LEU H 1 1 9 3736 1 1 17 LEU HA H 5.119 1.866 -4.101 1.00 . A A . 17 LEU HA 1 1 9 3737 1 1 17 LEU HB2 H 3.383 3.248 -4.453 1.00 . A A . 17 LEU HB2 1 1 9 3738 1 1 17 LEU HB3 H 2.918 3.218 -2.766 1.00 . A A . 17 LEU HB3 1 1 9 3739 1 1 17 LEU HD11 H 2.649 5.685 -4.331 1.00 . A A . 17 LEU HD11 1 1 9 3740 1 1 17 LEU HD12 H 4.043 5.299 -5.341 1.00 . A A . 17 LEU HD12 1 1 9 3741 1 1 17 LEU HD13 H 4.096 6.690 -4.258 1.00 . A A . 17 LEU HD13 1 1 9 3742 1 1 17 LEU HD21 H 3.874 6.428 -1.940 1.00 . A A . 17 LEU HD21 1 1 9 3743 1 1 17 LEU HD22 H 4.503 4.988 -1.139 1.00 . A A . 17 LEU HD22 1 1 9 3744 1 1 17 LEU HD23 H 2.836 5.023 -1.707 1.00 . A A . 17 LEU HD23 1 1 9 3745 1 1 17 LEU HG H 5.367 4.789 -3.325 1.00 . A A . 17 LEU HG 1 1 9 3746 1 1 17 LEU N N 4.256 1.233 -2.338 1.00 . A A . 17 LEU N 1 1 9 3747 1 1 17 LEU O O 7.088 3.026 -3.143 1.00 . A A . 17 LEU O 1 1 9 3748 1 1 18 HIS C C 8.074 2.757 -0.306 1.00 . A A . 18 HIS C 1 1 9 3749 1 1 18 HIS CA C 7.086 3.851 -0.590 1.00 . A A . 18 HIS CA 1 1 9 3750 1 1 18 HIS CB C 6.692 4.592 0.674 1.00 . A A . 18 HIS CB 1 1 9 3751 1 1 18 HIS CD2 C 4.925 3.185 1.965 1.00 . A A . 18 HIS CD2 1 1 9 3752 1 1 18 HIS CE1 C 6.212 2.384 3.511 1.00 . A A . 18 HIS CE1 1 1 9 3753 1 1 18 HIS CG C 6.180 3.658 1.721 1.00 . A A . 18 HIS CG 1 1 9 3754 1 1 18 HIS H H 5.075 3.143 -0.773 1.00 . A A . 18 HIS H 1 1 9 3755 1 1 18 HIS HA H 7.551 4.553 -1.267 1.00 . A A . 18 HIS HA 1 1 9 3756 1 1 18 HIS HB2 H 7.543 5.131 1.055 1.00 . A A . 18 HIS HB2 1 1 9 3757 1 1 18 HIS HB3 H 5.920 5.274 0.421 1.00 . A A . 18 HIS HB3 1 1 9 3758 1 1 18 HIS HD1 H 7.959 3.286 2.822 1.00 . A A . 18 HIS HD1 1 1 9 3759 1 1 18 HIS HD2 H 4.057 3.399 1.357 1.00 . A A . 18 HIS HD2 1 1 9 3760 1 1 18 HIS HE1 H 6.576 1.839 4.372 1.00 . A A . 18 HIS HE1 1 1 9 3761 1 1 18 HIS HE2 H 4.190 1.900 3.510 1.00 . A A . 18 HIS HE2 1 1 9 3762 1 1 18 HIS N N 5.929 3.272 -1.255 1.00 . A A . 18 HIS N 1 1 9 3763 1 1 18 HIS ND1 N 6.990 3.135 2.715 1.00 . A A . 18 HIS ND1 1 1 9 3764 1 1 18 HIS NE2 N 4.942 2.377 3.100 1.00 . A A . 18 HIS NE2 1 1 9 3765 1 1 18 HIS O O 9.273 2.893 -0.556 1.00 . A A . 18 HIS O 1 1 9 3766 1 1 19 LEU C C 9.198 0.239 -0.838 1.00 . A A . 19 LEU C 1 1 9 3767 1 1 19 LEU CA C 8.372 0.476 0.405 1.00 . A A . 19 LEU CA 1 1 9 3768 1 1 19 LEU CB C 7.502 -0.754 0.654 1.00 . A A . 19 LEU CB 1 1 9 3769 1 1 19 LEU CD1 C 9.180 -1.558 2.336 1.00 . A A . 19 LEU CD1 1 1 9 3770 1 1 19 LEU CD2 C 7.209 -0.202 3.064 1.00 . A A . 19 LEU CD2 1 1 9 3771 1 1 19 LEU CG C 7.697 -1.261 2.078 1.00 . A A . 19 LEU CG 1 1 9 3772 1 1 19 LEU H H 6.569 1.610 0.287 1.00 . A A . 19 LEU H 1 1 9 3773 1 1 19 LEU HA H 9.018 0.654 1.247 1.00 . A A . 19 LEU HA 1 1 9 3774 1 1 19 LEU HB2 H 6.468 -0.496 0.508 1.00 . A A . 19 LEU HB2 1 1 9 3775 1 1 19 LEU HB3 H 7.775 -1.536 -0.044 1.00 . A A . 19 LEU HB3 1 1 9 3776 1 1 19 LEU HD11 H 9.741 -1.421 1.424 1.00 . A A . 19 LEU HD11 1 1 9 3777 1 1 19 LEU HD12 H 9.289 -2.577 2.675 1.00 . A A . 19 LEU HD12 1 1 9 3778 1 1 19 LEU HD13 H 9.553 -0.885 3.091 1.00 . A A . 19 LEU HD13 1 1 9 3779 1 1 19 LEU HD21 H 6.151 -0.041 2.928 1.00 . A A . 19 LEU HD21 1 1 9 3780 1 1 19 LEU HD22 H 7.739 0.721 2.886 1.00 . A A . 19 LEU HD22 1 1 9 3781 1 1 19 LEU HD23 H 7.395 -0.531 4.075 1.00 . A A . 19 LEU HD23 1 1 9 3782 1 1 19 LEU HG H 7.124 -2.160 2.203 1.00 . A A . 19 LEU HG 1 1 9 3783 1 1 19 LEU N N 7.543 1.647 0.156 1.00 . A A . 19 LEU N 1 1 9 3784 1 1 19 LEU O O 10.337 -0.232 -0.788 1.00 . A A . 19 LEU O 1 1 9 3785 1 1 20 ALA C C 10.432 1.411 -3.287 1.00 . A A . 20 ALA C 1 1 9 3786 1 1 20 ALA CA C 9.248 0.473 -3.256 1.00 . A A . 20 ALA CA 1 1 9 3787 1 1 20 ALA CB C 8.286 0.843 -4.389 1.00 . A A . 20 ALA CB 1 1 9 3788 1 1 20 ALA H H 7.683 0.987 -1.898 1.00 . A A . 20 ALA H 1 1 9 3789 1 1 20 ALA HA H 9.590 -0.536 -3.389 1.00 . A A . 20 ALA HA 1 1 9 3790 1 1 20 ALA HB1 H 8.469 1.861 -4.698 1.00 . A A . 20 ALA HB1 1 1 9 3791 1 1 20 ALA HB2 H 7.268 0.750 -4.044 1.00 . A A . 20 ALA HB2 1 1 9 3792 1 1 20 ALA HB3 H 8.444 0.180 -5.226 1.00 . A A . 20 ALA HB3 1 1 9 3793 1 1 20 ALA N N 8.595 0.604 -1.958 1.00 . A A . 20 ALA N 1 1 9 3794 1 1 20 ALA O O 11.581 0.989 -3.411 1.00 . A A . 20 ALA O 1 1 9 3795 1 1 21 LEU C C 12.221 3.299 -2.101 1.00 . A A . 21 LEU C 1 1 9 3796 1 1 21 LEU CA C 11.180 3.705 -3.123 1.00 . A A . 21 LEU CA 1 1 9 3797 1 1 21 LEU CB C 10.601 5.071 -2.745 1.00 . A A . 21 LEU CB 1 1 9 3798 1 1 21 LEU CD1 C 11.360 6.055 -4.931 1.00 . A A . 21 LEU CD1 1 1 9 3799 1 1 21 LEU CD2 C 9.085 5.033 -4.753 1.00 . A A . 21 LEU CD2 1 1 9 3800 1 1 21 LEU CG C 10.157 5.834 -4.005 1.00 . A A . 21 LEU CG 1 1 9 3801 1 1 21 LEU H H 9.203 2.951 -3.029 1.00 . A A . 21 LEU H 1 1 9 3802 1 1 21 LEU HA H 11.638 3.764 -4.095 1.00 . A A . 21 LEU HA 1 1 9 3803 1 1 21 LEU HB2 H 9.754 4.929 -2.091 1.00 . A A . 21 LEU HB2 1 1 9 3804 1 1 21 LEU HB3 H 11.357 5.647 -2.228 1.00 . A A . 21 LEU HB3 1 1 9 3805 1 1 21 LEU HD11 H 11.497 5.187 -5.561 1.00 . A A . 21 LEU HD11 1 1 9 3806 1 1 21 LEU HD12 H 12.252 6.212 -4.338 1.00 . A A . 21 LEU HD12 1 1 9 3807 1 1 21 LEU HD13 H 11.181 6.923 -5.548 1.00 . A A . 21 LEU HD13 1 1 9 3808 1 1 21 LEU HD21 H 8.292 4.765 -4.075 1.00 . A A . 21 LEU HD21 1 1 9 3809 1 1 21 LEU HD22 H 9.523 4.139 -5.169 1.00 . A A . 21 LEU HD22 1 1 9 3810 1 1 21 LEU HD23 H 8.681 5.636 -5.554 1.00 . A A . 21 LEU HD23 1 1 9 3811 1 1 21 LEU HG H 9.749 6.792 -3.716 1.00 . A A . 21 LEU HG 1 1 9 3812 1 1 21 LEU N N 10.136 2.691 -3.143 1.00 . A A . 21 LEU N 1 1 9 3813 1 1 21 LEU O O 13.426 3.378 -2.347 1.00 . A A . 21 LEU O 1 1 9 3814 1 1 22 ALA C C 13.482 1.270 -0.430 1.00 . A A . 22 ALA C 1 1 9 3815 1 1 22 ALA CA C 12.599 2.379 0.107 1.00 . A A . 22 ALA CA 1 1 9 3816 1 1 22 ALA CB C 11.774 1.863 1.290 1.00 . A A . 22 ALA CB 1 1 9 3817 1 1 22 ALA H H 10.754 2.792 -0.852 1.00 . A A . 22 ALA H 1 1 9 3818 1 1 22 ALA HA H 13.219 3.195 0.433 1.00 . A A . 22 ALA HA 1 1 9 3819 1 1 22 ALA HB1 H 11.506 0.833 1.116 1.00 . A A . 22 ALA HB1 1 1 9 3820 1 1 22 ALA HB2 H 10.879 2.454 1.392 1.00 . A A . 22 ALA HB2 1 1 9 3821 1 1 22 ALA HB3 H 12.358 1.935 2.196 1.00 . A A . 22 ALA HB3 1 1 9 3822 1 1 22 ALA N N 11.729 2.840 -0.962 1.00 . A A . 22 ALA N 1 1 9 3823 1 1 22 ALA O O 14.682 1.233 -0.170 1.00 . A A . 22 ALA O 1 1 9 3824 1 1 23 LEU C C 14.567 -0.141 -2.844 1.00 . A A . 23 LEU C 1 1 9 3825 1 1 23 LEU CA C 13.616 -0.713 -1.815 1.00 . A A . 23 LEU CA 1 1 9 3826 1 1 23 LEU CB C 12.661 -1.695 -2.495 1.00 . A A . 23 LEU CB 1 1 9 3827 1 1 23 LEU CD1 C 13.528 -3.891 -1.621 1.00 . A A . 23 LEU CD1 1 1 9 3828 1 1 23 LEU CD2 C 12.650 -3.733 -3.955 1.00 . A A . 23 LEU CD2 1 1 9 3829 1 1 23 LEU CG C 13.410 -2.986 -2.855 1.00 . A A . 23 LEU CG 1 1 9 3830 1 1 23 LEU H H 11.918 0.488 -1.389 1.00 . A A . 23 LEU H 1 1 9 3831 1 1 23 LEU HA H 14.179 -1.223 -1.057 1.00 . A A . 23 LEU HA 1 1 9 3832 1 1 23 LEU HB2 H 11.847 -1.918 -1.827 1.00 . A A . 23 LEU HB2 1 1 9 3833 1 1 23 LEU HB3 H 12.273 -1.247 -3.396 1.00 . A A . 23 LEU HB3 1 1 9 3834 1 1 23 LEU HD11 H 12.728 -4.619 -1.626 1.00 . A A . 23 LEU HD11 1 1 9 3835 1 1 23 LEU HD12 H 13.464 -3.294 -0.726 1.00 . A A . 23 LEU HD12 1 1 9 3836 1 1 23 LEU HD13 H 14.476 -4.406 -1.643 1.00 . A A . 23 LEU HD13 1 1 9 3837 1 1 23 LEU HD21 H 13.266 -4.538 -4.327 1.00 . A A . 23 LEU HD21 1 1 9 3838 1 1 23 LEU HD22 H 12.418 -3.057 -4.764 1.00 . A A . 23 LEU HD22 1 1 9 3839 1 1 23 LEU HD23 H 11.734 -4.143 -3.555 1.00 . A A . 23 LEU HD23 1 1 9 3840 1 1 23 LEU HG H 14.402 -2.737 -3.213 1.00 . A A . 23 LEU HG 1 1 9 3841 1 1 23 LEU N N 12.876 0.384 -1.207 1.00 . A A . 23 LEU N 1 1 9 3842 1 1 23 LEU O O 15.765 -0.419 -2.825 1.00 . A A . 23 LEU O 1 1 9 3843 1 1 24 LYS C C 15.992 2.023 -4.087 1.00 . A A . 24 LYS C 1 1 9 3844 1 1 24 LYS CA C 14.814 1.332 -4.752 1.00 . A A . 24 LYS CA 1 1 9 3845 1 1 24 LYS CB C 13.961 2.355 -5.508 1.00 . A A . 24 LYS CB 1 1 9 3846 1 1 24 LYS CD C 15.347 4.250 -6.396 1.00 . A A . 24 LYS CD 1 1 9 3847 1 1 24 LYS CE C 16.797 4.294 -6.875 1.00 . A A . 24 LYS CE 1 1 9 3848 1 1 24 LYS CG C 14.733 2.885 -6.724 1.00 . A A . 24 LYS CG 1 1 9 3849 1 1 24 LYS H H 13.052 0.867 -3.657 1.00 . A A . 24 LYS H 1 1 9 3850 1 1 24 LYS HA H 15.176 0.589 -5.441 1.00 . A A . 24 LYS HA 1 1 9 3851 1 1 24 LYS HB2 H 13.047 1.883 -5.843 1.00 . A A . 24 LYS HB2 1 1 9 3852 1 1 24 LYS HB3 H 13.717 3.176 -4.851 1.00 . A A . 24 LYS HB3 1 1 9 3853 1 1 24 LYS HD2 H 14.779 5.025 -6.891 1.00 . A A . 24 LYS HD2 1 1 9 3854 1 1 24 LYS HD3 H 15.322 4.417 -5.329 1.00 . A A . 24 LYS HD3 1 1 9 3855 1 1 24 LYS HE2 H 17.190 5.289 -6.735 1.00 . A A . 24 LYS HE2 1 1 9 3856 1 1 24 LYS HE3 H 17.385 3.595 -6.301 1.00 . A A . 24 LYS HE3 1 1 9 3857 1 1 24 LYS HG2 H 15.520 2.190 -6.982 1.00 . A A . 24 LYS HG2 1 1 9 3858 1 1 24 LYS HG3 H 14.057 2.989 -7.556 1.00 . A A . 24 LYS HG3 1 1 9 3859 1 1 24 LYS HZ1 H 17.271 4.715 -8.860 1.00 . A A . 24 LYS HZ1 1 1 9 3860 1 1 24 LYS HZ2 H 15.912 3.719 -8.676 1.00 . A A . 24 LYS HZ2 1 1 9 3861 1 1 24 LYS HZ3 H 17.465 3.086 -8.428 1.00 . A A . 24 LYS HZ3 1 1 9 3862 1 1 24 LYS N N 14.015 0.683 -3.723 1.00 . A A . 24 LYS N 1 1 9 3863 1 1 24 LYS NZ N 16.862 3.928 -8.318 1.00 . A A . 24 LYS NZ 1 1 9 3864 1 1 24 LYS O O 17.132 1.929 -4.542 1.00 . A A . 24 LYS O 1 1 9 3865 1 1 25 LYS C C 17.675 4.167 -3.050 1.00 . A A . 25 LYS C 1 1 9 3866 1 1 25 LYS CA C 16.691 3.384 -2.182 1.00 . A A . 25 LYS CA 1 1 9 3867 1 1 25 LYS CB C 17.453 2.365 -1.340 1.00 . A A . 25 LYS CB 1 1 9 3868 1 1 25 LYS CD C 19.155 2.403 0.509 1.00 . A A . 25 LYS CD 1 1 9 3869 1 1 25 LYS CE C 19.918 3.466 1.310 1.00 . A A . 25 LYS CE 1 1 9 3870 1 1 25 LYS CG C 17.819 2.977 0.019 1.00 . A A . 25 LYS CG 1 1 9 3871 1 1 25 LYS H H 14.755 2.687 -2.674 1.00 . A A . 25 LYS H 1 1 9 3872 1 1 25 LYS HA H 16.190 4.071 -1.514 1.00 . A A . 25 LYS HA 1 1 9 3873 1 1 25 LYS HB2 H 16.831 1.492 -1.189 1.00 . A A . 25 LYS HB2 1 1 9 3874 1 1 25 LYS HB3 H 18.352 2.075 -1.861 1.00 . A A . 25 LYS HB3 1 1 9 3875 1 1 25 LYS HD2 H 18.965 1.548 1.144 1.00 . A A . 25 LYS HD2 1 1 9 3876 1 1 25 LYS HD3 H 19.750 2.095 -0.337 1.00 . A A . 25 LYS HD3 1 1 9 3877 1 1 25 LYS HE2 H 19.336 3.752 2.173 1.00 . A A . 25 LYS HE2 1 1 9 3878 1 1 25 LYS HE3 H 20.865 3.059 1.634 1.00 . A A . 25 LYS HE3 1 1 9 3879 1 1 25 LYS HG2 H 17.896 4.049 -0.077 1.00 . A A . 25 LYS HG2 1 1 9 3880 1 1 25 LYS HG3 H 17.046 2.739 0.739 1.00 . A A . 25 LYS HG3 1 1 9 3881 1 1 25 LYS HZ1 H 20.784 5.326 0.957 1.00 . A A . 25 LYS HZ1 1 1 9 3882 1 1 25 LYS HZ2 H 19.257 5.140 0.255 1.00 . A A . 25 LYS HZ2 1 1 9 3883 1 1 25 LYS HZ3 H 20.615 4.375 -0.445 1.00 . A A . 25 LYS HZ3 1 1 9 3884 1 1 25 LYS N N 15.688 2.687 -2.981 1.00 . A A . 25 LYS N 1 1 9 3885 1 1 25 LYS NZ N 20.159 4.664 0.455 1.00 . A A . 25 LYS NZ 1 1 9 3886 1 1 25 LYS O O 17.355 4.595 -4.157 1.00 . A A . 25 LYS O 1 1 9 3887 1 1 26 ALA C C 21.284 4.569 -2.765 1.00 . A A . 26 ALA C 1 1 9 3888 1 1 26 ALA CA C 19.929 5.079 -3.227 1.00 . A A . 26 ALA CA 1 1 9 3889 1 1 26 ALA CB C 19.821 6.575 -2.917 1.00 . A A . 26 ALA CB 1 1 9 3890 1 1 26 ALA H H 19.075 3.982 -1.636 1.00 . A A . 26 ALA H 1 1 9 3891 1 1 26 ALA HA H 19.825 4.923 -4.293 1.00 . A A . 26 ALA HA 1 1 9 3892 1 1 26 ALA HB1 H 20.213 6.765 -1.930 1.00 . A A . 26 ALA HB1 1 1 9 3893 1 1 26 ALA HB2 H 18.784 6.874 -2.957 1.00 . A A . 26 ALA HB2 1 1 9 3894 1 1 26 ALA HB3 H 20.387 7.139 -3.643 1.00 . A A . 26 ALA HB3 1 1 9 3895 1 1 26 ALA N N 18.881 4.351 -2.524 1.00 . A A . 26 ALA N 1 1 9 3896 1 1 26 ALA O O 22.199 4.548 -3.564 1.00 . A A . 26 ALA O 1 1 9 3897 1 1 26 ALA OXT O 21.383 4.189 -1.613 1.00 . A A . 26 ALA OXT 1 1 10 3898 1 1 1 LYS C C -18.446 5.267 -12.065 1.00 . A A . 1 LYS C 1 1 10 3899 1 1 1 LYS CA C -19.819 5.927 -12.207 1.00 . A A . 1 LYS CA 1 1 10 3900 1 1 1 LYS CB C -20.211 6.073 -13.691 1.00 . A A . 1 LYS CB 1 1 10 3901 1 1 1 LYS CD C -19.343 6.786 -15.932 1.00 . A A . 1 LYS CD 1 1 10 3902 1 1 1 LYS CE C -18.555 7.871 -16.680 1.00 . A A . 1 LYS CE 1 1 10 3903 1 1 1 LYS CG C -19.218 6.991 -14.419 1.00 . A A . 1 LYS CG 1 1 10 3904 1 1 1 LYS H1 H -19.709 8.006 -12.281 1.00 . A A . 1 LYS H1 1 1 10 3905 1 1 1 LYS H2 H -18.953 7.316 -10.928 1.00 . A A . 1 LYS H2 1 1 10 3906 1 1 1 LYS H3 H -20.648 7.408 -11.006 1.00 . A A . 1 LYS H3 1 1 10 3907 1 1 1 LYS HA H -20.556 5.319 -11.701 1.00 . A A . 1 LYS HA 1 1 10 3908 1 1 1 LYS HB2 H -20.213 5.098 -14.158 1.00 . A A . 1 LYS HB2 1 1 10 3909 1 1 1 LYS HB3 H -21.203 6.500 -13.756 1.00 . A A . 1 LYS HB3 1 1 10 3910 1 1 1 LYS HD2 H -18.954 5.814 -16.199 1.00 . A A . 1 LYS HD2 1 1 10 3911 1 1 1 LYS HD3 H -20.385 6.846 -16.214 1.00 . A A . 1 LYS HD3 1 1 10 3912 1 1 1 LYS HE2 H -18.266 7.496 -17.650 1.00 . A A . 1 LYS HE2 1 1 10 3913 1 1 1 LYS HE3 H -19.177 8.746 -16.807 1.00 . A A . 1 LYS HE3 1 1 10 3914 1 1 1 LYS HG2 H -19.439 8.021 -14.175 1.00 . A A . 1 LYS HG2 1 1 10 3915 1 1 1 LYS HG3 H -18.211 6.754 -14.107 1.00 . A A . 1 LYS HG3 1 1 10 3916 1 1 1 LYS HZ1 H -16.825 8.994 -16.411 1.00 . A A . 1 LYS HZ1 1 1 10 3917 1 1 1 LYS HZ2 H -16.715 7.409 -15.816 1.00 . A A . 1 LYS HZ2 1 1 10 3918 1 1 1 LYS HZ3 H -17.599 8.576 -14.967 1.00 . A A . 1 LYS HZ3 1 1 10 3919 1 1 1 LYS N N -19.780 7.265 -11.560 1.00 . A A . 1 LYS N 1 1 10 3920 1 1 1 LYS NZ N -17.332 8.237 -15.910 1.00 . A A . 1 LYS NZ 1 1 10 3921 1 1 1 LYS O O -17.806 5.374 -11.017 1.00 . A A . 1 LYS O 1 1 10 3922 1 1 2 LYS C C -16.687 2.911 -11.920 1.00 . A A . 2 LYS C 1 1 10 3923 1 1 2 LYS CA C -16.713 3.896 -13.091 1.00 . A A . 2 LYS CA 1 1 10 3924 1 1 2 LYS CB C -15.567 4.919 -12.969 1.00 . A A . 2 LYS CB 1 1 10 3925 1 1 2 LYS CD C -13.799 3.225 -13.563 1.00 . A A . 2 LYS CD 1 1 10 3926 1 1 2 LYS CE C -12.767 2.826 -14.624 1.00 . A A . 2 LYS CE 1 1 10 3927 1 1 2 LYS CG C -14.438 4.567 -13.949 1.00 . A A . 2 LYS CG 1 1 10 3928 1 1 2 LYS H H -18.559 4.524 -13.922 1.00 . A A . 2 LYS H 1 1 10 3929 1 1 2 LYS HA H -16.597 3.346 -14.013 1.00 . A A . 2 LYS HA 1 1 10 3930 1 1 2 LYS HB2 H -15.943 5.904 -13.203 1.00 . A A . 2 LYS HB2 1 1 10 3931 1 1 2 LYS HB3 H -15.182 4.920 -11.962 1.00 . A A . 2 LYS HB3 1 1 10 3932 1 1 2 LYS HD2 H -13.308 3.322 -12.607 1.00 . A A . 2 LYS HD2 1 1 10 3933 1 1 2 LYS HD3 H -14.559 2.462 -13.502 1.00 . A A . 2 LYS HD3 1 1 10 3934 1 1 2 LYS HE2 H -12.013 3.595 -14.702 1.00 . A A . 2 LYS HE2 1 1 10 3935 1 1 2 LYS HE3 H -12.300 1.896 -14.338 1.00 . A A . 2 LYS HE3 1 1 10 3936 1 1 2 LYS HG2 H -14.839 4.501 -14.948 1.00 . A A . 2 LYS HG2 1 1 10 3937 1 1 2 LYS HG3 H -13.684 5.342 -13.920 1.00 . A A . 2 LYS HG3 1 1 10 3938 1 1 2 LYS HZ1 H -14.395 3.055 -15.912 1.00 . A A . 2 LYS HZ1 1 1 10 3939 1 1 2 LYS HZ2 H -13.495 1.648 -16.184 1.00 . A A . 2 LYS HZ2 1 1 10 3940 1 1 2 LYS HZ3 H -12.887 3.156 -16.678 1.00 . A A . 2 LYS HZ3 1 1 10 3941 1 1 2 LYS N N -18.003 4.580 -13.117 1.00 . A A . 2 LYS N 1 1 10 3942 1 1 2 LYS NZ N -13.439 2.659 -15.944 1.00 . A A . 2 LYS NZ 1 1 10 3943 1 1 2 LYS O O -17.686 2.240 -11.652 1.00 . A A . 2 LYS O 1 1 10 3944 1 1 3 ALA C C -15.605 2.694 -8.787 1.00 . A A . 3 ALA C 1 1 10 3945 1 1 3 ALA CA C -15.446 1.925 -10.091 1.00 . A A . 3 ALA CA 1 1 10 3946 1 1 3 ALA CB C -14.087 1.220 -10.113 1.00 . A A . 3 ALA CB 1 1 10 3947 1 1 3 ALA H H -14.797 3.391 -11.476 1.00 . A A . 3 ALA H 1 1 10 3948 1 1 3 ALA HA H -16.224 1.180 -10.153 1.00 . A A . 3 ALA HA 1 1 10 3949 1 1 3 ALA HB1 H -13.967 0.643 -9.207 1.00 . A A . 3 ALA HB1 1 1 10 3950 1 1 3 ALA HB2 H -13.298 1.956 -10.179 1.00 . A A . 3 ALA HB2 1 1 10 3951 1 1 3 ALA HB3 H -14.037 0.559 -10.967 1.00 . A A . 3 ALA HB3 1 1 10 3952 1 1 3 ALA N N -15.561 2.829 -11.226 1.00 . A A . 3 ALA N 1 1 10 3953 1 1 3 ALA O O -14.640 3.261 -8.273 1.00 . A A . 3 ALA O 1 1 10 3954 1 1 4 LEU C C -16.148 2.788 -5.932 1.00 . A A . 4 LEU C 1 1 10 3955 1 1 4 LEU CA C -17.069 3.386 -6.986 1.00 . A A . 4 LEU CA 1 1 10 3956 1 1 4 LEU CB C -18.540 3.213 -6.575 1.00 . A A . 4 LEU CB 1 1 10 3957 1 1 4 LEU CD1 C -18.318 3.821 -4.142 1.00 . A A . 4 LEU CD1 1 1 10 3958 1 1 4 LEU CD2 C -18.439 5.635 -5.865 1.00 . A A . 4 LEU CD2 1 1 10 3959 1 1 4 LEU CG C -18.931 4.231 -5.486 1.00 . A A . 4 LEU CG 1 1 10 3960 1 1 4 LEU H H -17.551 2.223 -8.687 1.00 . A A . 4 LEU H 1 1 10 3961 1 1 4 LEU HA H -16.845 4.435 -7.103 1.00 . A A . 4 LEU HA 1 1 10 3962 1 1 4 LEU HB2 H -19.170 3.360 -7.441 1.00 . A A . 4 LEU HB2 1 1 10 3963 1 1 4 LEU HB3 H -18.688 2.212 -6.197 1.00 . A A . 4 LEU HB3 1 1 10 3964 1 1 4 LEU HD11 H -19.026 4.013 -3.349 1.00 . A A . 4 LEU HD11 1 1 10 3965 1 1 4 LEU HD12 H -17.416 4.393 -3.967 1.00 . A A . 4 LEU HD12 1 1 10 3966 1 1 4 LEU HD13 H -18.079 2.767 -4.161 1.00 . A A . 4 LEU HD13 1 1 10 3967 1 1 4 LEU HD21 H -18.477 5.755 -6.938 1.00 . A A . 4 LEU HD21 1 1 10 3968 1 1 4 LEU HD22 H -17.422 5.767 -5.524 1.00 . A A . 4 LEU HD22 1 1 10 3969 1 1 4 LEU HD23 H -19.073 6.375 -5.400 1.00 . A A . 4 LEU HD23 1 1 10 3970 1 1 4 LEU HG H -20.008 4.244 -5.390 1.00 . A A . 4 LEU HG 1 1 10 3971 1 1 4 LEU N N -16.819 2.699 -8.244 1.00 . A A . 4 LEU N 1 1 10 3972 1 1 4 LEU O O -15.986 1.564 -5.881 1.00 . A A . 4 LEU O 1 1 10 3973 1 1 5 LEU C C -13.381 2.553 -4.778 1.00 . A A . 5 LEU C 1 1 10 3974 1 1 5 LEU CA C -14.596 3.180 -4.095 1.00 . A A . 5 LEU CA 1 1 10 3975 1 1 5 LEU CB C -15.295 2.175 -3.162 1.00 . A A . 5 LEU CB 1 1 10 3976 1 1 5 LEU CD1 C -13.237 1.895 -1.750 1.00 . A A . 5 LEU CD1 1 1 10 3977 1 1 5 LEU CD2 C -15.049 0.169 -1.696 1.00 . A A . 5 LEU CD2 1 1 10 3978 1 1 5 LEU CG C -14.295 1.166 -2.582 1.00 . A A . 5 LEU CG 1 1 10 3979 1 1 5 LEU H H -15.685 4.605 -5.234 1.00 . A A . 5 LEU H 1 1 10 3980 1 1 5 LEU HA H -14.268 4.030 -3.516 1.00 . A A . 5 LEU HA 1 1 10 3981 1 1 5 LEU HB2 H -15.762 2.713 -2.351 1.00 . A A . 5 LEU HB2 1 1 10 3982 1 1 5 LEU HB3 H -16.054 1.642 -3.713 1.00 . A A . 5 LEU HB3 1 1 10 3983 1 1 5 LEU HD11 H -13.681 2.751 -1.266 1.00 . A A . 5 LEU HD11 1 1 10 3984 1 1 5 LEU HD12 H -12.441 2.225 -2.397 1.00 . A A . 5 LEU HD12 1 1 10 3985 1 1 5 LEU HD13 H -12.839 1.226 -1.008 1.00 . A A . 5 LEU HD13 1 1 10 3986 1 1 5 LEU HD21 H -15.608 0.706 -0.943 1.00 . A A . 5 LEU HD21 1 1 10 3987 1 1 5 LEU HD22 H -14.344 -0.496 -1.216 1.00 . A A . 5 LEU HD22 1 1 10 3988 1 1 5 LEU HD23 H -15.729 -0.410 -2.305 1.00 . A A . 5 LEU HD23 1 1 10 3989 1 1 5 LEU HG H -13.812 0.632 -3.387 1.00 . A A . 5 LEU HG 1 1 10 3990 1 1 5 LEU N N -15.529 3.644 -5.123 1.00 . A A . 5 LEU N 1 1 10 3991 1 1 5 LEU O O -12.259 3.042 -4.646 1.00 . A A . 5 LEU O 1 1 10 3992 1 1 6 ALA C C -11.449 0.306 -5.425 1.00 . A A . 6 ALA C 1 1 10 3993 1 1 6 ALA CA C -12.601 0.787 -6.296 1.00 . A A . 6 ALA CA 1 1 10 3994 1 1 6 ALA CB C -12.041 1.702 -7.388 1.00 . A A . 6 ALA CB 1 1 10 3995 1 1 6 ALA H H -14.565 1.179 -5.611 1.00 . A A . 6 ALA H 1 1 10 3996 1 1 6 ALA HA H -13.048 -0.071 -6.771 1.00 . A A . 6 ALA HA 1 1 10 3997 1 1 6 ALA HB1 H -11.534 2.541 -6.932 1.00 . A A . 6 ALA HB1 1 1 10 3998 1 1 6 ALA HB2 H -12.847 2.062 -8.001 1.00 . A A . 6 ALA HB2 1 1 10 3999 1 1 6 ALA HB3 H -11.343 1.148 -7.997 1.00 . A A . 6 ALA HB3 1 1 10 4000 1 1 6 ALA N N -13.635 1.489 -5.536 1.00 . A A . 6 ALA N 1 1 10 4001 1 1 6 ALA O O -11.213 -0.895 -5.308 1.00 . A A . 6 ALA O 1 1 10 4002 1 1 7 LEU C C -9.894 -0.052 -2.903 1.00 . A A . 7 LEU C 1 1 10 4003 1 1 7 LEU CA C -9.542 0.884 -4.057 1.00 . A A . 7 LEU CA 1 1 10 4004 1 1 7 LEU CB C -8.822 2.133 -3.526 1.00 . A A . 7 LEU CB 1 1 10 4005 1 1 7 LEU CD1 C -9.848 2.134 -1.231 1.00 . A A . 7 LEU CD1 1 1 10 4006 1 1 7 LEU CD2 C -9.060 4.261 -2.244 1.00 . A A . 7 LEU CD2 1 1 10 4007 1 1 7 LEU CG C -9.707 2.910 -2.541 1.00 . A A . 7 LEU CG 1 1 10 4008 1 1 7 LEU H H -10.919 2.187 -5.017 1.00 . A A . 7 LEU H 1 1 10 4009 1 1 7 LEU HA H -8.855 0.359 -4.705 1.00 . A A . 7 LEU HA 1 1 10 4010 1 1 7 LEU HB2 H -7.915 1.827 -3.026 1.00 . A A . 7 LEU HB2 1 1 10 4011 1 1 7 LEU HB3 H -8.566 2.775 -4.359 1.00 . A A . 7 LEU HB3 1 1 10 4012 1 1 7 LEU HD11 H -9.867 2.823 -0.402 1.00 . A A . 7 LEU HD11 1 1 10 4013 1 1 7 LEU HD12 H -9.014 1.464 -1.120 1.00 . A A . 7 LEU HD12 1 1 10 4014 1 1 7 LEU HD13 H -10.764 1.567 -1.246 1.00 . A A . 7 LEU HD13 1 1 10 4015 1 1 7 LEU HD21 H -9.805 4.934 -1.850 1.00 . A A . 7 LEU HD21 1 1 10 4016 1 1 7 LEU HD22 H -8.648 4.671 -3.154 1.00 . A A . 7 LEU HD22 1 1 10 4017 1 1 7 LEU HD23 H -8.271 4.130 -1.517 1.00 . A A . 7 LEU HD23 1 1 10 4018 1 1 7 LEU HG H -10.681 3.064 -2.974 1.00 . A A . 7 LEU HG 1 1 10 4019 1 1 7 LEU N N -10.704 1.242 -4.862 1.00 . A A . 7 LEU N 1 1 10 4020 1 1 7 LEU O O -11.063 -0.231 -2.544 1.00 . A A . 7 LEU O 1 1 10 4021 1 1 8 ALA C C -7.607 -2.205 -0.965 1.00 . A A . 8 ALA C 1 1 10 4022 1 1 8 ALA CA C -8.962 -1.569 -1.209 1.00 . A A . 8 ALA CA 1 1 10 4023 1 1 8 ALA CB C -10.004 -2.660 -1.501 1.00 . A A . 8 ALA CB 1 1 10 4024 1 1 8 ALA H H -7.951 -0.427 -2.677 1.00 . A A . 8 ALA H 1 1 10 4025 1 1 8 ALA HA H -9.251 -1.027 -0.328 1.00 . A A . 8 ALA HA 1 1 10 4026 1 1 8 ALA HB1 H -9.505 -3.564 -1.815 1.00 . A A . 8 ALA HB1 1 1 10 4027 1 1 8 ALA HB2 H -10.663 -2.329 -2.285 1.00 . A A . 8 ALA HB2 1 1 10 4028 1 1 8 ALA HB3 H -10.576 -2.859 -0.611 1.00 . A A . 8 ALA HB3 1 1 10 4029 1 1 8 ALA N N -8.846 -0.636 -2.331 1.00 . A A . 8 ALA N 1 1 10 4030 1 1 8 ALA O O -7.131 -2.296 0.168 1.00 . A A . 8 ALA O 1 1 10 4031 1 1 9 LEU C C -4.603 -2.164 -2.157 1.00 . A A . 9 LEU C 1 1 10 4032 1 1 9 LEU CA C -5.665 -3.229 -2.001 1.00 . A A . 9 LEU CA 1 1 10 4033 1 1 9 LEU CB C -5.494 -4.211 -3.138 1.00 . A A . 9 LEU CB 1 1 10 4034 1 1 9 LEU CD1 C -7.483 -5.326 -2.065 1.00 . A A . 9 LEU CD1 1 1 10 4035 1 1 9 LEU CD2 C -6.510 -6.228 -4.169 1.00 . A A . 9 LEU CD2 1 1 10 4036 1 1 9 LEU CG C -6.184 -5.548 -2.841 1.00 . A A . 9 LEU CG 1 1 10 4037 1 1 9 LEU H H -7.422 -2.491 -2.919 1.00 . A A . 9 LEU H 1 1 10 4038 1 1 9 LEU HA H -5.533 -3.733 -1.063 1.00 . A A . 9 LEU HA 1 1 10 4039 1 1 9 LEU HB2 H -5.916 -3.779 -4.029 1.00 . A A . 9 LEU HB2 1 1 10 4040 1 1 9 LEU HB3 H -4.439 -4.378 -3.286 1.00 . A A . 9 LEU HB3 1 1 10 4041 1 1 9 LEU HD11 H -8.008 -6.267 -1.971 1.00 . A A . 9 LEU HD11 1 1 10 4042 1 1 9 LEU HD12 H -8.101 -4.620 -2.599 1.00 . A A . 9 LEU HD12 1 1 10 4043 1 1 9 LEU HD13 H -7.258 -4.941 -1.083 1.00 . A A . 9 LEU HD13 1 1 10 4044 1 1 9 LEU HD21 H -7.461 -5.870 -4.531 1.00 . A A . 9 LEU HD21 1 1 10 4045 1 1 9 LEU HD22 H -6.555 -7.297 -4.026 1.00 . A A . 9 LEU HD22 1 1 10 4046 1 1 9 LEU HD23 H -5.741 -5.992 -4.889 1.00 . A A . 9 LEU HD23 1 1 10 4047 1 1 9 LEU HG H -5.521 -6.178 -2.266 1.00 . A A . 9 LEU HG 1 1 10 4048 1 1 9 LEU N N -6.986 -2.616 -2.054 1.00 . A A . 9 LEU N 1 1 10 4049 1 1 9 LEU O O -3.653 -2.101 -1.383 1.00 . A A . 9 LEU O 1 1 10 4050 1 1 10 HIS C C -3.403 0.346 -2.124 1.00 . A A . 10 HIS C 1 1 10 4051 1 1 10 HIS CA C -3.852 -0.228 -3.444 1.00 . A A . 10 HIS CA 1 1 10 4052 1 1 10 HIS CB C -4.548 0.861 -4.244 1.00 . A A . 10 HIS CB 1 1 10 4053 1 1 10 HIS CD2 C -4.748 0.161 -6.772 1.00 . A A . 10 HIS CD2 1 1 10 4054 1 1 10 HIS CE1 C -2.919 1.070 -7.496 1.00 . A A . 10 HIS CE1 1 1 10 4055 1 1 10 HIS CG C -4.151 0.767 -5.693 1.00 . A A . 10 HIS CG 1 1 10 4056 1 1 10 HIS H H -5.575 -1.443 -3.737 1.00 . A A . 10 HIS H 1 1 10 4057 1 1 10 HIS HA H -3.000 -0.601 -3.991 1.00 . A A . 10 HIS HA 1 1 10 4058 1 1 10 HIS HB2 H -5.612 0.736 -4.147 1.00 . A A . 10 HIS HB2 1 1 10 4059 1 1 10 HIS HB3 H -4.265 1.827 -3.852 1.00 . A A . 10 HIS HB3 1 1 10 4060 1 1 10 HIS HD1 H -2.328 1.863 -5.660 1.00 . A A . 10 HIS HD1 1 1 10 4061 1 1 10 HIS HD2 H -5.684 -0.375 -6.743 1.00 . A A . 10 HIS HD2 1 1 10 4062 1 1 10 HIS HE1 H -2.116 1.396 -8.144 1.00 . A A . 10 HIS HE1 1 1 10 4063 1 1 10 HIS HE2 H -4.147 0.027 -8.817 1.00 . A A . 10 HIS HE2 1 1 10 4064 1 1 10 HIS N N -4.786 -1.324 -3.172 1.00 . A A . 10 HIS N 1 1 10 4065 1 1 10 HIS ND1 N -2.986 1.343 -6.179 1.00 . A A . 10 HIS ND1 1 1 10 4066 1 1 10 HIS NE2 N -3.967 0.353 -7.910 1.00 . A A . 10 HIS NE2 1 1 10 4067 1 1 10 HIS O O -2.252 0.731 -1.932 1.00 . A A . 10 HIS O 1 1 10 4068 1 1 11 HIS C C -2.756 0.322 0.598 1.00 . A A . 11 HIS C 1 1 10 4069 1 1 11 HIS CA C -4.124 0.787 0.142 1.00 . A A . 11 HIS CA 1 1 10 4070 1 1 11 HIS CB C -5.190 0.126 1.005 1.00 . A A . 11 HIS CB 1 1 10 4071 1 1 11 HIS CD2 C -7.618 1.104 0.901 1.00 . A A . 11 HIS CD2 1 1 10 4072 1 1 11 HIS CE1 C -7.322 2.856 2.137 1.00 . A A . 11 HIS CE1 1 1 10 4073 1 1 11 HIS CG C -6.305 1.096 1.287 1.00 . A A . 11 HIS CG 1 1 10 4074 1 1 11 HIS H H -5.225 -0.018 -1.448 1.00 . A A . 11 HIS H 1 1 10 4075 1 1 11 HIS HA H -4.201 1.857 0.206 1.00 . A A . 11 HIS HA 1 1 10 4076 1 1 11 HIS HB2 H -5.587 -0.738 0.468 1.00 . A A . 11 HIS HB2 1 1 10 4077 1 1 11 HIS HB3 H -4.754 -0.203 1.928 1.00 . A A . 11 HIS HB3 1 1 10 4078 1 1 11 HIS HD1 H -5.301 2.510 2.512 1.00 . A A . 11 HIS HD1 1 1 10 4079 1 1 11 HIS HD2 H -8.084 0.361 0.271 1.00 . A A . 11 HIS HD2 1 1 10 4080 1 1 11 HIS HE1 H -7.497 3.768 2.688 1.00 . A A . 11 HIS HE1 1 1 10 4081 1 1 11 HIS HE2 H -9.209 2.462 1.339 1.00 . A A . 11 HIS HE2 1 1 10 4082 1 1 11 HIS N N -4.347 0.342 -1.210 1.00 . A A . 11 HIS N 1 1 10 4083 1 1 11 HIS ND1 N -6.135 2.225 2.075 1.00 . A A . 11 HIS ND1 1 1 10 4084 1 1 11 HIS NE2 N -8.261 2.214 1.439 1.00 . A A . 11 HIS NE2 1 1 10 4085 1 1 11 HIS O O -1.945 1.080 1.132 1.00 . A A . 11 HIS O 1 1 10 4086 1 1 12 LEU C C -0.213 -1.114 -0.329 1.00 . A A . 12 LEU C 1 1 10 4087 1 1 12 LEU CA C -1.250 -1.560 0.670 1.00 . A A . 12 LEU CA 1 1 10 4088 1 1 12 LEU CB C -1.393 -3.083 0.628 1.00 . A A . 12 LEU CB 1 1 10 4089 1 1 12 LEU CD1 C -3.374 -4.608 0.899 1.00 . A A . 12 LEU CD1 1 1 10 4090 1 1 12 LEU CD2 C -1.930 -4.064 2.867 1.00 . A A . 12 LEU CD2 1 1 10 4091 1 1 12 LEU CG C -2.527 -3.517 1.567 1.00 . A A . 12 LEU CG 1 1 10 4092 1 1 12 LEU H H -3.204 -1.463 -0.137 1.00 . A A . 12 LEU H 1 1 10 4093 1 1 12 LEU HA H -0.954 -1.251 1.655 1.00 . A A . 12 LEU HA 1 1 10 4094 1 1 12 LEU HB2 H -1.617 -3.392 -0.385 1.00 . A A . 12 LEU HB2 1 1 10 4095 1 1 12 LEU HB3 H -0.466 -3.538 0.945 1.00 . A A . 12 LEU HB3 1 1 10 4096 1 1 12 LEU HD11 H -4.398 -4.517 1.228 1.00 . A A . 12 LEU HD11 1 1 10 4097 1 1 12 LEU HD12 H -2.995 -5.579 1.178 1.00 . A A . 12 LEU HD12 1 1 10 4098 1 1 12 LEU HD13 H -3.328 -4.499 -0.175 1.00 . A A . 12 LEU HD13 1 1 10 4099 1 1 12 LEU HD21 H -1.444 -5.010 2.673 1.00 . A A . 12 LEU HD21 1 1 10 4100 1 1 12 LEU HD22 H -2.717 -4.209 3.594 1.00 . A A . 12 LEU HD22 1 1 10 4101 1 1 12 LEU HD23 H -1.208 -3.362 3.255 1.00 . A A . 12 LEU HD23 1 1 10 4102 1 1 12 LEU HG H -3.157 -2.668 1.789 1.00 . A A . 12 LEU HG 1 1 10 4103 1 1 12 LEU N N -2.513 -0.939 0.332 1.00 . A A . 12 LEU N 1 1 10 4104 1 1 12 LEU O O 0.880 -0.682 0.033 1.00 . A A . 12 LEU O 1 1 10 4105 1 1 13 ALA C C 0.870 0.599 -2.332 1.00 . A A . 13 ALA C 1 1 10 4106 1 1 13 ALA CA C 0.290 -0.764 -2.675 1.00 . A A . 13 ALA CA 1 1 10 4107 1 1 13 ALA CB C -0.481 -0.681 -4.000 1.00 . A A . 13 ALA CB 1 1 10 4108 1 1 13 ALA H H -1.490 -1.521 -1.794 1.00 . A A . 13 ALA H 1 1 10 4109 1 1 13 ALA HA H 1.094 -1.473 -2.777 1.00 . A A . 13 ALA HA 1 1 10 4110 1 1 13 ALA HB1 H 0.213 -0.697 -4.826 1.00 . A A . 13 ALA HB1 1 1 10 4111 1 1 13 ALA HB2 H -1.048 0.238 -4.029 1.00 . A A . 13 ALA HB2 1 1 10 4112 1 1 13 ALA HB3 H -1.153 -1.524 -4.080 1.00 . A A . 13 ALA HB3 1 1 10 4113 1 1 13 ALA N N -0.590 -1.191 -1.593 1.00 . A A . 13 ALA N 1 1 10 4114 1 1 13 ALA O O 2.011 0.909 -2.661 1.00 . A A . 13 ALA O 1 1 10 4115 1 1 14 HIS C C 1.622 2.594 -0.221 1.00 . A A . 14 HIS C 1 1 10 4116 1 1 14 HIS CA C 0.485 2.723 -1.216 1.00 . A A . 14 HIS CA 1 1 10 4117 1 1 14 HIS CB C -0.716 3.434 -0.597 1.00 . A A . 14 HIS CB 1 1 10 4118 1 1 14 HIS CD2 C -0.648 4.426 1.825 1.00 . A A . 14 HIS CD2 1 1 10 4119 1 1 14 HIS CE1 C 0.719 6.065 1.467 1.00 . A A . 14 HIS CE1 1 1 10 4120 1 1 14 HIS CG C -0.300 4.369 0.499 1.00 . A A . 14 HIS CG 1 1 10 4121 1 1 14 HIS H H -0.824 1.073 -1.402 1.00 . A A . 14 HIS H 1 1 10 4122 1 1 14 HIS HA H 0.825 3.280 -2.067 1.00 . A A . 14 HIS HA 1 1 10 4123 1 1 14 HIS HB2 H -1.210 3.984 -1.365 1.00 . A A . 14 HIS HB2 1 1 10 4124 1 1 14 HIS HB3 H -1.396 2.700 -0.197 1.00 . A A . 14 HIS HB3 1 1 10 4125 1 1 14 HIS HD1 H 0.993 5.675 -0.565 1.00 . A A . 14 HIS HD1 1 1 10 4126 1 1 14 HIS HD2 H -1.336 3.752 2.315 1.00 . A A . 14 HIS HD2 1 1 10 4127 1 1 14 HIS HE1 H 1.328 6.949 1.603 1.00 . A A . 14 HIS HE1 1 1 10 4128 1 1 14 HIS HE2 H -0.054 5.764 3.380 1.00 . A A . 14 HIS HE2 1 1 10 4129 1 1 14 HIS N N 0.071 1.395 -1.641 1.00 . A A . 14 HIS N 1 1 10 4130 1 1 14 HIS ND1 N 0.573 5.425 0.291 1.00 . A A . 14 HIS ND1 1 1 10 4131 1 1 14 HIS NE2 N -0.001 5.494 2.436 1.00 . A A . 14 HIS NE2 1 1 10 4132 1 1 14 HIS O O 2.724 3.115 -0.425 1.00 . A A . 14 HIS O 1 1 10 4133 1 1 15 LEU C C 3.532 0.916 1.101 1.00 . A A . 15 LEU C 1 1 10 4134 1 1 15 LEU CA C 2.402 1.596 1.813 1.00 . A A . 15 LEU CA 1 1 10 4135 1 1 15 LEU CB C 1.890 0.655 2.904 1.00 . A A . 15 LEU CB 1 1 10 4136 1 1 15 LEU CD1 C 1.334 2.884 3.928 1.00 . A A . 15 LEU CD1 1 1 10 4137 1 1 15 LEU CD2 C -0.467 1.207 3.519 1.00 . A A . 15 LEU CD2 1 1 10 4138 1 1 15 LEU CG C 1.001 1.392 3.906 1.00 . A A . 15 LEU CG 1 1 10 4139 1 1 15 LEU H H 0.486 1.415 0.914 1.00 . A A . 15 LEU H 1 1 10 4140 1 1 15 LEU HA H 2.750 2.523 2.231 1.00 . A A . 15 LEU HA 1 1 10 4141 1 1 15 LEU HB2 H 1.321 -0.139 2.438 1.00 . A A . 15 LEU HB2 1 1 10 4142 1 1 15 LEU HB3 H 2.733 0.226 3.421 1.00 . A A . 15 LEU HB3 1 1 10 4143 1 1 15 LEU HD11 H 2.382 3.017 4.149 1.00 . A A . 15 LEU HD11 1 1 10 4144 1 1 15 LEU HD12 H 0.741 3.369 4.686 1.00 . A A . 15 LEU HD12 1 1 10 4145 1 1 15 LEU HD13 H 1.111 3.315 2.964 1.00 . A A . 15 LEU HD13 1 1 10 4146 1 1 15 LEU HD21 H -0.619 0.212 3.133 1.00 . A A . 15 LEU HD21 1 1 10 4147 1 1 15 LEU HD22 H -0.731 1.929 2.765 1.00 . A A . 15 LEU HD22 1 1 10 4148 1 1 15 LEU HD23 H -1.090 1.354 4.387 1.00 . A A . 15 LEU HD23 1 1 10 4149 1 1 15 LEU HG H 1.166 0.977 4.884 1.00 . A A . 15 LEU HG 1 1 10 4150 1 1 15 LEU N N 1.366 1.843 0.828 1.00 . A A . 15 LEU N 1 1 10 4151 1 1 15 LEU O O 4.705 1.086 1.411 1.00 . A A . 15 LEU O 1 1 10 4152 1 1 16 ALA C C 4.865 0.390 -1.564 1.00 . A A . 16 ALA C 1 1 10 4153 1 1 16 ALA CA C 4.107 -0.580 -0.674 1.00 . A A . 16 ALA CA 1 1 10 4154 1 1 16 ALA CB C 3.403 -1.625 -1.538 1.00 . A A . 16 ALA CB 1 1 10 4155 1 1 16 ALA H H 2.168 0.078 -0.053 1.00 . A A . 16 ALA H 1 1 10 4156 1 1 16 ALA HA H 4.806 -1.070 -0.016 1.00 . A A . 16 ALA HA 1 1 10 4157 1 1 16 ALA HB1 H 3.165 -1.194 -2.499 1.00 . A A . 16 ALA HB1 1 1 10 4158 1 1 16 ALA HB2 H 2.493 -1.942 -1.049 1.00 . A A . 16 ALA HB2 1 1 10 4159 1 1 16 ALA HB3 H 4.052 -2.474 -1.675 1.00 . A A . 16 ALA HB3 1 1 10 4160 1 1 16 ALA N N 3.142 0.148 0.128 1.00 . A A . 16 ALA N 1 1 10 4161 1 1 16 ALA O O 5.998 0.132 -1.953 1.00 . A A . 16 ALA O 1 1 10 4162 1 1 17 LEU C C 6.052 3.103 -2.151 1.00 . A A . 17 LEU C 1 1 10 4163 1 1 17 LEU CA C 4.786 2.522 -2.748 1.00 . A A . 17 LEU CA 1 1 10 4164 1 1 17 LEU CB C 3.738 3.624 -3.007 1.00 . A A . 17 LEU CB 1 1 10 4165 1 1 17 LEU CD1 C 5.226 5.662 -2.986 1.00 . A A . 17 LEU CD1 1 1 10 4166 1 1 17 LEU CD2 C 2.839 5.839 -2.289 1.00 . A A . 17 LEU CD2 1 1 10 4167 1 1 17 LEU CG C 4.076 4.937 -2.278 1.00 . A A . 17 LEU CG 1 1 10 4168 1 1 17 LEU H H 3.296 1.613 -1.544 1.00 . A A . 17 LEU H 1 1 10 4169 1 1 17 LEU HA H 5.040 2.068 -3.685 1.00 . A A . 17 LEU HA 1 1 10 4170 1 1 17 LEU HB2 H 3.686 3.816 -4.064 1.00 . A A . 17 LEU HB2 1 1 10 4171 1 1 17 LEU HB3 H 2.778 3.271 -2.664 1.00 . A A . 17 LEU HB3 1 1 10 4172 1 1 17 LEU HD11 H 5.980 5.930 -2.262 1.00 . A A . 17 LEU HD11 1 1 10 4173 1 1 17 LEU HD12 H 4.850 6.556 -3.459 1.00 . A A . 17 LEU HD12 1 1 10 4174 1 1 17 LEU HD13 H 5.661 5.018 -3.736 1.00 . A A . 17 LEU HD13 1 1 10 4175 1 1 17 LEU HD21 H 1.971 5.261 -2.011 1.00 . A A . 17 LEU HD21 1 1 10 4176 1 1 17 LEU HD22 H 2.699 6.247 -3.277 1.00 . A A . 17 LEU HD22 1 1 10 4177 1 1 17 LEU HD23 H 2.975 6.645 -1.583 1.00 . A A . 17 LEU HD23 1 1 10 4178 1 1 17 LEU HG H 4.350 4.729 -1.260 1.00 . A A . 17 LEU HG 1 1 10 4179 1 1 17 LEU N N 4.209 1.494 -1.886 1.00 . A A . 17 LEU N 1 1 10 4180 1 1 17 LEU O O 7.079 3.204 -2.822 1.00 . A A . 17 LEU O 1 1 10 4181 1 1 18 HIS C C 8.156 2.952 0.028 1.00 . A A . 18 HIS C 1 1 10 4182 1 1 18 HIS CA C 7.176 4.054 -0.264 1.00 . A A . 18 HIS CA 1 1 10 4183 1 1 18 HIS CB C 6.823 4.826 0.990 1.00 . A A . 18 HIS CB 1 1 10 4184 1 1 18 HIS CD2 C 5.105 3.393 2.316 1.00 . A A . 18 HIS CD2 1 1 10 4185 1 1 18 HIS CE1 C 6.381 2.785 3.961 1.00 . A A . 18 HIS CE1 1 1 10 4186 1 1 18 HIS CG C 6.339 3.925 2.078 1.00 . A A . 18 HIS CG 1 1 10 4187 1 1 18 HIS H H 5.134 3.382 -0.389 1.00 . A A . 18 HIS H 1 1 10 4188 1 1 18 HIS HA H 7.634 4.731 -0.964 1.00 . A A . 18 HIS HA 1 1 10 4189 1 1 18 HIS HB2 H 7.690 5.368 1.330 1.00 . A A . 18 HIS HB2 1 1 10 4190 1 1 18 HIS HB3 H 6.047 5.509 0.743 1.00 . A A . 18 HIS HB3 1 1 10 4191 1 1 18 HIS HD1 H 8.104 3.723 3.244 1.00 . A A . 18 HIS HD1 1 1 10 4192 1 1 18 HIS HD2 H 4.249 3.509 1.663 1.00 . A A . 18 HIS HD2 1 1 10 4193 1 1 18 HIS HE1 H 6.734 2.351 4.886 1.00 . A A . 18 HIS HE1 1 1 10 4194 1 1 18 HIS HE2 H 4.385 2.173 3.921 1.00 . A A . 18 HIS HE2 1 1 10 4195 1 1 18 HIS N N 5.988 3.486 -0.892 1.00 . A A . 18 HIS N 1 1 10 4196 1 1 18 HIS ND1 N 7.143 3.523 3.132 1.00 . A A . 18 HIS ND1 1 1 10 4197 1 1 18 HIS NE2 N 5.127 2.672 3.509 1.00 . A A . 18 HIS NE2 1 1 10 4198 1 1 18 HIS O O 9.356 3.070 -0.245 1.00 . A A . 18 HIS O 1 1 10 4199 1 1 19 LEU C C 9.106 0.295 -0.517 1.00 . A A . 19 LEU C 1 1 10 4200 1 1 19 LEU CA C 8.467 0.699 0.793 1.00 . A A . 19 LEU CA 1 1 10 4201 1 1 19 LEU CB C 7.629 -0.466 1.309 1.00 . A A . 19 LEU CB 1 1 10 4202 1 1 19 LEU CD1 C 5.929 -1.116 2.999 1.00 . A A . 19 LEU CD1 1 1 10 4203 1 1 19 LEU CD2 C 8.087 -0.060 3.710 1.00 . A A . 19 LEU CD2 1 1 10 4204 1 1 19 LEU CG C 7.000 -0.088 2.639 1.00 . A A . 19 LEU CG 1 1 10 4205 1 1 19 LEU H H 6.662 1.825 0.684 1.00 . A A . 19 LEU H 1 1 10 4206 1 1 19 LEU HA H 9.232 0.950 1.509 1.00 . A A . 19 LEU HA 1 1 10 4207 1 1 19 LEU HB2 H 6.853 -0.695 0.594 1.00 . A A . 19 LEU HB2 1 1 10 4208 1 1 19 LEU HB3 H 8.261 -1.331 1.443 1.00 . A A . 19 LEU HB3 1 1 10 4209 1 1 19 LEU HD11 H 6.399 -2.060 3.226 1.00 . A A . 19 LEU HD11 1 1 10 4210 1 1 19 LEU HD12 H 5.257 -1.240 2.162 1.00 . A A . 19 LEU HD12 1 1 10 4211 1 1 19 LEU HD13 H 5.375 -0.771 3.856 1.00 . A A . 19 LEU HD13 1 1 10 4212 1 1 19 LEU HD21 H 7.658 0.247 4.650 1.00 . A A . 19 LEU HD21 1 1 10 4213 1 1 19 LEU HD22 H 8.857 0.641 3.421 1.00 . A A . 19 LEU HD22 1 1 10 4214 1 1 19 LEU HD23 H 8.519 -1.044 3.810 1.00 . A A . 19 LEU HD23 1 1 10 4215 1 1 19 LEU HG H 6.549 0.886 2.555 1.00 . A A . 19 LEU HG 1 1 10 4216 1 1 19 LEU N N 7.631 1.859 0.529 1.00 . A A . 19 LEU N 1 1 10 4217 1 1 19 LEU O O 10.203 -0.263 -0.563 1.00 . A A . 19 LEU O 1 1 10 4218 1 1 20 ALA C C 10.048 1.169 -3.250 1.00 . A A . 20 ALA C 1 1 10 4219 1 1 20 ALA CA C 8.859 0.296 -2.935 1.00 . A A . 20 ALA CA 1 1 10 4220 1 1 20 ALA CB C 7.763 0.544 -3.976 1.00 . A A . 20 ALA CB 1 1 10 4221 1 1 20 ALA H H 7.517 1.064 -1.451 1.00 . A A . 20 ALA H 1 1 10 4222 1 1 20 ALA HA H 9.159 -0.736 -2.979 1.00 . A A . 20 ALA HA 1 1 10 4223 1 1 20 ALA HB1 H 7.317 -0.396 -4.260 1.00 . A A . 20 ALA HB1 1 1 10 4224 1 1 20 ALA HB2 H 8.191 1.015 -4.847 1.00 . A A . 20 ALA HB2 1 1 10 4225 1 1 20 ALA HB3 H 7.009 1.189 -3.559 1.00 . A A . 20 ALA HB3 1 1 10 4226 1 1 20 ALA N N 8.387 0.603 -1.584 1.00 . A A . 20 ALA N 1 1 10 4227 1 1 20 ALA O O 11.145 0.683 -3.523 1.00 . A A . 20 ALA O 1 1 10 4228 1 1 21 LEU C C 12.099 3.049 -2.651 1.00 . A A . 21 LEU C 1 1 10 4229 1 1 21 LEU CA C 10.876 3.429 -3.454 1.00 . A A . 21 LEU CA 1 1 10 4230 1 1 21 LEU CB C 10.421 4.838 -3.066 1.00 . A A . 21 LEU CB 1 1 10 4231 1 1 21 LEU CD1 C 11.217 5.881 -5.205 1.00 . A A . 21 LEU CD1 1 1 10 4232 1 1 21 LEU CD2 C 11.032 7.263 -3.129 1.00 . A A . 21 LEU CD2 1 1 10 4233 1 1 21 LEU CG C 11.370 5.874 -3.678 1.00 . A A . 21 LEU CG 1 1 10 4234 1 1 21 LEU H H 8.919 2.778 -2.962 1.00 . A A . 21 LEU H 1 1 10 4235 1 1 21 LEU HA H 11.124 3.409 -4.499 1.00 . A A . 21 LEU HA 1 1 10 4236 1 1 21 LEU HB2 H 9.418 5.004 -3.429 1.00 . A A . 21 LEU HB2 1 1 10 4237 1 1 21 LEU HB3 H 10.431 4.933 -1.987 1.00 . A A . 21 LEU HB3 1 1 10 4238 1 1 21 LEU HD11 H 11.765 5.049 -5.631 1.00 . A A . 21 LEU HD11 1 1 10 4239 1 1 21 LEU HD12 H 11.611 6.808 -5.600 1.00 . A A . 21 LEU HD12 1 1 10 4240 1 1 21 LEU HD13 H 10.170 5.794 -5.464 1.00 . A A . 21 LEU HD13 1 1 10 4241 1 1 21 LEU HD21 H 10.098 7.599 -3.551 1.00 . A A . 21 LEU HD21 1 1 10 4242 1 1 21 LEU HD22 H 11.814 7.956 -3.398 1.00 . A A . 21 LEU HD22 1 1 10 4243 1 1 21 LEU HD23 H 10.946 7.215 -2.051 1.00 . A A . 21 LEU HD23 1 1 10 4244 1 1 21 LEU HG H 12.389 5.616 -3.417 1.00 . A A . 21 LEU HG 1 1 10 4245 1 1 21 LEU N N 9.818 2.466 -3.194 1.00 . A A . 21 LEU N 1 1 10 4246 1 1 21 LEU O O 13.201 2.951 -3.182 1.00 . A A . 21 LEU O 1 1 10 4247 1 1 22 ALA C C 13.629 1.165 -0.985 1.00 . A A . 22 ALA C 1 1 10 4248 1 1 22 ALA CA C 12.953 2.427 -0.470 1.00 . A A . 22 ALA CA 1 1 10 4249 1 1 22 ALA CB C 12.401 2.185 0.934 1.00 . A A . 22 ALA CB 1 1 10 4250 1 1 22 ALA H H 10.962 2.911 -1.030 1.00 . A A . 22 ALA H 1 1 10 4251 1 1 22 ALA HA H 13.678 3.219 -0.431 1.00 . A A . 22 ALA HA 1 1 10 4252 1 1 22 ALA HB1 H 12.123 3.129 1.378 1.00 . A A . 22 ALA HB1 1 1 10 4253 1 1 22 ALA HB2 H 13.156 1.710 1.543 1.00 . A A . 22 ALA HB2 1 1 10 4254 1 1 22 ALA HB3 H 11.535 1.546 0.875 1.00 . A A . 22 ALA HB3 1 1 10 4255 1 1 22 ALA N N 11.877 2.821 -1.371 1.00 . A A . 22 ALA N 1 1 10 4256 1 1 22 ALA O O 14.839 0.989 -0.843 1.00 . A A . 22 ALA O 1 1 10 4257 1 1 23 LEU C C 14.433 -0.637 -3.165 1.00 . A A . 23 LEU C 1 1 10 4258 1 1 23 LEU CA C 13.363 -0.947 -2.135 1.00 . A A . 23 LEU CA 1 1 10 4259 1 1 23 LEU CB C 12.239 -1.765 -2.778 1.00 . A A . 23 LEU CB 1 1 10 4260 1 1 23 LEU CD1 C 13.772 -3.743 -2.984 1.00 . A A . 23 LEU CD1 1 1 10 4261 1 1 23 LEU CD2 C 12.332 -3.492 -0.952 1.00 . A A . 23 LEU CD2 1 1 10 4262 1 1 23 LEU CG C 12.415 -3.259 -2.466 1.00 . A A . 23 LEU CG 1 1 10 4263 1 1 23 LEU H H 11.887 0.498 -1.675 1.00 . A A . 23 LEU H 1 1 10 4264 1 1 23 LEU HA H 13.804 -1.518 -1.340 1.00 . A A . 23 LEU HA 1 1 10 4265 1 1 23 LEU HB2 H 11.288 -1.429 -2.396 1.00 . A A . 23 LEU HB2 1 1 10 4266 1 1 23 LEU HB3 H 12.262 -1.622 -3.849 1.00 . A A . 23 LEU HB3 1 1 10 4267 1 1 23 LEU HD11 H 13.739 -4.814 -3.118 1.00 . A A . 23 LEU HD11 1 1 10 4268 1 1 23 LEU HD12 H 14.544 -3.493 -2.270 1.00 . A A . 23 LEU HD12 1 1 10 4269 1 1 23 LEU HD13 H 13.989 -3.271 -3.930 1.00 . A A . 23 LEU HD13 1 1 10 4270 1 1 23 LEU HD21 H 12.236 -2.546 -0.442 1.00 . A A . 23 LEU HD21 1 1 10 4271 1 1 23 LEU HD22 H 13.229 -3.993 -0.617 1.00 . A A . 23 LEU HD22 1 1 10 4272 1 1 23 LEU HD23 H 11.473 -4.108 -0.731 1.00 . A A . 23 LEU HD23 1 1 10 4273 1 1 23 LEU HG H 11.629 -3.819 -2.956 1.00 . A A . 23 LEU HG 1 1 10 4274 1 1 23 LEU N N 12.838 0.294 -1.588 1.00 . A A . 23 LEU N 1 1 10 4275 1 1 23 LEU O O 15.521 -1.209 -3.137 1.00 . A A . 23 LEU O 1 1 10 4276 1 1 24 LYS C C 15.944 1.824 -4.587 1.00 . A A . 24 LYS C 1 1 10 4277 1 1 24 LYS CA C 15.067 0.690 -5.095 1.00 . A A . 24 LYS CA 1 1 10 4278 1 1 24 LYS CB C 14.354 1.131 -6.387 1.00 . A A . 24 LYS CB 1 1 10 4279 1 1 24 LYS CD C 12.015 0.225 -6.407 1.00 . A A . 24 LYS CD 1 1 10 4280 1 1 24 LYS CE C 10.562 0.655 -6.656 1.00 . A A . 24 LYS CE 1 1 10 4281 1 1 24 LYS CG C 12.878 1.461 -6.127 1.00 . A A . 24 LYS CG 1 1 10 4282 1 1 24 LYS H H 13.234 0.710 -4.010 1.00 . A A . 24 LYS H 1 1 10 4283 1 1 24 LYS HA H 15.696 -0.148 -5.323 1.00 . A A . 24 LYS HA 1 1 10 4284 1 1 24 LYS HB2 H 14.847 2.010 -6.778 1.00 . A A . 24 LYS HB2 1 1 10 4285 1 1 24 LYS HB3 H 14.421 0.332 -7.114 1.00 . A A . 24 LYS HB3 1 1 10 4286 1 1 24 LYS HD2 H 12.398 -0.289 -7.280 1.00 . A A . 24 LYS HD2 1 1 10 4287 1 1 24 LYS HD3 H 12.051 -0.440 -5.557 1.00 . A A . 24 LYS HD3 1 1 10 4288 1 1 24 LYS HE2 H 9.937 0.291 -5.856 1.00 . A A . 24 LYS HE2 1 1 10 4289 1 1 24 LYS HE3 H 10.504 1.733 -6.692 1.00 . A A . 24 LYS HE3 1 1 10 4290 1 1 24 LYS HG2 H 12.747 1.771 -5.101 1.00 . A A . 24 LYS HG2 1 1 10 4291 1 1 24 LYS HG3 H 12.575 2.264 -6.782 1.00 . A A . 24 LYS HG3 1 1 10 4292 1 1 24 LYS HZ1 H 9.622 -0.827 -7.778 1.00 . A A . 24 LYS HZ1 1 1 10 4293 1 1 24 LYS HZ2 H 10.885 -0.045 -8.594 1.00 . A A . 24 LYS HZ2 1 1 10 4294 1 1 24 LYS HZ3 H 9.395 0.741 -8.381 1.00 . A A . 24 LYS HZ3 1 1 10 4295 1 1 24 LYS N N 14.116 0.287 -4.060 1.00 . A A . 24 LYS N 1 1 10 4296 1 1 24 LYS NZ N 10.082 0.090 -7.949 1.00 . A A . 24 LYS NZ 1 1 10 4297 1 1 24 LYS O O 17.161 1.670 -4.443 1.00 . A A . 24 LYS O 1 1 10 4298 1 1 25 LYS C C 15.886 4.182 -2.272 1.00 . A A . 25 LYS C 1 1 10 4299 1 1 25 LYS CA C 16.027 4.117 -3.789 1.00 . A A . 25 LYS CA 1 1 10 4300 1 1 25 LYS CB C 15.483 5.408 -4.418 1.00 . A A . 25 LYS CB 1 1 10 4301 1 1 25 LYS CD C 16.842 7.159 -3.228 1.00 . A A . 25 LYS CD 1 1 10 4302 1 1 25 LYS CE C 18.344 7.263 -2.934 1.00 . A A . 25 LYS CE 1 1 10 4303 1 1 25 LYS CG C 16.621 6.427 -4.560 1.00 . A A . 25 LYS CG 1 1 10 4304 1 1 25 LYS H H 14.344 2.997 -4.419 1.00 . A A . 25 LYS H 1 1 10 4305 1 1 25 LYS HA H 17.072 4.023 -4.041 1.00 . A A . 25 LYS HA 1 1 10 4306 1 1 25 LYS HB2 H 15.074 5.188 -5.395 1.00 . A A . 25 LYS HB2 1 1 10 4307 1 1 25 LYS HB3 H 14.707 5.822 -3.789 1.00 . A A . 25 LYS HB3 1 1 10 4308 1 1 25 LYS HD2 H 16.420 8.154 -3.293 1.00 . A A . 25 LYS HD2 1 1 10 4309 1 1 25 LYS HD3 H 16.357 6.618 -2.432 1.00 . A A . 25 LYS HD3 1 1 10 4310 1 1 25 LYS HE2 H 18.852 7.676 -3.797 1.00 . A A . 25 LYS HE2 1 1 10 4311 1 1 25 LYS HE3 H 18.500 7.911 -2.084 1.00 . A A . 25 LYS HE3 1 1 10 4312 1 1 25 LYS HG2 H 17.528 5.916 -4.847 1.00 . A A . 25 LYS HG2 1 1 10 4313 1 1 25 LYS HG3 H 16.363 7.145 -5.323 1.00 . A A . 25 LYS HG3 1 1 10 4314 1 1 25 LYS HZ1 H 18.532 5.222 -3.317 1.00 . A A . 25 LYS HZ1 1 1 10 4315 1 1 25 LYS HZ2 H 18.607 5.623 -1.666 1.00 . A A . 25 LYS HZ2 1 1 10 4316 1 1 25 LYS HZ3 H 19.934 5.941 -2.690 1.00 . A A . 25 LYS HZ3 1 1 10 4317 1 1 25 LYS N N 15.314 2.953 -4.302 1.00 . A A . 25 LYS N 1 1 10 4318 1 1 25 LYS NZ N 18.892 5.910 -2.633 1.00 . A A . 25 LYS NZ 1 1 10 4319 1 1 25 LYS O O 14.943 4.782 -1.748 1.00 . A A . 25 LYS O 1 1 10 4320 1 1 26 ALA C C 17.558 4.752 0.425 1.00 . A A . 26 ALA C 1 1 10 4321 1 1 26 ALA CA C 16.800 3.550 -0.118 1.00 . A A . 26 ALA CA 1 1 10 4322 1 1 26 ALA CB C 17.433 2.261 0.409 1.00 . A A . 26 ALA CB 1 1 10 4323 1 1 26 ALA H H 17.551 3.100 -2.045 1.00 . A A . 26 ALA H 1 1 10 4324 1 1 26 ALA HA H 15.774 3.599 0.215 1.00 . A A . 26 ALA HA 1 1 10 4325 1 1 26 ALA HB1 H 18.507 2.363 0.409 1.00 . A A . 26 ALA HB1 1 1 10 4326 1 1 26 ALA HB2 H 17.153 1.435 -0.228 1.00 . A A . 26 ALA HB2 1 1 10 4327 1 1 26 ALA HB3 H 17.089 2.072 1.414 1.00 . A A . 26 ALA HB3 1 1 10 4328 1 1 26 ALA N N 16.826 3.561 -1.573 1.00 . A A . 26 ALA N 1 1 10 4329 1 1 26 ALA O O 18.295 5.350 -0.331 1.00 . A A . 26 ALA O 1 1 10 4330 1 1 26 ALA OXT O 17.395 5.055 1.589 1.00 . A A . 26 ALA OXT 1 1 11 4331 1 1 1 LYS C C -18.824 7.820 -5.721 1.00 . A A . 1 LYS C 1 1 11 4332 1 1 1 LYS CA C -19.090 7.390 -7.161 1.00 . A A . 1 LYS CA 1 1 11 4333 1 1 1 LYS CB C -18.254 8.245 -8.136 1.00 . A A . 1 LYS CB 1 1 11 4334 1 1 1 LYS CD C -16.044 7.974 -9.301 1.00 . A A . 1 LYS CD 1 1 11 4335 1 1 1 LYS CE C -15.014 6.882 -9.602 1.00 . A A . 1 LYS CE 1 1 11 4336 1 1 1 LYS CG C -17.416 7.333 -9.039 1.00 . A A . 1 LYS CG 1 1 11 4337 1 1 1 LYS H1 H -21.056 7.692 -6.552 1.00 . A A . 1 LYS H1 1 1 11 4338 1 1 1 LYS H2 H -20.903 6.716 -7.932 1.00 . A A . 1 LYS H2 1 1 11 4339 1 1 1 LYS H3 H -20.683 8.392 -8.049 1.00 . A A . 1 LYS H3 1 1 11 4340 1 1 1 LYS HA H -18.829 6.349 -7.275 1.00 . A A . 1 LYS HA 1 1 11 4341 1 1 1 LYS HB2 H -18.912 8.845 -8.745 1.00 . A A . 1 LYS HB2 1 1 11 4342 1 1 1 LYS HB3 H -17.598 8.893 -7.571 1.00 . A A . 1 LYS HB3 1 1 11 4343 1 1 1 LYS HD2 H -16.112 8.648 -10.145 1.00 . A A . 1 LYS HD2 1 1 11 4344 1 1 1 LYS HD3 H -15.732 8.527 -8.427 1.00 . A A . 1 LYS HD3 1 1 11 4345 1 1 1 LYS HE2 H -14.167 7.317 -10.111 1.00 . A A . 1 LYS HE2 1 1 11 4346 1 1 1 LYS HE3 H -14.684 6.434 -8.675 1.00 . A A . 1 LYS HE3 1 1 11 4347 1 1 1 LYS HG2 H -17.282 6.377 -8.556 1.00 . A A . 1 LYS HG2 1 1 11 4348 1 1 1 LYS HG3 H -17.932 7.189 -9.978 1.00 . A A . 1 LYS HG3 1 1 11 4349 1 1 1 LYS HZ1 H -15.928 6.265 -11.370 1.00 . A A . 1 LYS HZ1 1 1 11 4350 1 1 1 LYS HZ2 H -16.450 5.422 -9.987 1.00 . A A . 1 LYS HZ2 1 1 11 4351 1 1 1 LYS HZ3 H -14.929 5.094 -10.656 1.00 . A A . 1 LYS HZ3 1 1 11 4352 1 1 1 LYS N N -20.540 7.562 -7.447 1.00 . A A . 1 LYS N 1 1 11 4353 1 1 1 LYS NZ N -15.629 5.840 -10.466 1.00 . A A . 1 LYS NZ 1 1 11 4354 1 1 1 LYS O O -19.762 8.021 -4.941 1.00 . A A . 1 LYS O 1 1 11 4355 1 1 2 LYS C C -17.573 7.294 -3.009 1.00 . A A . 2 LYS C 1 1 11 4356 1 1 2 LYS CA C -17.153 8.352 -4.022 1.00 . A A . 2 LYS CA 1 1 11 4357 1 1 2 LYS CB C -17.775 9.711 -3.656 1.00 . A A . 2 LYS CB 1 1 11 4358 1 1 2 LYS CD C -16.681 11.015 -1.798 1.00 . A A . 2 LYS CD 1 1 11 4359 1 1 2 LYS CE C -15.978 9.885 -1.036 1.00 . A A . 2 LYS CE 1 1 11 4360 1 1 2 LYS CG C -16.670 10.721 -3.304 1.00 . A A . 2 LYS CG 1 1 11 4361 1 1 2 LYS H H -16.850 7.769 -6.035 1.00 . A A . 2 LYS H 1 1 11 4362 1 1 2 LYS HA H -16.075 8.443 -3.994 1.00 . A A . 2 LYS HA 1 1 11 4363 1 1 2 LYS HB2 H -18.338 10.083 -4.500 1.00 . A A . 2 LYS HB2 1 1 11 4364 1 1 2 LYS HB3 H -18.437 9.592 -2.808 1.00 . A A . 2 LYS HB3 1 1 11 4365 1 1 2 LYS HD2 H -16.160 11.946 -1.616 1.00 . A A . 2 LYS HD2 1 1 11 4366 1 1 2 LYS HD3 H -17.702 11.102 -1.452 1.00 . A A . 2 LYS HD3 1 1 11 4367 1 1 2 LYS HE2 H -15.826 9.044 -1.698 1.00 . A A . 2 LYS HE2 1 1 11 4368 1 1 2 LYS HE3 H -15.020 10.232 -0.676 1.00 . A A . 2 LYS HE3 1 1 11 4369 1 1 2 LYS HG2 H -15.708 10.321 -3.587 1.00 . A A . 2 LYS HG2 1 1 11 4370 1 1 2 LYS HG3 H -16.842 11.639 -3.844 1.00 . A A . 2 LYS HG3 1 1 11 4371 1 1 2 LYS HZ1 H -16.222 9.382 0.968 1.00 . A A . 2 LYS HZ1 1 1 11 4372 1 1 2 LYS HZ2 H -17.244 8.529 -0.086 1.00 . A A . 2 LYS HZ2 1 1 11 4373 1 1 2 LYS HZ3 H -17.572 10.157 0.285 1.00 . A A . 2 LYS HZ3 1 1 11 4374 1 1 2 LYS N N -17.546 7.950 -5.370 1.00 . A A . 2 LYS N 1 1 11 4375 1 1 2 LYS NZ N -16.815 9.459 0.116 1.00 . A A . 2 LYS NZ 1 1 11 4376 1 1 2 LYS O O -16.749 6.514 -2.542 1.00 . A A . 2 LYS O 1 1 11 4377 1 1 3 ALA C C -18.552 6.369 -0.421 1.00 . A A . 3 ALA C 1 1 11 4378 1 1 3 ALA CA C -19.363 6.307 -1.712 1.00 . A A . 3 ALA CA 1 1 11 4379 1 1 3 ALA CB C -19.295 4.894 -2.294 1.00 . A A . 3 ALA CB 1 1 11 4380 1 1 3 ALA H H -19.467 7.922 -3.081 1.00 . A A . 3 ALA H 1 1 11 4381 1 1 3 ALA HA H -20.393 6.548 -1.495 1.00 . A A . 3 ALA HA 1 1 11 4382 1 1 3 ALA HB1 H -19.470 4.933 -3.360 1.00 . A A . 3 ALA HB1 1 1 11 4383 1 1 3 ALA HB2 H -20.050 4.282 -1.827 1.00 . A A . 3 ALA HB2 1 1 11 4384 1 1 3 ALA HB3 H -18.320 4.471 -2.104 1.00 . A A . 3 ALA HB3 1 1 11 4385 1 1 3 ALA N N -18.851 7.273 -2.676 1.00 . A A . 3 ALA N 1 1 11 4386 1 1 3 ALA O O -17.801 7.320 -0.200 1.00 . A A . 3 ALA O 1 1 11 4387 1 1 4 LEU C C -16.871 4.261 1.644 1.00 . A A . 4 LEU C 1 1 11 4388 1 1 4 LEU CA C -17.964 5.322 1.688 1.00 . A A . 4 LEU CA 1 1 11 4389 1 1 4 LEU CB C -18.912 5.049 2.874 1.00 . A A . 4 LEU CB 1 1 11 4390 1 1 4 LEU CD1 C -21.032 4.745 1.543 1.00 . A A . 4 LEU CD1 1 1 11 4391 1 1 4 LEU CD2 C -19.455 2.819 1.824 1.00 . A A . 4 LEU CD2 1 1 11 4392 1 1 4 LEU CG C -20.038 4.068 2.492 1.00 . A A . 4 LEU CG 1 1 11 4393 1 1 4 LEU H H -19.307 4.622 0.198 1.00 . A A . 4 LEU H 1 1 11 4394 1 1 4 LEU HA H -17.498 6.285 1.839 1.00 . A A . 4 LEU HA 1 1 11 4395 1 1 4 LEU HB2 H -18.340 4.631 3.694 1.00 . A A . 4 LEU HB2 1 1 11 4396 1 1 4 LEU HB3 H -19.350 5.983 3.195 1.00 . A A . 4 LEU HB3 1 1 11 4397 1 1 4 LEU HD11 H -20.757 5.780 1.410 1.00 . A A . 4 LEU HD11 1 1 11 4398 1 1 4 LEU HD12 H -22.023 4.691 1.969 1.00 . A A . 4 LEU HD12 1 1 11 4399 1 1 4 LEU HD13 H -21.024 4.247 0.585 1.00 . A A . 4 LEU HD13 1 1 11 4400 1 1 4 LEU HD21 H -19.183 3.042 0.804 1.00 . A A . 4 LEU HD21 1 1 11 4401 1 1 4 LEU HD22 H -20.196 2.031 1.831 1.00 . A A . 4 LEU HD22 1 1 11 4402 1 1 4 LEU HD23 H -18.581 2.492 2.370 1.00 . A A . 4 LEU HD23 1 1 11 4403 1 1 4 LEU HG H -20.563 3.771 3.390 1.00 . A A . 4 LEU HG 1 1 11 4404 1 1 4 LEU N N -18.699 5.356 0.425 1.00 . A A . 4 LEU N 1 1 11 4405 1 1 4 LEU O O -16.161 4.048 2.629 1.00 . A A . 4 LEU O 1 1 11 4406 1 1 5 LEU C C -14.446 3.166 -0.236 1.00 . A A . 5 LEU C 1 1 11 4407 1 1 5 LEU CA C -15.725 2.569 0.338 1.00 . A A . 5 LEU CA 1 1 11 4408 1 1 5 LEU CB C -16.236 1.462 -0.601 1.00 . A A . 5 LEU CB 1 1 11 4409 1 1 5 LEU CD1 C -14.847 -0.259 0.594 1.00 . A A . 5 LEU CD1 1 1 11 4410 1 1 5 LEU CD2 C -17.189 0.177 1.340 1.00 . A A . 5 LEU CD2 1 1 11 4411 1 1 5 LEU CG C -16.257 0.107 0.126 1.00 . A A . 5 LEU CG 1 1 11 4412 1 1 5 LEU H H -17.328 3.827 -0.249 1.00 . A A . 5 LEU H 1 1 11 4413 1 1 5 LEU HA H -15.507 2.142 1.304 1.00 . A A . 5 LEU HA 1 1 11 4414 1 1 5 LEU HB2 H -17.234 1.705 -0.933 1.00 . A A . 5 LEU HB2 1 1 11 4415 1 1 5 LEU HB3 H -15.583 1.393 -1.458 1.00 . A A . 5 LEU HB3 1 1 11 4416 1 1 5 LEU HD11 H -14.154 -0.161 -0.228 1.00 . A A . 5 LEU HD11 1 1 11 4417 1 1 5 LEU HD12 H -14.842 -1.277 0.949 1.00 . A A . 5 LEU HD12 1 1 11 4418 1 1 5 LEU HD13 H -14.554 0.399 1.396 1.00 . A A . 5 LEU HD13 1 1 11 4419 1 1 5 LEU HD21 H -16.749 0.802 2.103 1.00 . A A . 5 LEU HD21 1 1 11 4420 1 1 5 LEU HD22 H -17.338 -0.818 1.735 1.00 . A A . 5 LEU HD22 1 1 11 4421 1 1 5 LEU HD23 H -18.141 0.588 1.042 1.00 . A A . 5 LEU HD23 1 1 11 4422 1 1 5 LEU HG H -16.616 -0.654 -0.555 1.00 . A A . 5 LEU HG 1 1 11 4423 1 1 5 LEU N N -16.739 3.606 0.500 1.00 . A A . 5 LEU N 1 1 11 4424 1 1 5 LEU O O -14.451 4.272 -0.777 1.00 . A A . 5 LEU O 1 1 11 4425 1 1 6 ALA C C -11.270 1.662 -1.135 1.00 . A A . 6 ALA C 1 1 11 4426 1 1 6 ALA CA C -12.066 2.861 -0.644 1.00 . A A . 6 ALA CA 1 1 11 4427 1 1 6 ALA CB C -11.276 3.589 0.442 1.00 . A A . 6 ALA CB 1 1 11 4428 1 1 6 ALA H H -13.418 1.539 0.308 1.00 . A A . 6 ALA H 1 1 11 4429 1 1 6 ALA HA H -12.233 3.537 -1.470 1.00 . A A . 6 ALA HA 1 1 11 4430 1 1 6 ALA HB1 H -11.958 4.105 1.102 1.00 . A A . 6 ALA HB1 1 1 11 4431 1 1 6 ALA HB2 H -10.612 4.307 -0.016 1.00 . A A . 6 ALA HB2 1 1 11 4432 1 1 6 ALA HB3 H -10.698 2.874 1.008 1.00 . A A . 6 ALA HB3 1 1 11 4433 1 1 6 ALA N N -13.354 2.416 -0.124 1.00 . A A . 6 ALA N 1 1 11 4434 1 1 6 ALA O O -11.636 0.514 -0.872 1.00 . A A . 6 ALA O 1 1 11 4435 1 1 7 LEU C C -8.493 0.246 -1.248 1.00 . A A . 7 LEU C 1 1 11 4436 1 1 7 LEU CA C -9.358 0.833 -2.360 1.00 . A A . 7 LEU CA 1 1 11 4437 1 1 7 LEU CB C -8.465 1.333 -3.502 1.00 . A A . 7 LEU CB 1 1 11 4438 1 1 7 LEU CD1 C -9.128 -0.436 -5.151 1.00 . A A . 7 LEU CD1 1 1 11 4439 1 1 7 LEU CD2 C -10.578 1.574 -4.824 1.00 . A A . 7 LEU CD2 1 1 11 4440 1 1 7 LEU CG C -9.135 1.065 -4.855 1.00 . A A . 7 LEU CG 1 1 11 4441 1 1 7 LEU H H -9.926 2.850 -2.030 1.00 . A A . 7 LEU H 1 1 11 4442 1 1 7 LEU HA H -10.007 0.059 -2.739 1.00 . A A . 7 LEU HA 1 1 11 4443 1 1 7 LEU HB2 H -8.295 2.393 -3.390 1.00 . A A . 7 LEU HB2 1 1 11 4444 1 1 7 LEU HB3 H -7.522 0.814 -3.468 1.00 . A A . 7 LEU HB3 1 1 11 4445 1 1 7 LEU HD11 H -9.235 -0.590 -6.214 1.00 . A A . 7 LEU HD11 1 1 11 4446 1 1 7 LEU HD12 H -9.949 -0.911 -4.635 1.00 . A A . 7 LEU HD12 1 1 11 4447 1 1 7 LEU HD13 H -8.197 -0.864 -4.817 1.00 . A A . 7 LEU HD13 1 1 11 4448 1 1 7 LEU HD21 H -10.666 2.363 -4.092 1.00 . A A . 7 LEU HD21 1 1 11 4449 1 1 7 LEU HD22 H -11.242 0.763 -4.562 1.00 . A A . 7 LEU HD22 1 1 11 4450 1 1 7 LEU HD23 H -10.844 1.957 -5.797 1.00 . A A . 7 LEU HD23 1 1 11 4451 1 1 7 LEU HG H -8.589 1.583 -5.630 1.00 . A A . 7 LEU HG 1 1 11 4452 1 1 7 LEU N N -10.180 1.920 -1.844 1.00 . A A . 7 LEU N 1 1 11 4453 1 1 7 LEU O O -7.279 0.461 -1.208 1.00 . A A . 7 LEU O 1 1 11 4454 1 1 8 ALA C C -7.206 -1.883 0.270 1.00 . A A . 8 ALA C 1 1 11 4455 1 1 8 ALA CA C -8.432 -1.136 0.762 1.00 . A A . 8 ALA CA 1 1 11 4456 1 1 8 ALA CB C -9.367 -2.110 1.468 1.00 . A A . 8 ALA CB 1 1 11 4457 1 1 8 ALA H H -10.100 -0.636 -0.450 1.00 . A A . 8 ALA H 1 1 11 4458 1 1 8 ALA HA H -8.118 -0.375 1.456 1.00 . A A . 8 ALA HA 1 1 11 4459 1 1 8 ALA HB1 H -9.562 -2.955 0.821 1.00 . A A . 8 ALA HB1 1 1 11 4460 1 1 8 ALA HB2 H -10.294 -1.611 1.697 1.00 . A A . 8 ALA HB2 1 1 11 4461 1 1 8 ALA HB3 H -8.906 -2.458 2.378 1.00 . A A . 8 ALA HB3 1 1 11 4462 1 1 8 ALA N N -9.132 -0.503 -0.354 1.00 . A A . 8 ALA N 1 1 11 4463 1 1 8 ALA O O -6.285 -2.175 1.031 1.00 . A A . 8 ALA O 1 1 11 4464 1 1 9 LEU C C -4.962 -1.944 -1.912 1.00 . A A . 9 LEU C 1 1 11 4465 1 1 9 LEU CA C -6.105 -2.894 -1.626 1.00 . A A . 9 LEU CA 1 1 11 4466 1 1 9 LEU CB C -6.570 -3.494 -2.935 1.00 . A A . 9 LEU CB 1 1 11 4467 1 1 9 LEU CD1 C -8.599 -4.649 -2.027 1.00 . A A . 9 LEU CD1 1 1 11 4468 1 1 9 LEU CD2 C -7.420 -5.570 -4.025 1.00 . A A . 9 LEU CD2 1 1 11 4469 1 1 9 LEU CG C -7.235 -4.851 -2.689 1.00 . A A . 9 LEU CG 1 1 11 4470 1 1 9 LEU H H -7.982 -1.928 -1.549 1.00 . A A . 9 LEU H 1 1 11 4471 1 1 9 LEU HA H -5.761 -3.674 -0.971 1.00 . A A . 9 LEU HA 1 1 11 4472 1 1 9 LEU HB2 H -7.276 -2.817 -3.397 1.00 . A A . 9 LEU HB2 1 1 11 4473 1 1 9 LEU HB3 H -5.719 -3.621 -3.582 1.00 . A A . 9 LEU HB3 1 1 11 4474 1 1 9 LEU HD11 H -9.279 -5.419 -2.362 1.00 . A A . 9 LEU HD11 1 1 11 4475 1 1 9 LEU HD12 H -8.992 -3.679 -2.296 1.00 . A A . 9 LEU HD12 1 1 11 4476 1 1 9 LEU HD13 H -8.488 -4.708 -0.957 1.00 . A A . 9 LEU HD13 1 1 11 4477 1 1 9 LEU HD21 H -7.676 -6.603 -3.846 1.00 . A A . 9 LEU HD21 1 1 11 4478 1 1 9 LEU HD22 H -6.497 -5.519 -4.589 1.00 . A A . 9 LEU HD22 1 1 11 4479 1 1 9 LEU HD23 H -8.211 -5.095 -4.586 1.00 . A A . 9 LEU HD23 1 1 11 4480 1 1 9 LEU HG H -6.606 -5.449 -2.042 1.00 . A A . 9 LEU HG 1 1 11 4481 1 1 9 LEU N N -7.211 -2.186 -1.007 1.00 . A A . 9 LEU N 1 1 11 4482 1 1 9 LEU O O -3.885 -2.052 -1.326 1.00 . A A . 9 LEU O 1 1 11 4483 1 1 10 HIS C C -3.568 0.487 -1.918 1.00 . A A . 10 HIS C 1 1 11 4484 1 1 10 HIS CA C -4.201 -0.023 -3.181 1.00 . A A . 10 HIS CA 1 1 11 4485 1 1 10 HIS CB C -4.820 1.145 -3.928 1.00 . A A . 10 HIS CB 1 1 11 4486 1 1 10 HIS CD2 C -4.974 -0.402 -6.043 1.00 . A A . 10 HIS CD2 1 1 11 4487 1 1 10 HIS CE1 C -5.069 1.143 -7.560 1.00 . A A . 10 HIS CE1 1 1 11 4488 1 1 10 HIS CG C -4.933 0.803 -5.387 1.00 . A A . 10 HIS CG 1 1 11 4489 1 1 10 HIS H H -6.101 -0.979 -3.227 1.00 . A A . 10 HIS H 1 1 11 4490 1 1 10 HIS HA H -3.449 -0.491 -3.797 1.00 . A A . 10 HIS HA 1 1 11 4491 1 1 10 HIS HB2 H -5.795 1.355 -3.521 1.00 . A A . 10 HIS HB2 1 1 11 4492 1 1 10 HIS HB3 H -4.191 2.011 -3.804 1.00 . A A . 10 HIS HB3 1 1 11 4493 1 1 10 HIS HD1 H -4.986 2.747 -6.234 1.00 . A A . 10 HIS HD1 1 1 11 4494 1 1 10 HIS HD2 H -4.960 -1.372 -5.563 1.00 . A A . 10 HIS HD2 1 1 11 4495 1 1 10 HIS HE1 H -5.134 1.647 -8.511 1.00 . A A . 10 HIS HE1 1 1 11 4496 1 1 10 HIS HE2 H -5.073 -0.862 -8.126 1.00 . A A . 10 HIS HE2 1 1 11 4497 1 1 10 HIS N N -5.216 -1.009 -2.816 1.00 . A A . 10 HIS N 1 1 11 4498 1 1 10 HIS ND1 N -4.996 1.774 -6.375 1.00 . A A . 10 HIS ND1 1 1 11 4499 1 1 10 HIS NE2 N -5.057 -0.187 -7.415 1.00 . A A . 10 HIS NE2 1 1 11 4500 1 1 10 HIS O O -2.370 0.764 -1.854 1.00 . A A . 10 HIS O 1 1 11 4501 1 1 11 HIS C C -2.645 0.368 0.728 1.00 . A A . 11 HIS C 1 1 11 4502 1 1 11 HIS CA C -3.993 0.985 0.406 1.00 . A A . 11 HIS CA 1 1 11 4503 1 1 11 HIS CB C -5.029 0.461 1.387 1.00 . A A . 11 HIS CB 1 1 11 4504 1 1 11 HIS CD2 C -6.881 2.325 1.462 1.00 . A A . 11 HIS CD2 1 1 11 4505 1 1 11 HIS CE1 C -6.481 3.085 3.452 1.00 . A A . 11 HIS CE1 1 1 11 4506 1 1 11 HIS CG C -5.832 1.595 1.964 1.00 . A A . 11 HIS CG 1 1 11 4507 1 1 11 HIS H H -5.337 0.299 -1.051 1.00 . A A . 11 HIS H 1 1 11 4508 1 1 11 HIS HA H -3.937 2.055 0.464 1.00 . A A . 11 HIS HA 1 1 11 4509 1 1 11 HIS HB2 H -5.689 -0.215 0.853 1.00 . A A . 11 HIS HB2 1 1 11 4510 1 1 11 HIS HB3 H -4.528 -0.078 2.181 1.00 . A A . 11 HIS HB3 1 1 11 4511 1 1 11 HIS HD1 H -4.905 1.785 3.864 1.00 . A A . 11 HIS HD1 1 1 11 4512 1 1 11 HIS HD2 H -7.329 2.186 0.489 1.00 . A A . 11 HIS HD2 1 1 11 4513 1 1 11 HIS HE1 H -6.544 3.650 4.373 1.00 . A A . 11 HIS HE1 1 1 11 4514 1 1 11 HIS HE2 H -8.009 3.929 2.314 1.00 . A A . 11 HIS HE2 1 1 11 4515 1 1 11 HIS N N -4.406 0.566 -0.909 1.00 . A A . 11 HIS N 1 1 11 4516 1 1 11 HIS ND1 N -5.594 2.097 3.233 1.00 . A A . 11 HIS ND1 1 1 11 4517 1 1 11 HIS NE2 N -7.287 3.267 2.403 1.00 . A A . 11 HIS NE2 1 1 11 4518 1 1 11 HIS O O -1.734 1.022 1.238 1.00 . A A . 11 HIS O 1 1 11 4519 1 1 12 LEU C C -0.302 -1.255 -0.462 1.00 . A A . 12 LEU C 1 1 11 4520 1 1 12 LEU CA C -1.296 -1.629 0.614 1.00 . A A . 12 LEU CA 1 1 11 4521 1 1 12 LEU CB C -1.548 -3.136 0.592 1.00 . A A . 12 LEU CB 1 1 11 4522 1 1 12 LEU CD1 C -3.753 -3.339 1.756 1.00 . A A . 12 LEU CD1 1 1 11 4523 1 1 12 LEU CD2 C -1.980 -5.049 2.139 1.00 . A A . 12 LEU CD2 1 1 11 4524 1 1 12 LEU CG C -2.248 -3.564 1.887 1.00 . A A . 12 LEU CG 1 1 11 4525 1 1 12 LEU H H -3.298 -1.349 -0.048 1.00 . A A . 12 LEU H 1 1 11 4526 1 1 12 LEU HA H -0.897 -1.348 1.571 1.00 . A A . 12 LEU HA 1 1 11 4527 1 1 12 LEU HB2 H -2.170 -3.383 -0.255 1.00 . A A . 12 LEU HB2 1 1 11 4528 1 1 12 LEU HB3 H -0.602 -3.653 0.505 1.00 . A A . 12 LEU HB3 1 1 11 4529 1 1 12 LEU HD11 H -4.080 -3.650 0.777 1.00 . A A . 12 LEU HD11 1 1 11 4530 1 1 12 LEU HD12 H -3.969 -2.290 1.889 1.00 . A A . 12 LEU HD12 1 1 11 4531 1 1 12 LEU HD13 H -4.273 -3.912 2.511 1.00 . A A . 12 LEU HD13 1 1 11 4532 1 1 12 LEU HD21 H -1.952 -5.576 1.196 1.00 . A A . 12 LEU HD21 1 1 11 4533 1 1 12 LEU HD22 H -2.767 -5.460 2.758 1.00 . A A . 12 LEU HD22 1 1 11 4534 1 1 12 LEU HD23 H -1.031 -5.161 2.641 1.00 . A A . 12 LEU HD23 1 1 11 4535 1 1 12 LEU HG H -1.869 -2.982 2.715 1.00 . A A . 12 LEU HG 1 1 11 4536 1 1 12 LEU N N -2.533 -0.901 0.387 1.00 . A A . 12 LEU N 1 1 11 4537 1 1 12 LEU O O 0.851 -0.925 -0.182 1.00 . A A . 12 LEU O 1 1 11 4538 1 1 13 ALA C C 0.718 0.440 -2.530 1.00 . A A . 13 ALA C 1 1 11 4539 1 1 13 ALA CA C 0.067 -0.901 -2.830 1.00 . A A . 13 ALA CA 1 1 11 4540 1 1 13 ALA CB C -0.773 -0.794 -4.106 1.00 . A A . 13 ALA CB 1 1 11 4541 1 1 13 ALA H H -1.712 -1.518 -1.839 1.00 . A A . 13 ALA H 1 1 11 4542 1 1 13 ALA HA H 0.831 -1.649 -2.968 1.00 . A A . 13 ALA HA 1 1 11 4543 1 1 13 ALA HB1 H -1.328 0.130 -4.094 1.00 . A A . 13 ALA HB1 1 1 11 4544 1 1 13 ALA HB2 H -1.463 -1.624 -4.157 1.00 . A A . 13 ALA HB2 1 1 11 4545 1 1 13 ALA HB3 H -0.124 -0.812 -4.968 1.00 . A A . 13 ALA HB3 1 1 11 4546 1 1 13 ALA N N -0.773 -1.274 -1.696 1.00 . A A . 13 ALA N 1 1 11 4547 1 1 13 ALA O O 1.827 0.729 -2.972 1.00 . A A . 13 ALA O 1 1 11 4548 1 1 14 HIS C C 1.661 2.394 -0.429 1.00 . A A . 14 HIS C 1 1 11 4549 1 1 14 HIS CA C 0.476 2.557 -1.349 1.00 . A A . 14 HIS CA 1 1 11 4550 1 1 14 HIS CB C -0.669 3.299 -0.661 1.00 . A A . 14 HIS CB 1 1 11 4551 1 1 14 HIS CD2 C -0.722 4.178 1.802 1.00 . A A . 14 HIS CD2 1 1 11 4552 1 1 14 HIS CE1 C 0.993 5.497 1.723 1.00 . A A . 14 HIS CE1 1 1 11 4553 1 1 14 HIS CG C -0.204 4.079 0.536 1.00 . A A . 14 HIS CG 1 1 11 4554 1 1 14 HIS H H -0.873 0.927 -1.437 1.00 . A A . 14 HIS H 1 1 11 4555 1 1 14 HIS HA H 0.780 3.104 -2.219 1.00 . A A . 14 HIS HA 1 1 11 4556 1 1 14 HIS HB2 H -1.099 3.969 -1.366 1.00 . A A . 14 HIS HB2 1 1 11 4557 1 1 14 HIS HB3 H -1.419 2.589 -0.350 1.00 . A A . 14 HIS HB3 1 1 11 4558 1 1 14 HIS HD1 H 1.502 5.073 -0.255 1.00 . A A . 14 HIS HD1 1 1 11 4559 1 1 14 HIS HD2 H -1.578 3.625 2.168 1.00 . A A . 14 HIS HD2 1 1 11 4560 1 1 14 HIS HE1 H 1.757 6.210 1.997 1.00 . A A . 14 HIS HE1 1 1 11 4561 1 1 14 HIS HE2 H -0.116 5.349 3.485 1.00 . A A . 14 HIS HE2 1 1 11 4562 1 1 14 HIS N N 0.002 1.242 -1.756 1.00 . A A . 14 HIS N 1 1 11 4563 1 1 14 HIS ND1 N 0.896 4.924 0.509 1.00 . A A . 14 HIS ND1 1 1 11 4564 1 1 14 HIS NE2 N 0.031 5.077 2.551 1.00 . A A . 14 HIS NE2 1 1 11 4565 1 1 14 HIS O O 2.755 2.895 -0.698 1.00 . A A . 14 HIS O 1 1 11 4566 1 1 15 LEU C C 3.618 0.681 0.776 1.00 . A A . 15 LEU C 1 1 11 4567 1 1 15 LEU CA C 2.534 1.365 1.555 1.00 . A A . 15 LEU CA 1 1 11 4568 1 1 15 LEU CB C 2.063 0.405 2.648 1.00 . A A . 15 LEU CB 1 1 11 4569 1 1 15 LEU CD1 C 1.344 2.650 3.578 1.00 . A A . 15 LEU CD1 1 1 11 4570 1 1 15 LEU CD2 C -0.085 0.637 3.903 1.00 . A A . 15 LEU CD2 1 1 11 4571 1 1 15 LEU CG C 1.356 1.137 3.797 1.00 . A A . 15 LEU CG 1 1 11 4572 1 1 15 LEU H H 0.575 1.234 0.768 1.00 . A A . 15 LEU H 1 1 11 4573 1 1 15 LEU HA H 2.911 2.278 1.978 1.00 . A A . 15 LEU HA 1 1 11 4574 1 1 15 LEU HB2 H 1.379 -0.309 2.208 1.00 . A A . 15 LEU HB2 1 1 11 4575 1 1 15 LEU HB3 H 2.917 -0.126 3.037 1.00 . A A . 15 LEU HB3 1 1 11 4576 1 1 15 LEU HD11 H 0.632 3.105 4.250 1.00 . A A . 15 LEU HD11 1 1 11 4577 1 1 15 LEU HD12 H 1.059 2.861 2.561 1.00 . A A . 15 LEU HD12 1 1 11 4578 1 1 15 LEU HD13 H 2.325 3.054 3.769 1.00 . A A . 15 LEU HD13 1 1 11 4579 1 1 15 LEU HD21 H -0.444 0.782 4.910 1.00 . A A . 15 LEU HD21 1 1 11 4580 1 1 15 LEU HD22 H -0.124 -0.414 3.656 1.00 . A A . 15 LEU HD22 1 1 11 4581 1 1 15 LEU HD23 H -0.708 1.191 3.218 1.00 . A A . 15 LEU HD23 1 1 11 4582 1 1 15 LEU HG H 1.874 0.917 4.711 1.00 . A A . 15 LEU HG 1 1 11 4583 1 1 15 LEU N N 1.457 1.642 0.630 1.00 . A A . 15 LEU N 1 1 11 4584 1 1 15 LEU O O 4.809 0.847 1.018 1.00 . A A . 15 LEU O 1 1 11 4585 1 1 16 ALA C C 4.788 0.114 -1.967 1.00 . A A . 16 ALA C 1 1 11 4586 1 1 16 ALA CA C 4.061 -0.836 -1.033 1.00 . A A . 16 ALA CA 1 1 11 4587 1 1 16 ALA CB C 3.274 -1.856 -1.853 1.00 . A A . 16 ALA CB 1 1 11 4588 1 1 16 ALA H H 2.178 -0.156 -0.296 1.00 . A A . 16 ALA H 1 1 11 4589 1 1 16 ALA HA H 4.783 -1.352 -0.423 1.00 . A A . 16 ALA HA 1 1 11 4590 1 1 16 ALA HB1 H 2.884 -1.377 -2.739 1.00 . A A . 16 ALA HB1 1 1 11 4591 1 1 16 ALA HB2 H 2.457 -2.241 -1.262 1.00 . A A . 16 ALA HB2 1 1 11 4592 1 1 16 ALA HB3 H 3.926 -2.666 -2.140 1.00 . A A . 16 ALA HB3 1 1 11 4593 1 1 16 ALA N N 3.161 -0.092 -0.172 1.00 . A A . 16 ALA N 1 1 11 4594 1 1 16 ALA O O 5.894 -0.168 -2.430 1.00 . A A . 16 ALA O 1 1 11 4595 1 1 17 LEU C C 5.971 2.822 -2.577 1.00 . A A . 17 LEU C 1 1 11 4596 1 1 17 LEU CA C 4.697 2.230 -3.143 1.00 . A A . 17 LEU CA 1 1 11 4597 1 1 17 LEU CB C 3.637 3.314 -3.423 1.00 . A A . 17 LEU CB 1 1 11 4598 1 1 17 LEU CD1 C 5.174 5.311 -3.555 1.00 . A A . 17 LEU CD1 1 1 11 4599 1 1 17 LEU CD2 C 2.791 5.586 -2.848 1.00 . A A . 17 LEU CD2 1 1 11 4600 1 1 17 LEU CG C 4.010 4.662 -2.793 1.00 . A A . 17 LEU CG 1 1 11 4601 1 1 17 LEU H H 3.257 1.374 -1.853 1.00 . A A . 17 LEU H 1 1 11 4602 1 1 17 LEU HA H 4.947 1.748 -4.065 1.00 . A A . 17 LEU HA 1 1 11 4603 1 1 17 LEU HB2 H 3.535 3.439 -4.487 1.00 . A A . 17 LEU HB2 1 1 11 4604 1 1 17 LEU HB3 H 2.694 2.987 -3.012 1.00 . A A . 17 LEU HB3 1 1 11 4605 1 1 17 LEU HD11 H 4.897 6.313 -3.853 1.00 . A A . 17 LEU HD11 1 1 11 4606 1 1 17 LEU HD12 H 5.404 4.727 -4.434 1.00 . A A . 17 LEU HD12 1 1 11 4607 1 1 17 LEU HD13 H 6.046 5.357 -2.916 1.00 . A A . 17 LEU HD13 1 1 11 4608 1 1 17 LEU HD21 H 2.019 5.203 -2.196 1.00 . A A . 17 LEU HD21 1 1 11 4609 1 1 17 LEU HD22 H 2.414 5.631 -3.857 1.00 . A A . 17 LEU HD22 1 1 11 4610 1 1 17 LEU HD23 H 3.076 6.579 -2.524 1.00 . A A . 17 LEU HD23 1 1 11 4611 1 1 17 LEU HG H 4.290 4.513 -1.762 1.00 . A A . 17 LEU HG 1 1 11 4612 1 1 17 LEU N N 4.141 1.228 -2.247 1.00 . A A . 17 LEU N 1 1 11 4613 1 1 17 LEU O O 6.993 2.872 -3.262 1.00 . A A . 17 LEU O 1 1 11 4614 1 1 18 HIS C C 8.068 2.711 -0.383 1.00 . A A . 18 HIS C 1 1 11 4615 1 1 18 HIS CA C 7.123 3.827 -0.735 1.00 . A A . 18 HIS CA 1 1 11 4616 1 1 18 HIS CB C 6.781 4.672 0.471 1.00 . A A . 18 HIS CB 1 1 11 4617 1 1 18 HIS CD2 C 5.074 3.300 1.875 1.00 . A A . 18 HIS CD2 1 1 11 4618 1 1 18 HIS CE1 C 6.360 2.785 3.546 1.00 . A A . 18 HIS CE1 1 1 11 4619 1 1 18 HIS CG C 6.303 3.834 1.613 1.00 . A A . 18 HIS CG 1 1 11 4620 1 1 18 HIS H H 5.077 3.190 -0.823 1.00 . A A . 18 HIS H 1 1 11 4621 1 1 18 HIS HA H 7.603 4.453 -1.472 1.00 . A A . 18 HIS HA 1 1 11 4622 1 1 18 HIS HB2 H 7.644 5.236 0.772 1.00 . A A . 18 HIS HB2 1 1 11 4623 1 1 18 HIS HB3 H 6.001 5.335 0.184 1.00 . A A . 18 HIS HB3 1 1 11 4624 1 1 18 HIS HD1 H 8.058 3.743 2.801 1.00 . A A . 18 HIS HD1 1 1 11 4625 1 1 18 HIS HD2 H 4.216 3.370 1.215 1.00 . A A . 18 HIS HD2 1 1 11 4626 1 1 18 HIS HE1 H 6.730 2.361 4.469 1.00 . A A . 18 HIS HE1 1 1 11 4627 1 1 18 HIS HE2 H 4.364 2.167 3.548 1.00 . A A . 18 HIS HE2 1 1 11 4628 1 1 18 HIS N N 5.924 3.258 -1.336 1.00 . A A . 18 HIS N 1 1 11 4629 1 1 18 HIS ND1 N 7.112 3.498 2.685 1.00 . A A . 18 HIS ND1 1 1 11 4630 1 1 18 HIS NE2 N 5.105 2.637 3.103 1.00 . A A . 18 HIS NE2 1 1 11 4631 1 1 18 HIS O O 9.281 2.811 -0.585 1.00 . A A . 18 HIS O 1 1 11 4632 1 1 19 LEU C C 9.142 0.160 -0.823 1.00 . A A . 19 LEU C 1 1 11 4633 1 1 19 LEU CA C 8.285 0.443 0.392 1.00 . A A . 19 LEU CA 1 1 11 4634 1 1 19 LEU CB C 7.384 -0.765 0.643 1.00 . A A . 19 LEU CB 1 1 11 4635 1 1 19 LEU CD1 C 8.793 -1.302 2.634 1.00 . A A . 19 LEU CD1 1 1 11 4636 1 1 19 LEU CD2 C 6.678 -0.001 2.914 1.00 . A A . 19 LEU CD2 1 1 11 4637 1 1 19 LEU CG C 7.361 -1.117 2.126 1.00 . A A . 19 LEU CG 1 1 11 4638 1 1 19 LEU H H 6.512 1.607 0.179 1.00 . A A . 19 LEU H 1 1 11 4639 1 1 19 LEU HA H 8.912 0.630 1.252 1.00 . A A . 19 LEU HA 1 1 11 4640 1 1 19 LEU HB2 H 6.385 -0.539 0.315 1.00 . A A . 19 LEU HB2 1 1 11 4641 1 1 19 LEU HB3 H 7.760 -1.614 0.085 1.00 . A A . 19 LEU HB3 1 1 11 4642 1 1 19 LEU HD11 H 9.141 -0.378 3.075 1.00 . A A . 19 LEU HD11 1 1 11 4643 1 1 19 LEU HD12 H 9.436 -1.567 1.808 1.00 . A A . 19 LEU HD12 1 1 11 4644 1 1 19 LEU HD13 H 8.814 -2.085 3.374 1.00 . A A . 19 LEU HD13 1 1 11 4645 1 1 19 LEU HD21 H 5.638 -0.255 3.074 1.00 . A A . 19 LEU HD21 1 1 11 4646 1 1 19 LEU HD22 H 6.742 0.921 2.357 1.00 . A A . 19 LEU HD22 1 1 11 4647 1 1 19 LEU HD23 H 7.169 0.121 3.868 1.00 . A A . 19 LEU HD23 1 1 11 4648 1 1 19 LEU HG H 6.813 -2.032 2.248 1.00 . A A . 19 LEU HG 1 1 11 4649 1 1 19 LEU N N 7.491 1.622 0.084 1.00 . A A . 19 LEU N 1 1 11 4650 1 1 19 LEU O O 10.267 -0.338 -0.734 1.00 . A A . 19 LEU O 1 1 11 4651 1 1 20 ALA C C 10.453 1.247 -3.307 1.00 . A A . 20 ALA C 1 1 11 4652 1 1 20 ALA CA C 9.256 0.323 -3.245 1.00 . A A . 20 ALA CA 1 1 11 4653 1 1 20 ALA CB C 8.316 0.639 -4.410 1.00 . A A . 20 ALA CB 1 1 11 4654 1 1 20 ALA H H 7.668 0.914 -1.939 1.00 . A A . 20 ALA H 1 1 11 4655 1 1 20 ALA HA H 9.591 -0.697 -3.322 1.00 . A A . 20 ALA HA 1 1 11 4656 1 1 20 ALA HB1 H 8.406 -0.131 -5.160 1.00 . A A . 20 ALA HB1 1 1 11 4657 1 1 20 ALA HB2 H 8.586 1.593 -4.840 1.00 . A A . 20 ALA HB2 1 1 11 4658 1 1 20 ALA HB3 H 7.298 0.680 -4.055 1.00 . A A . 20 ALA HB3 1 1 11 4659 1 1 20 ALA N N 8.572 0.508 -1.966 1.00 . A A . 20 ALA N 1 1 11 4660 1 1 20 ALA O O 11.596 0.814 -3.483 1.00 . A A . 20 ALA O 1 1 11 4661 1 1 21 LEU C C 12.299 3.136 -2.155 1.00 . A A . 21 LEU C 1 1 11 4662 1 1 21 LEU CA C 11.228 3.530 -3.153 1.00 . A A . 21 LEU CA 1 1 11 4663 1 1 21 LEU CB C 10.657 4.895 -2.766 1.00 . A A . 21 LEU CB 1 1 11 4664 1 1 21 LEU CD1 C 8.891 6.592 -3.285 1.00 . A A . 21 LEU CD1 1 1 11 4665 1 1 21 LEU CD2 C 10.183 5.521 -5.149 1.00 . A A . 21 LEU CD2 1 1 11 4666 1 1 21 LEU CG C 9.565 5.301 -3.761 1.00 . A A . 21 LEU CG 1 1 11 4667 1 1 21 LEU H H 9.245 2.789 -2.999 1.00 . A A . 21 LEU H 1 1 11 4668 1 1 21 LEU HA H 11.663 3.591 -4.134 1.00 . A A . 21 LEU HA 1 1 11 4669 1 1 21 LEU HB2 H 10.234 4.837 -1.773 1.00 . A A . 21 LEU HB2 1 1 11 4670 1 1 21 LEU HB3 H 11.448 5.633 -2.775 1.00 . A A . 21 LEU HB3 1 1 11 4671 1 1 21 LEU HD11 H 8.801 6.578 -2.210 1.00 . A A . 21 LEU HD11 1 1 11 4672 1 1 21 LEU HD12 H 7.906 6.668 -3.726 1.00 . A A . 21 LEU HD12 1 1 11 4673 1 1 21 LEU HD13 H 9.484 7.443 -3.585 1.00 . A A . 21 LEU HD13 1 1 11 4674 1 1 21 LEU HD21 H 11.106 6.076 -5.054 1.00 . A A . 21 LEU HD21 1 1 11 4675 1 1 21 LEU HD22 H 9.493 6.075 -5.767 1.00 . A A . 21 LEU HD22 1 1 11 4676 1 1 21 LEU HD23 H 10.386 4.565 -5.607 1.00 . A A . 21 LEU HD23 1 1 11 4677 1 1 21 LEU HG H 8.826 4.516 -3.820 1.00 . A A . 21 LEU HG 1 1 11 4678 1 1 21 LEU N N 10.177 2.524 -3.143 1.00 . A A . 21 LEU N 1 1 11 4679 1 1 21 LEU O O 13.491 3.104 -2.467 1.00 . A A . 21 LEU O 1 1 11 4680 1 1 22 ALA C C 13.647 1.281 -0.376 1.00 . A A . 22 ALA C 1 1 11 4681 1 1 22 ALA CA C 12.750 2.407 0.114 1.00 . A A . 22 ALA CA 1 1 11 4682 1 1 22 ALA CB C 11.956 1.937 1.334 1.00 . A A . 22 ALA CB 1 1 11 4683 1 1 22 ALA H H 10.881 2.860 -0.789 1.00 . A A . 22 ALA H 1 1 11 4684 1 1 22 ALA HA H 13.363 3.247 0.394 1.00 . A A . 22 ALA HA 1 1 11 4685 1 1 22 ALA HB1 H 12.425 2.308 2.232 1.00 . A A . 22 ALA HB1 1 1 11 4686 1 1 22 ALA HB2 H 11.940 0.857 1.359 1.00 . A A . 22 ALA HB2 1 1 11 4687 1 1 22 ALA HB3 H 10.945 2.308 1.274 1.00 . A A . 22 ALA HB3 1 1 11 4688 1 1 22 ALA N N 11.847 2.820 -0.954 1.00 . A A . 22 ALA N 1 1 11 4689 1 1 22 ALA O O 14.806 1.165 0.031 1.00 . A A . 22 ALA O 1 1 11 4690 1 1 23 LEU C C 14.771 -0.124 -2.913 1.00 . A A . 23 LEU C 1 1 11 4691 1 1 23 LEU CA C 13.835 -0.647 -1.841 1.00 . A A . 23 LEU CA 1 1 11 4692 1 1 23 LEU CB C 12.854 -1.646 -2.465 1.00 . A A . 23 LEU CB 1 1 11 4693 1 1 23 LEU CD1 C 13.950 -3.715 -1.544 1.00 . A A . 23 LEU CD1 1 1 11 4694 1 1 23 LEU CD2 C 12.667 -3.821 -3.685 1.00 . A A . 23 LEU CD2 1 1 11 4695 1 1 23 LEU CG C 13.582 -2.950 -2.820 1.00 . A A . 23 LEU CG 1 1 11 4696 1 1 23 LEU H H 12.176 0.627 -1.545 1.00 . A A . 23 LEU H 1 1 11 4697 1 1 23 LEU HA H 14.409 -1.140 -1.073 1.00 . A A . 23 LEU HA 1 1 11 4698 1 1 23 LEU HB2 H 12.059 -1.848 -1.764 1.00 . A A . 23 LEU HB2 1 1 11 4699 1 1 23 LEU HB3 H 12.437 -1.217 -3.361 1.00 . A A . 23 LEU HB3 1 1 11 4700 1 1 23 LEU HD11 H 13.600 -4.732 -1.620 1.00 . A A . 23 LEU HD11 1 1 11 4701 1 1 23 LEU HD12 H 13.490 -3.239 -0.689 1.00 . A A . 23 LEU HD12 1 1 11 4702 1 1 23 LEU HD13 H 15.021 -3.716 -1.424 1.00 . A A . 23 LEU HD13 1 1 11 4703 1 1 23 LEU HD21 H 12.625 -3.416 -4.686 1.00 . A A . 23 LEU HD21 1 1 11 4704 1 1 23 LEU HD22 H 11.675 -3.835 -3.257 1.00 . A A . 23 LEU HD22 1 1 11 4705 1 1 23 LEU HD23 H 13.054 -4.826 -3.722 1.00 . A A . 23 LEU HD23 1 1 11 4706 1 1 23 LEU HG H 14.482 -2.717 -3.370 1.00 . A A . 23 LEU HG 1 1 11 4707 1 1 23 LEU N N 13.099 0.466 -1.263 1.00 . A A . 23 LEU N 1 1 11 4708 1 1 23 LEU O O 15.949 -0.470 -2.969 1.00 . A A . 23 LEU O 1 1 11 4709 1 1 24 LYS C C 16.237 1.992 -4.345 1.00 . A A . 24 LYS C 1 1 11 4710 1 1 24 LYS CA C 14.975 1.308 -4.855 1.00 . A A . 24 LYS CA 1 1 11 4711 1 1 24 LYS CB C 14.106 2.323 -5.605 1.00 . A A . 24 LYS CB 1 1 11 4712 1 1 24 LYS CD C 15.483 4.230 -6.487 1.00 . A A . 24 LYS CD 1 1 11 4713 1 1 24 LYS CE C 16.785 4.430 -7.269 1.00 . A A . 24 LYS CE 1 1 11 4714 1 1 24 LYS CG C 14.873 2.862 -6.822 1.00 . A A . 24 LYS CG 1 1 11 4715 1 1 24 LYS H H 13.266 0.937 -3.650 1.00 . A A . 24 LYS H 1 1 11 4716 1 1 24 LYS HA H 15.261 0.530 -5.537 1.00 . A A . 24 LYS HA 1 1 11 4717 1 1 24 LYS HB2 H 13.201 1.839 -5.937 1.00 . A A . 24 LYS HB2 1 1 11 4718 1 1 24 LYS HB3 H 13.857 3.141 -4.945 1.00 . A A . 24 LYS HB3 1 1 11 4719 1 1 24 LYS HD2 H 14.784 5.007 -6.750 1.00 . A A . 24 LYS HD2 1 1 11 4720 1 1 24 LYS HD3 H 15.693 4.282 -5.431 1.00 . A A . 24 LYS HD3 1 1 11 4721 1 1 24 LYS HE2 H 17.002 5.487 -7.331 1.00 . A A . 24 LYS HE2 1 1 11 4722 1 1 24 LYS HE3 H 17.592 3.928 -6.759 1.00 . A A . 24 LYS HE3 1 1 11 4723 1 1 24 LYS HG2 H 15.661 2.171 -7.086 1.00 . A A . 24 LYS HG2 1 1 11 4724 1 1 24 LYS HG3 H 14.194 2.967 -7.654 1.00 . A A . 24 LYS HG3 1 1 11 4725 1 1 24 LYS HZ1 H 15.647 3.917 -8.936 1.00 . A A . 24 LYS HZ1 1 1 11 4726 1 1 24 LYS HZ2 H 16.965 2.889 -8.654 1.00 . A A . 24 LYS HZ2 1 1 11 4727 1 1 24 LYS HZ3 H 17.217 4.435 -9.304 1.00 . A A . 24 LYS HZ3 1 1 11 4728 1 1 24 LYS N N 14.217 0.717 -3.761 1.00 . A A . 24 LYS N 1 1 11 4729 1 1 24 LYS NZ N 16.640 3.875 -8.642 1.00 . A A . 24 LYS NZ 1 1 11 4730 1 1 24 LYS O O 17.325 1.794 -4.894 1.00 . A A . 24 LYS O 1 1 11 4731 1 1 25 LYS C C 17.459 3.091 -1.300 1.00 . A A . 25 LYS C 1 1 11 4732 1 1 25 LYS CA C 17.227 3.518 -2.740 1.00 . A A . 25 LYS CA 1 1 11 4733 1 1 25 LYS CB C 16.991 5.037 -2.801 1.00 . A A . 25 LYS CB 1 1 11 4734 1 1 25 LYS CD C 16.023 6.590 -1.063 1.00 . A A . 25 LYS CD 1 1 11 4735 1 1 25 LYS CE C 16.951 6.144 0.073 1.00 . A A . 25 LYS CE 1 1 11 4736 1 1 25 LYS CG C 15.726 5.413 -2.009 1.00 . A A . 25 LYS CG 1 1 11 4737 1 1 25 LYS H H 15.194 2.914 -2.923 1.00 . A A . 25 LYS H 1 1 11 4738 1 1 25 LYS HA H 18.109 3.281 -3.317 1.00 . A A . 25 LYS HA 1 1 11 4739 1 1 25 LYS HB2 H 17.844 5.550 -2.385 1.00 . A A . 25 LYS HB2 1 1 11 4740 1 1 25 LYS HB3 H 16.866 5.338 -3.831 1.00 . A A . 25 LYS HB3 1 1 11 4741 1 1 25 LYS HD2 H 16.500 7.387 -1.616 1.00 . A A . 25 LYS HD2 1 1 11 4742 1 1 25 LYS HD3 H 15.099 6.955 -0.644 1.00 . A A . 25 LYS HD3 1 1 11 4743 1 1 25 LYS HE2 H 17.921 5.897 -0.327 1.00 . A A . 25 LYS HE2 1 1 11 4744 1 1 25 LYS HE3 H 17.053 6.947 0.785 1.00 . A A . 25 LYS HE3 1 1 11 4745 1 1 25 LYS HG2 H 14.949 5.700 -2.702 1.00 . A A . 25 LYS HG2 1 1 11 4746 1 1 25 LYS HG3 H 15.392 4.565 -1.435 1.00 . A A . 25 LYS HG3 1 1 11 4747 1 1 25 LYS HZ1 H 17.040 4.630 1.502 1.00 . A A . 25 LYS HZ1 1 1 11 4748 1 1 25 LYS HZ2 H 16.250 4.183 0.065 1.00 . A A . 25 LYS HZ2 1 1 11 4749 1 1 25 LYS HZ3 H 15.466 5.201 1.177 1.00 . A A . 25 LYS HZ3 1 1 11 4750 1 1 25 LYS N N 16.087 2.799 -3.309 1.00 . A A . 25 LYS N 1 1 11 4751 1 1 25 LYS NZ N 16.380 4.954 0.753 1.00 . A A . 25 LYS NZ 1 1 11 4752 1 1 25 LYS O O 16.513 2.971 -0.519 1.00 . A A . 25 LYS O 1 1 11 4753 1 1 26 ALA C C 18.853 3.661 1.353 1.00 . A A . 26 ALA C 1 1 11 4754 1 1 26 ALA CA C 19.068 2.485 0.410 1.00 . A A . 26 ALA CA 1 1 11 4755 1 1 26 ALA CB C 20.532 2.030 0.485 1.00 . A A . 26 ALA CB 1 1 11 4756 1 1 26 ALA H H 19.432 3.003 -1.610 1.00 . A A . 26 ALA H 1 1 11 4757 1 1 26 ALA HA H 18.432 1.668 0.714 1.00 . A A . 26 ALA HA 1 1 11 4758 1 1 26 ALA HB1 H 20.668 1.145 -0.117 1.00 . A A . 26 ALA HB1 1 1 11 4759 1 1 26 ALA HB2 H 20.787 1.810 1.513 1.00 . A A . 26 ALA HB2 1 1 11 4760 1 1 26 ALA HB3 H 21.173 2.816 0.117 1.00 . A A . 26 ALA HB3 1 1 11 4761 1 1 26 ALA N N 18.722 2.881 -0.948 1.00 . A A . 26 ALA N 1 1 11 4762 1 1 26 ALA O O 19.607 4.607 1.269 1.00 . A A . 26 ALA O 1 1 11 4763 1 1 26 ALA OXT O 17.923 3.607 2.134 1.00 . A A . 26 ALA OXT 1 1 12 4764 1 1 1 LYS C C -18.739 4.749 -0.640 1.00 . A A . 1 LYS C 1 1 12 4765 1 1 1 LYS CA C -18.601 4.529 0.865 1.00 . A A . 1 LYS CA 1 1 12 4766 1 1 1 LYS CB C -18.828 5.853 1.614 1.00 . A A . 1 LYS CB 1 1 12 4767 1 1 1 LYS CD C -20.710 7.329 2.371 1.00 . A A . 1 LYS CD 1 1 12 4768 1 1 1 LYS CE C -21.798 7.402 3.444 1.00 . A A . 1 LYS CE 1 1 12 4769 1 1 1 LYS CG C -20.247 5.877 2.204 1.00 . A A . 1 LYS CG 1 1 12 4770 1 1 1 LYS H1 H -17.250 2.966 1.109 1.00 . A A . 1 LYS H1 1 1 12 4771 1 1 1 LYS H2 H -16.945 4.304 2.107 1.00 . A A . 1 LYS H2 1 1 12 4772 1 1 1 LYS H3 H -16.570 4.367 0.454 1.00 . A A . 1 LYS H3 1 1 12 4773 1 1 1 LYS HA H -19.336 3.805 1.186 1.00 . A A . 1 LYS HA 1 1 12 4774 1 1 1 LYS HB2 H -18.103 5.943 2.411 1.00 . A A . 1 LYS HB2 1 1 12 4775 1 1 1 LYS HB3 H -18.712 6.678 0.929 1.00 . A A . 1 LYS HB3 1 1 12 4776 1 1 1 LYS HD2 H -19.870 7.944 2.666 1.00 . A A . 1 LYS HD2 1 1 12 4777 1 1 1 LYS HD3 H -21.106 7.690 1.432 1.00 . A A . 1 LYS HD3 1 1 12 4778 1 1 1 LYS HE2 H -21.360 7.222 4.415 1.00 . A A . 1 LYS HE2 1 1 12 4779 1 1 1 LYS HE3 H -22.249 8.384 3.431 1.00 . A A . 1 LYS HE3 1 1 12 4780 1 1 1 LYS HG2 H -20.921 5.356 1.539 1.00 . A A . 1 LYS HG2 1 1 12 4781 1 1 1 LYS HG3 H -20.245 5.389 3.169 1.00 . A A . 1 LYS HG3 1 1 12 4782 1 1 1 LYS HZ1 H -23.395 6.642 2.332 1.00 . A A . 1 LYS HZ1 1 1 12 4783 1 1 1 LYS HZ2 H -23.471 6.292 3.996 1.00 . A A . 1 LYS HZ2 1 1 12 4784 1 1 1 LYS HZ3 H -22.386 5.452 3.003 1.00 . A A . 1 LYS HZ3 1 1 12 4785 1 1 1 LYS N N -17.238 4.004 1.157 1.00 . A A . 1 LYS N 1 1 12 4786 1 1 1 LYS NZ N -22.840 6.369 3.173 1.00 . A A . 1 LYS NZ 1 1 12 4787 1 1 1 LYS O O -19.432 3.995 -1.319 1.00 . A A . 1 LYS O 1 1 12 4788 1 1 2 LYS C C -17.472 4.967 -3.386 1.00 . A A . 2 LYS C 1 1 12 4789 1 1 2 LYS CA C -18.143 6.078 -2.590 1.00 . A A . 2 LYS CA 1 1 12 4790 1 1 2 LYS CB C -17.466 7.425 -2.896 1.00 . A A . 2 LYS CB 1 1 12 4791 1 1 2 LYS CD C -15.085 7.093 -3.654 1.00 . A A . 2 LYS CD 1 1 12 4792 1 1 2 LYS CE C -15.092 8.273 -4.637 1.00 . A A . 2 LYS CE 1 1 12 4793 1 1 2 LYS CG C -15.996 7.389 -2.455 1.00 . A A . 2 LYS CG 1 1 12 4794 1 1 2 LYS H H -17.532 6.356 -0.575 1.00 . A A . 2 LYS H 1 1 12 4795 1 1 2 LYS HA H -19.183 6.137 -2.885 1.00 . A A . 2 LYS HA 1 1 12 4796 1 1 2 LYS HB2 H -17.523 7.623 -3.957 1.00 . A A . 2 LYS HB2 1 1 12 4797 1 1 2 LYS HB3 H -17.979 8.211 -2.360 1.00 . A A . 2 LYS HB3 1 1 12 4798 1 1 2 LYS HD2 H -14.076 6.926 -3.303 1.00 . A A . 2 LYS HD2 1 1 12 4799 1 1 2 LYS HD3 H -15.435 6.206 -4.159 1.00 . A A . 2 LYS HD3 1 1 12 4800 1 1 2 LYS HE2 H -14.242 8.192 -5.297 1.00 . A A . 2 LYS HE2 1 1 12 4801 1 1 2 LYS HE3 H -16.002 8.250 -5.222 1.00 . A A . 2 LYS HE3 1 1 12 4802 1 1 2 LYS HG2 H -15.728 8.343 -2.027 1.00 . A A . 2 LYS HG2 1 1 12 4803 1 1 2 LYS HG3 H -15.865 6.618 -1.712 1.00 . A A . 2 LYS HG3 1 1 12 4804 1 1 2 LYS HZ1 H -15.869 9.679 -3.310 1.00 . A A . 2 LYS HZ1 1 1 12 4805 1 1 2 LYS HZ2 H -14.949 10.351 -4.561 1.00 . A A . 2 LYS HZ2 1 1 12 4806 1 1 2 LYS HZ3 H -14.179 9.564 -3.271 1.00 . A A . 2 LYS HZ3 1 1 12 4807 1 1 2 LYS N N -18.076 5.784 -1.161 1.00 . A A . 2 LYS N 1 1 12 4808 1 1 2 LYS NZ N -15.016 9.561 -3.890 1.00 . A A . 2 LYS NZ 1 1 12 4809 1 1 2 LYS O O -16.665 4.207 -2.843 1.00 . A A . 2 LYS O 1 1 12 4810 1 1 3 ALA C C -15.883 4.309 -6.061 1.00 . A A . 3 ALA C 1 1 12 4811 1 1 3 ALA CA C -17.226 3.850 -5.518 1.00 . A A . 3 ALA CA 1 1 12 4812 1 1 3 ALA CB C -18.164 3.545 -6.681 1.00 . A A . 3 ALA CB 1 1 12 4813 1 1 3 ALA H H -18.452 5.511 -5.042 1.00 . A A . 3 ALA H 1 1 12 4814 1 1 3 ALA HA H -17.084 2.952 -4.938 1.00 . A A . 3 ALA HA 1 1 12 4815 1 1 3 ALA HB1 H -19.068 3.103 -6.301 1.00 . A A . 3 ALA HB1 1 1 12 4816 1 1 3 ALA HB2 H -17.682 2.858 -7.358 1.00 . A A . 3 ALA HB2 1 1 12 4817 1 1 3 ALA HB3 H -18.399 4.459 -7.203 1.00 . A A . 3 ALA HB3 1 1 12 4818 1 1 3 ALA N N -17.805 4.876 -4.665 1.00 . A A . 3 ALA N 1 1 12 4819 1 1 3 ALA O O -15.683 5.501 -6.314 1.00 . A A . 3 ALA O 1 1 12 4820 1 1 4 LEU C C -12.950 2.399 -7.228 1.00 . A A . 4 LEU C 1 1 12 4821 1 1 4 LEU CA C -13.650 3.678 -6.777 1.00 . A A . 4 LEU CA 1 1 12 4822 1 1 4 LEU CB C -12.807 4.387 -5.709 1.00 . A A . 4 LEU CB 1 1 12 4823 1 1 4 LEU CD1 C -11.628 6.519 -5.113 1.00 . A A . 4 LEU CD1 1 1 12 4824 1 1 4 LEU CD2 C -11.453 5.623 -7.428 1.00 . A A . 4 LEU CD2 1 1 12 4825 1 1 4 LEU CG C -12.379 5.772 -6.218 1.00 . A A . 4 LEU CG 1 1 12 4826 1 1 4 LEU H H -15.194 2.432 -6.040 1.00 . A A . 4 LEU H 1 1 12 4827 1 1 4 LEU HA H -13.762 4.334 -7.628 1.00 . A A . 4 LEU HA 1 1 12 4828 1 1 4 LEU HB2 H -13.396 4.502 -4.809 1.00 . A A . 4 LEU HB2 1 1 12 4829 1 1 4 LEU HB3 H -11.930 3.799 -5.490 1.00 . A A . 4 LEU HB3 1 1 12 4830 1 1 4 LEU HD11 H -10.595 6.203 -5.104 1.00 . A A . 4 LEU HD11 1 1 12 4831 1 1 4 LEU HD12 H -12.081 6.304 -4.157 1.00 . A A . 4 LEU HD12 1 1 12 4832 1 1 4 LEU HD13 H -11.675 7.581 -5.304 1.00 . A A . 4 LEU HD13 1 1 12 4833 1 1 4 LEU HD21 H -11.262 6.597 -7.853 1.00 . A A . 4 LEU HD21 1 1 12 4834 1 1 4 LEU HD22 H -11.921 4.994 -8.169 1.00 . A A . 4 LEU HD22 1 1 12 4835 1 1 4 LEU HD23 H -10.520 5.180 -7.113 1.00 . A A . 4 LEU HD23 1 1 12 4836 1 1 4 LEU HG H -13.256 6.338 -6.503 1.00 . A A . 4 LEU HG 1 1 12 4837 1 1 4 LEU N N -14.972 3.362 -6.251 1.00 . A A . 4 LEU N 1 1 12 4838 1 1 4 LEU O O -13.590 1.357 -7.392 1.00 . A A . 4 LEU O 1 1 12 4839 1 1 5 LEU C C -10.624 0.376 -6.677 1.00 . A A . 5 LEU C 1 1 12 4840 1 1 5 LEU CA C -10.870 1.315 -7.853 1.00 . A A . 5 LEU CA 1 1 12 4841 1 1 5 LEU CB C -9.533 1.759 -8.454 1.00 . A A . 5 LEU CB 1 1 12 4842 1 1 5 LEU CD1 C -8.437 3.310 -10.093 1.00 . A A . 5 LEU CD1 1 1 12 4843 1 1 5 LEU CD2 C -10.755 2.510 -10.516 1.00 . A A . 5 LEU CD2 1 1 12 4844 1 1 5 LEU CG C -9.760 2.925 -9.429 1.00 . A A . 5 LEU CG 1 1 12 4845 1 1 5 LEU H H -11.181 3.332 -7.272 1.00 . A A . 5 LEU H 1 1 12 4846 1 1 5 LEU HA H -11.433 0.784 -8.608 1.00 . A A . 5 LEU HA 1 1 12 4847 1 1 5 LEU HB2 H -8.873 2.075 -7.656 1.00 . A A . 5 LEU HB2 1 1 12 4848 1 1 5 LEU HB3 H -9.086 0.930 -8.983 1.00 . A A . 5 LEU HB3 1 1 12 4849 1 1 5 LEU HD11 H -7.785 3.768 -9.364 1.00 . A A . 5 LEU HD11 1 1 12 4850 1 1 5 LEU HD12 H -8.629 4.010 -10.892 1.00 . A A . 5 LEU HD12 1 1 12 4851 1 1 5 LEU HD13 H -7.964 2.427 -10.496 1.00 . A A . 5 LEU HD13 1 1 12 4852 1 1 5 LEU HD21 H -10.835 3.299 -11.253 1.00 . A A . 5 LEU HD21 1 1 12 4853 1 1 5 LEU HD22 H -11.724 2.334 -10.071 1.00 . A A . 5 LEU HD22 1 1 12 4854 1 1 5 LEU HD23 H -10.408 1.605 -10.995 1.00 . A A . 5 LEU HD23 1 1 12 4855 1 1 5 LEU HG H -10.148 3.776 -8.888 1.00 . A A . 5 LEU HG 1 1 12 4856 1 1 5 LEU N N -11.639 2.478 -7.421 1.00 . A A . 5 LEU N 1 1 12 4857 1 1 5 LEU O O -11.424 0.311 -5.741 1.00 . A A . 5 LEU O 1 1 12 4858 1 1 6 ALA C C -8.914 -0.550 -4.345 1.00 . A A . 6 ALA C 1 1 12 4859 1 1 6 ALA CA C -9.172 -1.290 -5.662 1.00 . A A . 6 ALA CA 1 1 12 4860 1 1 6 ALA CB C -7.931 -2.104 -6.055 1.00 . A A . 6 ALA CB 1 1 12 4861 1 1 6 ALA H H -8.914 -0.262 -7.497 1.00 . A A . 6 ALA H 1 1 12 4862 1 1 6 ALA HA H -9.999 -1.972 -5.521 1.00 . A A . 6 ALA HA 1 1 12 4863 1 1 6 ALA HB1 H -7.041 -1.557 -5.785 1.00 . A A . 6 ALA HB1 1 1 12 4864 1 1 6 ALA HB2 H -7.936 -2.279 -7.121 1.00 . A A . 6 ALA HB2 1 1 12 4865 1 1 6 ALA HB3 H -7.940 -3.053 -5.536 1.00 . A A . 6 ALA HB3 1 1 12 4866 1 1 6 ALA N N -9.513 -0.352 -6.727 1.00 . A A . 6 ALA N 1 1 12 4867 1 1 6 ALA O O -7.810 -0.601 -3.797 1.00 . A A . 6 ALA O 1 1 12 4868 1 1 7 LEU C C -9.501 -0.113 -1.463 1.00 . A A . 7 LEU C 1 1 12 4869 1 1 7 LEU CA C -9.810 0.859 -2.593 1.00 . A A . 7 LEU CA 1 1 12 4870 1 1 7 LEU CB C -11.108 1.615 -2.285 1.00 . A A . 7 LEU CB 1 1 12 4871 1 1 7 LEU CD1 C -9.961 3.446 -1.004 1.00 . A A . 7 LEU CD1 1 1 12 4872 1 1 7 LEU CD2 C -10.119 3.577 -3.499 1.00 . A A . 7 LEU CD2 1 1 12 4873 1 1 7 LEU CG C -10.835 3.124 -2.220 1.00 . A A . 7 LEU CG 1 1 12 4874 1 1 7 LEU H H -10.799 0.128 -4.321 1.00 . A A . 7 LEU H 1 1 12 4875 1 1 7 LEU HA H -8.999 1.567 -2.684 1.00 . A A . 7 LEU HA 1 1 12 4876 1 1 7 LEU HB2 H -11.830 1.414 -3.062 1.00 . A A . 7 LEU HB2 1 1 12 4877 1 1 7 LEU HB3 H -11.501 1.279 -1.336 1.00 . A A . 7 LEU HB3 1 1 12 4878 1 1 7 LEU HD11 H -10.085 4.486 -0.740 1.00 . A A . 7 LEU HD11 1 1 12 4879 1 1 7 LEU HD12 H -8.924 3.261 -1.246 1.00 . A A . 7 LEU HD12 1 1 12 4880 1 1 7 LEU HD13 H -10.254 2.824 -0.170 1.00 . A A . 7 LEU HD13 1 1 12 4881 1 1 7 LEU HD21 H -10.442 4.574 -3.756 1.00 . A A . 7 LEU HD21 1 1 12 4882 1 1 7 LEU HD22 H -10.357 2.902 -4.307 1.00 . A A . 7 LEU HD22 1 1 12 4883 1 1 7 LEU HD23 H -9.053 3.578 -3.334 1.00 . A A . 7 LEU HD23 1 1 12 4884 1 1 7 LEU HG H -11.775 3.651 -2.131 1.00 . A A . 7 LEU HG 1 1 12 4885 1 1 7 LEU N N -9.940 0.128 -3.843 1.00 . A A . 7 LEU N 1 1 12 4886 1 1 7 LEU O O -9.865 -1.287 -1.535 1.00 . A A . 7 LEU O 1 1 12 4887 1 1 8 ALA C C -7.329 -1.417 0.314 1.00 . A A . 8 ALA C 1 1 12 4888 1 1 8 ALA CA C -8.430 -0.452 0.708 1.00 . A A . 8 ALA CA 1 1 12 4889 1 1 8 ALA CB C -9.635 -1.234 1.222 1.00 . A A . 8 ALA CB 1 1 12 4890 1 1 8 ALA H H -8.534 1.311 -0.457 1.00 . A A . 8 ALA H 1 1 12 4891 1 1 8 ALA HA H -8.064 0.188 1.490 1.00 . A A . 8 ALA HA 1 1 12 4892 1 1 8 ALA HB1 H -9.800 -2.094 0.590 1.00 . A A . 8 ALA HB1 1 1 12 4893 1 1 8 ALA HB2 H -10.510 -0.600 1.207 1.00 . A A . 8 ALA HB2 1 1 12 4894 1 1 8 ALA HB3 H -9.443 -1.560 2.232 1.00 . A A . 8 ALA HB3 1 1 12 4895 1 1 8 ALA N N -8.807 0.376 -0.439 1.00 . A A . 8 ALA N 1 1 12 4896 1 1 8 ALA O O -6.535 -1.859 1.145 1.00 . A A . 8 ALA O 1 1 12 4897 1 1 9 LEU C C -5.065 -1.797 -1.892 1.00 . A A . 9 LEU C 1 1 12 4898 1 1 9 LEU CA C -6.272 -2.609 -1.495 1.00 . A A . 9 LEU CA 1 1 12 4899 1 1 9 LEU CB C -6.816 -3.315 -2.720 1.00 . A A . 9 LEU CB 1 1 12 4900 1 1 9 LEU CD1 C -8.576 -4.602 -1.498 1.00 . A A . 9 LEU CD1 1 1 12 4901 1 1 9 LEU CD2 C -7.636 -5.470 -3.634 1.00 . A A . 9 LEU CD2 1 1 12 4902 1 1 9 LEU CG C -7.311 -4.713 -2.351 1.00 . A A . 9 LEU CG 1 1 12 4903 1 1 9 LEU H H -7.938 -1.316 -1.567 1.00 . A A . 9 LEU H 1 1 12 4904 1 1 9 LEU HA H -5.992 -3.332 -0.751 1.00 . A A . 9 LEU HA 1 1 12 4905 1 1 9 LEU HB2 H -7.636 -2.736 -3.117 1.00 . A A . 9 LEU HB2 1 1 12 4906 1 1 9 LEU HB3 H -6.036 -3.389 -3.459 1.00 . A A . 9 LEU HB3 1 1 12 4907 1 1 9 LEU HD11 H -8.354 -4.889 -0.481 1.00 . A A . 9 LEU HD11 1 1 12 4908 1 1 9 LEU HD12 H -9.337 -5.260 -1.897 1.00 . A A . 9 LEU HD12 1 1 12 4909 1 1 9 LEU HD13 H -8.935 -3.586 -1.518 1.00 . A A . 9 LEU HD13 1 1 12 4910 1 1 9 LEU HD21 H -6.727 -5.647 -4.191 1.00 . A A . 9 LEU HD21 1 1 12 4911 1 1 9 LEU HD22 H -8.314 -4.881 -4.232 1.00 . A A . 9 LEU HD22 1 1 12 4912 1 1 9 LEU HD23 H -8.097 -6.412 -3.389 1.00 . A A . 9 LEU HD23 1 1 12 4913 1 1 9 LEU HG H -6.542 -5.239 -1.800 1.00 . A A . 9 LEU HG 1 1 12 4914 1 1 9 LEU N N -7.281 -1.718 -0.962 1.00 . A A . 9 LEU N 1 1 12 4915 1 1 9 LEU O O -3.976 -1.954 -1.336 1.00 . A A . 9 LEU O 1 1 12 4916 1 1 10 HIS C C -3.515 0.519 -2.071 1.00 . A A . 10 HIS C 1 1 12 4917 1 1 10 HIS CA C -4.216 -0.005 -3.297 1.00 . A A . 10 HIS CA 1 1 12 4918 1 1 10 HIS CB C -4.794 1.175 -4.074 1.00 . A A . 10 HIS CB 1 1 12 4919 1 1 10 HIS CD2 C -4.997 -0.395 -6.168 1.00 . A A . 10 HIS CD2 1 1 12 4920 1 1 10 HIS CE1 C -5.156 1.130 -7.700 1.00 . A A . 10 HIS CE1 1 1 12 4921 1 1 10 HIS CG C -4.932 0.816 -5.528 1.00 . A A . 10 HIS CG 1 1 12 4922 1 1 10 HIS H H -6.191 -0.813 -3.214 1.00 . A A . 10 HIS H 1 1 12 4923 1 1 10 HIS HA H -3.518 -0.549 -3.916 1.00 . A A . 10 HIS HA 1 1 12 4924 1 1 10 HIS HB2 H -5.762 1.428 -3.670 1.00 . A A . 10 HIS HB2 1 1 12 4925 1 1 10 HIS HB3 H -4.131 2.023 -3.971 1.00 . A A . 10 HIS HB3 1 1 12 4926 1 1 10 HIS HD1 H -5.011 2.754 -6.400 1.00 . A A . 10 HIS HD1 1 1 12 4927 1 1 10 HIS HD2 H -4.972 -1.358 -5.677 1.00 . A A . 10 HIS HD2 1 1 12 4928 1 1 10 HIS HE1 H -5.279 1.623 -8.656 1.00 . A A . 10 HIS HE1 1 1 12 4929 1 1 10 HIS HE2 H -5.188 -0.884 -8.240 1.00 . A A . 10 HIS HE2 1 1 12 4930 1 1 10 HIS N N -5.285 -0.894 -2.841 1.00 . A A . 10 HIS N 1 1 12 4931 1 1 10 HIS ND1 N -5.033 1.776 -6.526 1.00 . A A . 10 HIS ND1 1 1 12 4932 1 1 10 HIS NE2 N -5.134 -0.197 -7.539 1.00 . A A . 10 HIS NE2 1 1 12 4933 1 1 10 HIS O O -2.301 0.686 -2.024 1.00 . A A . 10 HIS O 1 1 12 4934 1 1 11 HIS C C -2.606 0.500 0.624 1.00 . A A . 11 HIS C 1 1 12 4935 1 1 11 HIS CA C -3.891 1.199 0.223 1.00 . A A . 11 HIS CA 1 1 12 4936 1 1 11 HIS CB C -4.978 0.846 1.223 1.00 . A A . 11 HIS CB 1 1 12 4937 1 1 11 HIS CD2 C -6.349 3.017 0.699 1.00 . A A . 11 HIS CD2 1 1 12 4938 1 1 11 HIS CE1 C -6.932 3.529 2.722 1.00 . A A . 11 HIS CE1 1 1 12 4939 1 1 11 HIS CG C -5.807 2.062 1.521 1.00 . A A . 11 HIS CG 1 1 12 4940 1 1 11 HIS H H -5.284 0.545 -1.195 1.00 . A A . 11 HIS H 1 1 12 4941 1 1 11 HIS HA H -3.738 2.262 0.205 1.00 . A A . 11 HIS HA 1 1 12 4942 1 1 11 HIS HB2 H -5.607 0.075 0.784 1.00 . A A . 11 HIS HB2 1 1 12 4943 1 1 11 HIS HB3 H -4.521 0.469 2.124 1.00 . A A . 11 HIS HB3 1 1 12 4944 1 1 11 HIS HD1 H -5.957 1.922 3.635 1.00 . A A . 11 HIS HD1 1 1 12 4945 1 1 11 HIS HD2 H -6.236 3.048 -0.375 1.00 . A A . 11 HIS HD2 1 1 12 4946 1 1 11 HIS HE1 H -7.368 4.036 3.574 1.00 . A A . 11 HIS HE1 1 1 12 4947 1 1 11 HIS HE2 H -7.559 4.728 1.128 1.00 . A A . 11 HIS HE2 1 1 12 4948 1 1 11 HIS N N -4.333 0.735 -1.067 1.00 . A A . 11 HIS N 1 1 12 4949 1 1 11 HIS ND1 N -6.188 2.408 2.809 1.00 . A A . 11 HIS ND1 1 1 12 4950 1 1 11 HIS NE2 N -7.062 3.943 1.456 1.00 . A A . 11 HIS NE2 1 1 12 4951 1 1 11 HIS O O -1.672 1.111 1.150 1.00 . A A . 11 HIS O 1 1 12 4952 1 1 12 LEU C C -0.357 -1.361 -0.372 1.00 . A A . 12 LEU C 1 1 12 4953 1 1 12 LEU CA C -1.413 -1.594 0.676 1.00 . A A . 12 LEU CA 1 1 12 4954 1 1 12 LEU CB C -1.797 -3.076 0.701 1.00 . A A . 12 LEU CB 1 1 12 4955 1 1 12 LEU CD1 C -3.438 -4.735 1.589 1.00 . A A . 12 LEU CD1 1 1 12 4956 1 1 12 LEU CD2 C -2.392 -3.063 3.132 1.00 . A A . 12 LEU CD2 1 1 12 4957 1 1 12 LEU CG C -2.922 -3.299 1.711 1.00 . A A . 12 LEU CG 1 1 12 4958 1 1 12 LEU H H -3.353 -1.203 -0.083 1.00 . A A . 12 LEU H 1 1 12 4959 1 1 12 LEU HA H -1.027 -1.300 1.641 1.00 . A A . 12 LEU HA 1 1 12 4960 1 1 12 LEU HB2 H -2.129 -3.371 -0.284 1.00 . A A . 12 LEU HB2 1 1 12 4961 1 1 12 LEU HB3 H -0.937 -3.666 0.981 1.00 . A A . 12 LEU HB3 1 1 12 4962 1 1 12 LEU HD11 H -3.500 -5.011 0.545 1.00 . A A . 12 LEU HD11 1 1 12 4963 1 1 12 LEU HD12 H -4.421 -4.803 2.039 1.00 . A A . 12 LEU HD12 1 1 12 4964 1 1 12 LEU HD13 H -2.759 -5.404 2.096 1.00 . A A . 12 LEU HD13 1 1 12 4965 1 1 12 LEU HD21 H -2.876 -3.743 3.818 1.00 . A A . 12 LEU HD21 1 1 12 4966 1 1 12 LEU HD22 H -2.593 -2.041 3.429 1.00 . A A . 12 LEU HD22 1 1 12 4967 1 1 12 LEU HD23 H -1.325 -3.235 3.153 1.00 . A A . 12 LEU HD23 1 1 12 4968 1 1 12 LEU HG H -3.731 -2.613 1.505 1.00 . A A . 12 LEU HG 1 1 12 4969 1 1 12 LEU N N -2.576 -0.788 0.356 1.00 . A A . 12 LEU N 1 1 12 4970 1 1 12 LEU O O 0.812 -1.115 -0.067 1.00 . A A . 12 LEU O 1 1 12 4971 1 1 13 ALA C C 0.789 0.147 -2.544 1.00 . A A . 13 ALA C 1 1 12 4972 1 1 13 ALA CA C 0.092 -1.182 -2.743 1.00 . A A . 13 ALA CA 1 1 12 4973 1 1 13 ALA CB C -0.694 -1.166 -4.055 1.00 . A A . 13 ALA CB 1 1 12 4974 1 1 13 ALA H H -1.756 -1.590 -1.756 1.00 . A A . 13 ALA H 1 1 12 4975 1 1 13 ALA HA H 0.829 -1.969 -2.777 1.00 . A A . 13 ALA HA 1 1 12 4976 1 1 13 ALA HB1 H -0.010 -1.052 -4.882 1.00 . A A . 13 ALA HB1 1 1 12 4977 1 1 13 ALA HB2 H -1.393 -0.345 -4.049 1.00 . A A . 13 ALA HB2 1 1 12 4978 1 1 13 ALA HB3 H -1.232 -2.098 -4.164 1.00 . A A . 13 ALA HB3 1 1 12 4979 1 1 13 ALA N N -0.799 -1.412 -1.611 1.00 . A A . 13 ALA N 1 1 12 4980 1 1 13 ALA O O 1.924 0.354 -2.973 1.00 . A A . 13 ALA O 1 1 12 4981 1 1 14 HIS C C 1.739 2.216 -0.566 1.00 . A A . 14 HIS C 1 1 12 4982 1 1 14 HIS CA C 0.597 2.346 -1.552 1.00 . A A . 14 HIS CA 1 1 12 4983 1 1 14 HIS CB C -0.530 3.182 -0.971 1.00 . A A . 14 HIS CB 1 1 12 4984 1 1 14 HIS CD2 C -0.196 4.390 1.339 1.00 . A A . 14 HIS CD2 1 1 12 4985 1 1 14 HIS CE1 C 1.172 5.945 0.696 1.00 . A A . 14 HIS CE1 1 1 12 4986 1 1 14 HIS CG C 0.004 4.210 -0.008 1.00 . A A . 14 HIS CG 1 1 12 4987 1 1 14 HIS H H -0.812 0.781 -1.554 1.00 . A A . 14 HIS H 1 1 12 4988 1 1 14 HIS HA H 0.958 2.811 -2.450 1.00 . A A . 14 HIS HA 1 1 12 4989 1 1 14 HIS HB2 H -1.031 3.664 -1.777 1.00 . A A . 14 HIS HB2 1 1 12 4990 1 1 14 HIS HB3 H -1.224 2.534 -0.459 1.00 . A A . 14 HIS HB3 1 1 12 4991 1 1 14 HIS HD1 H 1.224 5.360 -1.308 1.00 . A A . 14 HIS HD1 1 1 12 4992 1 1 14 HIS HD2 H -0.830 3.771 1.964 1.00 . A A . 14 HIS HD2 1 1 12 4993 1 1 14 HIS HE1 H 1.826 6.802 0.694 1.00 . A A . 14 HIS HE1 1 1 12 4994 1 1 14 HIS HE2 H 0.616 5.822 2.703 1.00 . A A . 14 HIS HE2 1 1 12 4995 1 1 14 HIS N N 0.085 1.031 -1.864 1.00 . A A . 14 HIS N 1 1 12 4996 1 1 14 HIS ND1 N 0.879 5.213 -0.398 1.00 . A A . 14 HIS ND1 1 1 12 4997 1 1 14 HIS NE2 N 0.546 5.483 1.781 1.00 . A A . 14 HIS NE2 1 1 12 4998 1 1 14 HIS O O 2.838 2.729 -0.785 1.00 . A A . 14 HIS O 1 1 12 4999 1 1 15 LEU C C 3.662 0.583 0.733 1.00 . A A . 15 LEU C 1 1 12 5000 1 1 15 LEU CA C 2.534 1.234 1.473 1.00 . A A . 15 LEU CA 1 1 12 5001 1 1 15 LEU CB C 2.050 0.253 2.543 1.00 . A A . 15 LEU CB 1 1 12 5002 1 1 15 LEU CD1 C 0.680 2.273 3.173 1.00 . A A . 15 LEU CD1 1 1 12 5003 1 1 15 LEU CD2 C 0.109 0.032 4.078 1.00 . A A . 15 LEU CD2 1 1 12 5004 1 1 15 LEU CG C 1.259 0.949 3.657 1.00 . A A . 15 LEU CG 1 1 12 5005 1 1 15 LEU H H 0.614 1.058 0.596 1.00 . A A . 15 LEU H 1 1 12 5006 1 1 15 LEU HA H 2.858 2.159 1.910 1.00 . A A . 15 LEU HA 1 1 12 5007 1 1 15 LEU HB2 H 1.419 -0.486 2.075 1.00 . A A . 15 LEU HB2 1 1 12 5008 1 1 15 LEU HB3 H 2.908 -0.245 2.974 1.00 . A A . 15 LEU HB3 1 1 12 5009 1 1 15 LEU HD11 H -0.027 2.642 3.902 1.00 . A A . 15 LEU HD11 1 1 12 5010 1 1 15 LEU HD12 H 0.178 2.118 2.232 1.00 . A A . 15 LEU HD12 1 1 12 5011 1 1 15 LEU HD13 H 1.475 2.994 3.046 1.00 . A A . 15 LEU HD13 1 1 12 5012 1 1 15 LEU HD21 H -0.724 0.168 3.401 1.00 . A A . 15 LEU HD21 1 1 12 5013 1 1 15 LEU HD22 H -0.202 0.277 5.081 1.00 . A A . 15 LEU HD22 1 1 12 5014 1 1 15 LEU HD23 H 0.434 -0.997 4.042 1.00 . A A . 15 LEU HD23 1 1 12 5015 1 1 15 LEU HG H 1.905 1.127 4.500 1.00 . A A . 15 LEU HG 1 1 12 5016 1 1 15 LEU N N 1.490 1.478 0.495 1.00 . A A . 15 LEU N 1 1 12 5017 1 1 15 LEU O O 4.844 0.802 0.998 1.00 . A A . 15 LEU O 1 1 12 5018 1 1 16 ALA C C 4.950 0.033 -1.925 1.00 . A A . 16 ALA C 1 1 12 5019 1 1 16 ALA CA C 4.196 -0.942 -1.042 1.00 . A A . 16 ALA CA 1 1 12 5020 1 1 16 ALA CB C 3.467 -1.971 -1.908 1.00 . A A . 16 ALA CB 1 1 12 5021 1 1 16 ALA H H 2.273 -0.318 -0.357 1.00 . A A . 16 ALA H 1 1 12 5022 1 1 16 ALA HA H 4.899 -1.450 -0.405 1.00 . A A . 16 ALA HA 1 1 12 5023 1 1 16 ALA HB1 H 4.096 -2.838 -2.041 1.00 . A A . 16 ALA HB1 1 1 12 5024 1 1 16 ALA HB2 H 3.243 -1.537 -2.873 1.00 . A A . 16 ALA HB2 1 1 12 5025 1 1 16 ALA HB3 H 2.548 -2.263 -1.421 1.00 . A A . 16 ALA HB3 1 1 12 5026 1 1 16 ALA N N 3.253 -0.221 -0.213 1.00 . A A . 16 ALA N 1 1 12 5027 1 1 16 ALA O O 6.101 -0.203 -2.298 1.00 . A A . 16 ALA O 1 1 12 5028 1 1 17 LEU C C 6.120 2.738 -2.461 1.00 . A A . 17 LEU C 1 1 12 5029 1 1 17 LEU CA C 4.879 2.156 -3.105 1.00 . A A . 17 LEU CA 1 1 12 5030 1 1 17 LEU CB C 3.838 3.252 -3.420 1.00 . A A . 17 LEU CB 1 1 12 5031 1 1 17 LEU CD1 C 5.367 5.230 -3.704 1.00 . A A . 17 LEU CD1 1 1 12 5032 1 1 17 LEU CD2 C 3.041 5.562 -2.866 1.00 . A A . 17 LEU CD2 1 1 12 5033 1 1 17 LEU CG C 4.250 4.621 -2.851 1.00 . A A . 17 LEU CG 1 1 12 5034 1 1 17 LEU H H 3.374 1.250 -1.928 1.00 . A A . 17 LEU H 1 1 12 5035 1 1 17 LEU HA H 5.177 1.695 -4.026 1.00 . A A . 17 LEU HA 1 1 12 5036 1 1 17 LEU HB2 H 3.727 3.335 -4.489 1.00 . A A . 17 LEU HB2 1 1 12 5037 1 1 17 LEU HB3 H 2.892 2.965 -2.990 1.00 . A A . 17 LEU HB3 1 1 12 5038 1 1 17 LEU HD11 H 4.935 5.848 -4.476 1.00 . A A . 17 LEU HD11 1 1 12 5039 1 1 17 LEU HD12 H 5.948 4.442 -4.160 1.00 . A A . 17 LEU HD12 1 1 12 5040 1 1 17 LEU HD13 H 6.008 5.829 -3.079 1.00 . A A . 17 LEU HD13 1 1 12 5041 1 1 17 LEU HD21 H 3.057 6.158 -3.768 1.00 . A A . 17 LEU HD21 1 1 12 5042 1 1 17 LEU HD22 H 3.082 6.212 -2.004 1.00 . A A . 17 LEU HD22 1 1 12 5043 1 1 17 LEU HD23 H 2.131 4.982 -2.835 1.00 . A A . 17 LEU HD23 1 1 12 5044 1 1 17 LEU HG H 4.596 4.507 -1.833 1.00 . A A . 17 LEU HG 1 1 12 5045 1 1 17 LEU N N 4.285 1.131 -2.256 1.00 . A A . 17 LEU N 1 1 12 5046 1 1 17 LEU O O 7.180 2.799 -3.088 1.00 . A A . 17 LEU O 1 1 12 5047 1 1 18 HIS C C 8.124 2.613 -0.209 1.00 . A A . 18 HIS C 1 1 12 5048 1 1 18 HIS CA C 7.174 3.717 -0.550 1.00 . A A . 18 HIS CA 1 1 12 5049 1 1 18 HIS CB C 6.787 4.524 0.672 1.00 . A A . 18 HIS CB 1 1 12 5050 1 1 18 HIS CD2 C 4.852 3.303 1.921 1.00 . A A . 18 HIS CD2 1 1 12 5051 1 1 18 HIS CE1 C 5.969 2.589 3.635 1.00 . A A . 18 HIS CE1 1 1 12 5052 1 1 18 HIS CG C 6.149 3.689 1.737 1.00 . A A . 18 HIS CG 1 1 12 5053 1 1 18 HIS H H 5.141 3.076 -0.748 1.00 . A A . 18 HIS H 1 1 12 5054 1 1 18 HIS HA H 7.670 4.374 -1.248 1.00 . A A . 18 HIS HA 1 1 12 5055 1 1 18 HIS HB2 H 7.663 5.008 1.070 1.00 . A A . 18 HIS HB2 1 1 12 5056 1 1 18 HIS HB3 H 6.089 5.257 0.355 1.00 . A A . 18 HIS HB3 1 1 12 5057 1 1 18 HIS HD1 H 7.816 3.337 3.007 1.00 . A A . 18 HIS HD1 1 1 12 5058 1 1 18 HIS HD2 H 4.044 3.502 1.230 1.00 . A A . 18 HIS HD2 1 1 12 5059 1 1 18 HIS HE1 H 6.234 2.105 4.565 1.00 . A A . 18 HIS HE1 1 1 12 5060 1 1 18 HIS HE2 H 3.922 2.226 3.518 1.00 . A A . 18 HIS HE2 1 1 12 5061 1 1 18 HIS N N 6.008 3.156 -1.217 1.00 . A A . 18 HIS N 1 1 12 5062 1 1 18 HIS ND1 N 6.851 3.223 2.837 1.00 . A A . 18 HIS ND1 1 1 12 5063 1 1 18 HIS NE2 N 4.736 2.609 3.125 1.00 . A A . 18 HIS NE2 1 1 12 5064 1 1 18 HIS O O 9.333 2.717 -0.426 1.00 . A A . 18 HIS O 1 1 12 5065 1 1 19 LEU C C 9.214 0.083 -0.690 1.00 . A A . 19 LEU C 1 1 12 5066 1 1 19 LEU CA C 8.372 0.349 0.539 1.00 . A A . 19 LEU CA 1 1 12 5067 1 1 19 LEU CB C 7.476 -0.860 0.797 1.00 . A A . 19 LEU CB 1 1 12 5068 1 1 19 LEU CD1 C 7.336 0.123 3.088 1.00 . A A . 19 LEU CD1 1 1 12 5069 1 1 19 LEU CD2 C 6.221 -2.051 2.594 1.00 . A A . 19 LEU CD2 1 1 12 5070 1 1 19 LEU CG C 7.437 -1.174 2.292 1.00 . A A . 19 LEU CG 1 1 12 5071 1 1 19 LEU H H 6.581 1.500 0.356 1.00 . A A . 19 LEU H 1 1 12 5072 1 1 19 LEU HA H 9.009 0.532 1.390 1.00 . A A . 19 LEU HA 1 1 12 5073 1 1 19 LEU HB2 H 6.480 -0.645 0.447 1.00 . A A . 19 LEU HB2 1 1 12 5074 1 1 19 LEU HB3 H 7.867 -1.714 0.261 1.00 . A A . 19 LEU HB3 1 1 12 5075 1 1 19 LEU HD11 H 8.325 0.440 3.391 1.00 . A A . 19 LEU HD11 1 1 12 5076 1 1 19 LEU HD12 H 6.725 -0.035 3.965 1.00 . A A . 19 LEU HD12 1 1 12 5077 1 1 19 LEU HD13 H 6.889 0.885 2.469 1.00 . A A . 19 LEU HD13 1 1 12 5078 1 1 19 LEU HD21 H 5.320 -1.523 2.327 1.00 . A A . 19 LEU HD21 1 1 12 5079 1 1 19 LEU HD22 H 6.202 -2.287 3.646 1.00 . A A . 19 LEU HD22 1 1 12 5080 1 1 19 LEU HD23 H 6.286 -2.966 2.024 1.00 . A A . 19 LEU HD23 1 1 12 5081 1 1 19 LEU HG H 8.339 -1.695 2.570 1.00 . A A . 19 LEU HG 1 1 12 5082 1 1 19 LEU N N 7.561 1.525 0.255 1.00 . A A . 19 LEU N 1 1 12 5083 1 1 19 LEU O O 10.358 -0.378 -0.620 1.00 . A A . 19 LEU O 1 1 12 5084 1 1 20 ALA C C 10.437 1.244 -3.168 1.00 . A A . 20 ALA C 1 1 12 5085 1 1 20 ALA CA C 9.292 0.265 -3.104 1.00 . A A . 20 ALA CA 1 1 12 5086 1 1 20 ALA CB C 8.333 0.530 -4.268 1.00 . A A . 20 ALA CB 1 1 12 5087 1 1 20 ALA H H 7.708 0.813 -1.782 1.00 . A A . 20 ALA H 1 1 12 5088 1 1 20 ALA HA H 9.678 -0.734 -3.181 1.00 . A A . 20 ALA HA 1 1 12 5089 1 1 20 ALA HB1 H 8.442 1.553 -4.600 1.00 . A A . 20 ALA HB1 1 1 12 5090 1 1 20 ALA HB2 H 7.318 0.365 -3.948 1.00 . A A . 20 ALA HB2 1 1 12 5091 1 1 20 ALA HB3 H 8.568 -0.137 -5.080 1.00 . A A . 20 ALA HB3 1 1 12 5092 1 1 20 ALA N N 8.618 0.420 -1.823 1.00 . A A . 20 ALA N 1 1 12 5093 1 1 20 ALA O O 11.603 0.867 -3.270 1.00 . A A . 20 ALA O 1 1 12 5094 1 1 21 LEU C C 12.183 3.241 -2.100 1.00 . A A . 21 LEU C 1 1 12 5095 1 1 21 LEU CA C 11.083 3.575 -3.087 1.00 . A A . 21 LEU CA 1 1 12 5096 1 1 21 LEU CB C 10.444 4.903 -2.692 1.00 . A A . 21 LEU CB 1 1 12 5097 1 1 21 LEU CD1 C 8.677 6.561 -3.252 1.00 . A A . 21 LEU CD1 1 1 12 5098 1 1 21 LEU CD2 C 9.965 5.444 -5.081 1.00 . A A . 21 LEU CD2 1 1 12 5099 1 1 21 LEU CG C 9.348 5.264 -3.691 1.00 . A A . 21 LEU CG 1 1 12 5100 1 1 21 LEU H H 9.140 2.734 -2.970 1.00 . A A . 21 LEU H 1 1 12 5101 1 1 21 LEU HA H 11.503 3.657 -4.074 1.00 . A A . 21 LEU HA 1 1 12 5102 1 1 21 LEU HB2 H 10.016 4.814 -1.702 1.00 . A A . 21 LEU HB2 1 1 12 5103 1 1 21 LEU HB3 H 11.196 5.677 -2.690 1.00 . A A . 21 LEU HB3 1 1 12 5104 1 1 21 LEU HD11 H 9.385 7.376 -3.324 1.00 . A A . 21 LEU HD11 1 1 12 5105 1 1 21 LEU HD12 H 8.341 6.466 -2.229 1.00 . A A . 21 LEU HD12 1 1 12 5106 1 1 21 LEU HD13 H 7.830 6.761 -3.891 1.00 . A A . 21 LEU HD13 1 1 12 5107 1 1 21 LEU HD21 H 9.310 6.046 -5.692 1.00 . A A . 21 LEU HD21 1 1 12 5108 1 1 21 LEU HD22 H 10.100 4.477 -5.545 1.00 . A A . 21 LEU HD22 1 1 12 5109 1 1 21 LEU HD23 H 10.923 5.936 -4.990 1.00 . A A . 21 LEU HD23 1 1 12 5110 1 1 21 LEU HG H 8.612 4.471 -3.722 1.00 . A A . 21 LEU HG 1 1 12 5111 1 1 21 LEU N N 10.087 2.511 -3.073 1.00 . A A . 21 LEU N 1 1 12 5112 1 1 21 LEU O O 13.369 3.309 -2.414 1.00 . A A . 21 LEU O 1 1 12 5113 1 1 22 ALA C C 13.670 1.454 -0.354 1.00 . A A . 22 ALA C 1 1 12 5114 1 1 22 ALA CA C 12.690 2.502 0.157 1.00 . A A . 22 ALA CA 1 1 12 5115 1 1 22 ALA CB C 11.923 1.950 1.361 1.00 . A A . 22 ALA CB 1 1 12 5116 1 1 22 ALA H H 10.789 2.838 -0.740 1.00 . A A . 22 ALA H 1 1 12 5117 1 1 22 ALA HA H 13.238 3.376 0.457 1.00 . A A . 22 ALA HA 1 1 12 5118 1 1 22 ALA HB1 H 11.198 1.225 1.026 1.00 . A A . 22 ALA HB1 1 1 12 5119 1 1 22 ALA HB2 H 11.415 2.760 1.868 1.00 . A A . 22 ALA HB2 1 1 12 5120 1 1 22 ALA HB3 H 12.616 1.477 2.043 1.00 . A A . 22 ALA HB3 1 1 12 5121 1 1 22 ALA N N 11.759 2.869 -0.905 1.00 . A A . 22 ALA N 1 1 12 5122 1 1 22 ALA O O 14.839 1.441 0.030 1.00 . A A . 22 ALA O 1 1 12 5123 1 1 23 LEU C C 14.751 0.127 -3.016 1.00 . A A . 23 LEU C 1 1 12 5124 1 1 23 LEU CA C 14.007 -0.447 -1.826 1.00 . A A . 23 LEU CA 1 1 12 5125 1 1 23 LEU CB C 13.143 -1.634 -2.273 1.00 . A A . 23 LEU CB 1 1 12 5126 1 1 23 LEU CD1 C 12.559 -3.988 -1.629 1.00 . A A . 23 LEU CD1 1 1 12 5127 1 1 23 LEU CD2 C 14.879 -3.441 -2.374 1.00 . A A . 23 LEU CD2 1 1 12 5128 1 1 23 LEU CG C 13.657 -2.922 -1.609 1.00 . A A . 23 LEU CG 1 1 12 5129 1 1 23 LEU H H 12.240 0.675 -1.506 1.00 . A A . 23 LEU H 1 1 12 5130 1 1 23 LEU HA H 14.720 -0.783 -1.100 1.00 . A A . 23 LEU HA 1 1 12 5131 1 1 23 LEU HB2 H 12.116 -1.459 -1.981 1.00 . A A . 23 LEU HB2 1 1 12 5132 1 1 23 LEU HB3 H 13.197 -1.737 -3.346 1.00 . A A . 23 LEU HB3 1 1 12 5133 1 1 23 LEU HD11 H 11.744 -3.682 -0.990 1.00 . A A . 23 LEU HD11 1 1 12 5134 1 1 23 LEU HD12 H 12.960 -4.925 -1.276 1.00 . A A . 23 LEU HD12 1 1 12 5135 1 1 23 LEU HD13 H 12.196 -4.112 -2.639 1.00 . A A . 23 LEU HD13 1 1 12 5136 1 1 23 LEU HD21 H 15.752 -2.875 -2.088 1.00 . A A . 23 LEU HD21 1 1 12 5137 1 1 23 LEU HD22 H 14.714 -3.336 -3.436 1.00 . A A . 23 LEU HD22 1 1 12 5138 1 1 23 LEU HD23 H 15.035 -4.483 -2.139 1.00 . A A . 23 LEU HD23 1 1 12 5139 1 1 23 LEU HG H 13.936 -2.714 -0.585 1.00 . A A . 23 LEU HG 1 1 12 5140 1 1 23 LEU N N 13.179 0.593 -1.235 1.00 . A A . 23 LEU N 1 1 12 5141 1 1 23 LEU O O 15.976 0.039 -3.102 1.00 . A A . 23 LEU O 1 1 12 5142 1 1 24 LYS C C 15.707 2.276 -4.690 1.00 . A A . 24 LYS C 1 1 12 5143 1 1 24 LYS CA C 14.566 1.359 -5.109 1.00 . A A . 24 LYS CA 1 1 12 5144 1 1 24 LYS CB C 13.479 2.170 -5.834 1.00 . A A . 24 LYS CB 1 1 12 5145 1 1 24 LYS CD C 14.592 3.322 -7.766 1.00 . A A . 24 LYS CD 1 1 12 5146 1 1 24 LYS CE C 16.056 2.876 -7.861 1.00 . A A . 24 LYS CE 1 1 12 5147 1 1 24 LYS CG C 13.708 2.134 -7.351 1.00 . A A . 24 LYS CG 1 1 12 5148 1 1 24 LYS H H 13.022 0.777 -3.774 1.00 . A A . 24 LYS H 1 1 12 5149 1 1 24 LYS HA H 14.940 0.598 -5.767 1.00 . A A . 24 LYS HA 1 1 12 5150 1 1 24 LYS HB2 H 12.510 1.751 -5.609 1.00 . A A . 24 LYS HB2 1 1 12 5151 1 1 24 LYS HB3 H 13.508 3.196 -5.494 1.00 . A A . 24 LYS HB3 1 1 12 5152 1 1 24 LYS HD2 H 14.265 3.692 -8.726 1.00 . A A . 24 LYS HD2 1 1 12 5153 1 1 24 LYS HD3 H 14.504 4.108 -7.031 1.00 . A A . 24 LYS HD3 1 1 12 5154 1 1 24 LYS HE2 H 16.182 1.940 -7.340 1.00 . A A . 24 LYS HE2 1 1 12 5155 1 1 24 LYS HE3 H 16.324 2.746 -8.898 1.00 . A A . 24 LYS HE3 1 1 12 5156 1 1 24 LYS HG2 H 14.192 1.208 -7.622 1.00 . A A . 24 LYS HG2 1 1 12 5157 1 1 24 LYS HG3 H 12.756 2.204 -7.861 1.00 . A A . 24 LYS HG3 1 1 12 5158 1 1 24 LYS HZ1 H 17.220 3.607 -6.287 1.00 . A A . 24 LYS HZ1 1 1 12 5159 1 1 24 LYS HZ2 H 16.436 4.822 -7.186 1.00 . A A . 24 LYS HZ2 1 1 12 5160 1 1 24 LYS HZ3 H 17.798 4.021 -7.830 1.00 . A A . 24 LYS HZ3 1 1 12 5161 1 1 24 LYS N N 13.993 0.734 -3.921 1.00 . A A . 24 LYS N 1 1 12 5162 1 1 24 LYS NZ N 16.943 3.905 -7.246 1.00 . A A . 24 LYS NZ 1 1 12 5163 1 1 24 LYS O O 16.829 2.181 -5.190 1.00 . A A . 24 LYS O 1 1 12 5164 1 1 25 LYS C C 16.968 4.981 -4.269 1.00 . A A . 25 LYS C 1 1 12 5165 1 1 25 LYS CA C 16.347 4.101 -3.190 1.00 . A A . 25 LYS CA 1 1 12 5166 1 1 25 LYS CB C 17.450 3.365 -2.419 1.00 . A A . 25 LYS CB 1 1 12 5167 1 1 25 LYS CD C 17.524 5.236 -0.747 1.00 . A A . 25 LYS CD 1 1 12 5168 1 1 25 LYS CE C 18.797 5.523 0.052 1.00 . A A . 25 LYS CE 1 1 12 5169 1 1 25 LYS CG C 17.354 3.721 -0.931 1.00 . A A . 25 LYS CG 1 1 12 5170 1 1 25 LYS H H 14.475 3.136 -3.400 1.00 . A A . 25 LYS H 1 1 12 5171 1 1 25 LYS HA H 15.817 4.735 -2.497 1.00 . A A . 25 LYS HA 1 1 12 5172 1 1 25 LYS HB2 H 17.329 2.299 -2.542 1.00 . A A . 25 LYS HB2 1 1 12 5173 1 1 25 LYS HB3 H 18.418 3.663 -2.795 1.00 . A A . 25 LYS HB3 1 1 12 5174 1 1 25 LYS HD2 H 17.592 5.714 -1.714 1.00 . A A . 25 LYS HD2 1 1 12 5175 1 1 25 LYS HD3 H 16.673 5.631 -0.212 1.00 . A A . 25 LYS HD3 1 1 12 5176 1 1 25 LYS HE2 H 19.055 6.566 -0.056 1.00 . A A . 25 LYS HE2 1 1 12 5177 1 1 25 LYS HE3 H 18.627 5.299 1.093 1.00 . A A . 25 LYS HE3 1 1 12 5178 1 1 25 LYS HG2 H 16.386 3.422 -0.554 1.00 . A A . 25 LYS HG2 1 1 12 5179 1 1 25 LYS HG3 H 18.125 3.203 -0.384 1.00 . A A . 25 LYS HG3 1 1 12 5180 1 1 25 LYS HZ1 H 20.163 3.963 0.239 1.00 . A A . 25 LYS HZ1 1 1 12 5181 1 1 25 LYS HZ2 H 20.735 5.281 -0.659 1.00 . A A . 25 LYS HZ2 1 1 12 5182 1 1 25 LYS HZ3 H 19.613 4.214 -1.349 1.00 . A A . 25 LYS HZ3 1 1 12 5183 1 1 25 LYS N N 15.392 3.144 -3.746 1.00 . A A . 25 LYS N 1 1 12 5184 1 1 25 LYS NZ N 19.909 4.681 -0.467 1.00 . A A . 25 LYS NZ 1 1 12 5185 1 1 25 LYS O O 17.775 4.517 -5.079 1.00 . A A . 25 LYS O 1 1 12 5186 1 1 26 ALA C C 16.830 6.802 -6.650 1.00 . A A . 26 ALA C 1 1 12 5187 1 1 26 ALA CA C 17.112 7.234 -5.212 1.00 . A A . 26 ALA CA 1 1 12 5188 1 1 26 ALA CB C 18.618 7.408 -5.010 1.00 . A A . 26 ALA CB 1 1 12 5189 1 1 26 ALA H H 15.957 6.556 -3.566 1.00 . A A . 26 ALA H 1 1 12 5190 1 1 26 ALA HA H 16.629 8.179 -5.034 1.00 . A A . 26 ALA HA 1 1 12 5191 1 1 26 ALA HB1 H 19.129 6.505 -5.303 1.00 . A A . 26 ALA HB1 1 1 12 5192 1 1 26 ALA HB2 H 18.822 7.613 -3.970 1.00 . A A . 26 ALA HB2 1 1 12 5193 1 1 26 ALA HB3 H 18.970 8.230 -5.614 1.00 . A A . 26 ALA HB3 1 1 12 5194 1 1 26 ALA N N 16.592 6.259 -4.253 1.00 . A A . 26 ALA N 1 1 12 5195 1 1 26 ALA O O 15.891 6.060 -6.857 1.00 . A A . 26 ALA O 1 1 12 5196 1 1 26 ALA OXT O 17.563 7.218 -7.525 1.00 . A A . 26 ALA OXT 1 1 13 5197 1 1 1 LYS C C -13.415 4.649 12.400 1.00 . A A . 1 LYS C 1 1 13 5198 1 1 1 LYS CA C -14.066 5.852 13.081 1.00 . A A . 1 LYS CA 1 1 13 5199 1 1 1 LYS CB C -15.140 6.463 12.164 1.00 . A A . 1 LYS CB 1 1 13 5200 1 1 1 LYS CD C -16.880 4.667 11.916 1.00 . A A . 1 LYS CD 1 1 13 5201 1 1 1 LYS CE C -18.140 4.064 12.549 1.00 . A A . 1 LYS CE 1 1 13 5202 1 1 1 LYS CG C -16.533 5.996 12.601 1.00 . A A . 1 LYS CG 1 1 13 5203 1 1 1 LYS H1 H -12.417 6.991 12.533 1.00 . A A . 1 LYS H1 1 1 13 5204 1 1 1 LYS H2 H -12.448 6.558 14.172 1.00 . A A . 1 LYS H2 1 1 13 5205 1 1 1 LYS H3 H -13.480 7.778 13.600 1.00 . A A . 1 LYS H3 1 1 13 5206 1 1 1 LYS HA H -14.521 5.536 14.007 1.00 . A A . 1 LYS HA 1 1 13 5207 1 1 1 LYS HB2 H -15.088 7.541 12.225 1.00 . A A . 1 LYS HB2 1 1 13 5208 1 1 1 LYS HB3 H -14.966 6.157 11.144 1.00 . A A . 1 LYS HB3 1 1 13 5209 1 1 1 LYS HD2 H -17.060 4.834 10.864 1.00 . A A . 1 LYS HD2 1 1 13 5210 1 1 1 LYS HD3 H -16.058 3.974 12.033 1.00 . A A . 1 LYS HD3 1 1 13 5211 1 1 1 LYS HE2 H -18.680 3.493 11.806 1.00 . A A . 1 LYS HE2 1 1 13 5212 1 1 1 LYS HE3 H -17.855 3.413 13.363 1.00 . A A . 1 LYS HE3 1 1 13 5213 1 1 1 LYS HG2 H -16.548 5.862 13.674 1.00 . A A . 1 LYS HG2 1 1 13 5214 1 1 1 LYS HG3 H -17.262 6.741 12.323 1.00 . A A . 1 LYS HG3 1 1 13 5215 1 1 1 LYS HZ1 H -18.560 5.624 13.865 1.00 . A A . 1 LYS HZ1 1 1 13 5216 1 1 1 LYS HZ2 H -19.920 4.734 13.380 1.00 . A A . 1 LYS HZ2 1 1 13 5217 1 1 1 LYS HZ3 H -19.206 5.837 12.309 1.00 . A A . 1 LYS HZ3 1 1 13 5218 1 1 1 LYS N N -13.025 6.872 13.368 1.00 . A A . 1 LYS N 1 1 13 5219 1 1 1 LYS NZ N -19.019 5.148 13.065 1.00 . A A . 1 LYS NZ 1 1 13 5220 1 1 1 LYS O O -13.275 3.580 12.999 1.00 . A A . 1 LYS O 1 1 13 5221 1 1 2 LYS C C -11.847 4.335 9.071 1.00 . A A . 2 LYS C 1 1 13 5222 1 1 2 LYS CA C -12.377 3.767 10.382 1.00 . A A . 2 LYS CA 1 1 13 5223 1 1 2 LYS CB C -13.380 2.644 10.078 1.00 . A A . 2 LYS CB 1 1 13 5224 1 1 2 LYS CD C -13.974 0.242 10.498 1.00 . A A . 2 LYS CD 1 1 13 5225 1 1 2 LYS CE C -13.413 -0.519 9.288 1.00 . A A . 2 LYS CE 1 1 13 5226 1 1 2 LYS CG C -13.026 1.385 10.887 1.00 . A A . 2 LYS CG 1 1 13 5227 1 1 2 LYS H H -13.153 5.708 10.722 1.00 . A A . 2 LYS H 1 1 13 5228 1 1 2 LYS HA H -11.554 3.365 10.954 1.00 . A A . 2 LYS HA 1 1 13 5229 1 1 2 LYS HB2 H -14.375 2.971 10.340 1.00 . A A . 2 LYS HB2 1 1 13 5230 1 1 2 LYS HB3 H -13.348 2.410 9.024 1.00 . A A . 2 LYS HB3 1 1 13 5231 1 1 2 LYS HD2 H -14.076 -0.436 11.334 1.00 . A A . 2 LYS HD2 1 1 13 5232 1 1 2 LYS HD3 H -14.942 0.649 10.250 1.00 . A A . 2 LYS HD3 1 1 13 5233 1 1 2 LYS HE2 H -14.172 -1.182 8.894 1.00 . A A . 2 LYS HE2 1 1 13 5234 1 1 2 LYS HE3 H -13.117 0.183 8.521 1.00 . A A . 2 LYS HE3 1 1 13 5235 1 1 2 LYS HG2 H -12.006 1.098 10.681 1.00 . A A . 2 LYS HG2 1 1 13 5236 1 1 2 LYS HG3 H -13.133 1.595 11.942 1.00 . A A . 2 LYS HG3 1 1 13 5237 1 1 2 LYS HZ1 H -12.481 -1.916 10.521 1.00 . A A . 2 LYS HZ1 1 1 13 5238 1 1 2 LYS HZ2 H -11.452 -0.681 9.978 1.00 . A A . 2 LYS HZ2 1 1 13 5239 1 1 2 LYS HZ3 H -11.921 -1.927 8.921 1.00 . A A . 2 LYS HZ3 1 1 13 5240 1 1 2 LYS N N -13.019 4.831 11.147 1.00 . A A . 2 LYS N 1 1 13 5241 1 1 2 LYS NZ N -12.229 -1.320 9.709 1.00 . A A . 2 LYS NZ 1 1 13 5242 1 1 2 LYS O O -12.443 5.251 8.499 1.00 . A A . 2 LYS O 1 1 13 5243 1 1 3 ALA C C -10.858 3.616 6.156 1.00 . A A . 3 ALA C 1 1 13 5244 1 1 3 ALA CA C -10.148 4.254 7.345 1.00 . A A . 3 ALA CA 1 1 13 5245 1 1 3 ALA CB C -8.655 3.907 7.301 1.00 . A A . 3 ALA CB 1 1 13 5246 1 1 3 ALA H H -10.309 3.058 9.092 1.00 . A A . 3 ALA H 1 1 13 5247 1 1 3 ALA HA H -10.258 5.329 7.283 1.00 . A A . 3 ALA HA 1 1 13 5248 1 1 3 ALA HB1 H -8.148 4.591 6.635 1.00 . A A . 3 ALA HB1 1 1 13 5249 1 1 3 ALA HB2 H -8.528 2.897 6.942 1.00 . A A . 3 ALA HB2 1 1 13 5250 1 1 3 ALA HB3 H -8.234 3.996 8.291 1.00 . A A . 3 ALA HB3 1 1 13 5251 1 1 3 ALA N N -10.738 3.791 8.597 1.00 . A A . 3 ALA N 1 1 13 5252 1 1 3 ALA O O -10.218 3.064 5.262 1.00 . A A . 3 ALA O 1 1 13 5253 1 1 4 LEU C C -12.758 3.939 3.778 1.00 . A A . 4 LEU C 1 1 13 5254 1 1 4 LEU CA C -12.963 3.123 5.053 1.00 . A A . 4 LEU CA 1 1 13 5255 1 1 4 LEU CB C -14.462 3.060 5.396 1.00 . A A . 4 LEU CB 1 1 13 5256 1 1 4 LEU CD1 C -14.572 5.384 6.316 1.00 . A A . 4 LEU CD1 1 1 13 5257 1 1 4 LEU CD2 C -16.243 3.669 7.041 1.00 . A A . 4 LEU CD2 1 1 13 5258 1 1 4 LEU CG C -14.782 3.901 6.636 1.00 . A A . 4 LEU CG 1 1 13 5259 1 1 4 LEU H H -12.640 4.155 6.885 1.00 . A A . 4 LEU H 1 1 13 5260 1 1 4 LEU HA H -12.610 2.118 4.875 1.00 . A A . 4 LEU HA 1 1 13 5261 1 1 4 LEU HB2 H -15.036 3.432 4.559 1.00 . A A . 4 LEU HB2 1 1 13 5262 1 1 4 LEU HB3 H -14.740 2.032 5.583 1.00 . A A . 4 LEU HB3 1 1 13 5263 1 1 4 LEU HD11 H -13.560 5.543 5.983 1.00 . A A . 4 LEU HD11 1 1 13 5264 1 1 4 LEU HD12 H -14.756 5.973 7.203 1.00 . A A . 4 LEU HD12 1 1 13 5265 1 1 4 LEU HD13 H -15.255 5.685 5.538 1.00 . A A . 4 LEU HD13 1 1 13 5266 1 1 4 LEU HD21 H -16.605 4.522 7.598 1.00 . A A . 4 LEU HD21 1 1 13 5267 1 1 4 LEU HD22 H -16.312 2.783 7.655 1.00 . A A . 4 LEU HD22 1 1 13 5268 1 1 4 LEU HD23 H -16.846 3.539 6.155 1.00 . A A . 4 LEU HD23 1 1 13 5269 1 1 4 LEU HG H -14.133 3.610 7.451 1.00 . A A . 4 LEU HG 1 1 13 5270 1 1 4 LEU N N -12.183 3.698 6.150 1.00 . A A . 4 LEU N 1 1 13 5271 1 1 4 LEU O O -11.868 4.792 3.719 1.00 . A A . 4 LEU O 1 1 13 5272 1 1 5 LEU C C -12.141 4.027 0.824 1.00 . A A . 5 LEU C 1 1 13 5273 1 1 5 LEU CA C -13.468 4.369 1.486 1.00 . A A . 5 LEU CA 1 1 13 5274 1 1 5 LEU CB C -13.558 5.891 1.675 1.00 . A A . 5 LEU CB 1 1 13 5275 1 1 5 LEU CD1 C -15.033 7.769 2.396 1.00 . A A . 5 LEU CD1 1 1 13 5276 1 1 5 LEU CD2 C -16.028 5.537 1.935 1.00 . A A . 5 LEU CD2 1 1 13 5277 1 1 5 LEU CG C -14.802 6.262 2.490 1.00 . A A . 5 LEU CG 1 1 13 5278 1 1 5 LEU H H -14.260 2.968 2.874 1.00 . A A . 5 LEU H 1 1 13 5279 1 1 5 LEU HA H -14.273 4.046 0.843 1.00 . A A . 5 LEU HA 1 1 13 5280 1 1 5 LEU HB2 H -12.675 6.237 2.189 1.00 . A A . 5 LEU HB2 1 1 13 5281 1 1 5 LEU HB3 H -13.613 6.367 0.705 1.00 . A A . 5 LEU HB3 1 1 13 5282 1 1 5 LEU HD11 H -16.045 7.995 2.695 1.00 . A A . 5 LEU HD11 1 1 13 5283 1 1 5 LEU HD12 H -14.880 8.091 1.378 1.00 . A A . 5 LEU HD12 1 1 13 5284 1 1 5 LEU HD13 H -14.341 8.285 3.046 1.00 . A A . 5 LEU HD13 1 1 13 5285 1 1 5 LEU HD21 H -15.969 5.496 0.857 1.00 . A A . 5 LEU HD21 1 1 13 5286 1 1 5 LEU HD22 H -16.922 6.068 2.227 1.00 . A A . 5 LEU HD22 1 1 13 5287 1 1 5 LEU HD23 H -16.062 4.532 2.334 1.00 . A A . 5 LEU HD23 1 1 13 5288 1 1 5 LEU HG H -14.648 5.983 3.523 1.00 . A A . 5 LEU HG 1 1 13 5289 1 1 5 LEU N N -13.577 3.667 2.766 1.00 . A A . 5 LEU N 1 1 13 5290 1 1 5 LEU O O -11.334 3.275 1.377 1.00 . A A . 5 LEU O 1 1 13 5291 1 1 6 ALA C C -10.528 2.856 -1.392 1.00 . A A . 6 ALA C 1 1 13 5292 1 1 6 ALA CA C -10.686 4.343 -1.102 1.00 . A A . 6 ALA CA 1 1 13 5293 1 1 6 ALA CB C -9.481 4.840 -0.307 1.00 . A A . 6 ALA CB 1 1 13 5294 1 1 6 ALA H H -12.602 5.174 -0.747 1.00 . A A . 6 ALA H 1 1 13 5295 1 1 6 ALA HA H -10.732 4.881 -2.036 1.00 . A A . 6 ALA HA 1 1 13 5296 1 1 6 ALA HB1 H -8.696 5.121 -0.992 1.00 . A A . 6 ALA HB1 1 1 13 5297 1 1 6 ALA HB2 H -9.128 4.054 0.344 1.00 . A A . 6 ALA HB2 1 1 13 5298 1 1 6 ALA HB3 H -9.769 5.699 0.283 1.00 . A A . 6 ALA HB3 1 1 13 5299 1 1 6 ALA N N -11.917 4.585 -0.361 1.00 . A A . 6 ALA N 1 1 13 5300 1 1 6 ALA O O -11.479 2.087 -1.260 1.00 . A A . 6 ALA O 1 1 13 5301 1 1 7 LEU C C -8.219 0.426 -0.981 1.00 . A A . 7 LEU C 1 1 13 5302 1 1 7 LEU CA C -9.065 1.055 -2.086 1.00 . A A . 7 LEU CA 1 1 13 5303 1 1 7 LEU CB C -8.336 0.943 -3.429 1.00 . A A . 7 LEU CB 1 1 13 5304 1 1 7 LEU CD1 C -9.480 -1.064 -4.424 1.00 . A A . 7 LEU CD1 1 1 13 5305 1 1 7 LEU CD2 C -10.658 1.142 -4.403 1.00 . A A . 7 LEU CD2 1 1 13 5306 1 1 7 LEU CG C -9.292 0.453 -4.532 1.00 . A A . 7 LEU CG 1 1 13 5307 1 1 7 LEU H H -8.604 3.113 -1.871 1.00 . A A . 7 LEU H 1 1 13 5308 1 1 7 LEU HA H -10.004 0.527 -2.151 1.00 . A A . 7 LEU HA 1 1 13 5309 1 1 7 LEU HB2 H -7.944 1.913 -3.701 1.00 . A A . 7 LEU HB2 1 1 13 5310 1 1 7 LEU HB3 H -7.520 0.244 -3.334 1.00 . A A . 7 LEU HB3 1 1 13 5311 1 1 7 LEU HD11 H -9.526 -1.349 -3.385 1.00 . A A . 7 LEU HD11 1 1 13 5312 1 1 7 LEU HD12 H -8.648 -1.564 -4.898 1.00 . A A . 7 LEU HD12 1 1 13 5313 1 1 7 LEU HD13 H -10.400 -1.351 -4.916 1.00 . A A . 7 LEU HD13 1 1 13 5314 1 1 7 LEU HD21 H -11.125 1.194 -5.375 1.00 . A A . 7 LEU HD21 1 1 13 5315 1 1 7 LEU HD22 H -10.526 2.142 -4.015 1.00 . A A . 7 LEU HD22 1 1 13 5316 1 1 7 LEU HD23 H -11.288 0.577 -3.733 1.00 . A A . 7 LEU HD23 1 1 13 5317 1 1 7 LEU HG H -8.863 0.686 -5.495 1.00 . A A . 7 LEU HG 1 1 13 5318 1 1 7 LEU N N -9.326 2.456 -1.783 1.00 . A A . 7 LEU N 1 1 13 5319 1 1 7 LEU O O -6.994 0.560 -0.981 1.00 . A A . 7 LEU O 1 1 13 5320 1 1 8 ALA C C -7.006 -1.728 0.516 1.00 . A A . 8 ALA C 1 1 13 5321 1 1 8 ALA CA C -8.182 -0.931 1.052 1.00 . A A . 8 ALA CA 1 1 13 5322 1 1 8 ALA CB C -9.132 -1.878 1.774 1.00 . A A . 8 ALA CB 1 1 13 5323 1 1 8 ALA H H -9.859 -0.347 -0.120 1.00 . A A . 8 ALA H 1 1 13 5324 1 1 8 ALA HA H -7.825 -0.185 1.742 1.00 . A A . 8 ALA HA 1 1 13 5325 1 1 8 ALA HB1 H -10.109 -1.427 1.842 1.00 . A A . 8 ALA HB1 1 1 13 5326 1 1 8 ALA HB2 H -8.753 -2.076 2.763 1.00 . A A . 8 ALA HB2 1 1 13 5327 1 1 8 ALA HB3 H -9.200 -2.803 1.219 1.00 . A A . 8 ALA HB3 1 1 13 5328 1 1 8 ALA N N -8.882 -0.270 -0.054 1.00 . A A . 8 ALA N 1 1 13 5329 1 1 8 ALA O O -6.064 -2.059 1.236 1.00 . A A . 8 ALA O 1 1 13 5330 1 1 9 LEU C C -4.911 -1.813 -1.807 1.00 . A A . 9 LEU C 1 1 13 5331 1 1 9 LEU CA C -6.047 -2.752 -1.459 1.00 . A A . 9 LEU CA 1 1 13 5332 1 1 9 LEU CB C -6.614 -3.309 -2.749 1.00 . A A . 9 LEU CB 1 1 13 5333 1 1 9 LEU CD1 C -8.072 -5.019 -1.661 1.00 . A A . 9 LEU CD1 1 1 13 5334 1 1 9 LEU CD2 C -7.218 -5.392 -3.982 1.00 . A A . 9 LEU CD2 1 1 13 5335 1 1 9 LEU CG C -6.894 -4.804 -2.607 1.00 . A A . 9 LEU CG 1 1 13 5336 1 1 9 LEU H H -7.876 -1.715 -1.256 1.00 . A A . 9 LEU H 1 1 13 5337 1 1 9 LEU HA H -5.681 -3.548 -0.842 1.00 . A A . 9 LEU HA 1 1 13 5338 1 1 9 LEU HB2 H -7.527 -2.782 -2.983 1.00 . A A . 9 LEU HB2 1 1 13 5339 1 1 9 LEU HB3 H -5.898 -3.149 -3.536 1.00 . A A . 9 LEU HB3 1 1 13 5340 1 1 9 LEU HD11 H -8.462 -6.018 -1.793 1.00 . A A . 9 LEU HD11 1 1 13 5341 1 1 9 LEU HD12 H -8.846 -4.296 -1.873 1.00 . A A . 9 LEU HD12 1 1 13 5342 1 1 9 LEU HD13 H -7.737 -4.896 -0.642 1.00 . A A . 9 LEU HD13 1 1 13 5343 1 1 9 LEU HD21 H -7.960 -4.780 -4.475 1.00 . A A . 9 LEU HD21 1 1 13 5344 1 1 9 LEU HD22 H -7.596 -6.395 -3.863 1.00 . A A . 9 LEU HD22 1 1 13 5345 1 1 9 LEU HD23 H -6.320 -5.416 -4.578 1.00 . A A . 9 LEU HD23 1 1 13 5346 1 1 9 LEU HG H -6.023 -5.297 -2.206 1.00 . A A . 9 LEU HG 1 1 13 5347 1 1 9 LEU N N -7.085 -2.017 -0.761 1.00 . A A . 9 LEU N 1 1 13 5348 1 1 9 LEU O O -3.793 -1.940 -1.305 1.00 . A A . 9 LEU O 1 1 13 5349 1 1 10 HIS C C -3.532 0.617 -1.838 1.00 . A A . 10 HIS C 1 1 13 5350 1 1 10 HIS CA C -4.241 0.143 -3.079 1.00 . A A . 10 HIS CA 1 1 13 5351 1 1 10 HIS CB C -4.915 1.333 -3.750 1.00 . A A . 10 HIS CB 1 1 13 5352 1 1 10 HIS CD2 C -5.290 -0.146 -5.898 1.00 . A A . 10 HIS CD2 1 1 13 5353 1 1 10 HIS CE1 C -5.503 1.458 -7.338 1.00 . A A . 10 HIS CE1 1 1 13 5354 1 1 10 HIS CG C -5.158 1.035 -5.203 1.00 . A A . 10 HIS CG 1 1 13 5355 1 1 10 HIS H H -6.141 -0.805 -3.002 1.00 . A A . 10 HIS H 1 1 13 5356 1 1 10 HIS HA H -3.530 -0.306 -3.754 1.00 . A A . 10 HIS HA 1 1 13 5357 1 1 10 HIS HB2 H -5.853 1.540 -3.257 1.00 . A A . 10 HIS HB2 1 1 13 5358 1 1 10 HIS HB3 H -4.269 2.195 -3.662 1.00 . A A . 10 HIS HB3 1 1 13 5359 1 1 10 HIS HD1 H -5.238 3.010 -5.970 1.00 . A A . 10 HIS HD1 1 1 13 5360 1 1 10 HIS HD2 H -5.234 -1.135 -5.465 1.00 . A A . 10 HIS HD2 1 1 13 5361 1 1 10 HIS HE1 H -5.655 2.003 -8.260 1.00 . A A . 10 HIS HE1 1 1 13 5362 1 1 10 HIS HE2 H -5.627 -0.525 -7.976 1.00 . A A . 10 HIS HE2 1 1 13 5363 1 1 10 HIS N N -5.226 -0.851 -2.667 1.00 . A A . 10 HIS N 1 1 13 5364 1 1 10 HIS ND1 N -5.295 2.042 -6.143 1.00 . A A . 10 HIS ND1 1 1 13 5365 1 1 10 HIS NE2 N -5.508 0.125 -7.246 1.00 . A A . 10 HIS NE2 1 1 13 5366 1 1 10 HIS O O -2.323 0.845 -1.823 1.00 . A A . 10 HIS O 1 1 13 5367 1 1 11 HIS C C -2.516 0.430 0.794 1.00 . A A . 11 HIS C 1 1 13 5368 1 1 11 HIS CA C -3.843 1.104 0.516 1.00 . A A . 11 HIS CA 1 1 13 5369 1 1 11 HIS CB C -4.866 0.637 1.542 1.00 . A A . 11 HIS CB 1 1 13 5370 1 1 11 HIS CD2 C -6.588 2.608 1.656 1.00 . A A . 11 HIS CD2 1 1 13 5371 1 1 11 HIS CE1 C -6.055 3.383 3.610 1.00 . A A . 11 HIS CE1 1 1 13 5372 1 1 11 HIS CG C -5.568 1.823 2.131 1.00 . A A . 11 HIS CG 1 1 13 5373 1 1 11 HIS H H -5.273 0.482 -0.895 1.00 . A A . 11 HIS H 1 1 13 5374 1 1 11 HIS HA H -3.733 2.172 0.569 1.00 . A A . 11 HIS HA 1 1 13 5375 1 1 11 HIS HB2 H -5.586 -0.007 1.041 1.00 . A A . 11 HIS HB2 1 1 13 5376 1 1 11 HIS HB3 H -4.363 0.082 2.318 1.00 . A A . 11 HIS HB3 1 1 13 5377 1 1 11 HIS HD1 H -4.550 1.989 3.987 1.00 . A A . 11 HIS HD1 1 1 13 5378 1 1 11 HIS HD2 H -7.089 2.469 0.707 1.00 . A A . 11 HIS HD2 1 1 13 5379 1 1 11 HIS HE1 H -6.040 3.974 4.515 1.00 . A A . 11 HIS HE1 1 1 13 5380 1 1 11 HIS HE2 H -7.578 4.300 2.511 1.00 . A A . 11 HIS HE2 1 1 13 5381 1 1 11 HIS N N -4.325 0.714 -0.789 1.00 . A A . 11 HIS N 1 1 13 5382 1 1 11 HIS ND1 N -5.243 2.334 3.379 1.00 . A A . 11 HIS ND1 1 1 13 5383 1 1 11 HIS NE2 N -6.893 3.595 2.589 1.00 . A A . 11 HIS NE2 1 1 13 5384 1 1 11 HIS O O -1.588 1.036 1.334 1.00 . A A . 11 HIS O 1 1 13 5385 1 1 12 LEU C C -0.273 -1.319 -0.552 1.00 . A A . 12 LEU C 1 1 13 5386 1 1 12 LEU CA C -1.231 -1.613 0.581 1.00 . A A . 12 LEU CA 1 1 13 5387 1 1 12 LEU CB C -1.559 -3.110 0.602 1.00 . A A . 12 LEU CB 1 1 13 5388 1 1 12 LEU CD1 C -0.591 -3.647 2.846 1.00 . A A . 12 LEU CD1 1 1 13 5389 1 1 12 LEU CD2 C -2.835 -2.551 2.690 1.00 . A A . 12 LEU CD2 1 1 13 5390 1 1 12 LEU CG C -1.884 -3.557 2.030 1.00 . A A . 12 LEU CG 1 1 13 5391 1 1 12 LEU H H -3.224 -1.235 -0.044 1.00 . A A . 12 LEU H 1 1 13 5392 1 1 12 LEU HA H -0.768 -1.334 1.512 1.00 . A A . 12 LEU HA 1 1 13 5393 1 1 12 LEU HB2 H -2.409 -3.304 -0.037 1.00 . A A . 12 LEU HB2 1 1 13 5394 1 1 12 LEU HB3 H -0.710 -3.666 0.238 1.00 . A A . 12 LEU HB3 1 1 13 5395 1 1 12 LEU HD11 H 0.202 -3.124 2.331 1.00 . A A . 12 LEU HD11 1 1 13 5396 1 1 12 LEU HD12 H -0.319 -4.684 2.964 1.00 . A A . 12 LEU HD12 1 1 13 5397 1 1 12 LEU HD13 H -0.746 -3.204 3.817 1.00 . A A . 12 LEU HD13 1 1 13 5398 1 1 12 LEU HD21 H -3.619 -2.287 1.996 1.00 . A A . 12 LEU HD21 1 1 13 5399 1 1 12 LEU HD22 H -2.284 -1.664 2.972 1.00 . A A . 12 LEU HD22 1 1 13 5400 1 1 12 LEU HD23 H -3.270 -2.996 3.570 1.00 . A A . 12 LEU HD23 1 1 13 5401 1 1 12 LEU HG H -2.352 -4.530 2.000 1.00 . A A . 12 LEU HG 1 1 13 5402 1 1 12 LEU N N -2.442 -0.829 0.399 1.00 . A A . 12 LEU N 1 1 13 5403 1 1 12 LEU O O 0.919 -1.093 -0.337 1.00 . A A . 12 LEU O 1 1 13 5404 1 1 13 ALA C C 0.706 0.318 -2.703 1.00 . A A . 13 ALA C 1 1 13 5405 1 1 13 ALA CA C -0.018 -0.994 -2.939 1.00 . A A . 13 ALA CA 1 1 13 5406 1 1 13 ALA CB C -0.909 -0.880 -4.180 1.00 . A A . 13 ALA CB 1 1 13 5407 1 1 13 ALA H H -1.782 -1.458 -1.838 1.00 . A A . 13 ALA H 1 1 13 5408 1 1 13 ALA HA H 0.704 -1.779 -3.086 1.00 . A A . 13 ALA HA 1 1 13 5409 1 1 13 ALA HB1 H -1.684 -1.630 -4.140 1.00 . A A . 13 ALA HB1 1 1 13 5410 1 1 13 ALA HB2 H -0.309 -1.031 -5.067 1.00 . A A . 13 ALA HB2 1 1 13 5411 1 1 13 ALA HB3 H -1.361 0.101 -4.211 1.00 . A A . 13 ALA HB3 1 1 13 5412 1 1 13 ALA N N -0.818 -1.294 -1.755 1.00 . A A . 13 ALA N 1 1 13 5413 1 1 13 ALA O O 1.809 0.547 -3.197 1.00 . A A . 13 ALA O 1 1 13 5414 1 1 14 HIS C C 1.718 2.272 -0.567 1.00 . A A . 14 HIS C 1 1 13 5415 1 1 14 HIS CA C 0.592 2.457 -1.555 1.00 . A A . 14 HIS CA 1 1 13 5416 1 1 14 HIS CB C -0.521 3.306 -0.952 1.00 . A A . 14 HIS CB 1 1 13 5417 1 1 14 HIS CD2 C -0.414 4.284 1.476 1.00 . A A . 14 HIS CD2 1 1 13 5418 1 1 14 HIS CE1 C 1.256 5.642 1.208 1.00 . A A . 14 HIS CE1 1 1 13 5419 1 1 14 HIS CG C -0.005 4.161 0.174 1.00 . A A . 14 HIS CG 1 1 13 5420 1 1 14 HIS H H -0.819 0.890 -1.559 1.00 . A A . 14 HIS H 1 1 13 5421 1 1 14 HIS HA H 0.972 2.944 -2.434 1.00 . A A . 14 HIS HA 1 1 13 5422 1 1 14 HIS HB2 H -0.919 3.929 -1.716 1.00 . A A . 14 HIS HB2 1 1 13 5423 1 1 14 HIS HB3 H -1.302 2.656 -0.579 1.00 . A A . 14 HIS HB3 1 1 13 5424 1 1 14 HIS HD1 H 1.577 5.177 -0.799 1.00 . A A . 14 HIS HD1 1 1 13 5425 1 1 14 HIS HD2 H -1.218 3.719 1.933 1.00 . A A . 14 HIS HD2 1 1 13 5426 1 1 14 HIS HE1 H 2.025 6.377 1.391 1.00 . A A . 14 HIS HE1 1 1 13 5427 1 1 14 HIS HE2 H 0.312 5.510 3.068 1.00 . A A . 14 HIS HE2 1 1 13 5428 1 1 14 HIS N N 0.056 1.160 -1.917 1.00 . A A . 14 HIS N 1 1 13 5429 1 1 14 HIS ND1 N 1.060 5.033 0.021 1.00 . A A . 14 HIS ND1 1 1 13 5430 1 1 14 HIS NE2 N 0.382 5.221 2.130 1.00 . A A . 14 HIS NE2 1 1 13 5431 1 1 14 HIS O O 2.822 2.784 -0.751 1.00 . A A . 14 HIS O 1 1 13 5432 1 1 15 LEU C C 3.614 0.594 0.666 1.00 . A A . 15 LEU C 1 1 13 5433 1 1 15 LEU CA C 2.483 1.206 1.429 1.00 . A A . 15 LEU CA 1 1 13 5434 1 1 15 LEU CB C 1.993 0.184 2.453 1.00 . A A . 15 LEU CB 1 1 13 5435 1 1 15 LEU CD1 C 0.718 2.244 3.184 1.00 . A A . 15 LEU CD1 1 1 13 5436 1 1 15 LEU CD2 C 0.008 -0.013 3.929 1.00 . A A . 15 LEU CD2 1 1 13 5437 1 1 15 LEU CG C 1.215 0.855 3.592 1.00 . A A . 15 LEU CG 1 1 13 5438 1 1 15 LEU H H 0.571 1.080 0.536 1.00 . A A . 15 LEU H 1 1 13 5439 1 1 15 LEU HA H 2.814 2.112 1.909 1.00 . A A . 15 LEU HA 1 1 13 5440 1 1 15 LEU HB2 H 1.352 -0.529 1.953 1.00 . A A . 15 LEU HB2 1 1 13 5441 1 1 15 LEU HB3 H 2.846 -0.337 2.862 1.00 . A A . 15 LEU HB3 1 1 13 5442 1 1 15 LEU HD11 H 1.542 2.939 3.162 1.00 . A A . 15 LEU HD11 1 1 13 5443 1 1 15 LEU HD12 H -0.016 2.585 3.900 1.00 . A A . 15 LEU HD12 1 1 13 5444 1 1 15 LEU HD13 H 0.264 2.187 2.211 1.00 . A A . 15 LEU HD13 1 1 13 5445 1 1 15 LEU HD21 H 0.343 -0.949 4.349 1.00 . A A . 15 LEU HD21 1 1 13 5446 1 1 15 LEU HD22 H -0.555 -0.204 3.028 1.00 . A A . 15 LEU HD22 1 1 13 5447 1 1 15 LEU HD23 H -0.617 0.502 4.637 1.00 . A A . 15 LEU HD23 1 1 13 5448 1 1 15 LEU HG H 1.851 0.935 4.455 1.00 . A A . 15 LEU HG 1 1 13 5449 1 1 15 LEU N N 1.454 1.494 0.460 1.00 . A A . 15 LEU N 1 1 13 5450 1 1 15 LEU O O 4.792 0.796 0.953 1.00 . A A . 15 LEU O 1 1 13 5451 1 1 16 ALA C C 4.893 0.189 -2.038 1.00 . A A . 16 ALA C 1 1 13 5452 1 1 16 ALA CA C 4.147 -0.832 -1.202 1.00 . A A . 16 ALA CA 1 1 13 5453 1 1 16 ALA CB C 3.417 -1.817 -2.122 1.00 . A A . 16 ALA CB 1 1 13 5454 1 1 16 ALA H H 2.225 -0.239 -0.481 1.00 . A A . 16 ALA H 1 1 13 5455 1 1 16 ALA HA H 4.852 -1.370 -0.597 1.00 . A A . 16 ALA HA 1 1 13 5456 1 1 16 ALA HB1 H 2.395 -1.931 -1.795 1.00 . A A . 16 ALA HB1 1 1 13 5457 1 1 16 ALA HB2 H 3.915 -2.776 -2.087 1.00 . A A . 16 ALA HB2 1 1 13 5458 1 1 16 ALA HB3 H 3.431 -1.442 -3.134 1.00 . A A . 16 ALA HB3 1 1 13 5459 1 1 16 ALA N N 3.206 -0.155 -0.329 1.00 . A A . 16 ALA N 1 1 13 5460 1 1 16 ALA O O 6.058 0.000 -2.376 1.00 . A A . 16 ALA O 1 1 13 5461 1 1 17 LEU C C 6.063 2.864 -2.503 1.00 . A A . 17 LEU C 1 1 13 5462 1 1 17 LEU CA C 4.814 2.327 -3.178 1.00 . A A . 17 LEU CA 1 1 13 5463 1 1 17 LEU CB C 3.782 3.449 -3.442 1.00 . A A . 17 LEU CB 1 1 13 5464 1 1 17 LEU CD1 C 3.911 5.767 -4.404 1.00 . A A . 17 LEU CD1 1 1 13 5465 1 1 17 LEU CD2 C 3.989 5.455 -1.924 1.00 . A A . 17 LEU CD2 1 1 13 5466 1 1 17 LEU CG C 4.403 4.852 -3.276 1.00 . A A . 17 LEU CG 1 1 13 5467 1 1 17 LEU H H 3.287 1.362 -2.074 1.00 . A A . 17 LEU H 1 1 13 5468 1 1 17 LEU HA H 5.110 1.902 -4.116 1.00 . A A . 17 LEU HA 1 1 13 5469 1 1 17 LEU HB2 H 3.410 3.347 -4.449 1.00 . A A . 17 LEU HB2 1 1 13 5470 1 1 17 LEU HB3 H 2.961 3.341 -2.755 1.00 . A A . 17 LEU HB3 1 1 13 5471 1 1 17 LEU HD11 H 4.370 6.739 -4.306 1.00 . A A . 17 LEU HD11 1 1 13 5472 1 1 17 LEU HD12 H 2.838 5.872 -4.342 1.00 . A A . 17 LEU HD12 1 1 13 5473 1 1 17 LEU HD13 H 4.176 5.337 -5.361 1.00 . A A . 17 LEU HD13 1 1 13 5474 1 1 17 LEU HD21 H 2.967 5.802 -1.977 1.00 . A A . 17 LEU HD21 1 1 13 5475 1 1 17 LEU HD22 H 4.637 6.290 -1.694 1.00 . A A . 17 LEU HD22 1 1 13 5476 1 1 17 LEU HD23 H 4.078 4.710 -1.152 1.00 . A A . 17 LEU HD23 1 1 13 5477 1 1 17 LEU HG H 5.477 4.782 -3.321 1.00 . A A . 17 LEU HG 1 1 13 5478 1 1 17 LEU N N 4.213 1.272 -2.372 1.00 . A A . 17 LEU N 1 1 13 5479 1 1 17 LEU O O 7.123 2.965 -3.128 1.00 . A A . 17 LEU O 1 1 13 5480 1 1 18 HIS C C 8.055 2.546 -0.250 1.00 . A A . 18 HIS C 1 1 13 5481 1 1 18 HIS CA C 7.140 3.697 -0.541 1.00 . A A . 18 HIS CA 1 1 13 5482 1 1 18 HIS CB C 6.771 4.454 0.721 1.00 . A A . 18 HIS CB 1 1 13 5483 1 1 18 HIS CD2 C 4.840 3.243 1.983 1.00 . A A . 18 HIS CD2 1 1 13 5484 1 1 18 HIS CE1 C 6.019 2.268 3.519 1.00 . A A . 18 HIS CE1 1 1 13 5485 1 1 18 HIS CG C 6.147 3.565 1.748 1.00 . A A . 18 HIS CG 1 1 13 5486 1 1 18 HIS H H 5.099 3.084 -0.759 1.00 . A A . 18 HIS H 1 1 13 5487 1 1 18 HIS HA H 7.655 4.370 -1.205 1.00 . A A . 18 HIS HA 1 1 13 5488 1 1 18 HIS HB2 H 7.652 4.911 1.132 1.00 . A A . 18 HIS HB2 1 1 13 5489 1 1 18 HIS HB3 H 6.070 5.207 0.451 1.00 . A A . 18 HIS HB3 1 1 13 5490 1 1 18 HIS HD1 H 7.859 2.973 2.849 1.00 . A A . 18 HIS HD1 1 1 13 5491 1 1 18 HIS HD2 H 4.004 3.564 1.372 1.00 . A A . 18 HIS HD2 1 1 13 5492 1 1 18 HIS HE1 H 6.312 1.671 4.369 1.00 . A A . 18 HIS HE1 1 1 13 5493 1 1 18 HIS HE2 H 3.946 2.049 3.519 1.00 . A A . 18 HIS HE2 1 1 13 5494 1 1 18 HIS N N 5.961 3.194 -1.233 1.00 . A A . 18 HIS N 1 1 13 5495 1 1 18 HIS ND1 N 6.883 2.935 2.733 1.00 . A A . 18 HIS ND1 1 1 13 5496 1 1 18 HIS NE2 N 4.757 2.424 3.108 1.00 . A A . 18 HIS NE2 1 1 13 5497 1 1 18 HIS O O 9.255 2.607 -0.504 1.00 . A A . 18 HIS O 1 1 13 5498 1 1 19 LEU C C 9.052 -0.033 -0.746 1.00 . A A . 19 LEU C 1 1 13 5499 1 1 19 LEU CA C 8.234 0.265 0.492 1.00 . A A . 19 LEU CA 1 1 13 5500 1 1 19 LEU CB C 7.308 -0.924 0.751 1.00 . A A . 19 LEU CB 1 1 13 5501 1 1 19 LEU CD1 C 8.987 -1.664 2.453 1.00 . A A . 19 LEU CD1 1 1 13 5502 1 1 19 LEU CD2 C 6.950 -0.413 3.163 1.00 . A A . 19 LEU CD2 1 1 13 5503 1 1 19 LEU CG C 7.500 -1.438 2.171 1.00 . A A . 19 LEU CG 1 1 13 5504 1 1 19 LEU H H 6.493 1.494 0.377 1.00 . A A . 19 LEU H 1 1 13 5505 1 1 19 LEU HA H 8.887 0.419 1.333 1.00 . A A . 19 LEU HA 1 1 13 5506 1 1 19 LEU HB2 H 6.285 -0.619 0.617 1.00 . A A . 19 LEU HB2 1 1 13 5507 1 1 19 LEU HB3 H 7.535 -1.718 0.052 1.00 . A A . 19 LEU HB3 1 1 13 5508 1 1 19 LEU HD11 H 9.522 -1.739 1.520 1.00 . A A . 19 LEU HD11 1 1 13 5509 1 1 19 LEU HD12 H 9.112 -2.576 3.015 1.00 . A A . 19 LEU HD12 1 1 13 5510 1 1 19 LEU HD13 H 9.376 -0.831 3.022 1.00 . A A . 19 LEU HD13 1 1 13 5511 1 1 19 LEU HD21 H 5.926 -0.179 2.912 1.00 . A A . 19 LEU HD21 1 1 13 5512 1 1 19 LEU HD22 H 7.550 0.485 3.118 1.00 . A A . 19 LEU HD22 1 1 13 5513 1 1 19 LEU HD23 H 6.988 -0.817 4.162 1.00 . A A . 19 LEU HD23 1 1 13 5514 1 1 19 LEU HG H 6.969 -2.367 2.274 1.00 . A A . 19 LEU HG 1 1 13 5515 1 1 19 LEU N N 7.468 1.474 0.232 1.00 . A A . 19 LEU N 1 1 13 5516 1 1 19 LEU O O 10.164 -0.557 -0.681 1.00 . A A . 19 LEU O 1 1 13 5517 1 1 20 ALA C C 10.232 1.122 -3.317 1.00 . A A . 20 ALA C 1 1 13 5518 1 1 20 ALA CA C 9.111 0.122 -3.160 1.00 . A A . 20 ALA CA 1 1 13 5519 1 1 20 ALA CB C 8.109 0.293 -4.303 1.00 . A A . 20 ALA CB 1 1 13 5520 1 1 20 ALA H H 7.570 0.749 -1.821 1.00 . A A . 20 ALA H 1 1 13 5521 1 1 20 ALA HA H 9.520 -0.868 -3.195 1.00 . A A . 20 ALA HA 1 1 13 5522 1 1 20 ALA HB1 H 7.601 -0.641 -4.480 1.00 . A A . 20 ALA HB1 1 1 13 5523 1 1 20 ALA HB2 H 8.635 0.595 -5.198 1.00 . A A . 20 ALA HB2 1 1 13 5524 1 1 20 ALA HB3 H 7.387 1.047 -4.039 1.00 . A A . 20 ALA HB3 1 1 13 5525 1 1 20 ALA N N 8.465 0.326 -1.871 1.00 . A A . 20 ALA N 1 1 13 5526 1 1 20 ALA O O 11.402 0.757 -3.442 1.00 . A A . 20 ALA O 1 1 13 5527 1 1 21 LEU C C 11.984 3.182 -2.434 1.00 . A A . 21 LEU C 1 1 13 5528 1 1 21 LEU CA C 10.856 3.444 -3.414 1.00 . A A . 21 LEU CA 1 1 13 5529 1 1 21 LEU CB C 10.208 4.793 -3.113 1.00 . A A . 21 LEU CB 1 1 13 5530 1 1 21 LEU CD1 C 11.230 6.054 -5.026 1.00 . A A . 21 LEU CD1 1 1 13 5531 1 1 21 LEU CD2 C 9.216 4.610 -5.418 1.00 . A A . 21 LEU CD2 1 1 13 5532 1 1 21 LEU CG C 9.918 5.543 -4.420 1.00 . A A . 21 LEU CG 1 1 13 5533 1 1 21 LEU H H 8.921 2.606 -3.175 1.00 . A A . 21 LEU H 1 1 13 5534 1 1 21 LEU HA H 11.252 3.449 -4.412 1.00 . A A . 21 LEU HA 1 1 13 5535 1 1 21 LEU HB2 H 9.286 4.632 -2.578 1.00 . A A . 21 LEU HB2 1 1 13 5536 1 1 21 LEU HB3 H 10.875 5.385 -2.503 1.00 . A A . 21 LEU HB3 1 1 13 5537 1 1 21 LEU HD11 H 11.321 7.112 -4.837 1.00 . A A . 21 LEU HD11 1 1 13 5538 1 1 21 LEU HD12 H 11.228 5.878 -6.092 1.00 . A A . 21 LEU HD12 1 1 13 5539 1 1 21 LEU HD13 H 12.064 5.535 -4.578 1.00 . A A . 21 LEU HD13 1 1 13 5540 1 1 21 LEU HD21 H 8.543 5.187 -6.037 1.00 . A A . 21 LEU HD21 1 1 13 5541 1 1 21 LEU HD22 H 8.653 3.861 -4.882 1.00 . A A . 21 LEU HD22 1 1 13 5542 1 1 21 LEU HD23 H 9.952 4.127 -6.045 1.00 . A A . 21 LEU HD23 1 1 13 5543 1 1 21 LEU HG H 9.277 6.386 -4.206 1.00 . A A . 21 LEU HG 1 1 13 5544 1 1 21 LEU N N 9.870 2.385 -3.294 1.00 . A A . 21 LEU N 1 1 13 5545 1 1 21 LEU O O 13.161 3.310 -2.765 1.00 . A A . 21 LEU O 1 1 13 5546 1 1 22 ALA C C 13.513 1.409 -0.638 1.00 . A A . 22 ALA C 1 1 13 5547 1 1 22 ALA CA C 12.544 2.480 -0.173 1.00 . A A . 22 ALA CA 1 1 13 5548 1 1 22 ALA CB C 11.804 1.993 1.074 1.00 . A A . 22 ALA CB 1 1 13 5549 1 1 22 ALA H H 10.632 2.703 -1.057 1.00 . A A . 22 ALA H 1 1 13 5550 1 1 22 ALA HA H 13.095 3.365 0.074 1.00 . A A . 22 ALA HA 1 1 13 5551 1 1 22 ALA HB1 H 12.487 1.976 1.912 1.00 . A A . 22 ALA HB1 1 1 13 5552 1 1 22 ALA HB2 H 11.421 0.998 0.900 1.00 . A A . 22 ALA HB2 1 1 13 5553 1 1 22 ALA HB3 H 10.984 2.661 1.291 1.00 . A A . 22 ALA HB3 1 1 13 5554 1 1 22 ALA N N 11.593 2.792 -1.231 1.00 . A A . 22 ALA N 1 1 13 5555 1 1 22 ALA O O 14.711 1.478 -0.372 1.00 . A A . 22 ALA O 1 1 13 5556 1 1 23 LEU C C 14.909 -0.120 -2.741 1.00 . A A . 23 LEU C 1 1 13 5557 1 1 23 LEU CA C 13.797 -0.671 -1.862 1.00 . A A . 23 LEU CA 1 1 13 5558 1 1 23 LEU CB C 12.919 -1.612 -2.693 1.00 . A A . 23 LEU CB 1 1 13 5559 1 1 23 LEU CD1 C 12.201 -3.989 -3.018 1.00 . A A . 23 LEU CD1 1 1 13 5560 1 1 23 LEU CD2 C 14.631 -3.435 -2.770 1.00 . A A . 23 LEU CD2 1 1 13 5561 1 1 23 LEU CG C 13.212 -3.069 -2.321 1.00 . A A . 23 LEU CG 1 1 13 5562 1 1 23 LEU H H 12.016 0.439 -1.522 1.00 . A A . 23 LEU H 1 1 13 5563 1 1 23 LEU HA H 14.227 -1.214 -1.042 1.00 . A A . 23 LEU HA 1 1 13 5564 1 1 23 LEU HB2 H 11.879 -1.392 -2.498 1.00 . A A . 23 LEU HB2 1 1 13 5565 1 1 23 LEU HB3 H 13.127 -1.460 -3.743 1.00 . A A . 23 LEU HB3 1 1 13 5566 1 1 23 LEU HD11 H 11.515 -3.394 -3.606 1.00 . A A . 23 LEU HD11 1 1 13 5567 1 1 23 LEU HD12 H 11.646 -4.543 -2.275 1.00 . A A . 23 LEU HD12 1 1 13 5568 1 1 23 LEU HD13 H 12.723 -4.679 -3.664 1.00 . A A . 23 LEU HD13 1 1 13 5569 1 1 23 LEU HD21 H 14.714 -3.313 -3.838 1.00 . A A . 23 LEU HD21 1 1 13 5570 1 1 23 LEU HD22 H 14.837 -4.462 -2.511 1.00 . A A . 23 LEU HD22 1 1 13 5571 1 1 23 LEU HD23 H 15.343 -2.791 -2.276 1.00 . A A . 23 LEU HD23 1 1 13 5572 1 1 23 LEU HG H 13.129 -3.190 -1.249 1.00 . A A . 23 LEU HG 1 1 13 5573 1 1 23 LEU N N 12.981 0.425 -1.341 1.00 . A A . 23 LEU N 1 1 13 5574 1 1 23 LEU O O 16.050 -0.588 -2.710 1.00 . A A . 23 LEU O 1 1 13 5575 1 1 24 LYS C C 16.285 2.595 -3.754 1.00 . A A . 24 LYS C 1 1 13 5576 1 1 24 LYS CA C 15.489 1.496 -4.452 1.00 . A A . 24 LYS CA 1 1 13 5577 1 1 24 LYS CB C 14.745 2.092 -5.653 1.00 . A A . 24 LYS CB 1 1 13 5578 1 1 24 LYS CD C 13.137 1.432 -7.467 1.00 . A A . 24 LYS CD 1 1 13 5579 1 1 24 LYS CE C 13.027 2.933 -7.764 1.00 . A A . 24 LYS CE 1 1 13 5580 1 1 24 LYS CG C 13.529 1.221 -6.000 1.00 . A A . 24 LYS CG 1 1 13 5581 1 1 24 LYS H H 13.615 1.168 -3.512 1.00 . A A . 24 LYS H 1 1 13 5582 1 1 24 LYS HA H 16.176 0.751 -4.806 1.00 . A A . 24 LYS HA 1 1 13 5583 1 1 24 LYS HB2 H 14.417 3.093 -5.408 1.00 . A A . 24 LYS HB2 1 1 13 5584 1 1 24 LYS HB3 H 15.413 2.134 -6.503 1.00 . A A . 24 LYS HB3 1 1 13 5585 1 1 24 LYS HD2 H 13.894 0.992 -8.108 1.00 . A A . 24 LYS HD2 1 1 13 5586 1 1 24 LYS HD3 H 12.186 0.958 -7.657 1.00 . A A . 24 LYS HD3 1 1 13 5587 1 1 24 LYS HE2 H 12.520 3.428 -6.946 1.00 . A A . 24 LYS HE2 1 1 13 5588 1 1 24 LYS HE3 H 14.018 3.350 -7.868 1.00 . A A . 24 LYS HE3 1 1 13 5589 1 1 24 LYS HG2 H 13.773 0.181 -5.841 1.00 . A A . 24 LYS HG2 1 1 13 5590 1 1 24 LYS HG3 H 12.697 1.496 -5.368 1.00 . A A . 24 LYS HG3 1 1 13 5591 1 1 24 LYS HZ1 H 12.087 4.164 -9.154 1.00 . A A . 24 LYS HZ1 1 1 13 5592 1 1 24 LYS HZ2 H 11.356 2.647 -8.979 1.00 . A A . 24 LYS HZ2 1 1 13 5593 1 1 24 LYS HZ3 H 12.819 2.790 -9.831 1.00 . A A . 24 LYS HZ3 1 1 13 5594 1 1 24 LYS N N 14.545 0.866 -3.535 1.00 . A A . 24 LYS N 1 1 13 5595 1 1 24 LYS NZ N 12.264 3.149 -9.024 1.00 . A A . 24 LYS NZ 1 1 13 5596 1 1 24 LYS O O 17.491 2.721 -3.958 1.00 . A A . 24 LYS O 1 1 13 5597 1 1 25 LYS C C 15.927 4.487 -0.761 1.00 . A A . 25 LYS C 1 1 13 5598 1 1 25 LYS CA C 16.263 4.495 -2.248 1.00 . A A . 25 LYS CA 1 1 13 5599 1 1 25 LYS CB C 15.836 5.830 -2.860 1.00 . A A . 25 LYS CB 1 1 13 5600 1 1 25 LYS CD C 17.918 6.868 -3.803 1.00 . A A . 25 LYS CD 1 1 13 5601 1 1 25 LYS CE C 17.554 8.301 -3.392 1.00 . A A . 25 LYS CE 1 1 13 5602 1 1 25 LYS CG C 16.639 6.086 -4.141 1.00 . A A . 25 LYS CG 1 1 13 5603 1 1 25 LYS H H 14.639 3.253 -2.839 1.00 . A A . 25 LYS H 1 1 13 5604 1 1 25 LYS HA H 17.330 4.389 -2.363 1.00 . A A . 25 LYS HA 1 1 13 5605 1 1 25 LYS HB2 H 14.782 5.796 -3.094 1.00 . A A . 25 LYS HB2 1 1 13 5606 1 1 25 LYS HB3 H 16.020 6.622 -2.153 1.00 . A A . 25 LYS HB3 1 1 13 5607 1 1 25 LYS HD2 H 18.435 6.376 -2.986 1.00 . A A . 25 LYS HD2 1 1 13 5608 1 1 25 LYS HD3 H 18.563 6.895 -4.666 1.00 . A A . 25 LYS HD3 1 1 13 5609 1 1 25 LYS HE2 H 17.211 8.304 -2.369 1.00 . A A . 25 LYS HE2 1 1 13 5610 1 1 25 LYS HE3 H 18.428 8.933 -3.475 1.00 . A A . 25 LYS HE3 1 1 13 5611 1 1 25 LYS HG2 H 16.903 5.142 -4.597 1.00 . A A . 25 LYS HG2 1 1 13 5612 1 1 25 LYS HG3 H 16.039 6.659 -4.831 1.00 . A A . 25 LYS HG3 1 1 13 5613 1 1 25 LYS HZ1 H 16.605 9.839 -4.427 1.00 . A A . 25 LYS HZ1 1 1 13 5614 1 1 25 LYS HZ2 H 15.546 8.658 -3.832 1.00 . A A . 25 LYS HZ2 1 1 13 5615 1 1 25 LYS HZ3 H 16.504 8.332 -5.197 1.00 . A A . 25 LYS HZ3 1 1 13 5616 1 1 25 LYS N N 15.603 3.395 -2.952 1.00 . A A . 25 LYS N 1 1 13 5617 1 1 25 LYS NZ N 16.473 8.821 -4.279 1.00 . A A . 25 LYS NZ 1 1 13 5618 1 1 25 LYS O O 14.760 4.594 -0.375 1.00 . A A . 25 LYS O 1 1 13 5619 1 1 26 ALA C C 17.935 5.078 2.198 1.00 . A A . 26 ALA C 1 1 13 5620 1 1 26 ALA CA C 16.772 4.370 1.516 1.00 . A A . 26 ALA CA 1 1 13 5621 1 1 26 ALA CB C 16.685 2.930 2.028 1.00 . A A . 26 ALA CB 1 1 13 5622 1 1 26 ALA H H 17.867 4.313 -0.292 1.00 . A A . 26 ALA H 1 1 13 5623 1 1 26 ALA HA H 15.852 4.881 1.759 1.00 . A A . 26 ALA HA 1 1 13 5624 1 1 26 ALA HB1 H 17.672 2.492 2.036 1.00 . A A . 26 ALA HB1 1 1 13 5625 1 1 26 ALA HB2 H 16.042 2.354 1.379 1.00 . A A . 26 ALA HB2 1 1 13 5626 1 1 26 ALA HB3 H 16.279 2.926 3.030 1.00 . A A . 26 ALA HB3 1 1 13 5627 1 1 26 ALA N N 16.959 4.378 0.072 1.00 . A A . 26 ALA N 1 1 13 5628 1 1 26 ALA O O 17.685 5.971 2.984 1.00 . A A . 26 ALA O 1 1 13 5629 1 1 26 ALA OXT O 19.062 4.712 1.933 1.00 . A A . 26 ALA OXT 1 1 14 5630 1 1 1 LYS C C -15.500 7.821 -2.918 1.00 . A A . 1 LYS C 1 1 14 5631 1 1 1 LYS CA C -16.019 8.090 -1.515 1.00 . A A . 1 LYS CA 1 1 14 5632 1 1 1 LYS CB C -14.964 8.872 -0.722 1.00 . A A . 1 LYS CB 1 1 14 5633 1 1 1 LYS CD C -16.376 10.643 0.362 1.00 . A A . 1 LYS CD 1 1 14 5634 1 1 1 LYS CE C -15.808 11.797 1.190 1.00 . A A . 1 LYS CE 1 1 14 5635 1 1 1 LYS CG C -15.554 9.373 0.604 1.00 . A A . 1 LYS CG 1 1 14 5636 1 1 1 LYS H1 H -15.595 6.085 -1.162 1.00 . A A . 1 LYS H1 1 1 14 5637 1 1 1 LYS H2 H -17.248 6.465 -1.124 1.00 . A A . 1 LYS H2 1 1 14 5638 1 1 1 LYS H3 H -16.250 6.896 0.174 1.00 . A A . 1 LYS H3 1 1 14 5639 1 1 1 LYS HA H -16.932 8.664 -1.569 1.00 . A A . 1 LYS HA 1 1 14 5640 1 1 1 LYS HB2 H -14.117 8.229 -0.520 1.00 . A A . 1 LYS HB2 1 1 14 5641 1 1 1 LYS HB3 H -14.637 9.717 -1.310 1.00 . A A . 1 LYS HB3 1 1 14 5642 1 1 1 LYS HD2 H -16.348 10.905 -0.686 1.00 . A A . 1 LYS HD2 1 1 14 5643 1 1 1 LYS HD3 H -17.401 10.467 0.656 1.00 . A A . 1 LYS HD3 1 1 14 5644 1 1 1 LYS HE2 H -16.381 12.694 0.997 1.00 . A A . 1 LYS HE2 1 1 14 5645 1 1 1 LYS HE3 H -15.872 11.548 2.238 1.00 . A A . 1 LYS HE3 1 1 14 5646 1 1 1 LYS HG2 H -16.188 8.610 1.028 1.00 . A A . 1 LYS HG2 1 1 14 5647 1 1 1 LYS HG3 H -14.752 9.592 1.293 1.00 . A A . 1 LYS HG3 1 1 14 5648 1 1 1 LYS HZ1 H -13.786 11.285 1.227 1.00 . A A . 1 LYS HZ1 1 1 14 5649 1 1 1 LYS HZ2 H -14.083 12.955 1.198 1.00 . A A . 1 LYS HZ2 1 1 14 5650 1 1 1 LYS HZ3 H -14.282 12.041 -0.215 1.00 . A A . 1 LYS HZ3 1 1 14 5651 1 1 1 LYS N N -16.299 6.788 -0.855 1.00 . A A . 1 LYS N 1 1 14 5652 1 1 1 LYS NZ N -14.384 12.035 0.820 1.00 . A A . 1 LYS NZ 1 1 14 5653 1 1 1 LYS O O -14.669 6.938 -3.110 1.00 . A A . 1 LYS O 1 1 14 5654 1 1 2 LYS C C -15.839 7.018 -5.784 1.00 . A A . 2 LYS C 1 1 14 5655 1 1 2 LYS CA C -15.562 8.433 -5.276 1.00 . A A . 2 LYS CA 1 1 14 5656 1 1 2 LYS CB C -14.068 8.748 -5.411 1.00 . A A . 2 LYS CB 1 1 14 5657 1 1 2 LYS CD C -14.324 11.141 -6.081 1.00 . A A . 2 LYS CD 1 1 14 5658 1 1 2 LYS CE C -14.531 12.062 -7.291 1.00 . A A . 2 LYS CE 1 1 14 5659 1 1 2 LYS CG C -13.858 9.760 -6.544 1.00 . A A . 2 LYS CG 1 1 14 5660 1 1 2 LYS H H -16.654 9.281 -3.662 1.00 . A A . 2 LYS H 1 1 14 5661 1 1 2 LYS HA H -16.117 9.133 -5.884 1.00 . A A . 2 LYS HA 1 1 14 5662 1 1 2 LYS HB2 H -13.703 9.166 -4.485 1.00 . A A . 2 LYS HB2 1 1 14 5663 1 1 2 LYS HB3 H -13.527 7.841 -5.635 1.00 . A A . 2 LYS HB3 1 1 14 5664 1 1 2 LYS HD2 H -15.257 11.045 -5.542 1.00 . A A . 2 LYS HD2 1 1 14 5665 1 1 2 LYS HD3 H -13.577 11.569 -5.428 1.00 . A A . 2 LYS HD3 1 1 14 5666 1 1 2 LYS HE2 H -15.548 11.968 -7.646 1.00 . A A . 2 LYS HE2 1 1 14 5667 1 1 2 LYS HE3 H -14.348 13.084 -6.998 1.00 . A A . 2 LYS HE3 1 1 14 5668 1 1 2 LYS HG2 H -12.807 9.800 -6.802 1.00 . A A . 2 LYS HG2 1 1 14 5669 1 1 2 LYS HG3 H -14.427 9.461 -7.410 1.00 . A A . 2 LYS HG3 1 1 14 5670 1 1 2 LYS HZ1 H -12.639 11.535 -7.987 1.00 . A A . 2 LYS HZ1 1 1 14 5671 1 1 2 LYS HZ2 H -13.555 12.432 -9.094 1.00 . A A . 2 LYS HZ2 1 1 14 5672 1 1 2 LYS HZ3 H -13.913 10.793 -8.828 1.00 . A A . 2 LYS HZ3 1 1 14 5673 1 1 2 LYS N N -15.988 8.589 -3.887 1.00 . A A . 2 LYS N 1 1 14 5674 1 1 2 LYS NZ N -13.589 11.677 -8.381 1.00 . A A . 2 LYS NZ 1 1 14 5675 1 1 2 LYS O O -16.325 6.159 -5.044 1.00 . A A . 2 LYS O 1 1 14 5676 1 1 3 ALA C C -14.777 4.436 -7.126 1.00 . A A . 3 ALA C 1 1 14 5677 1 1 3 ALA CA C -15.748 5.482 -7.671 1.00 . A A . 3 ALA CA 1 1 14 5678 1 1 3 ALA CB C -15.583 5.593 -9.189 1.00 . A A . 3 ALA CB 1 1 14 5679 1 1 3 ALA H H -15.145 7.514 -7.592 1.00 . A A . 3 ALA H 1 1 14 5680 1 1 3 ALA HA H -16.756 5.160 -7.458 1.00 . A A . 3 ALA HA 1 1 14 5681 1 1 3 ALA HB1 H -15.547 4.603 -9.621 1.00 . A A . 3 ALA HB1 1 1 14 5682 1 1 3 ALA HB2 H -14.667 6.114 -9.414 1.00 . A A . 3 ALA HB2 1 1 14 5683 1 1 3 ALA HB3 H -16.419 6.136 -9.603 1.00 . A A . 3 ALA HB3 1 1 14 5684 1 1 3 ALA N N -15.528 6.787 -7.055 1.00 . A A . 3 ALA N 1 1 14 5685 1 1 3 ALA O O -14.230 3.630 -7.885 1.00 . A A . 3 ALA O 1 1 14 5686 1 1 4 LEU C C -14.271 3.019 -3.857 1.00 . A A . 4 LEU C 1 1 14 5687 1 1 4 LEU CA C -13.684 3.473 -5.187 1.00 . A A . 4 LEU CA 1 1 14 5688 1 1 4 LEU CB C -12.290 4.087 -4.974 1.00 . A A . 4 LEU CB 1 1 14 5689 1 1 4 LEU CD1 C -12.383 5.130 -2.689 1.00 . A A . 4 LEU CD1 1 1 14 5690 1 1 4 LEU CD2 C -11.220 6.314 -4.549 1.00 . A A . 4 LEU CD2 1 1 14 5691 1 1 4 LEU CG C -12.401 5.405 -4.196 1.00 . A A . 4 LEU CG 1 1 14 5692 1 1 4 LEU H H -15.049 5.093 -5.259 1.00 . A A . 4 LEU H 1 1 14 5693 1 1 4 LEU HA H -13.590 2.616 -5.836 1.00 . A A . 4 LEU HA 1 1 14 5694 1 1 4 LEU HB2 H -11.674 3.394 -4.421 1.00 . A A . 4 LEU HB2 1 1 14 5695 1 1 4 LEU HB3 H -11.836 4.278 -5.935 1.00 . A A . 4 LEU HB3 1 1 14 5696 1 1 4 LEU HD11 H -12.016 6.005 -2.173 1.00 . A A . 4 LEU HD11 1 1 14 5697 1 1 4 LEU HD12 H -11.735 4.292 -2.477 1.00 . A A . 4 LEU HD12 1 1 14 5698 1 1 4 LEU HD13 H -13.386 4.905 -2.349 1.00 . A A . 4 LEU HD13 1 1 14 5699 1 1 4 LEU HD21 H -10.305 5.878 -4.182 1.00 . A A . 4 LEU HD21 1 1 14 5700 1 1 4 LEU HD22 H -11.363 7.280 -4.088 1.00 . A A . 4 LEU HD22 1 1 14 5701 1 1 4 LEU HD23 H -11.160 6.432 -5.623 1.00 . A A . 4 LEU HD23 1 1 14 5702 1 1 4 LEU HG H -13.323 5.896 -4.461 1.00 . A A . 4 LEU HG 1 1 14 5703 1 1 4 LEU N N -14.575 4.440 -5.817 1.00 . A A . 4 LEU N 1 1 14 5704 1 1 4 LEU O O -15.439 3.296 -3.562 1.00 . A A . 4 LEU O 1 1 14 5705 1 1 5 LEU C C -12.740 1.785 -0.799 1.00 . A A . 5 LEU C 1 1 14 5706 1 1 5 LEU CA C -13.916 1.831 -1.764 1.00 . A A . 5 LEU CA 1 1 14 5707 1 1 5 LEU CB C -14.516 0.425 -1.916 1.00 . A A . 5 LEU CB 1 1 14 5708 1 1 5 LEU CD1 C -16.703 -0.513 -1.101 1.00 . A A . 5 LEU CD1 1 1 14 5709 1 1 5 LEU CD2 C -14.598 -0.936 0.187 1.00 . A A . 5 LEU CD2 1 1 14 5710 1 1 5 LEU CG C -15.353 0.080 -0.676 1.00 . A A . 5 LEU CG 1 1 14 5711 1 1 5 LEU H H -12.552 2.137 -3.357 1.00 . A A . 5 LEU H 1 1 14 5712 1 1 5 LEU HA H -14.668 2.497 -1.374 1.00 . A A . 5 LEU HA 1 1 14 5713 1 1 5 LEU HB2 H -15.141 0.399 -2.797 1.00 . A A . 5 LEU HB2 1 1 14 5714 1 1 5 LEU HB3 H -13.716 -0.292 -2.023 1.00 . A A . 5 LEU HB3 1 1 14 5715 1 1 5 LEU HD11 H -16.995 -1.282 -0.404 1.00 . A A . 5 LEU HD11 1 1 14 5716 1 1 5 LEU HD12 H -16.621 -0.934 -2.091 1.00 . A A . 5 LEU HD12 1 1 14 5717 1 1 5 LEU HD13 H -17.453 0.267 -1.106 1.00 . A A . 5 LEU HD13 1 1 14 5718 1 1 5 LEU HD21 H -13.559 -0.654 0.258 1.00 . A A . 5 LEU HD21 1 1 14 5719 1 1 5 LEU HD22 H -14.673 -1.915 -0.258 1.00 . A A . 5 LEU HD22 1 1 14 5720 1 1 5 LEU HD23 H -15.033 -0.956 1.178 1.00 . A A . 5 LEU HD23 1 1 14 5721 1 1 5 LEU HG H -15.527 0.978 -0.099 1.00 . A A . 5 LEU HG 1 1 14 5722 1 1 5 LEU N N -13.469 2.323 -3.063 1.00 . A A . 5 LEU N 1 1 14 5723 1 1 5 LEU O O -11.594 1.618 -1.215 1.00 . A A . 5 LEU O 1 1 14 5724 1 1 6 ALA C C -11.403 0.492 1.616 1.00 . A A . 6 ALA C 1 1 14 5725 1 1 6 ALA CA C -11.968 1.901 1.493 1.00 . A A . 6 ALA CA 1 1 14 5726 1 1 6 ALA CB C -12.510 2.360 2.849 1.00 . A A . 6 ALA CB 1 1 14 5727 1 1 6 ALA H H -13.950 2.063 0.769 1.00 . A A . 6 ALA H 1 1 14 5728 1 1 6 ALA HA H -11.176 2.571 1.190 1.00 . A A . 6 ALA HA 1 1 14 5729 1 1 6 ALA HB1 H -12.747 3.413 2.805 1.00 . A A . 6 ALA HB1 1 1 14 5730 1 1 6 ALA HB2 H -11.764 2.192 3.611 1.00 . A A . 6 ALA HB2 1 1 14 5731 1 1 6 ALA HB3 H -13.399 1.800 3.088 1.00 . A A . 6 ALA HB3 1 1 14 5732 1 1 6 ALA N N -13.022 1.934 0.489 1.00 . A A . 6 ALA N 1 1 14 5733 1 1 6 ALA O O -11.531 -0.152 2.659 1.00 . A A . 6 ALA O 1 1 14 5734 1 1 7 LEU C C -8.856 -1.335 1.231 1.00 . A A . 7 LEU C 1 1 14 5735 1 1 7 LEU CA C -10.214 -1.326 0.532 1.00 . A A . 7 LEU CA 1 1 14 5736 1 1 7 LEU CB C -10.083 -1.845 -0.908 1.00 . A A . 7 LEU CB 1 1 14 5737 1 1 7 LEU CD1 C -8.722 -1.831 -3.003 1.00 . A A . 7 LEU CD1 1 1 14 5738 1 1 7 LEU CD2 C -8.997 0.271 -1.709 1.00 . A A . 7 LEU CD2 1 1 14 5739 1 1 7 LEU CG C -8.846 -1.247 -1.595 1.00 . A A . 7 LEU CG 1 1 14 5740 1 1 7 LEU H H -10.728 0.577 -0.267 1.00 . A A . 7 LEU H 1 1 14 5741 1 1 7 LEU HA H -10.880 -1.983 1.072 1.00 . A A . 7 LEU HA 1 1 14 5742 1 1 7 LEU HB2 H -10.000 -2.920 -0.891 1.00 . A A . 7 LEU HB2 1 1 14 5743 1 1 7 LEU HB3 H -10.967 -1.568 -1.465 1.00 . A A . 7 LEU HB3 1 1 14 5744 1 1 7 LEU HD11 H -8.944 -2.888 -2.980 1.00 . A A . 7 LEU HD11 1 1 14 5745 1 1 7 LEU HD12 H -7.717 -1.683 -3.368 1.00 . A A . 7 LEU HD12 1 1 14 5746 1 1 7 LEU HD13 H -9.420 -1.335 -3.658 1.00 . A A . 7 LEU HD13 1 1 14 5747 1 1 7 LEU HD21 H -8.896 0.721 -0.735 1.00 . A A . 7 LEU HD21 1 1 14 5748 1 1 7 LEU HD22 H -9.969 0.504 -2.114 1.00 . A A . 7 LEU HD22 1 1 14 5749 1 1 7 LEU HD23 H -8.236 0.660 -2.364 1.00 . A A . 7 LEU HD23 1 1 14 5750 1 1 7 LEU HG H -7.959 -1.483 -1.026 1.00 . A A . 7 LEU HG 1 1 14 5751 1 1 7 LEU N N -10.789 0.017 0.541 1.00 . A A . 7 LEU N 1 1 14 5752 1 1 7 LEU O O -8.402 -0.308 1.738 1.00 . A A . 7 LEU O 1 1 14 5753 1 1 8 ALA C C -5.827 -2.909 0.862 1.00 . A A . 8 ALA C 1 1 14 5754 1 1 8 ALA CA C -6.919 -2.678 1.897 1.00 . A A . 8 ALA CA 1 1 14 5755 1 1 8 ALA CB C -6.971 -3.892 2.808 1.00 . A A . 8 ALA CB 1 1 14 5756 1 1 8 ALA H H -8.651 -3.284 0.836 1.00 . A A . 8 ALA H 1 1 14 5757 1 1 8 ALA HA H -6.687 -1.804 2.481 1.00 . A A . 8 ALA HA 1 1 14 5758 1 1 8 ALA HB1 H -7.828 -3.819 3.457 1.00 . A A . 8 ALA HB1 1 1 14 5759 1 1 8 ALA HB2 H -6.070 -3.933 3.397 1.00 . A A . 8 ALA HB2 1 1 14 5760 1 1 8 ALA HB3 H -7.051 -4.785 2.206 1.00 . A A . 8 ALA HB3 1 1 14 5761 1 1 8 ALA N N -8.224 -2.507 1.254 1.00 . A A . 8 ALA N 1 1 14 5762 1 1 8 ALA O O -4.635 -2.907 1.173 1.00 . A A . 8 ALA O 1 1 14 5763 1 1 9 LEU C C -4.505 -2.157 -1.763 1.00 . A A . 9 LEU C 1 1 14 5764 1 1 9 LEU CA C -5.330 -3.388 -1.451 1.00 . A A . 9 LEU CA 1 1 14 5765 1 1 9 LEU CB C -6.126 -3.771 -2.684 1.00 . A A . 9 LEU CB 1 1 14 5766 1 1 9 LEU CD1 C -6.441 -5.455 -4.497 1.00 . A A . 9 LEU CD1 1 1 14 5767 1 1 9 LEU CD2 C -4.140 -4.909 -3.703 1.00 . A A . 9 LEU CD2 1 1 14 5768 1 1 9 LEU CG C -5.601 -5.083 -3.276 1.00 . A A . 9 LEU CG 1 1 14 5769 1 1 9 LEU H H -7.208 -3.131 -0.520 1.00 . A A . 9 LEU H 1 1 14 5770 1 1 9 LEU HA H -4.676 -4.197 -1.186 1.00 . A A . 9 LEU HA 1 1 14 5771 1 1 9 LEU HB2 H -7.160 -3.886 -2.403 1.00 . A A . 9 LEU HB2 1 1 14 5772 1 1 9 LEU HB3 H -6.037 -2.984 -3.415 1.00 . A A . 9 LEU HB3 1 1 14 5773 1 1 9 LEU HD11 H -6.131 -6.421 -4.867 1.00 . A A . 9 LEU HD11 1 1 14 5774 1 1 9 LEU HD12 H -6.303 -4.713 -5.271 1.00 . A A . 9 LEU HD12 1 1 14 5775 1 1 9 LEU HD13 H -7.484 -5.497 -4.218 1.00 . A A . 9 LEU HD13 1 1 14 5776 1 1 9 LEU HD21 H -4.035 -3.988 -4.256 1.00 . A A . 9 LEU HD21 1 1 14 5777 1 1 9 LEU HD22 H -3.850 -5.741 -4.328 1.00 . A A . 9 LEU HD22 1 1 14 5778 1 1 9 LEU HD23 H -3.509 -4.879 -2.826 1.00 . A A . 9 LEU HD23 1 1 14 5779 1 1 9 LEU HG H -5.675 -5.869 -2.539 1.00 . A A . 9 LEU HG 1 1 14 5780 1 1 9 LEU N N -6.250 -3.128 -0.354 1.00 . A A . 9 LEU N 1 1 14 5781 1 1 9 LEU O O -3.303 -2.112 -1.498 1.00 . A A . 9 LEU O 1 1 14 5782 1 1 10 HIS C C -3.644 0.483 -1.463 1.00 . A A . 10 HIS C 1 1 14 5783 1 1 10 HIS CA C -4.493 0.098 -2.646 1.00 . A A . 10 HIS CA 1 1 14 5784 1 1 10 HIS CB C -5.507 1.206 -2.902 1.00 . A A . 10 HIS CB 1 1 14 5785 1 1 10 HIS CD2 C -7.083 0.602 -4.909 1.00 . A A . 10 HIS CD2 1 1 14 5786 1 1 10 HIS CE1 C -5.950 1.543 -6.494 1.00 . A A . 10 HIS CE1 1 1 14 5787 1 1 10 HIS CG C -5.972 1.159 -4.328 1.00 . A A . 10 HIS CG 1 1 14 5788 1 1 10 HIS H H -6.125 -1.256 -2.482 1.00 . A A . 10 HIS H 1 1 14 5789 1 1 10 HIS HA H -3.871 -0.040 -3.517 1.00 . A A . 10 HIS HA 1 1 14 5790 1 1 10 HIS HB2 H -6.352 1.081 -2.241 1.00 . A A . 10 HIS HB2 1 1 14 5791 1 1 10 HIS HB3 H -5.037 2.156 -2.704 1.00 . A A . 10 HIS HB3 1 1 14 5792 1 1 10 HIS HD1 H -4.410 2.237 -5.276 1.00 . A A . 10 HIS HD1 1 1 14 5793 1 1 10 HIS HD2 H -7.857 0.064 -4.379 1.00 . A A . 10 HIS HD2 1 1 14 5794 1 1 10 HIS HE1 H -5.639 1.901 -7.463 1.00 . A A . 10 HIS HE1 1 1 14 5795 1 1 10 HIS HE2 H -7.740 0.570 -6.938 1.00 . A A . 10 HIS HE2 1 1 14 5796 1 1 10 HIS N N -5.169 -1.154 -2.316 1.00 . A A . 10 HIS N 1 1 14 5797 1 1 10 HIS ND1 N -5.262 1.752 -5.358 1.00 . A A . 10 HIS ND1 1 1 14 5798 1 1 10 HIS NE2 N -7.068 0.845 -6.275 1.00 . A A . 10 HIS NE2 1 1 14 5799 1 1 10 HIS O O -2.484 0.870 -1.589 1.00 . A A . 10 HIS O 1 1 14 5800 1 1 11 HIS C C -2.206 0.065 0.938 1.00 . A A . 11 HIS C 1 1 14 5801 1 1 11 HIS CA C -3.626 0.582 0.956 1.00 . A A . 11 HIS CA 1 1 14 5802 1 1 11 HIS CB C -4.413 -0.162 2.024 1.00 . A A . 11 HIS CB 1 1 14 5803 1 1 11 HIS CD2 C -6.346 1.499 2.588 1.00 . A A . 11 HIS CD2 1 1 14 5804 1 1 11 HIS CE1 C -5.735 2.051 4.590 1.00 . A A . 11 HIS CE1 1 1 14 5805 1 1 11 HIS CG C -5.195 0.812 2.850 1.00 . A A . 11 HIS CG 1 1 14 5806 1 1 11 HIS H H -5.175 -0.024 -0.321 1.00 . A A . 11 HIS H 1 1 14 5807 1 1 11 HIS HA H -3.638 1.637 1.165 1.00 . A A . 11 HIS HA 1 1 14 5808 1 1 11 HIS HB2 H -5.098 -0.853 1.533 1.00 . A A . 11 HIS HB2 1 1 14 5809 1 1 11 HIS HB3 H -3.733 -0.715 2.655 1.00 . A A . 11 HIS HB3 1 1 14 5810 1 1 11 HIS HD1 H -4.024 0.862 4.619 1.00 . A A . 11 HIS HD1 1 1 14 5811 1 1 11 HIS HD2 H -6.898 1.445 1.658 1.00 . A A . 11 HIS HD2 1 1 14 5812 1 1 11 HIS HE1 H -5.699 2.513 5.564 1.00 . A A . 11 HIS HE1 1 1 14 5813 1 1 11 HIS HE2 H -7.478 2.871 3.776 1.00 . A A . 11 HIS HE2 1 1 14 5814 1 1 11 HIS N N -4.258 0.318 -0.312 1.00 . A A . 11 HIS N 1 1 14 5815 1 1 11 HIS ND1 N -4.818 1.177 4.133 1.00 . A A . 11 HIS ND1 1 1 14 5816 1 1 11 HIS NE2 N -6.692 2.282 3.684 1.00 . A A . 11 HIS NE2 1 1 14 5817 1 1 11 HIS O O -1.269 0.742 1.347 1.00 . A A . 11 HIS O 1 1 14 5818 1 1 12 LEU C C -0.043 -1.291 -0.867 1.00 . A A . 12 LEU C 1 1 14 5819 1 1 12 LEU CA C -0.783 -1.794 0.353 1.00 . A A . 12 LEU CA 1 1 14 5820 1 1 12 LEU CB C -0.954 -3.318 0.261 1.00 . A A . 12 LEU CB 1 1 14 5821 1 1 12 LEU CD1 C -0.192 -5.526 1.180 1.00 . A A . 12 LEU CD1 1 1 14 5822 1 1 12 LEU CD2 C 1.457 -3.665 0.901 1.00 . A A . 12 LEU CD2 1 1 14 5823 1 1 12 LEU CG C 0.000 -4.008 1.249 1.00 . A A . 12 LEU CG 1 1 14 5824 1 1 12 LEU H H -2.882 -1.609 0.118 1.00 . A A . 12 LEU H 1 1 14 5825 1 1 12 LEU HA H -0.213 -1.555 1.230 1.00 . A A . 12 LEU HA 1 1 14 5826 1 1 12 LEU HB2 H -1.974 -3.580 0.505 1.00 . A A . 12 LEU HB2 1 1 14 5827 1 1 12 LEU HB3 H -0.731 -3.646 -0.742 1.00 . A A . 12 LEU HB3 1 1 14 5828 1 1 12 LEU HD11 H -0.282 -5.832 0.149 1.00 . A A . 12 LEU HD11 1 1 14 5829 1 1 12 LEU HD12 H -1.089 -5.801 1.717 1.00 . A A . 12 LEU HD12 1 1 14 5830 1 1 12 LEU HD13 H 0.660 -6.015 1.628 1.00 . A A . 12 LEU HD13 1 1 14 5831 1 1 12 LEU HD21 H 1.681 -2.659 1.228 1.00 . A A . 12 LEU HD21 1 1 14 5832 1 1 12 LEU HD22 H 1.604 -3.741 -0.167 1.00 . A A . 12 LEU HD22 1 1 14 5833 1 1 12 LEU HD23 H 2.120 -4.358 1.401 1.00 . A A . 12 LEU HD23 1 1 14 5834 1 1 12 LEU HG H -0.220 -3.669 2.252 1.00 . A A . 12 LEU HG 1 1 14 5835 1 1 12 LEU N N -2.078 -1.146 0.444 1.00 . A A . 12 LEU N 1 1 14 5836 1 1 12 LEU O O 1.131 -0.949 -0.798 1.00 . A A . 12 LEU O 1 1 14 5837 1 1 13 ALA C C 0.509 0.586 -3.008 1.00 . A A . 13 ALA C 1 1 14 5838 1 1 13 ALA CA C -0.162 -0.762 -3.224 1.00 . A A . 13 ALA CA 1 1 14 5839 1 1 13 ALA CB C -1.235 -0.632 -4.310 1.00 . A A . 13 ALA CB 1 1 14 5840 1 1 13 ALA H H -1.694 -1.517 -1.949 1.00 . A A . 13 ALA H 1 1 14 5841 1 1 13 ALA HA H 0.583 -1.465 -3.545 1.00 . A A . 13 ALA HA 1 1 14 5842 1 1 13 ALA HB1 H -1.880 0.205 -4.079 1.00 . A A . 13 ALA HB1 1 1 14 5843 1 1 13 ALA HB2 H -1.823 -1.537 -4.355 1.00 . A A . 13 ALA HB2 1 1 14 5844 1 1 13 ALA HB3 H -0.762 -0.463 -5.266 1.00 . A A . 13 ALA HB3 1 1 14 5845 1 1 13 ALA N N -0.752 -1.238 -1.977 1.00 . A A . 13 ALA N 1 1 14 5846 1 1 13 ALA O O 1.585 0.858 -3.540 1.00 . A A . 13 ALA O 1 1 14 5847 1 1 14 HIS C C 1.549 2.625 -0.950 1.00 . A A . 14 HIS C 1 1 14 5848 1 1 14 HIS CA C 0.417 2.745 -1.952 1.00 . A A . 14 HIS CA 1 1 14 5849 1 1 14 HIS CB C -0.685 3.688 -1.484 1.00 . A A . 14 HIS CB 1 1 14 5850 1 1 14 HIS CD2 C -1.302 3.770 1.062 1.00 . A A . 14 HIS CD2 1 1 14 5851 1 1 14 HIS CE1 C 0.261 5.117 1.728 1.00 . A A . 14 HIS CE1 1 1 14 5852 1 1 14 HIS CG C -0.543 4.077 -0.040 1.00 . A A . 14 HIS CG 1 1 14 5853 1 1 14 HIS H H -0.992 1.162 -1.826 1.00 . A A . 14 HIS H 1 1 14 5854 1 1 14 HIS HA H 0.827 3.128 -2.873 1.00 . A A . 14 HIS HA 1 1 14 5855 1 1 14 HIS HB2 H -0.627 4.564 -2.081 1.00 . A A . 14 HIS HB2 1 1 14 5856 1 1 14 HIS HB3 H -1.644 3.217 -1.637 1.00 . A A . 14 HIS HB3 1 1 14 5857 1 1 14 HIS HD1 H 1.163 5.339 -0.139 1.00 . A A . 14 HIS HD1 1 1 14 5858 1 1 14 HIS HD2 H -2.159 3.114 1.065 1.00 . A A . 14 HIS HD2 1 1 14 5859 1 1 14 HIS HE1 H 0.882 5.742 2.348 1.00 . A A . 14 HIS HE1 1 1 14 5860 1 1 14 HIS HE2 H -1.128 4.380 3.101 1.00 . A A . 14 HIS HE2 1 1 14 5861 1 1 14 HIS N N -0.135 1.431 -2.225 1.00 . A A . 14 HIS N 1 1 14 5862 1 1 14 HIS ND1 N 0.449 4.935 0.406 1.00 . A A . 14 HIS ND1 1 1 14 5863 1 1 14 HIS NE2 N -0.792 4.428 2.178 1.00 . A A . 14 HIS NE2 1 1 14 5864 1 1 14 HIS O O 2.616 3.228 -1.115 1.00 . A A . 14 HIS O 1 1 14 5865 1 1 15 LEU C C 3.558 1.026 0.222 1.00 . A A . 15 LEU C 1 1 14 5866 1 1 15 LEU CA C 2.390 1.543 1.014 1.00 . A A . 15 LEU CA 1 1 14 5867 1 1 15 LEU CB C 1.981 0.444 1.994 1.00 . A A . 15 LEU CB 1 1 14 5868 1 1 15 LEU CD1 C 0.725 2.373 3.011 1.00 . A A . 15 LEU CD1 1 1 14 5869 1 1 15 LEU CD2 C 0.307 0.037 3.766 1.00 . A A . 15 LEU CD2 1 1 14 5870 1 1 15 LEU CG C 1.370 1.014 3.272 1.00 . A A . 15 LEU CG 1 1 14 5871 1 1 15 LEU H H 0.499 1.300 0.100 1.00 . A A . 15 LEU H 1 1 14 5872 1 1 15 LEU HA H 2.650 2.449 1.529 1.00 . A A . 15 LEU HA 1 1 14 5873 1 1 15 LEU HB2 H 1.261 -0.201 1.515 1.00 . A A . 15 LEU HB2 1 1 14 5874 1 1 15 LEU HB3 H 2.853 -0.137 2.254 1.00 . A A . 15 LEU HB3 1 1 14 5875 1 1 15 LEU HD11 H 0.237 2.359 2.051 1.00 . A A . 15 LEU HD11 1 1 14 5876 1 1 15 LEU HD12 H 1.481 3.140 3.023 1.00 . A A . 15 LEU HD12 1 1 14 5877 1 1 15 LEU HD13 H -0.006 2.578 3.779 1.00 . A A . 15 LEU HD13 1 1 14 5878 1 1 15 LEU HD21 H -0.221 -0.377 2.919 1.00 . A A . 15 LEU HD21 1 1 14 5879 1 1 15 LEU HD22 H -0.387 0.555 4.404 1.00 . A A . 15 LEU HD22 1 1 14 5880 1 1 15 LEU HD23 H 0.782 -0.761 4.316 1.00 . A A . 15 LEU HD23 1 1 14 5881 1 1 15 LEU HG H 2.136 1.114 4.021 1.00 . A A . 15 LEU HG 1 1 14 5882 1 1 15 LEU N N 1.341 1.792 0.050 1.00 . A A . 15 LEU N 1 1 14 5883 1 1 15 LEU O O 4.718 1.321 0.488 1.00 . A A . 15 LEU O 1 1 14 5884 1 1 16 ALA C C 4.898 0.721 -2.424 1.00 . A A . 16 ALA C 1 1 14 5885 1 1 16 ALA CA C 4.160 -0.359 -1.663 1.00 . A A . 16 ALA CA 1 1 14 5886 1 1 16 ALA CB C 3.475 -1.311 -2.649 1.00 . A A . 16 ALA CB 1 1 14 5887 1 1 16 ALA H H 2.213 0.091 -0.907 1.00 . A A . 16 ALA H 1 1 14 5888 1 1 16 ALA HA H 4.869 -0.912 -1.073 1.00 . A A . 16 ALA HA 1 1 14 5889 1 1 16 ALA HB1 H 3.134 -0.754 -3.510 1.00 . A A . 16 ALA HB1 1 1 14 5890 1 1 16 ALA HB2 H 2.634 -1.786 -2.168 1.00 . A A . 16 ALA HB2 1 1 14 5891 1 1 16 ALA HB3 H 4.179 -2.064 -2.966 1.00 . A A . 16 ALA HB3 1 1 14 5892 1 1 16 ALA N N 3.189 0.249 -0.772 1.00 . A A . 16 ALA N 1 1 14 5893 1 1 16 ALA O O 6.046 0.543 -2.806 1.00 . A A . 16 ALA O 1 1 14 5894 1 1 17 LEU C C 6.029 3.456 -2.632 1.00 . A A . 17 LEU C 1 1 14 5895 1 1 17 LEU CA C 4.813 2.941 -3.367 1.00 . A A . 17 LEU CA 1 1 14 5896 1 1 17 LEU CB C 3.755 4.047 -3.581 1.00 . A A . 17 LEU CB 1 1 14 5897 1 1 17 LEU CD1 C 5.183 6.109 -3.700 1.00 . A A . 17 LEU CD1 1 1 14 5898 1 1 17 LEU CD2 C 2.892 6.231 -2.723 1.00 . A A . 17 LEU CD2 1 1 14 5899 1 1 17 LEU CG C 4.137 5.357 -2.873 1.00 . A A . 17 LEU CG 1 1 14 5900 1 1 17 LEU H H 3.301 1.899 -2.316 1.00 . A A . 17 LEU H 1 1 14 5901 1 1 17 LEU HA H 5.144 2.578 -4.317 1.00 . A A . 17 LEU HA 1 1 14 5902 1 1 17 LEU HB2 H 3.656 4.237 -4.635 1.00 . A A . 17 LEU HB2 1 1 14 5903 1 1 17 LEU HB3 H 2.809 3.700 -3.195 1.00 . A A . 17 LEU HB3 1 1 14 5904 1 1 17 LEU HD11 H 4.684 6.760 -4.405 1.00 . A A . 17 LEU HD11 1 1 14 5905 1 1 17 LEU HD12 H 5.797 5.399 -4.237 1.00 . A A . 17 LEU HD12 1 1 14 5906 1 1 17 LEU HD13 H 5.803 6.701 -3.044 1.00 . A A . 17 LEU HD13 1 1 14 5907 1 1 17 LEU HD21 H 2.513 6.491 -3.699 1.00 . A A . 17 LEU HD21 1 1 14 5908 1 1 17 LEU HD22 H 3.151 7.129 -2.187 1.00 . A A . 17 LEU HD22 1 1 14 5909 1 1 17 LEU HD23 H 2.137 5.687 -2.174 1.00 . A A . 17 LEU HD23 1 1 14 5910 1 1 17 LEU HG H 4.534 5.141 -1.895 1.00 . A A . 17 LEU HG 1 1 14 5911 1 1 17 LEU N N 4.222 1.831 -2.645 1.00 . A A . 17 LEU N 1 1 14 5912 1 1 17 LEU O O 7.093 3.653 -3.229 1.00 . A A . 17 LEU O 1 1 14 5913 1 1 18 HIS C C 7.925 2.979 -0.247 1.00 . A A . 18 HIS C 1 1 14 5914 1 1 18 HIS CA C 7.027 4.133 -0.572 1.00 . A A . 18 HIS CA 1 1 14 5915 1 1 18 HIS CB C 6.584 4.849 0.685 1.00 . A A . 18 HIS CB 1 1 14 5916 1 1 18 HIS CD2 C 4.553 3.658 1.801 1.00 . A A . 18 HIS CD2 1 1 14 5917 1 1 18 HIS CE1 C 5.615 2.601 3.368 1.00 . A A . 18 HIS CE1 1 1 14 5918 1 1 18 HIS CG C 5.879 3.938 1.640 1.00 . A A . 18 HIS CG 1 1 14 5919 1 1 18 HIS H H 5.015 3.468 -0.910 1.00 . A A . 18 HIS H 1 1 14 5920 1 1 18 HIS HA H 7.579 4.826 -1.182 1.00 . A A . 18 HIS HA 1 1 14 5921 1 1 18 HIS HB2 H 7.443 5.274 1.169 1.00 . A A . 18 HIS HB2 1 1 14 5922 1 1 18 HIS HB3 H 5.915 5.623 0.395 1.00 . A A . 18 HIS HB3 1 1 14 5923 1 1 18 HIS HD1 H 7.513 3.256 2.818 1.00 . A A . 18 HIS HD1 1 1 14 5924 1 1 18 HIS HD2 H 3.758 4.030 1.165 1.00 . A A . 18 HIS HD2 1 1 14 5925 1 1 18 HIS HE1 H 5.838 1.974 4.215 1.00 . A A . 18 HIS HE1 1 1 14 5926 1 1 18 HIS HE2 H 3.534 2.484 3.273 1.00 . A A . 18 HIS HE2 1 1 14 5927 1 1 18 HIS N N 5.889 3.656 -1.342 1.00 . A A . 18 HIS N 1 1 14 5928 1 1 18 HIS ND1 N 6.543 3.253 2.646 1.00 . A A . 18 HIS ND1 1 1 14 5929 1 1 18 HIS NE2 N 4.383 2.818 2.899 1.00 . A A . 18 HIS NE2 1 1 14 5930 1 1 18 HIS O O 9.141 3.040 -0.445 1.00 . A A . 18 HIS O 1 1 14 5931 1 1 19 LEU C C 8.921 0.401 -0.692 1.00 . A A . 19 LEU C 1 1 14 5932 1 1 19 LEU CA C 8.054 0.702 0.504 1.00 . A A . 19 LEU CA 1 1 14 5933 1 1 19 LEU CB C 7.111 -0.471 0.718 1.00 . A A . 19 LEU CB 1 1 14 5934 1 1 19 LEU CD1 C 5.192 -1.279 2.073 1.00 . A A . 19 LEU CD1 1 1 14 5935 1 1 19 LEU CD2 C 7.342 -0.611 3.178 1.00 . A A . 19 LEU CD2 1 1 14 5936 1 1 19 LEU CG C 6.374 -0.307 2.038 1.00 . A A . 19 LEU CG 1 1 14 5937 1 1 19 LEU H H 6.329 1.936 0.302 1.00 . A A . 19 LEU H 1 1 14 5938 1 1 19 LEU HA H 8.667 0.850 1.377 1.00 . A A . 19 LEU HA 1 1 14 5939 1 1 19 LEU HB2 H 6.399 -0.506 -0.089 1.00 . A A . 19 LEU HB2 1 1 14 5940 1 1 19 LEU HB3 H 7.679 -1.388 0.737 1.00 . A A . 19 LEU HB3 1 1 14 5941 1 1 19 LEU HD11 H 4.653 -1.161 3.000 1.00 . A A . 19 LEU HD11 1 1 14 5942 1 1 19 LEU HD12 H 5.556 -2.291 1.994 1.00 . A A . 19 LEU HD12 1 1 14 5943 1 1 19 LEU HD13 H 4.532 -1.071 1.243 1.00 . A A . 19 LEU HD13 1 1 14 5944 1 1 19 LEU HD21 H 6.792 -0.745 4.092 1.00 . A A . 19 LEU HD21 1 1 14 5945 1 1 19 LEU HD22 H 8.032 0.214 3.288 1.00 . A A . 19 LEU HD22 1 1 14 5946 1 1 19 LEU HD23 H 7.894 -1.510 2.952 1.00 . A A . 19 LEU HD23 1 1 14 5947 1 1 19 LEU HG H 6.013 0.704 2.128 1.00 . A A . 19 LEU HG 1 1 14 5948 1 1 19 LEU N N 7.308 1.912 0.206 1.00 . A A . 19 LEU N 1 1 14 5949 1 1 19 LEU O O 10.032 -0.118 -0.577 1.00 . A A . 19 LEU O 1 1 14 5950 1 1 20 ALA C C 10.382 1.338 -3.077 1.00 . A A . 20 ALA C 1 1 14 5951 1 1 20 ALA CA C 9.098 0.544 -3.101 1.00 . A A . 20 ALA CA 1 1 14 5952 1 1 20 ALA CB C 8.256 0.972 -4.304 1.00 . A A . 20 ALA CB 1 1 14 5953 1 1 20 ALA H H 7.482 1.185 -1.852 1.00 . A A . 20 ALA H 1 1 14 5954 1 1 20 ALA HA H 9.338 -0.500 -3.194 1.00 . A A . 20 ALA HA 1 1 14 5955 1 1 20 ALA HB1 H 8.894 1.422 -5.048 1.00 . A A . 20 ALA HB1 1 1 14 5956 1 1 20 ALA HB2 H 7.512 1.686 -3.992 1.00 . A A . 20 ALA HB2 1 1 14 5957 1 1 20 ALA HB3 H 7.770 0.108 -4.727 1.00 . A A . 20 ALA HB3 1 1 14 5958 1 1 20 ALA N N 8.382 0.757 -1.850 1.00 . A A . 20 ALA N 1 1 14 5959 1 1 20 ALA O O 11.472 0.778 -3.149 1.00 . A A . 20 ALA O 1 1 14 5960 1 1 21 LEU C C 12.399 2.991 -1.912 1.00 . A A . 21 LEU C 1 1 14 5961 1 1 21 LEU CA C 11.394 3.532 -2.907 1.00 . A A . 21 LEU CA 1 1 14 5962 1 1 21 LEU CB C 10.972 4.941 -2.482 1.00 . A A . 21 LEU CB 1 1 14 5963 1 1 21 LEU CD1 C 9.183 6.652 -2.815 1.00 . A A . 21 LEU CD1 1 1 14 5964 1 1 21 LEU CD2 C 10.687 6.035 -4.711 1.00 . A A . 21 LEU CD2 1 1 14 5965 1 1 21 LEU CG C 9.953 5.506 -3.477 1.00 . A A . 21 LEU CG 1 1 14 5966 1 1 21 LEU H H 9.333 3.015 -2.897 1.00 . A A . 21 LEU H 1 1 14 5967 1 1 21 LEU HA H 11.851 3.577 -3.877 1.00 . A A . 21 LEU HA 1 1 14 5968 1 1 21 LEU HB2 H 10.531 4.901 -1.496 1.00 . A A . 21 LEU HB2 1 1 14 5969 1 1 21 LEU HB3 H 11.841 5.580 -2.455 1.00 . A A . 21 LEU HB3 1 1 14 5970 1 1 21 LEU HD11 H 9.771 7.556 -2.862 1.00 . A A . 21 LEU HD11 1 1 14 5971 1 1 21 LEU HD12 H 8.989 6.405 -1.783 1.00 . A A . 21 LEU HD12 1 1 14 5972 1 1 21 LEU HD13 H 8.246 6.800 -3.332 1.00 . A A . 21 LEU HD13 1 1 14 5973 1 1 21 LEU HD21 H 11.079 5.207 -5.285 1.00 . A A . 21 LEU HD21 1 1 14 5974 1 1 21 LEU HD22 H 11.500 6.672 -4.400 1.00 . A A . 21 LEU HD22 1 1 14 5975 1 1 21 LEU HD23 H 10.002 6.602 -5.324 1.00 . A A . 21 LEU HD23 1 1 14 5976 1 1 21 LEU HG H 9.262 4.731 -3.769 1.00 . A A . 21 LEU HG 1 1 14 5977 1 1 21 LEU N N 10.238 2.646 -2.961 1.00 . A A . 21 LEU N 1 1 14 5978 1 1 21 LEU O O 13.586 2.851 -2.210 1.00 . A A . 21 LEU O 1 1 14 5979 1 1 22 ALA C C 13.530 0.944 -0.179 1.00 . A A . 22 ALA C 1 1 14 5980 1 1 22 ALA CA C 12.732 2.131 0.336 1.00 . A A . 22 ALA CA 1 1 14 5981 1 1 22 ALA CB C 11.864 1.700 1.517 1.00 . A A . 22 ALA CB 1 1 14 5982 1 1 22 ALA H H 10.937 2.814 -0.574 1.00 . A A . 22 ALA H 1 1 14 5983 1 1 22 ALA HA H 13.419 2.892 0.664 1.00 . A A . 22 ALA HA 1 1 14 5984 1 1 22 ALA HB1 H 12.383 0.947 2.091 1.00 . A A . 22 ALA HB1 1 1 14 5985 1 1 22 ALA HB2 H 10.932 1.296 1.151 1.00 . A A . 22 ALA HB2 1 1 14 5986 1 1 22 ALA HB3 H 11.662 2.555 2.144 1.00 . A A . 22 ALA HB3 1 1 14 5987 1 1 22 ALA N N 11.896 2.677 -0.729 1.00 . A A . 22 ALA N 1 1 14 5988 1 1 22 ALA O O 14.725 0.809 0.098 1.00 . A A . 22 ALA O 1 1 14 5989 1 1 23 LEU C C 14.377 -0.654 -2.688 1.00 . A A . 23 LEU C 1 1 14 5990 1 1 23 LEU CA C 13.522 -1.083 -1.511 1.00 . A A . 23 LEU CA 1 1 14 5991 1 1 23 LEU CB C 12.484 -2.101 -1.990 1.00 . A A . 23 LEU CB 1 1 14 5992 1 1 23 LEU CD1 C 10.357 -3.182 -1.237 1.00 . A A . 23 LEU CD1 1 1 14 5993 1 1 23 LEU CD2 C 12.524 -3.842 -0.192 1.00 . A A . 23 LEU CD2 1 1 14 5994 1 1 23 LEU CG C 11.729 -2.675 -0.787 1.00 . A A . 23 LEU CG 1 1 14 5995 1 1 23 LEU H H 11.917 0.254 -1.127 1.00 . A A . 23 LEU H 1 1 14 5996 1 1 23 LEU HA H 14.150 -1.538 -0.767 1.00 . A A . 23 LEU HA 1 1 14 5997 1 1 23 LEU HB2 H 11.786 -1.612 -2.657 1.00 . A A . 23 LEU HB2 1 1 14 5998 1 1 23 LEU HB3 H 12.985 -2.900 -2.515 1.00 . A A . 23 LEU HB3 1 1 14 5999 1 1 23 LEU HD11 H 9.748 -2.351 -1.561 1.00 . A A . 23 LEU HD11 1 1 14 6000 1 1 23 LEU HD12 H 9.871 -3.683 -0.411 1.00 . A A . 23 LEU HD12 1 1 14 6001 1 1 23 LEU HD13 H 10.480 -3.874 -2.055 1.00 . A A . 23 LEU HD13 1 1 14 6002 1 1 23 LEU HD21 H 13.020 -4.383 -0.985 1.00 . A A . 23 LEU HD21 1 1 14 6003 1 1 23 LEU HD22 H 11.848 -4.506 0.327 1.00 . A A . 23 LEU HD22 1 1 14 6004 1 1 23 LEU HD23 H 13.260 -3.466 0.502 1.00 . A A . 23 LEU HD23 1 1 14 6005 1 1 23 LEU HG H 11.601 -1.902 -0.039 1.00 . A A . 23 LEU HG 1 1 14 6006 1 1 23 LEU N N 12.864 0.090 -0.940 1.00 . A A . 23 LEU N 1 1 14 6007 1 1 23 LEU O O 15.554 -0.996 -2.781 1.00 . A A . 23 LEU O 1 1 14 6008 1 1 24 LYS C C 15.766 1.216 -4.386 1.00 . A A . 24 LYS C 1 1 14 6009 1 1 24 LYS CA C 14.432 0.601 -4.765 1.00 . A A . 24 LYS CA 1 1 14 6010 1 1 24 LYS CB C 13.551 1.658 -5.453 1.00 . A A . 24 LYS CB 1 1 14 6011 1 1 24 LYS CD C 14.837 2.959 -7.175 1.00 . A A . 24 LYS CD 1 1 14 6012 1 1 24 LYS CE C 14.008 4.206 -7.512 1.00 . A A . 24 LYS CE 1 1 14 6013 1 1 24 LYS CG C 13.911 1.756 -6.941 1.00 . A A . 24 LYS CG 1 1 14 6014 1 1 24 LYS H H 12.818 0.326 -3.426 1.00 . A A . 24 LYS H 1 1 14 6015 1 1 24 LYS HA H 14.600 -0.212 -5.444 1.00 . A A . 24 LYS HA 1 1 14 6016 1 1 24 LYS HB2 H 12.513 1.374 -5.352 1.00 . A A . 24 LYS HB2 1 1 14 6017 1 1 24 LYS HB3 H 13.706 2.617 -4.981 1.00 . A A . 24 LYS HB3 1 1 14 6018 1 1 24 LYS HD2 H 15.416 3.148 -6.280 1.00 . A A . 24 LYS HD2 1 1 14 6019 1 1 24 LYS HD3 H 15.508 2.744 -7.994 1.00 . A A . 24 LYS HD3 1 1 14 6020 1 1 24 LYS HE2 H 13.503 4.554 -6.623 1.00 . A A . 24 LYS HE2 1 1 14 6021 1 1 24 LYS HE3 H 14.662 4.980 -7.878 1.00 . A A . 24 LYS HE3 1 1 14 6022 1 1 24 LYS HG2 H 14.412 0.850 -7.253 1.00 . A A . 24 LYS HG2 1 1 14 6023 1 1 24 LYS HG3 H 13.010 1.880 -7.519 1.00 . A A . 24 LYS HG3 1 1 14 6024 1 1 24 LYS HZ1 H 13.315 3.050 -9.098 1.00 . A A . 24 LYS HZ1 1 1 14 6025 1 1 24 LYS HZ2 H 12.893 4.688 -9.200 1.00 . A A . 24 LYS HZ2 1 1 14 6026 1 1 24 LYS HZ3 H 12.086 3.675 -8.106 1.00 . A A . 24 LYS HZ3 1 1 14 6027 1 1 24 LYS N N 13.759 0.100 -3.578 1.00 . A A . 24 LYS N 1 1 14 6028 1 1 24 LYS NZ N 13.000 3.877 -8.556 1.00 . A A . 24 LYS NZ 1 1 14 6029 1 1 24 LYS O O 16.805 0.884 -4.960 1.00 . A A . 24 LYS O 1 1 14 6030 1 1 25 LYS C C 16.976 2.788 -1.420 1.00 . A A . 25 LYS C 1 1 14 6031 1 1 25 LYS CA C 16.923 2.779 -2.942 1.00 . A A . 25 LYS CA 1 1 14 6032 1 1 25 LYS CB C 16.952 4.216 -3.468 1.00 . A A . 25 LYS CB 1 1 14 6033 1 1 25 LYS CD C 18.188 6.036 -2.250 1.00 . A A . 25 LYS CD 1 1 14 6034 1 1 25 LYS CE C 18.766 5.693 -0.871 1.00 . A A . 25 LYS CE 1 1 14 6035 1 1 25 LYS CG C 18.328 4.836 -3.198 1.00 . A A . 25 LYS CG 1 1 14 6036 1 1 25 LYS H H 14.854 2.315 -2.999 1.00 . A A . 25 LYS H 1 1 14 6037 1 1 25 LYS HA H 17.788 2.253 -3.317 1.00 . A A . 25 LYS HA 1 1 14 6038 1 1 25 LYS HB2 H 16.761 4.212 -4.532 1.00 . A A . 25 LYS HB2 1 1 14 6039 1 1 25 LYS HB3 H 16.190 4.797 -2.970 1.00 . A A . 25 LYS HB3 1 1 14 6040 1 1 25 LYS HD2 H 18.724 6.880 -2.662 1.00 . A A . 25 LYS HD2 1 1 14 6041 1 1 25 LYS HD3 H 17.145 6.294 -2.145 1.00 . A A . 25 LYS HD3 1 1 14 6042 1 1 25 LYS HE2 H 18.884 6.600 -0.295 1.00 . A A . 25 LYS HE2 1 1 14 6043 1 1 25 LYS HE3 H 18.093 5.027 -0.355 1.00 . A A . 25 LYS HE3 1 1 14 6044 1 1 25 LYS HG2 H 18.969 4.095 -2.747 1.00 . A A . 25 LYS HG2 1 1 14 6045 1 1 25 LYS HG3 H 18.762 5.165 -4.130 1.00 . A A . 25 LYS HG3 1 1 14 6046 1 1 25 LYS HZ1 H 20.339 4.961 -2.034 1.00 . A A . 25 LYS HZ1 1 1 14 6047 1 1 25 LYS HZ2 H 20.057 4.072 -0.607 1.00 . A A . 25 LYS HZ2 1 1 14 6048 1 1 25 LYS HZ3 H 20.819 5.596 -0.533 1.00 . A A . 25 LYS HZ3 1 1 14 6049 1 1 25 LYS N N 15.722 2.106 -3.413 1.00 . A A . 25 LYS N 1 1 14 6050 1 1 25 LYS NZ N 20.093 5.034 -1.027 1.00 . A A . 25 LYS NZ 1 1 14 6051 1 1 25 LYS O O 16.356 3.639 -0.773 1.00 . A A . 25 LYS O 1 1 14 6052 1 1 26 ALA C C 19.051 2.615 1.062 1.00 . A A . 26 ALA C 1 1 14 6053 1 1 26 ALA CA C 17.877 1.759 0.595 1.00 . A A . 26 ALA CA 1 1 14 6054 1 1 26 ALA CB C 18.107 0.304 1.015 1.00 . A A . 26 ALA CB 1 1 14 6055 1 1 26 ALA H H 18.206 1.209 -1.425 1.00 . A A . 26 ALA H 1 1 14 6056 1 1 26 ALA HA H 16.970 2.117 1.061 1.00 . A A . 26 ALA HA 1 1 14 6057 1 1 26 ALA HB1 H 17.781 0.170 2.036 1.00 . A A . 26 ALA HB1 1 1 14 6058 1 1 26 ALA HB2 H 19.161 0.071 0.944 1.00 . A A . 26 ALA HB2 1 1 14 6059 1 1 26 ALA HB3 H 17.547 -0.355 0.370 1.00 . A A . 26 ALA HB3 1 1 14 6060 1 1 26 ALA N N 17.731 1.848 -0.855 1.00 . A A . 26 ALA N 1 1 14 6061 1 1 26 ALA O O 19.106 2.922 2.237 1.00 . A A . 26 ALA O 1 1 14 6062 1 1 26 ALA OXT O 19.885 2.943 0.238 1.00 . A A . 26 ALA OXT 1 1 15 6063 1 1 1 LYS C C -21.390 -1.618 -4.842 1.00 . A A . 1 LYS C 1 1 15 6064 1 1 1 LYS CA C -20.724 -0.574 -5.726 1.00 . A A . 1 LYS CA 1 1 15 6065 1 1 1 LYS CB C -21.273 0.826 -5.394 1.00 . A A . 1 LYS CB 1 1 15 6066 1 1 1 LYS CD C -20.524 3.217 -5.605 1.00 . A A . 1 LYS CD 1 1 15 6067 1 1 1 LYS CE C -20.474 4.362 -6.626 1.00 . A A . 1 LYS CE 1 1 15 6068 1 1 1 LYS CG C -20.648 1.871 -6.334 1.00 . A A . 1 LYS CG 1 1 15 6069 1 1 1 LYS H1 H -21.825 -1.543 -7.191 1.00 . A A . 1 LYS H1 1 1 15 6070 1 1 1 LYS H2 H -20.183 -1.361 -7.567 1.00 . A A . 1 LYS H2 1 1 15 6071 1 1 1 LYS H3 H -21.232 -0.033 -7.665 1.00 . A A . 1 LYS H3 1 1 15 6072 1 1 1 LYS HA H -19.659 -0.590 -5.560 1.00 . A A . 1 LYS HA 1 1 15 6073 1 1 1 LYS HB2 H -22.347 0.828 -5.515 1.00 . A A . 1 LYS HB2 1 1 15 6074 1 1 1 LYS HB3 H -21.027 1.071 -4.371 1.00 . A A . 1 LYS HB3 1 1 15 6075 1 1 1 LYS HD2 H -21.375 3.355 -4.952 1.00 . A A . 1 LYS HD2 1 1 15 6076 1 1 1 LYS HD3 H -19.617 3.226 -5.015 1.00 . A A . 1 LYS HD3 1 1 15 6077 1 1 1 LYS HE2 H -20.320 5.300 -6.109 1.00 . A A . 1 LYS HE2 1 1 15 6078 1 1 1 LYS HE3 H -19.658 4.196 -7.313 1.00 . A A . 1 LYS HE3 1 1 15 6079 1 1 1 LYS HG2 H -19.668 1.539 -6.645 1.00 . A A . 1 LYS HG2 1 1 15 6080 1 1 1 LYS HG3 H -21.277 1.994 -7.206 1.00 . A A . 1 LYS HG3 1 1 15 6081 1 1 1 LYS HZ1 H -22.535 4.089 -6.775 1.00 . A A . 1 LYS HZ1 1 1 15 6082 1 1 1 LYS HZ2 H -21.694 3.809 -8.217 1.00 . A A . 1 LYS HZ2 1 1 15 6083 1 1 1 LYS HZ3 H -21.942 5.398 -7.683 1.00 . A A . 1 LYS HZ3 1 1 15 6084 1 1 1 LYS N N -21.012 -0.899 -7.144 1.00 . A A . 1 LYS N 1 1 15 6085 1 1 1 LYS NZ N -21.755 4.417 -7.382 1.00 . A A . 1 LYS NZ 1 1 15 6086 1 1 1 LYS O O -22.052 -2.532 -5.334 1.00 . A A . 1 LYS O 1 1 15 6087 1 1 2 LYS C C -21.527 -1.896 -1.168 1.00 . A A . 2 LYS C 1 1 15 6088 1 1 2 LYS CA C -21.784 -2.403 -2.579 1.00 . A A . 2 LYS CA 1 1 15 6089 1 1 2 LYS CB C -21.172 -3.802 -2.749 1.00 . A A . 2 LYS CB 1 1 15 6090 1 1 2 LYS CD C -22.951 -5.252 -1.724 1.00 . A A . 2 LYS CD 1 1 15 6091 1 1 2 LYS CE C -23.865 -6.454 -1.975 1.00 . A A . 2 LYS CE 1 1 15 6092 1 1 2 LYS CG C -22.274 -4.833 -3.035 1.00 . A A . 2 LYS CG 1 1 15 6093 1 1 2 LYS H H -20.665 -0.726 -3.209 1.00 . A A . 2 LYS H 1 1 15 6094 1 1 2 LYS HA H -22.849 -2.460 -2.745 1.00 . A A . 2 LYS HA 1 1 15 6095 1 1 2 LYS HB2 H -20.475 -3.787 -3.575 1.00 . A A . 2 LYS HB2 1 1 15 6096 1 1 2 LYS HB3 H -20.647 -4.079 -1.847 1.00 . A A . 2 LYS HB3 1 1 15 6097 1 1 2 LYS HD2 H -22.197 -5.522 -1.000 1.00 . A A . 2 LYS HD2 1 1 15 6098 1 1 2 LYS HD3 H -23.541 -4.432 -1.343 1.00 . A A . 2 LYS HD3 1 1 15 6099 1 1 2 LYS HE2 H -23.265 -7.330 -2.182 1.00 . A A . 2 LYS HE2 1 1 15 6100 1 1 2 LYS HE3 H -24.473 -6.634 -1.102 1.00 . A A . 2 LYS HE3 1 1 15 6101 1 1 2 LYS HG2 H -23.010 -4.403 -3.700 1.00 . A A . 2 LYS HG2 1 1 15 6102 1 1 2 LYS HG3 H -21.837 -5.703 -3.503 1.00 . A A . 2 LYS HG3 1 1 15 6103 1 1 2 LYS HZ1 H -24.223 -6.316 -4.021 1.00 . A A . 2 LYS HZ1 1 1 15 6104 1 1 2 LYS HZ2 H -25.074 -5.188 -3.087 1.00 . A A . 2 LYS HZ2 1 1 15 6105 1 1 2 LYS HZ3 H -25.569 -6.808 -3.109 1.00 . A A . 2 LYS HZ3 1 1 15 6106 1 1 2 LYS N N -21.204 -1.476 -3.538 1.00 . A A . 2 LYS N 1 1 15 6107 1 1 2 LYS NZ N -24.745 -6.169 -3.136 1.00 . A A . 2 LYS NZ 1 1 15 6108 1 1 2 LYS O O -21.075 -0.764 -0.980 1.00 . A A . 2 LYS O 1 1 15 6109 1 1 3 ALA C C -20.096 -2.178 1.475 1.00 . A A . 3 ALA C 1 1 15 6110 1 1 3 ALA CA C -21.588 -2.365 1.211 1.00 . A A . 3 ALA CA 1 1 15 6111 1 1 3 ALA CB C -22.144 -3.452 2.144 1.00 . A A . 3 ALA CB 1 1 15 6112 1 1 3 ALA H H -22.150 -3.627 -0.395 1.00 . A A . 3 ALA H 1 1 15 6113 1 1 3 ALA HA H -22.103 -1.438 1.409 1.00 . A A . 3 ALA HA 1 1 15 6114 1 1 3 ALA HB1 H -22.592 -2.986 3.009 1.00 . A A . 3 ALA HB1 1 1 15 6115 1 1 3 ALA HB2 H -21.339 -4.101 2.464 1.00 . A A . 3 ALA HB2 1 1 15 6116 1 1 3 ALA HB3 H -22.889 -4.035 1.623 1.00 . A A . 3 ALA HB3 1 1 15 6117 1 1 3 ALA N N -21.803 -2.738 -0.182 1.00 . A A . 3 ALA N 1 1 15 6118 1 1 3 ALA O O -19.278 -2.977 1.019 1.00 . A A . 3 ALA O 1 1 15 6119 1 1 4 LEU C C -17.572 -0.569 1.233 1.00 . A A . 4 LEU C 1 1 15 6120 1 1 4 LEU CA C -18.346 -0.855 2.517 1.00 . A A . 4 LEU CA 1 1 15 6121 1 1 4 LEU CB C -17.732 -2.057 3.251 1.00 . A A . 4 LEU CB 1 1 15 6122 1 1 4 LEU CD1 C -17.746 -0.971 5.516 1.00 . A A . 4 LEU CD1 1 1 15 6123 1 1 4 LEU CD2 C -16.070 -2.741 4.997 1.00 . A A . 4 LEU CD2 1 1 15 6124 1 1 4 LEU CG C -16.859 -1.567 4.417 1.00 . A A . 4 LEU CG 1 1 15 6125 1 1 4 LEU H H -20.441 -0.520 2.545 1.00 . A A . 4 LEU H 1 1 15 6126 1 1 4 LEU HA H -18.286 0.013 3.158 1.00 . A A . 4 LEU HA 1 1 15 6127 1 1 4 LEU HB2 H -18.524 -2.685 3.631 1.00 . A A . 4 LEU HB2 1 1 15 6128 1 1 4 LEU HB3 H -17.126 -2.630 2.564 1.00 . A A . 4 LEU HB3 1 1 15 6129 1 1 4 LEU HD11 H -17.393 0.019 5.765 1.00 . A A . 4 LEU HD11 1 1 15 6130 1 1 4 LEU HD12 H -17.706 -1.599 6.395 1.00 . A A . 4 LEU HD12 1 1 15 6131 1 1 4 LEU HD13 H -18.767 -0.911 5.165 1.00 . A A . 4 LEU HD13 1 1 15 6132 1 1 4 LEU HD21 H -16.756 -3.504 5.337 1.00 . A A . 4 LEU HD21 1 1 15 6133 1 1 4 LEU HD22 H -15.478 -2.395 5.831 1.00 . A A . 4 LEU HD22 1 1 15 6134 1 1 4 LEU HD23 H -15.421 -3.150 4.237 1.00 . A A . 4 LEU HD23 1 1 15 6135 1 1 4 LEU HG H -16.170 -0.810 4.062 1.00 . A A . 4 LEU HG 1 1 15 6136 1 1 4 LEU N N -19.746 -1.125 2.208 1.00 . A A . 4 LEU N 1 1 15 6137 1 1 4 LEU O O -18.124 -0.016 0.279 1.00 . A A . 4 LEU O 1 1 15 6138 1 1 5 LEU C C -14.120 -1.440 0.240 1.00 . A A . 5 LEU C 1 1 15 6139 1 1 5 LEU CA C -15.450 -0.726 0.048 1.00 . A A . 5 LEU CA 1 1 15 6140 1 1 5 LEU CB C -15.204 0.774 -0.161 1.00 . A A . 5 LEU CB 1 1 15 6141 1 1 5 LEU CD1 C -15.764 0.927 -2.593 1.00 . A A . 5 LEU CD1 1 1 15 6142 1 1 5 LEU CD2 C -13.989 2.402 -1.632 1.00 . A A . 5 LEU CD2 1 1 15 6143 1 1 5 LEU CG C -14.633 1.014 -1.562 1.00 . A A . 5 LEU CG 1 1 15 6144 1 1 5 LEU H H -15.915 -1.373 2.008 1.00 . A A . 5 LEU H 1 1 15 6145 1 1 5 LEU HA H -15.943 -1.130 -0.822 1.00 . A A . 5 LEU HA 1 1 15 6146 1 1 5 LEU HB2 H -16.139 1.307 -0.057 1.00 . A A . 5 LEU HB2 1 1 15 6147 1 1 5 LEU HB3 H -14.505 1.127 0.581 1.00 . A A . 5 LEU HB3 1 1 15 6148 1 1 5 LEU HD11 H -16.491 0.196 -2.275 1.00 . A A . 5 LEU HD11 1 1 15 6149 1 1 5 LEU HD12 H -15.351 0.635 -3.550 1.00 . A A . 5 LEU HD12 1 1 15 6150 1 1 5 LEU HD13 H -16.240 1.890 -2.684 1.00 . A A . 5 LEU HD13 1 1 15 6151 1 1 5 LEU HD21 H -14.194 2.946 -0.720 1.00 . A A . 5 LEU HD21 1 1 15 6152 1 1 5 LEU HD22 H -14.391 2.942 -2.476 1.00 . A A . 5 LEU HD22 1 1 15 6153 1 1 5 LEU HD23 H -12.922 2.299 -1.753 1.00 . A A . 5 LEU HD23 1 1 15 6154 1 1 5 LEU HG H -13.891 0.260 -1.780 1.00 . A A . 5 LEU HG 1 1 15 6155 1 1 5 LEU N N -16.296 -0.941 1.216 1.00 . A A . 5 LEU N 1 1 15 6156 1 1 5 LEU O O -13.524 -1.373 1.317 1.00 . A A . 5 LEU O 1 1 15 6157 1 1 6 ALA C C -11.253 -1.908 -0.418 1.00 . A A . 6 ALA C 1 1 15 6158 1 1 6 ALA CA C -12.403 -2.858 -0.739 1.00 . A A . 6 ALA CA 1 1 15 6159 1 1 6 ALA CB C -12.128 -3.571 -2.072 1.00 . A A . 6 ALA CB 1 1 15 6160 1 1 6 ALA H H -14.191 -2.145 -1.630 1.00 . A A . 6 ALA H 1 1 15 6161 1 1 6 ALA HA H -12.471 -3.600 0.042 1.00 . A A . 6 ALA HA 1 1 15 6162 1 1 6 ALA HB1 H -13.022 -4.080 -2.402 1.00 . A A . 6 ALA HB1 1 1 15 6163 1 1 6 ALA HB2 H -11.335 -4.291 -1.936 1.00 . A A . 6 ALA HB2 1 1 15 6164 1 1 6 ALA HB3 H -11.831 -2.846 -2.816 1.00 . A A . 6 ALA HB3 1 1 15 6165 1 1 6 ALA N N -13.665 -2.128 -0.804 1.00 . A A . 6 ALA N 1 1 15 6166 1 1 6 ALA O O -10.679 -1.288 -1.317 1.00 . A A . 6 ALA O 1 1 15 6167 1 1 7 LEU C C -8.631 -1.751 1.712 1.00 . A A . 7 LEU C 1 1 15 6168 1 1 7 LEU CA C -9.833 -0.922 1.281 1.00 . A A . 7 LEU CA 1 1 15 6169 1 1 7 LEU CB C -10.286 -0.039 2.446 1.00 . A A . 7 LEU CB 1 1 15 6170 1 1 7 LEU CD1 C -11.876 1.481 1.247 1.00 . A A . 7 LEU CD1 1 1 15 6171 1 1 7 LEU CD2 C -10.506 2.354 3.144 1.00 . A A . 7 LEU CD2 1 1 15 6172 1 1 7 LEU CG C -10.518 1.393 1.951 1.00 . A A . 7 LEU CG 1 1 15 6173 1 1 7 LEU H H -11.408 -2.313 1.535 1.00 . A A . 7 LEU H 1 1 15 6174 1 1 7 LEU HA H -9.548 -0.289 0.453 1.00 . A A . 7 LEU HA 1 1 15 6175 1 1 7 LEU HB2 H -11.204 -0.434 2.859 1.00 . A A . 7 LEU HB2 1 1 15 6176 1 1 7 LEU HB3 H -9.526 -0.035 3.213 1.00 . A A . 7 LEU HB3 1 1 15 6177 1 1 7 LEU HD11 H -12.657 1.168 1.926 1.00 . A A . 7 LEU HD11 1 1 15 6178 1 1 7 LEU HD12 H -11.876 0.841 0.378 1.00 . A A . 7 LEU HD12 1 1 15 6179 1 1 7 LEU HD13 H -12.055 2.501 0.940 1.00 . A A . 7 LEU HD13 1 1 15 6180 1 1 7 LEU HD21 H -10.985 1.886 3.989 1.00 . A A . 7 LEU HD21 1 1 15 6181 1 1 7 LEU HD22 H -11.038 3.257 2.885 1.00 . A A . 7 LEU HD22 1 1 15 6182 1 1 7 LEU HD23 H -9.486 2.601 3.401 1.00 . A A . 7 LEU HD23 1 1 15 6183 1 1 7 LEU HG H -9.735 1.669 1.259 1.00 . A A . 7 LEU HG 1 1 15 6184 1 1 7 LEU N N -10.920 -1.797 0.860 1.00 . A A . 7 LEU N 1 1 15 6185 1 1 7 LEU O O -8.704 -2.977 1.765 1.00 . A A . 7 LEU O 1 1 15 6186 1 1 8 ALA C C -5.582 -2.346 1.256 1.00 . A A . 8 ALA C 1 1 15 6187 1 1 8 ALA CA C -6.296 -1.737 2.443 1.00 . A A . 8 ALA CA 1 1 15 6188 1 1 8 ALA CB C -6.599 -2.834 3.468 1.00 . A A . 8 ALA CB 1 1 15 6189 1 1 8 ALA H H -7.539 -0.097 1.940 1.00 . A A . 8 ALA H 1 1 15 6190 1 1 8 ALA HA H -5.650 -1.007 2.892 1.00 . A A . 8 ALA HA 1 1 15 6191 1 1 8 ALA HB1 H -6.862 -3.744 2.946 1.00 . A A . 8 ALA HB1 1 1 15 6192 1 1 8 ALA HB2 H -7.421 -2.528 4.096 1.00 . A A . 8 ALA HB2 1 1 15 6193 1 1 8 ALA HB3 H -5.724 -3.010 4.075 1.00 . A A . 8 ALA HB3 1 1 15 6194 1 1 8 ALA N N -7.528 -1.071 2.013 1.00 . A A . 8 ALA N 1 1 15 6195 1 1 8 ALA O O -4.368 -2.511 1.262 1.00 . A A . 8 ALA O 1 1 15 6196 1 1 9 LEU C C -4.881 -2.295 -1.657 1.00 . A A . 9 LEU C 1 1 15 6197 1 1 9 LEU CA C -5.809 -3.266 -0.964 1.00 . A A . 9 LEU CA 1 1 15 6198 1 1 9 LEU CB C -6.959 -3.622 -1.901 1.00 . A A . 9 LEU CB 1 1 15 6199 1 1 9 LEU CD1 C -8.077 -5.324 -0.452 1.00 . A A . 9 LEU CD1 1 1 15 6200 1 1 9 LEU CD2 C -8.184 -5.536 -2.938 1.00 . A A . 9 LEU CD2 1 1 15 6201 1 1 9 LEU CG C -7.312 -5.104 -1.756 1.00 . A A . 9 LEU CG 1 1 15 6202 1 1 9 LEU H H -7.310 -2.501 0.306 1.00 . A A . 9 LEU H 1 1 15 6203 1 1 9 LEU HA H -5.260 -4.151 -0.710 1.00 . A A . 9 LEU HA 1 1 15 6204 1 1 9 LEU HB2 H -7.819 -3.017 -1.649 1.00 . A A . 9 LEU HB2 1 1 15 6205 1 1 9 LEU HB3 H -6.664 -3.418 -2.918 1.00 . A A . 9 LEU HB3 1 1 15 6206 1 1 9 LEU HD11 H -7.456 -5.035 0.384 1.00 . A A . 9 LEU HD11 1 1 15 6207 1 1 9 LEU HD12 H -8.339 -6.366 -0.360 1.00 . A A . 9 LEU HD12 1 1 15 6208 1 1 9 LEU HD13 H -8.977 -4.728 -0.456 1.00 . A A . 9 LEU HD13 1 1 15 6209 1 1 9 LEU HD21 H -9.091 -4.956 -2.949 1.00 . A A . 9 LEU HD21 1 1 15 6210 1 1 9 LEU HD22 H -8.427 -6.582 -2.841 1.00 . A A . 9 LEU HD22 1 1 15 6211 1 1 9 LEU HD23 H -7.643 -5.378 -3.859 1.00 . A A . 9 LEU HD23 1 1 15 6212 1 1 9 LEU HG H -6.408 -5.692 -1.742 1.00 . A A . 9 LEU HG 1 1 15 6213 1 1 9 LEU N N -6.352 -2.671 0.243 1.00 . A A . 9 LEU N 1 1 15 6214 1 1 9 LEU O O -3.661 -2.438 -1.624 1.00 . A A . 9 LEU O 1 1 15 6215 1 1 10 HIS C C -3.858 0.418 -1.914 1.00 . A A . 10 HIS C 1 1 15 6216 1 1 10 HIS CA C -4.701 -0.269 -2.947 1.00 . A A . 10 HIS CA 1 1 15 6217 1 1 10 HIS CB C -5.624 0.723 -3.642 1.00 . A A . 10 HIS CB 1 1 15 6218 1 1 10 HIS CD2 C -7.131 2.127 -2.008 1.00 . A A . 10 HIS CD2 1 1 15 6219 1 1 10 HIS CE1 C -5.751 3.759 -1.624 1.00 . A A . 10 HIS CE1 1 1 15 6220 1 1 10 HIS CG C -5.987 1.858 -2.722 1.00 . A A . 10 HIS CG 1 1 15 6221 1 1 10 HIS H H -6.454 -1.229 -2.213 1.00 . A A . 10 HIS H 1 1 15 6222 1 1 10 HIS HA H -4.060 -0.739 -3.677 1.00 . A A . 10 HIS HA 1 1 15 6223 1 1 10 HIS HB2 H -5.122 1.112 -4.504 1.00 . A A . 10 HIS HB2 1 1 15 6224 1 1 10 HIS HB3 H -6.521 0.209 -3.944 1.00 . A A . 10 HIS HB3 1 1 15 6225 1 1 10 HIS HD1 H -4.205 3.014 -2.820 1.00 . A A . 10 HIS HD1 1 1 15 6226 1 1 10 HIS HD2 H -8.021 1.509 -2.002 1.00 . A A . 10 HIS HD2 1 1 15 6227 1 1 10 HIS HE1 H -5.327 4.686 -1.265 1.00 . A A . 10 HIS HE1 1 1 15 6228 1 1 10 HIS HE2 H -7.635 3.754 -0.707 1.00 . A A . 10 HIS HE2 1 1 15 6229 1 1 10 HIS N N -5.478 -1.292 -2.260 1.00 . A A . 10 HIS N 1 1 15 6230 1 1 10 HIS ND1 N -5.120 2.910 -2.463 1.00 . A A . 10 HIS ND1 1 1 15 6231 1 1 10 HIS NE2 N -6.980 3.325 -1.311 1.00 . A A . 10 HIS NE2 1 1 15 6232 1 1 10 HIS O O -2.703 0.779 -2.130 1.00 . A A . 10 HIS O 1 1 15 6233 1 1 11 HIS C C -2.501 0.423 0.596 1.00 . A A . 11 HIS C 1 1 15 6234 1 1 11 HIS CA C -3.828 1.112 0.384 1.00 . A A . 11 HIS CA 1 1 15 6235 1 1 11 HIS CB C -4.709 0.845 1.583 1.00 . A A . 11 HIS CB 1 1 15 6236 1 1 11 HIS CD2 C -6.598 2.647 1.812 1.00 . A A . 11 HIS CD2 1 1 15 6237 1 1 11 HIS CE1 C -5.551 4.054 3.081 1.00 . A A . 11 HIS CE1 1 1 15 6238 1 1 11 HIS CG C -5.356 2.118 2.048 1.00 . A A . 11 HIS CG 1 1 15 6239 1 1 11 HIS H H -5.374 0.187 -0.675 1.00 . A A . 11 HIS H 1 1 15 6240 1 1 11 HIS HA H -3.687 2.171 0.249 1.00 . A A . 11 HIS HA 1 1 15 6241 1 1 11 HIS HB2 H -5.471 0.132 1.291 1.00 . A A . 11 HIS HB2 1 1 15 6242 1 1 11 HIS HB3 H -4.105 0.425 2.373 1.00 . A A . 11 HIS HB3 1 1 15 6243 1 1 11 HIS HD1 H -3.788 2.949 3.221 1.00 . A A . 11 HIS HD1 1 1 15 6244 1 1 11 HIS HD2 H -7.371 2.179 1.219 1.00 . A A . 11 HIS HD2 1 1 15 6245 1 1 11 HIS HE1 H -5.317 4.914 3.692 1.00 . A A . 11 HIS HE1 1 1 15 6246 1 1 11 HIS HE2 H -7.493 4.472 2.455 1.00 . A A . 11 HIS HE2 1 1 15 6247 1 1 11 HIS N N -4.466 0.536 -0.764 1.00 . A A . 11 HIS N 1 1 15 6248 1 1 11 HIS ND1 N -4.703 3.031 2.862 1.00 . A A . 11 HIS ND1 1 1 15 6249 1 1 11 HIS NE2 N -6.720 3.868 2.465 1.00 . A A . 11 HIS NE2 1 1 15 6250 1 1 11 HIS O O -1.549 1.004 1.113 1.00 . A A . 11 HIS O 1 1 15 6251 1 1 12 LEU C C -0.286 -1.193 -0.765 1.00 . A A . 12 LEU C 1 1 15 6252 1 1 12 LEU CA C -1.234 -1.602 0.323 1.00 . A A . 12 LEU CA 1 1 15 6253 1 1 12 LEU CB C -1.531 -3.095 0.188 1.00 . A A . 12 LEU CB 1 1 15 6254 1 1 12 LEU CD1 C -1.436 -3.723 2.587 1.00 . A A . 12 LEU CD1 1 1 15 6255 1 1 12 LEU CD2 C -0.714 -5.353 0.831 1.00 . A A . 12 LEU CD2 1 1 15 6256 1 1 12 LEU CG C -0.748 -3.877 1.233 1.00 . A A . 12 LEU CG 1 1 15 6257 1 1 12 LEU H H -3.257 -1.239 -0.248 1.00 . A A . 12 LEU H 1 1 15 6258 1 1 12 LEU HA H -0.792 -1.395 1.287 1.00 . A A . 12 LEU HA 1 1 15 6259 1 1 12 LEU HB2 H -2.587 -3.265 0.327 1.00 . A A . 12 LEU HB2 1 1 15 6260 1 1 12 LEU HB3 H -1.244 -3.430 -0.797 1.00 . A A . 12 LEU HB3 1 1 15 6261 1 1 12 LEU HD11 H -2.012 -2.810 2.592 1.00 . A A . 12 LEU HD11 1 1 15 6262 1 1 12 LEU HD12 H -0.690 -3.684 3.367 1.00 . A A . 12 LEU HD12 1 1 15 6263 1 1 12 LEU HD13 H -2.095 -4.563 2.755 1.00 . A A . 12 LEU HD13 1 1 15 6264 1 1 12 LEU HD21 H -1.480 -5.890 1.367 1.00 . A A . 12 LEU HD21 1 1 15 6265 1 1 12 LEU HD22 H 0.253 -5.767 1.069 1.00 . A A . 12 LEU HD22 1 1 15 6266 1 1 12 LEU HD23 H -0.889 -5.442 -0.233 1.00 . A A . 12 LEU HD23 1 1 15 6267 1 1 12 LEU HG H 0.260 -3.493 1.293 1.00 . A A . 12 LEU HG 1 1 15 6268 1 1 12 LEU N N -2.453 -0.831 0.182 1.00 . A A . 12 LEU N 1 1 15 6269 1 1 12 LEU O O 0.906 -0.980 -0.542 1.00 . A A . 12 LEU O 1 1 15 6270 1 1 13 ALA C C 0.621 0.652 -2.784 1.00 . A A . 13 ALA C 1 1 15 6271 1 1 13 ALA CA C -0.074 -0.656 -3.106 1.00 . A A . 13 ALA CA 1 1 15 6272 1 1 13 ALA CB C -0.979 -0.477 -4.325 1.00 . A A . 13 ALA CB 1 1 15 6273 1 1 13 ALA H H -1.819 -1.240 -2.015 1.00 . A A . 13 ALA H 1 1 15 6274 1 1 13 ALA HA H 0.669 -1.410 -3.320 1.00 . A A . 13 ALA HA 1 1 15 6275 1 1 13 ALA HB1 H -1.493 -1.402 -4.536 1.00 . A A . 13 ALA HB1 1 1 15 6276 1 1 13 ALA HB2 H -0.378 -0.195 -5.178 1.00 . A A . 13 ALA HB2 1 1 15 6277 1 1 13 ALA HB3 H -1.701 0.299 -4.124 1.00 . A A . 13 ALA HB3 1 1 15 6278 1 1 13 ALA N N -0.850 -1.068 -1.942 1.00 . A A . 13 ALA N 1 1 15 6279 1 1 13 ALA O O 1.720 0.938 -3.258 1.00 . A A . 13 ALA O 1 1 15 6280 1 1 14 HIS C C 1.687 2.482 -0.617 1.00 . A A . 14 HIS C 1 1 15 6281 1 1 14 HIS CA C 0.483 2.710 -1.504 1.00 . A A . 14 HIS CA 1 1 15 6282 1 1 14 HIS CB C -0.617 3.448 -0.754 1.00 . A A . 14 HIS CB 1 1 15 6283 1 1 14 HIS CD2 C -0.279 4.332 1.686 1.00 . A A . 14 HIS CD2 1 1 15 6284 1 1 14 HIS CE1 C 1.192 5.870 1.280 1.00 . A A . 14 HIS CE1 1 1 15 6285 1 1 14 HIS CG C -0.048 4.311 0.337 1.00 . A A . 14 HIS CG 1 1 15 6286 1 1 14 HIS H H -0.903 1.124 -1.597 1.00 . A A . 14 HIS H 1 1 15 6287 1 1 14 HIS HA H 0.777 3.287 -2.360 1.00 . A A . 14 HIS HA 1 1 15 6288 1 1 14 HIS HB2 H -1.144 4.053 -1.451 1.00 . A A . 14 HIS HB2 1 1 15 6289 1 1 14 HIS HB3 H -1.299 2.733 -0.322 1.00 . A A . 14 HIS HB3 1 1 15 6290 1 1 14 HIS HD1 H 1.281 5.538 -0.779 1.00 . A A . 14 HIS HD1 1 1 15 6291 1 1 14 HIS HD2 H -0.946 3.661 2.210 1.00 . A A . 14 HIS HD2 1 1 15 6292 1 1 14 HIS HE1 H 1.908 6.674 1.404 1.00 . A A . 14 HIS HE1 1 1 15 6293 1 1 14 HIS HE2 H 0.539 5.560 3.238 1.00 . A A . 14 HIS HE2 1 1 15 6294 1 1 14 HIS N N -0.039 1.431 -1.945 1.00 . A A . 14 HIS N 1 1 15 6295 1 1 14 HIS ND1 N 0.895 5.300 0.095 1.00 . A A . 14 HIS ND1 1 1 15 6296 1 1 14 HIS NE2 N 0.501 5.320 2.283 1.00 . A A . 14 HIS NE2 1 1 15 6297 1 1 14 HIS O O 2.774 3.015 -0.862 1.00 . A A . 14 HIS O 1 1 15 6298 1 1 15 LEU C C 3.678 0.731 0.382 1.00 . A A . 15 LEU C 1 1 15 6299 1 1 15 LEU CA C 2.602 1.298 1.256 1.00 . A A . 15 LEU CA 1 1 15 6300 1 1 15 LEU CB C 2.193 0.208 2.252 1.00 . A A . 15 LEU CB 1 1 15 6301 1 1 15 LEU CD1 C 0.729 2.083 3.087 1.00 . A A . 15 LEU CD1 1 1 15 6302 1 1 15 LEU CD2 C 0.415 -0.241 3.933 1.00 . A A . 15 LEU CD2 1 1 15 6303 1 1 15 LEU CG C 1.444 0.785 3.461 1.00 . A A . 15 LEU CG 1 1 15 6304 1 1 15 LEU H H 0.634 1.214 0.492 1.00 . A A . 15 LEU H 1 1 15 6305 1 1 15 LEU HA H 2.963 2.171 1.766 1.00 . A A . 15 LEU HA 1 1 15 6306 1 1 15 LEU HB2 H 1.558 -0.504 1.747 1.00 . A A . 15 LEU HB2 1 1 15 6307 1 1 15 LEU HB3 H 3.084 -0.301 2.595 1.00 . A A . 15 LEU HB3 1 1 15 6308 1 1 15 LEU HD11 H 1.453 2.876 2.974 1.00 . A A . 15 LEU HD11 1 1 15 6309 1 1 15 LEU HD12 H 0.029 2.345 3.868 1.00 . A A . 15 LEU HD12 1 1 15 6310 1 1 15 LEU HD13 H 0.195 1.946 2.161 1.00 . A A . 15 LEU HD13 1 1 15 6311 1 1 15 LEU HD21 H 0.507 -0.377 4.998 1.00 . A A . 15 LEU HD21 1 1 15 6312 1 1 15 LEU HD22 H 0.591 -1.183 3.435 1.00 . A A . 15 LEU HD22 1 1 15 6313 1 1 15 LEU HD23 H -0.579 0.111 3.696 1.00 . A A . 15 LEU HD23 1 1 15 6314 1 1 15 LEU HG H 2.147 0.980 4.256 1.00 . A A . 15 LEU HG 1 1 15 6315 1 1 15 LEU N N 1.504 1.641 0.380 1.00 . A A . 15 LEU N 1 1 15 6316 1 1 15 LEU O O 4.867 0.968 0.566 1.00 . A A . 15 LEU O 1 1 15 6317 1 1 16 ALA C C 4.832 0.396 -2.352 1.00 . A A . 16 ALA C 1 1 15 6318 1 1 16 ALA CA C 4.093 -0.655 -1.547 1.00 . A A . 16 ALA CA 1 1 15 6319 1 1 16 ALA CB C 3.292 -1.557 -2.487 1.00 . A A . 16 ALA CB 1 1 15 6320 1 1 16 ALA H H 2.220 -0.128 -0.663 1.00 . A A . 16 ALA H 1 1 15 6321 1 1 16 ALA HA H 4.806 -1.252 -1.012 1.00 . A A . 16 ALA HA 1 1 15 6322 1 1 16 ALA HB1 H 3.944 -2.305 -2.910 1.00 . A A . 16 ALA HB1 1 1 15 6323 1 1 16 ALA HB2 H 2.867 -0.963 -3.282 1.00 . A A . 16 ALA HB2 1 1 15 6324 1 1 16 ALA HB3 H 2.499 -2.040 -1.938 1.00 . A A . 16 ALA HB3 1 1 15 6325 1 1 16 ALA N N 3.207 -0.015 -0.590 1.00 . A A . 16 ALA N 1 1 15 6326 1 1 16 ALA O O 5.953 0.174 -2.804 1.00 . A A . 16 ALA O 1 1 15 6327 1 1 17 LEU C C 6.045 3.114 -2.627 1.00 . A A . 17 LEU C 1 1 15 6328 1 1 17 LEU CA C 4.768 2.633 -3.277 1.00 . A A . 17 LEU CA 1 1 15 6329 1 1 17 LEU CB C 3.734 3.774 -3.430 1.00 . A A . 17 LEU CB 1 1 15 6330 1 1 17 LEU CD1 C 5.329 5.730 -3.427 1.00 . A A . 17 LEU CD1 1 1 15 6331 1 1 17 LEU CD2 C 2.979 6.020 -2.604 1.00 . A A . 17 LEU CD2 1 1 15 6332 1 1 17 LEU CG C 4.169 5.050 -2.685 1.00 . A A . 17 LEU CG 1 1 15 6333 1 1 17 LEU H H 3.290 1.637 -2.131 1.00 . A A . 17 LEU H 1 1 15 6334 1 1 17 LEU HA H 5.024 2.267 -4.249 1.00 . A A . 17 LEU HA 1 1 15 6335 1 1 17 LEU HB2 H 3.616 4.003 -4.472 1.00 . A A . 17 LEU HB2 1 1 15 6336 1 1 17 LEU HB3 H 2.788 3.442 -3.031 1.00 . A A . 17 LEU HB3 1 1 15 6337 1 1 17 LEU HD11 H 5.727 5.060 -4.175 1.00 . A A . 17 LEU HD11 1 1 15 6338 1 1 17 LEU HD12 H 6.107 5.985 -2.722 1.00 . A A . 17 LEU HD12 1 1 15 6339 1 1 17 LEU HD13 H 4.974 6.630 -3.908 1.00 . A A . 17 LEU HD13 1 1 15 6340 1 1 17 LEU HD21 H 2.066 5.500 -2.853 1.00 . A A . 17 LEU HD21 1 1 15 6341 1 1 17 LEU HD22 H 3.124 6.834 -3.299 1.00 . A A . 17 LEU HD22 1 1 15 6342 1 1 17 LEU HD23 H 2.906 6.414 -1.603 1.00 . A A . 17 LEU HD23 1 1 15 6343 1 1 17 LEU HG H 4.480 4.797 -1.685 1.00 . A A . 17 LEU HG 1 1 15 6344 1 1 17 LEU N N 4.186 1.536 -2.523 1.00 . A A . 17 LEU N 1 1 15 6345 1 1 17 LEU O O 7.083 3.208 -3.277 1.00 . A A . 17 LEU O 1 1 15 6346 1 1 18 HIS C C 8.060 2.687 -0.370 1.00 . A A . 18 HIS C 1 1 15 6347 1 1 18 HIS CA C 7.183 3.867 -0.661 1.00 . A A . 18 HIS CA 1 1 15 6348 1 1 18 HIS CB C 6.842 4.632 0.597 1.00 . A A . 18 HIS CB 1 1 15 6349 1 1 18 HIS CD2 C 5.027 3.293 1.893 1.00 . A A . 18 HIS CD2 1 1 15 6350 1 1 18 HIS CE1 C 6.260 2.552 3.516 1.00 . A A . 18 HIS CE1 1 1 15 6351 1 1 18 HIS CG C 6.295 3.741 1.665 1.00 . A A . 18 HIS CG 1 1 15 6352 1 1 18 HIS H H 5.125 3.304 -0.862 1.00 . A A . 18 HIS H 1 1 15 6353 1 1 18 HIS HA H 7.716 4.525 -1.327 1.00 . A A . 18 HIS HA 1 1 15 6354 1 1 18 HIS HB2 H 7.722 5.132 0.961 1.00 . A A . 18 HIS HB2 1 1 15 6355 1 1 18 HIS HB3 H 6.100 5.348 0.339 1.00 . A A . 18 HIS HB3 1 1 15 6356 1 1 18 HIS HD1 H 8.034 3.412 2.836 1.00 . A A . 18 HIS HD1 1 1 15 6357 1 1 18 HIS HD2 H 4.176 3.493 1.251 1.00 . A A . 18 HIS HD2 1 1 15 6358 1 1 18 HIS HE1 H 6.591 2.043 4.413 1.00 . A A . 18 HIS HE1 1 1 15 6359 1 1 18 HIS HE2 H 4.220 2.116 3.482 1.00 . A A . 18 HIS HE2 1 1 15 6360 1 1 18 HIS N N 5.982 3.408 -1.346 1.00 . A A . 18 HIS N 1 1 15 6361 1 1 18 HIS ND1 N 7.070 3.260 2.707 1.00 . A A . 18 HIS ND1 1 1 15 6362 1 1 18 HIS NE2 N 4.998 2.545 3.067 1.00 . A A . 18 HIS NE2 1 1 15 6363 1 1 18 HIS O O 9.281 2.750 -0.523 1.00 . A A . 18 HIS O 1 1 15 6364 1 1 19 LEU C C 9.060 0.151 -0.965 1.00 . A A . 19 LEU C 1 1 15 6365 1 1 19 LEU CA C 8.160 0.363 0.230 1.00 . A A . 19 LEU CA 1 1 15 6366 1 1 19 LEU CB C 7.208 -0.829 0.343 1.00 . A A . 19 LEU CB 1 1 15 6367 1 1 19 LEU CD1 C 8.462 -1.550 2.386 1.00 . A A . 19 LEU CD1 1 1 15 6368 1 1 19 LEU CD2 C 6.379 -0.192 2.603 1.00 . A A . 19 LEU CD2 1 1 15 6369 1 1 19 LEU CG C 7.078 -1.279 1.793 1.00 . A A . 19 LEU CG 1 1 15 6370 1 1 19 LEU H H 6.441 1.612 0.053 1.00 . A A . 19 LEU H 1 1 15 6371 1 1 19 LEU HA H 8.753 0.456 1.124 1.00 . A A . 19 LEU HA 1 1 15 6372 1 1 19 LEU HB2 H 6.239 -0.543 -0.026 1.00 . A A . 19 LEU HB2 1 1 15 6373 1 1 19 LEU HB3 H 7.585 -1.650 -0.250 1.00 . A A . 19 LEU HB3 1 1 15 6374 1 1 19 LEU HD11 H 8.405 -2.397 3.054 1.00 . A A . 19 LEU HD11 1 1 15 6375 1 1 19 LEU HD12 H 8.795 -0.680 2.936 1.00 . A A . 19 LEU HD12 1 1 15 6376 1 1 19 LEU HD13 H 9.160 -1.764 1.592 1.00 . A A . 19 LEU HD13 1 1 15 6377 1 1 19 LEU HD21 H 6.779 -0.174 3.606 1.00 . A A . 19 LEU HD21 1 1 15 6378 1 1 19 LEU HD22 H 5.319 -0.397 2.640 1.00 . A A . 19 LEU HD22 1 1 15 6379 1 1 19 LEU HD23 H 6.544 0.764 2.132 1.00 . A A . 19 LEU HD23 1 1 15 6380 1 1 19 LEU HG H 6.492 -2.179 1.822 1.00 . A A . 19 LEU HG 1 1 15 6381 1 1 19 LEU N N 7.423 1.594 -0.010 1.00 . A A . 19 LEU N 1 1 15 6382 1 1 19 LEU O O 10.172 -0.375 -0.856 1.00 . A A . 19 LEU O 1 1 15 6383 1 1 20 ALA C C 10.509 1.406 -3.290 1.00 . A A . 20 ALA C 1 1 15 6384 1 1 20 ALA CA C 9.302 0.497 -3.361 1.00 . A A . 20 ALA CA 1 1 15 6385 1 1 20 ALA CB C 8.435 0.906 -4.553 1.00 . A A . 20 ALA CB 1 1 15 6386 1 1 20 ALA H H 7.660 1.033 -2.096 1.00 . A A . 20 ALA H 1 1 15 6387 1 1 20 ALA HA H 9.633 -0.516 -3.497 1.00 . A A . 20 ALA HA 1 1 15 6388 1 1 20 ALA HB1 H 7.433 0.539 -4.417 1.00 . A A . 20 ALA HB1 1 1 15 6389 1 1 20 ALA HB2 H 8.851 0.491 -5.458 1.00 . A A . 20 ALA HB2 1 1 15 6390 1 1 20 ALA HB3 H 8.418 1.985 -4.632 1.00 . A A . 20 ALA HB3 1 1 15 6391 1 1 20 ALA N N 8.556 0.600 -2.109 1.00 . A A . 20 ALA N 1 1 15 6392 1 1 20 ALA O O 11.656 0.962 -3.380 1.00 . A A . 20 ALA O 1 1 15 6393 1 1 21 LEU C C 12.315 3.165 -1.996 1.00 . A A . 21 LEU C 1 1 15 6394 1 1 21 LEU CA C 11.288 3.671 -2.985 1.00 . A A . 21 LEU CA 1 1 15 6395 1 1 21 LEU CB C 10.723 5.002 -2.484 1.00 . A A . 21 LEU CB 1 1 15 6396 1 1 21 LEU CD1 C 9.078 6.828 -2.934 1.00 . A A . 21 LEU CD1 1 1 15 6397 1 1 21 LEU CD2 C 10.140 5.618 -4.841 1.00 . A A . 21 LEU CD2 1 1 15 6398 1 1 21 LEU CG C 9.601 5.475 -3.416 1.00 . A A . 21 LEU CG 1 1 15 6399 1 1 21 LEU H H 9.293 2.954 -3.024 1.00 . A A . 21 LEU H 1 1 15 6400 1 1 21 LEU HA H 11.752 3.816 -3.941 1.00 . A A . 21 LEU HA 1 1 15 6401 1 1 21 LEU HB2 H 10.333 4.872 -1.482 1.00 . A A . 21 LEU HB2 1 1 15 6402 1 1 21 LEU HB3 H 11.511 5.743 -2.467 1.00 . A A . 21 LEU HB3 1 1 15 6403 1 1 21 LEU HD11 H 8.831 6.767 -1.883 1.00 . A A . 21 LEU HD11 1 1 15 6404 1 1 21 LEU HD12 H 8.193 7.090 -3.497 1.00 . A A . 21 LEU HD12 1 1 15 6405 1 1 21 LEU HD13 H 9.837 7.582 -3.084 1.00 . A A . 21 LEU HD13 1 1 15 6406 1 1 21 LEU HD21 H 10.036 4.676 -5.361 1.00 . A A . 21 LEU HD21 1 1 15 6407 1 1 21 LEU HD22 H 11.184 5.900 -4.806 1.00 . A A . 21 LEU HD22 1 1 15 6408 1 1 21 LEU HD23 H 9.578 6.382 -5.363 1.00 . A A . 21 LEU HD23 1 1 15 6409 1 1 21 LEU HG H 8.795 4.756 -3.405 1.00 . A A . 21 LEU HG 1 1 15 6410 1 1 21 LEU N N 10.230 2.681 -3.103 1.00 . A A . 21 LEU N 1 1 15 6411 1 1 21 LEU O O 13.516 3.148 -2.272 1.00 . A A . 21 LEU O 1 1 15 6412 1 1 22 ALA C C 13.484 1.041 -0.347 1.00 . A A . 22 ALA C 1 1 15 6413 1 1 22 ALA CA C 12.666 2.197 0.202 1.00 . A A . 22 ALA CA 1 1 15 6414 1 1 22 ALA CB C 11.816 1.716 1.380 1.00 . A A . 22 ALA CB 1 1 15 6415 1 1 22 ALA H H 10.840 2.776 -0.715 1.00 . A A . 22 ALA H 1 1 15 6416 1 1 22 ALA HA H 13.336 2.967 0.539 1.00 . A A . 22 ALA HA 1 1 15 6417 1 1 22 ALA HB1 H 12.462 1.433 2.199 1.00 . A A . 22 ALA HB1 1 1 15 6418 1 1 22 ALA HB2 H 11.225 0.866 1.078 1.00 . A A . 22 ALA HB2 1 1 15 6419 1 1 22 ALA HB3 H 11.162 2.514 1.698 1.00 . A A . 22 ALA HB3 1 1 15 6420 1 1 22 ALA N N 11.814 2.736 -0.848 1.00 . A A . 22 ALA N 1 1 15 6421 1 1 22 ALA O O 14.682 0.925 -0.085 1.00 . A A . 22 ALA O 1 1 15 6422 1 1 23 LEU C C 14.590 -0.420 -2.664 1.00 . A A . 23 LEU C 1 1 15 6423 1 1 23 LEU CA C 13.489 -0.931 -1.753 1.00 . A A . 23 LEU CA 1 1 15 6424 1 1 23 LEU CB C 12.490 -1.766 -2.566 1.00 . A A . 23 LEU CB 1 1 15 6425 1 1 23 LEU CD1 C 11.312 -3.966 -2.520 1.00 . A A . 23 LEU CD1 1 1 15 6426 1 1 23 LEU CD2 C 13.769 -3.888 -2.943 1.00 . A A . 23 LEU CD2 1 1 15 6427 1 1 23 LEU CG C 12.613 -3.243 -2.176 1.00 . A A . 23 LEU CG 1 1 15 6428 1 1 23 LEU H H 11.876 0.369 -1.319 1.00 . A A . 23 LEU H 1 1 15 6429 1 1 23 LEU HA H 13.923 -1.543 -0.985 1.00 . A A . 23 LEU HA 1 1 15 6430 1 1 23 LEU HB2 H 11.487 -1.422 -2.365 1.00 . A A . 23 LEU HB2 1 1 15 6431 1 1 23 LEU HB3 H 12.701 -1.653 -3.620 1.00 . A A . 23 LEU HB3 1 1 15 6432 1 1 23 LEU HD11 H 10.483 -3.451 -2.059 1.00 . A A . 23 LEU HD11 1 1 15 6433 1 1 23 LEU HD12 H 11.359 -4.977 -2.152 1.00 . A A . 23 LEU HD12 1 1 15 6434 1 1 23 LEU HD13 H 11.177 -3.977 -3.591 1.00 . A A . 23 LEU HD13 1 1 15 6435 1 1 23 LEU HD21 H 13.750 -4.957 -2.790 1.00 . A A . 23 LEU HD21 1 1 15 6436 1 1 23 LEU HD22 H 14.707 -3.489 -2.584 1.00 . A A . 23 LEU HD22 1 1 15 6437 1 1 23 LEU HD23 H 13.666 -3.674 -3.997 1.00 . A A . 23 LEU HD23 1 1 15 6438 1 1 23 LEU HG H 12.794 -3.322 -1.115 1.00 . A A . 23 LEU HG 1 1 15 6439 1 1 23 LEU N N 12.825 0.205 -1.134 1.00 . A A . 23 LEU N 1 1 15 6440 1 1 23 LEU O O 15.738 -0.862 -2.591 1.00 . A A . 23 LEU O 1 1 15 6441 1 1 24 LYS C C 16.296 1.810 -3.645 1.00 . A A . 24 LYS C 1 1 15 6442 1 1 24 LYS CA C 15.184 1.129 -4.429 1.00 . A A . 24 LYS CA 1 1 15 6443 1 1 24 LYS CB C 14.486 2.157 -5.329 1.00 . A A . 24 LYS CB 1 1 15 6444 1 1 24 LYS CD C 15.526 3.682 -7.039 1.00 . A A . 24 LYS CD 1 1 15 6445 1 1 24 LYS CE C 16.690 4.193 -6.178 1.00 . A A . 24 LYS CE 1 1 15 6446 1 1 24 LYS CG C 15.199 2.224 -6.687 1.00 . A A . 24 LYS CG 1 1 15 6447 1 1 24 LYS H H 13.294 0.841 -3.496 1.00 . A A . 24 LYS H 1 1 15 6448 1 1 24 LYS HA H 15.609 0.353 -5.041 1.00 . A A . 24 LYS HA 1 1 15 6449 1 1 24 LYS HB2 H 13.456 1.861 -5.477 1.00 . A A . 24 LYS HB2 1 1 15 6450 1 1 24 LYS HB3 H 14.516 3.127 -4.856 1.00 . A A . 24 LYS HB3 1 1 15 6451 1 1 24 LYS HD2 H 15.797 3.748 -8.084 1.00 . A A . 24 LYS HD2 1 1 15 6452 1 1 24 LYS HD3 H 14.655 4.296 -6.858 1.00 . A A . 24 LYS HD3 1 1 15 6453 1 1 24 LYS HE2 H 17.105 5.081 -6.629 1.00 . A A . 24 LYS HE2 1 1 15 6454 1 1 24 LYS HE3 H 16.324 4.430 -5.191 1.00 . A A . 24 LYS HE3 1 1 15 6455 1 1 24 LYS HG2 H 16.109 1.648 -6.648 1.00 . A A . 24 LYS HG2 1 1 15 6456 1 1 24 LYS HG3 H 14.552 1.812 -7.448 1.00 . A A . 24 LYS HG3 1 1 15 6457 1 1 24 LYS HZ1 H 17.677 2.662 -5.154 1.00 . A A . 24 LYS HZ1 1 1 15 6458 1 1 24 LYS HZ2 H 18.685 3.593 -6.154 1.00 . A A . 24 LYS HZ2 1 1 15 6459 1 1 24 LYS HZ3 H 17.636 2.458 -6.845 1.00 . A A . 24 LYS HZ3 1 1 15 6460 1 1 24 LYS N N 14.226 0.530 -3.507 1.00 . A A . 24 LYS N 1 1 15 6461 1 1 24 LYS NZ N 17.750 3.148 -6.079 1.00 . A A . 24 LYS NZ 1 1 15 6462 1 1 24 LYS O O 17.449 1.841 -4.078 1.00 . A A . 24 LYS O 1 1 15 6463 1 1 25 LYS C C 17.470 4.267 -2.291 1.00 . A A . 25 LYS C 1 1 15 6464 1 1 25 LYS CA C 16.872 3.036 -1.611 1.00 . A A . 25 LYS CA 1 1 15 6465 1 1 25 LYS CB C 17.998 2.084 -1.187 1.00 . A A . 25 LYS CB 1 1 15 6466 1 1 25 LYS CD C 19.940 2.379 0.372 1.00 . A A . 25 LYS CD 1 1 15 6467 1 1 25 LYS CE C 20.494 3.785 0.137 1.00 . A A . 25 LYS CE 1 1 15 6468 1 1 25 LYS CG C 18.414 2.393 0.258 1.00 . A A . 25 LYS CG 1 1 15 6469 1 1 25 LYS H H 14.986 2.280 -2.222 1.00 . A A . 25 LYS H 1 1 15 6470 1 1 25 LYS HA H 16.341 3.355 -0.728 1.00 . A A . 25 LYS HA 1 1 15 6471 1 1 25 LYS HB2 H 17.648 1.061 -1.251 1.00 . A A . 25 LYS HB2 1 1 15 6472 1 1 25 LYS HB3 H 18.847 2.213 -1.842 1.00 . A A . 25 LYS HB3 1 1 15 6473 1 1 25 LYS HD2 H 20.225 2.040 1.356 1.00 . A A . 25 LYS HD2 1 1 15 6474 1 1 25 LYS HD3 H 20.349 1.709 -0.369 1.00 . A A . 25 LYS HD3 1 1 15 6475 1 1 25 LYS HE2 H 21.573 3.744 0.134 1.00 . A A . 25 LYS HE2 1 1 15 6476 1 1 25 LYS HE3 H 20.148 4.150 -0.820 1.00 . A A . 25 LYS HE3 1 1 15 6477 1 1 25 LYS HG2 H 18.041 3.363 0.542 1.00 . A A . 25 LYS HG2 1 1 15 6478 1 1 25 LYS HG3 H 18.002 1.641 0.918 1.00 . A A . 25 LYS HG3 1 1 15 6479 1 1 25 LYS HZ1 H 20.845 4.960 1.819 1.00 . A A . 25 LYS HZ1 1 1 15 6480 1 1 25 LYS HZ2 H 19.304 4.252 1.791 1.00 . A A . 25 LYS HZ2 1 1 15 6481 1 1 25 LYS HZ3 H 19.646 5.584 0.783 1.00 . A A . 25 LYS HZ3 1 1 15 6482 1 1 25 LYS N N 15.928 2.348 -2.491 1.00 . A A . 25 LYS N 1 1 15 6483 1 1 25 LYS NZ N 20.039 4.709 1.215 1.00 . A A . 25 LYS NZ 1 1 15 6484 1 1 25 LYS O O 17.736 4.262 -3.495 1.00 . A A . 25 LYS O 1 1 15 6485 1 1 26 ALA C C 19.130 7.216 -0.968 1.00 . A A . 26 ALA C 1 1 15 6486 1 1 26 ALA CA C 18.261 6.549 -2.028 1.00 . A A . 26 ALA CA 1 1 15 6487 1 1 26 ALA CB C 17.143 7.505 -2.451 1.00 . A A . 26 ALA CB 1 1 15 6488 1 1 26 ALA H H 17.464 5.259 -0.554 1.00 . A A . 26 ALA H 1 1 15 6489 1 1 26 ALA HA H 18.868 6.319 -2.891 1.00 . A A . 26 ALA HA 1 1 15 6490 1 1 26 ALA HB1 H 16.493 7.695 -1.608 1.00 . A A . 26 ALA HB1 1 1 15 6491 1 1 26 ALA HB2 H 16.569 7.058 -3.252 1.00 . A A . 26 ALA HB2 1 1 15 6492 1 1 26 ALA HB3 H 17.570 8.435 -2.793 1.00 . A A . 26 ALA HB3 1 1 15 6493 1 1 26 ALA N N 17.689 5.317 -1.507 1.00 . A A . 26 ALA N 1 1 15 6494 1 1 26 ALA O O 19.734 8.222 -1.272 1.00 . A A . 26 ALA O 1 1 15 6495 1 1 26 ALA OXT O 19.176 6.708 0.135 1.00 . A A . 26 ALA OXT 1 1 16 6496 1 1 1 LYS C C -23.294 3.336 -7.551 1.00 . A A . 1 LYS C 1 1 16 6497 1 1 1 LYS CA C -24.345 3.345 -8.658 1.00 . A A . 1 LYS CA 1 1 16 6498 1 1 1 LYS CB C -24.069 4.464 -9.673 1.00 . A A . 1 LYS CB 1 1 16 6499 1 1 1 LYS CD C -25.404 5.316 -11.635 1.00 . A A . 1 LYS CD 1 1 16 6500 1 1 1 LYS CE C -24.856 5.567 -13.048 1.00 . A A . 1 LYS CE 1 1 16 6501 1 1 1 LYS CG C -24.703 4.097 -11.026 1.00 . A A . 1 LYS CG 1 1 16 6502 1 1 1 LYS H1 H -26.425 3.339 -8.726 1.00 . A A . 1 LYS H1 1 1 16 6503 1 1 1 LYS H2 H -25.769 4.550 -7.736 1.00 . A A . 1 LYS H2 1 1 16 6504 1 1 1 LYS H3 H -25.781 2.936 -7.212 1.00 . A A . 1 LYS H3 1 1 16 6505 1 1 1 LYS HA H -24.338 2.392 -9.161 1.00 . A A . 1 LYS HA 1 1 16 6506 1 1 1 LYS HB2 H -24.494 5.389 -9.309 1.00 . A A . 1 LYS HB2 1 1 16 6507 1 1 1 LYS HB3 H -23.004 4.582 -9.795 1.00 . A A . 1 LYS HB3 1 1 16 6508 1 1 1 LYS HD2 H -26.469 5.126 -11.691 1.00 . A A . 1 LYS HD2 1 1 16 6509 1 1 1 LYS HD3 H -25.228 6.186 -11.020 1.00 . A A . 1 LYS HD3 1 1 16 6510 1 1 1 LYS HE2 H -24.755 4.623 -13.563 1.00 . A A . 1 LYS HE2 1 1 16 6511 1 1 1 LYS HE3 H -25.544 6.199 -13.594 1.00 . A A . 1 LYS HE3 1 1 16 6512 1 1 1 LYS HG2 H -23.931 3.755 -11.695 1.00 . A A . 1 LYS HG2 1 1 16 6513 1 1 1 LYS HG3 H -25.424 3.304 -10.883 1.00 . A A . 1 LYS HG3 1 1 16 6514 1 1 1 LYS HZ1 H -22.817 5.563 -12.599 1.00 . A A . 1 LYS HZ1 1 1 16 6515 1 1 1 LYS HZ2 H -23.577 7.061 -12.349 1.00 . A A . 1 LYS HZ2 1 1 16 6516 1 1 1 LYS HZ3 H -23.235 6.539 -13.925 1.00 . A A . 1 LYS HZ3 1 1 16 6517 1 1 1 LYS N N -25.680 3.558 -8.038 1.00 . A A . 1 LYS N 1 1 16 6518 1 1 1 LYS NZ N -23.522 6.232 -12.972 1.00 . A A . 1 LYS NZ 1 1 16 6519 1 1 1 LYS O O -23.637 3.250 -6.371 1.00 . A A . 1 LYS O 1 1 16 6520 1 1 2 LYS C C -20.907 2.038 -6.246 1.00 . A A . 2 LYS C 1 1 16 6521 1 1 2 LYS CA C -20.941 3.393 -6.934 1.00 . A A . 2 LYS CA 1 1 16 6522 1 1 2 LYS CB C -21.146 4.504 -5.892 1.00 . A A . 2 LYS CB 1 1 16 6523 1 1 2 LYS CD C -18.800 4.595 -5.015 1.00 . A A . 2 LYS CD 1 1 16 6524 1 1 2 LYS CE C -19.154 4.567 -3.525 1.00 . A A . 2 LYS CE 1 1 16 6525 1 1 2 LYS CG C -19.880 5.355 -5.794 1.00 . A A . 2 LYS CG 1 1 16 6526 1 1 2 LYS H H -21.793 3.468 -8.878 1.00 . A A . 2 LYS H 1 1 16 6527 1 1 2 LYS HA H -20.001 3.552 -7.437 1.00 . A A . 2 LYS HA 1 1 16 6528 1 1 2 LYS HB2 H -21.976 5.129 -6.192 1.00 . A A . 2 LYS HB2 1 1 16 6529 1 1 2 LYS HB3 H -21.358 4.065 -4.929 1.00 . A A . 2 LYS HB3 1 1 16 6530 1 1 2 LYS HD2 H -18.728 3.582 -5.386 1.00 . A A . 2 LYS HD2 1 1 16 6531 1 1 2 LYS HD3 H -17.850 5.091 -5.146 1.00 . A A . 2 LYS HD3 1 1 16 6532 1 1 2 LYS HE2 H -19.922 3.828 -3.350 1.00 . A A . 2 LYS HE2 1 1 16 6533 1 1 2 LYS HE3 H -18.275 4.312 -2.954 1.00 . A A . 2 LYS HE3 1 1 16 6534 1 1 2 LYS HG2 H -19.518 5.573 -6.792 1.00 . A A . 2 LYS HG2 1 1 16 6535 1 1 2 LYS HG3 H -20.109 6.279 -5.288 1.00 . A A . 2 LYS HG3 1 1 16 6536 1 1 2 LYS HZ1 H -20.651 6.007 -3.357 1.00 . A A . 2 LYS HZ1 1 1 16 6537 1 1 2 LYS HZ2 H -19.097 6.643 -3.580 1.00 . A A . 2 LYS HZ2 1 1 16 6538 1 1 2 LYS HZ3 H -19.540 6.009 -2.074 1.00 . A A . 2 LYS HZ3 1 1 16 6539 1 1 2 LYS N N -22.017 3.412 -7.925 1.00 . A A . 2 LYS N 1 1 16 6540 1 1 2 LYS NZ N -19.649 5.906 -3.104 1.00 . A A . 2 LYS NZ 1 1 16 6541 1 1 2 LYS O O -21.702 1.768 -5.342 1.00 . A A . 2 LYS O 1 1 16 6542 1 1 3 ALA C C -19.227 -0.117 -4.753 1.00 . A A . 3 ALA C 1 1 16 6543 1 1 3 ALA CA C -19.882 -0.158 -6.130 1.00 . A A . 3 ALA CA 1 1 16 6544 1 1 3 ALA CB C -19.059 -1.050 -7.069 1.00 . A A . 3 ALA CB 1 1 16 6545 1 1 3 ALA H H -19.404 1.452 -7.419 1.00 . A A . 3 ALA H 1 1 16 6546 1 1 3 ALA HA H -20.869 -0.581 -6.032 1.00 . A A . 3 ALA HA 1 1 16 6547 1 1 3 ALA HB1 H -18.287 -0.465 -7.546 1.00 . A A . 3 ALA HB1 1 1 16 6548 1 1 3 ALA HB2 H -19.707 -1.472 -7.822 1.00 . A A . 3 ALA HB2 1 1 16 6549 1 1 3 ALA HB3 H -18.603 -1.849 -6.503 1.00 . A A . 3 ALA HB3 1 1 16 6550 1 1 3 ALA N N -20.000 1.181 -6.693 1.00 . A A . 3 ALA N 1 1 16 6551 1 1 3 ALA O O -19.915 -0.112 -3.724 1.00 . A A . 3 ALA O 1 1 16 6552 1 1 4 LEU C C -17.366 1.239 -2.745 1.00 . A A . 4 LEU C 1 1 16 6553 1 1 4 LEU CA C -17.133 -0.065 -3.496 1.00 . A A . 4 LEU CA 1 1 16 6554 1 1 4 LEU CB C -15.636 -0.227 -3.795 1.00 . A A . 4 LEU CB 1 1 16 6555 1 1 4 LEU CD1 C -14.840 2.138 -4.038 1.00 . A A . 4 LEU CD1 1 1 16 6556 1 1 4 LEU CD2 C -13.919 0.347 -5.513 1.00 . A A . 4 LEU CD2 1 1 16 6557 1 1 4 LEU CG C -15.174 0.844 -4.790 1.00 . A A . 4 LEU CG 1 1 16 6558 1 1 4 LEU H H -17.415 -0.104 -5.593 1.00 . A A . 4 LEU H 1 1 16 6559 1 1 4 LEU HA H -17.450 -0.885 -2.872 1.00 . A A . 4 LEU HA 1 1 16 6560 1 1 4 LEU HB2 H -15.072 -0.132 -2.878 1.00 . A A . 4 LEU HB2 1 1 16 6561 1 1 4 LEU HB3 H -15.460 -1.203 -4.220 1.00 . A A . 4 LEU HB3 1 1 16 6562 1 1 4 LEU HD11 H -14.474 1.899 -3.050 1.00 . A A . 4 LEU HD11 1 1 16 6563 1 1 4 LEU HD12 H -15.727 2.747 -3.956 1.00 . A A . 4 LEU HD12 1 1 16 6564 1 1 4 LEU HD13 H -14.081 2.683 -4.582 1.00 . A A . 4 LEU HD13 1 1 16 6565 1 1 4 LEU HD21 H -14.144 -0.563 -6.048 1.00 . A A . 4 LEU HD21 1 1 16 6566 1 1 4 LEU HD22 H -13.142 0.154 -4.790 1.00 . A A . 4 LEU HD22 1 1 16 6567 1 1 4 LEU HD23 H -13.583 1.098 -6.208 1.00 . A A . 4 LEU HD23 1 1 16 6568 1 1 4 LEU HG H -15.957 1.036 -5.510 1.00 . A A . 4 LEU HG 1 1 16 6569 1 1 4 LEU N N -17.895 -0.097 -4.743 1.00 . A A . 4 LEU N 1 1 16 6570 1 1 4 LEU O O -18.146 2.092 -3.177 1.00 . A A . 4 LEU O 1 1 16 6571 1 1 5 LEU C C -15.393 3.089 -0.445 1.00 . A A . 5 LEU C 1 1 16 6572 1 1 5 LEU CA C -16.789 2.574 -0.789 1.00 . A A . 5 LEU CA 1 1 16 6573 1 1 5 LEU CB C -17.564 2.230 0.490 1.00 . A A . 5 LEU CB 1 1 16 6574 1 1 5 LEU CD1 C -16.478 3.786 2.136 1.00 . A A . 5 LEU CD1 1 1 16 6575 1 1 5 LEU CD2 C -18.132 4.685 0.491 1.00 . A A . 5 LEU CD2 1 1 16 6576 1 1 5 LEU CG C -17.764 3.479 1.363 1.00 . A A . 5 LEU CG 1 1 16 6577 1 1 5 LEU H H -16.074 0.666 -1.337 1.00 . A A . 5 LEU H 1 1 16 6578 1 1 5 LEU HA H -17.323 3.338 -1.331 1.00 . A A . 5 LEU HA 1 1 16 6579 1 1 5 LEU HB2 H -18.528 1.825 0.221 1.00 . A A . 5 LEU HB2 1 1 16 6580 1 1 5 LEU HB3 H -17.012 1.488 1.050 1.00 . A A . 5 LEU HB3 1 1 16 6581 1 1 5 LEU HD11 H -15.882 2.891 2.222 1.00 . A A . 5 LEU HD11 1 1 16 6582 1 1 5 LEU HD12 H -16.730 4.142 3.124 1.00 . A A . 5 LEU HD12 1 1 16 6583 1 1 5 LEU HD13 H -15.916 4.546 1.614 1.00 . A A . 5 LEU HD13 1 1 16 6584 1 1 5 LEU HD21 H -18.546 5.464 1.116 1.00 . A A . 5 LEU HD21 1 1 16 6585 1 1 5 LEU HD22 H -18.863 4.391 -0.247 1.00 . A A . 5 LEU HD22 1 1 16 6586 1 1 5 LEU HD23 H -17.246 5.058 -0.005 1.00 . A A . 5 LEU HD23 1 1 16 6587 1 1 5 LEU HG H -18.563 3.288 2.064 1.00 . A A . 5 LEU HG 1 1 16 6588 1 1 5 LEU N N -16.680 1.382 -1.619 1.00 . A A . 5 LEU N 1 1 16 6589 1 1 5 LEU O O -15.028 4.206 -0.807 1.00 . A A . 5 LEU O 1 1 16 6590 1 1 6 ALA C C -12.272 1.631 0.041 1.00 . A A . 6 ALA C 1 1 16 6591 1 1 6 ALA CA C -13.258 2.626 0.632 1.00 . A A . 6 ALA CA 1 1 16 6592 1 1 6 ALA CB C -13.126 2.624 2.156 1.00 . A A . 6 ALA CB 1 1 16 6593 1 1 6 ALA H H -14.961 1.379 0.500 1.00 . A A . 6 ALA H 1 1 16 6594 1 1 6 ALA HA H -13.031 3.614 0.258 1.00 . A A . 6 ALA HA 1 1 16 6595 1 1 6 ALA HB1 H -12.100 2.424 2.430 1.00 . A A . 6 ALA HB1 1 1 16 6596 1 1 6 ALA HB2 H -13.766 1.860 2.570 1.00 . A A . 6 ALA HB2 1 1 16 6597 1 1 6 ALA HB3 H -13.419 3.589 2.542 1.00 . A A . 6 ALA HB3 1 1 16 6598 1 1 6 ALA N N -14.618 2.262 0.250 1.00 . A A . 6 ALA N 1 1 16 6599 1 1 6 ALA O O -12.607 0.456 -0.139 1.00 . A A . 6 ALA O 1 1 16 6600 1 1 7 LEU C C -9.726 0.093 0.147 1.00 . A A . 7 LEU C 1 1 16 6601 1 1 7 LEU CA C -10.047 1.217 -0.824 1.00 . A A . 7 LEU CA 1 1 16 6602 1 1 7 LEU CB C -8.766 1.999 -1.133 1.00 . A A . 7 LEU CB 1 1 16 6603 1 1 7 LEU CD1 C -7.745 3.494 -2.845 1.00 . A A . 7 LEU CD1 1 1 16 6604 1 1 7 LEU CD2 C -10.071 2.658 -3.179 1.00 . A A . 7 LEU CD2 1 1 16 6605 1 1 7 LEU CG C -9.049 3.124 -2.138 1.00 . A A . 7 LEU CG 1 1 16 6606 1 1 7 LEU H H -10.853 3.033 -0.085 1.00 . A A . 7 LEU H 1 1 16 6607 1 1 7 LEU HA H -10.427 0.785 -1.736 1.00 . A A . 7 LEU HA 1 1 16 6608 1 1 7 LEU HB2 H -8.381 2.425 -0.219 1.00 . A A . 7 LEU HB2 1 1 16 6609 1 1 7 LEU HB3 H -8.032 1.327 -1.548 1.00 . A A . 7 LEU HB3 1 1 16 6610 1 1 7 LEU HD11 H -7.586 2.820 -3.675 1.00 . A A . 7 LEU HD11 1 1 16 6611 1 1 7 LEU HD12 H -6.923 3.415 -2.150 1.00 . A A . 7 LEU HD12 1 1 16 6612 1 1 7 LEU HD13 H -7.812 4.506 -3.212 1.00 . A A . 7 LEU HD13 1 1 16 6613 1 1 7 LEU HD21 H -10.069 3.343 -4.015 1.00 . A A . 7 LEU HD21 1 1 16 6614 1 1 7 LEU HD22 H -11.055 2.636 -2.736 1.00 . A A . 7 LEU HD22 1 1 16 6615 1 1 7 LEU HD23 H -9.808 1.670 -3.524 1.00 . A A . 7 LEU HD23 1 1 16 6616 1 1 7 LEU HG H -9.432 3.990 -1.613 1.00 . A A . 7 LEU HG 1 1 16 6617 1 1 7 LEU N N -11.064 2.093 -0.254 1.00 . A A . 7 LEU N 1 1 16 6618 1 1 7 LEU O O -10.038 0.185 1.336 1.00 . A A . 7 LEU O 1 1 16 6619 1 1 8 ALA C C -7.333 -2.579 0.215 1.00 . A A . 8 ALA C 1 1 16 6620 1 1 8 ALA CA C -8.742 -2.090 0.491 1.00 . A A . 8 ALA CA 1 1 16 6621 1 1 8 ALA CB C -9.734 -3.238 0.285 1.00 . A A . 8 ALA CB 1 1 16 6622 1 1 8 ALA H H -8.865 -0.969 -1.313 1.00 . A A . 8 ALA H 1 1 16 6623 1 1 8 ALA HA H -8.790 -1.776 1.513 1.00 . A A . 8 ALA HA 1 1 16 6624 1 1 8 ALA HB1 H -10.602 -3.079 0.906 1.00 . A A . 8 ALA HB1 1 1 16 6625 1 1 8 ALA HB2 H -9.266 -4.173 0.557 1.00 . A A . 8 ALA HB2 1 1 16 6626 1 1 8 ALA HB3 H -10.036 -3.275 -0.750 1.00 . A A . 8 ALA HB3 1 1 16 6627 1 1 8 ALA N N -9.096 -0.957 -0.357 1.00 . A A . 8 ALA N 1 1 16 6628 1 1 8 ALA O O -6.542 -2.776 1.135 1.00 . A A . 8 ALA O 1 1 16 6629 1 1 9 LEU C C -4.752 -2.116 -1.612 1.00 . A A . 9 LEU C 1 1 16 6630 1 1 9 LEU CA C -5.700 -3.273 -1.417 1.00 . A A . 9 LEU CA 1 1 16 6631 1 1 9 LEU CB C -5.763 -4.057 -2.716 1.00 . A A . 9 LEU CB 1 1 16 6632 1 1 9 LEU CD1 C -6.868 -5.753 -1.239 1.00 . A A . 9 LEU CD1 1 1 16 6633 1 1 9 LEU CD2 C -8.215 -4.560 -2.978 1.00 . A A . 9 LEU CD2 1 1 16 6634 1 1 9 LEU CG C -6.837 -5.153 -2.644 1.00 . A A . 9 LEU CG 1 1 16 6635 1 1 9 LEU H H -7.696 -2.627 -1.740 1.00 . A A . 9 LEU H 1 1 16 6636 1 1 9 LEU HA H -5.319 -3.909 -0.637 1.00 . A A . 9 LEU HA 1 1 16 6637 1 1 9 LEU HB2 H -5.990 -3.372 -3.517 1.00 . A A . 9 LEU HB2 1 1 16 6638 1 1 9 LEU HB3 H -4.799 -4.506 -2.892 1.00 . A A . 9 LEU HB3 1 1 16 6639 1 1 9 LEU HD11 H -7.308 -5.045 -0.555 1.00 . A A . 9 LEU HD11 1 1 16 6640 1 1 9 LEU HD12 H -5.860 -5.981 -0.922 1.00 . A A . 9 LEU HD12 1 1 16 6641 1 1 9 LEU HD13 H -7.454 -6.656 -1.249 1.00 . A A . 9 LEU HD13 1 1 16 6642 1 1 9 LEU HD21 H -8.087 -3.633 -3.515 1.00 . A A . 9 LEU HD21 1 1 16 6643 1 1 9 LEU HD22 H -8.764 -4.378 -2.066 1.00 . A A . 9 LEU HD22 1 1 16 6644 1 1 9 LEU HD23 H -8.766 -5.255 -3.594 1.00 . A A . 9 LEU HD23 1 1 16 6645 1 1 9 LEU HG H -6.600 -5.931 -3.356 1.00 . A A . 9 LEU HG 1 1 16 6646 1 1 9 LEU N N -7.024 -2.791 -1.046 1.00 . A A . 9 LEU N 1 1 16 6647 1 1 9 LEU O O -3.646 -2.098 -1.069 1.00 . A A . 9 LEU O 1 1 16 6648 1 1 10 HIS C C -3.676 0.429 -1.401 1.00 . A A . 10 HIS C 1 1 16 6649 1 1 10 HIS CA C -4.398 0.038 -2.667 1.00 . A A . 10 HIS CA 1 1 16 6650 1 1 10 HIS CB C -5.285 1.192 -3.099 1.00 . A A . 10 HIS CB 1 1 16 6651 1 1 10 HIS CD2 C -6.246 0.396 -5.412 1.00 . A A . 10 HIS CD2 1 1 16 6652 1 1 10 HIS CE1 C -5.167 1.774 -6.683 1.00 . A A . 10 HIS CE1 1 1 16 6653 1 1 10 HIS CG C -5.464 1.170 -4.590 1.00 . A A . 10 HIS CG 1 1 16 6654 1 1 10 HIS H H -6.097 -1.236 -2.778 1.00 . A A . 10 HIS H 1 1 16 6655 1 1 10 HIS HA H -3.680 -0.180 -3.441 1.00 . A A . 10 HIS HA 1 1 16 6656 1 1 10 HIS HB2 H -6.244 1.100 -2.616 1.00 . A A . 10 HIS HB2 1 1 16 6657 1 1 10 HIS HB3 H -4.821 2.120 -2.802 1.00 . A A . 10 HIS HB3 1 1 16 6658 1 1 10 HIS HD1 H -4.141 2.733 -5.146 1.00 . A A . 10 HIS HD1 1 1 16 6659 1 1 10 HIS HD2 H -6.913 -0.385 -5.082 1.00 . A A . 10 HIS HD2 1 1 16 6660 1 1 10 HIS HE1 H -4.801 2.304 -7.549 1.00 . A A . 10 HIS HE1 1 1 16 6661 1 1 10 HIS HE2 H -6.474 0.393 -7.534 1.00 . A A . 10 HIS HE2 1 1 16 6662 1 1 10 HIS N N -5.204 -1.148 -2.392 1.00 . A A . 10 HIS N 1 1 16 6663 1 1 10 HIS ND1 N -4.786 2.040 -5.425 1.00 . A A . 10 HIS ND1 1 1 16 6664 1 1 10 HIS NE2 N -6.055 0.779 -6.735 1.00 . A A . 10 HIS NE2 1 1 16 6665 1 1 10 HIS O O -2.525 0.851 -1.412 1.00 . A A . 10 HIS O 1 1 16 6666 1 1 11 HIS C C -2.427 0.081 1.098 1.00 . A A . 11 HIS C 1 1 16 6667 1 1 11 HIS CA C -3.888 0.470 1.018 1.00 . A A . 11 HIS CA 1 1 16 6668 1 1 11 HIS CB C -4.670 -0.436 1.959 1.00 . A A . 11 HIS CB 1 1 16 6669 1 1 11 HIS CD2 C -7.031 0.691 1.793 1.00 . A A . 11 HIS CD2 1 1 16 6670 1 1 11 HIS CE1 C -7.297 1.207 3.882 1.00 . A A . 11 HIS CE1 1 1 16 6671 1 1 11 HIS CG C -5.904 0.268 2.451 1.00 . A A . 11 HIS CG 1 1 16 6672 1 1 11 HIS H H -5.286 -0.153 -0.413 1.00 . A A . 11 HIS H 1 1 16 6673 1 1 11 HIS HA H -4.023 1.500 1.295 1.00 . A A . 11 HIS HA 1 1 16 6674 1 1 11 HIS HB2 H -4.961 -1.334 1.410 1.00 . A A . 11 HIS HB2 1 1 16 6675 1 1 11 HIS HB3 H -4.042 -0.714 2.789 1.00 . A A . 11 HIS HB3 1 1 16 6676 1 1 11 HIS HD1 H -5.464 0.442 4.526 1.00 . A A . 11 HIS HD1 1 1 16 6677 1 1 11 HIS HD2 H -7.210 0.576 0.736 1.00 . A A . 11 HIS HD2 1 1 16 6678 1 1 11 HIS HE1 H -7.716 1.582 4.809 1.00 . A A . 11 HIS HE1 1 1 16 6679 1 1 11 HIS HE2 H -8.792 1.668 2.503 1.00 . A A . 11 HIS HE2 1 1 16 6680 1 1 11 HIS N N -4.387 0.221 -0.313 1.00 . A A . 11 HIS N 1 1 16 6681 1 1 11 HIS ND1 N -6.094 0.607 3.784 1.00 . A A . 11 HIS ND1 1 1 16 6682 1 1 11 HIS NE2 N -7.911 1.283 2.695 1.00 . A A . 11 HIS NE2 1 1 16 6683 1 1 11 HIS O O -1.569 0.819 1.592 1.00 . A A . 11 HIS O 1 1 16 6684 1 1 12 LEU C C -0.101 -1.110 -0.628 1.00 . A A . 12 LEU C 1 1 16 6685 1 1 12 LEU CA C -0.826 -1.636 0.570 1.00 . A A . 12 LEU CA 1 1 16 6686 1 1 12 LEU CB C -0.863 -3.159 0.506 1.00 . A A . 12 LEU CB 1 1 16 6687 1 1 12 LEU CD1 C -1.411 -5.239 1.769 1.00 . A A . 12 LEU CD1 1 1 16 6688 1 1 12 LEU CD2 C -0.177 -3.375 2.896 1.00 . A A . 12 LEU CD2 1 1 16 6689 1 1 12 LEU CG C -1.262 -3.719 1.870 1.00 . A A . 12 LEU CG 1 1 16 6690 1 1 12 LEU H H -2.911 -1.610 0.184 1.00 . A A . 12 LEU H 1 1 16 6691 1 1 12 LEU HA H -0.310 -1.323 1.460 1.00 . A A . 12 LEU HA 1 1 16 6692 1 1 12 LEU HB2 H -1.581 -3.468 -0.240 1.00 . A A . 12 LEU HB2 1 1 16 6693 1 1 12 LEU HB3 H 0.115 -3.531 0.236 1.00 . A A . 12 LEU HB3 1 1 16 6694 1 1 12 LEU HD11 H -0.446 -5.707 1.900 1.00 . A A . 12 LEU HD11 1 1 16 6695 1 1 12 LEU HD12 H -1.810 -5.501 0.797 1.00 . A A . 12 LEU HD12 1 1 16 6696 1 1 12 LEU HD13 H -2.086 -5.582 2.539 1.00 . A A . 12 LEU HD13 1 1 16 6697 1 1 12 LEU HD21 H 0.798 -3.481 2.440 1.00 . A A . 12 LEU HD21 1 1 16 6698 1 1 12 LEU HD22 H -0.254 -4.042 3.741 1.00 . A A . 12 LEU HD22 1 1 16 6699 1 1 12 LEU HD23 H -0.307 -2.355 3.230 1.00 . A A . 12 LEU HD23 1 1 16 6700 1 1 12 LEU HG H -2.203 -3.283 2.177 1.00 . A A . 12 LEU HG 1 1 16 6701 1 1 12 LEU N N -2.169 -1.096 0.582 1.00 . A A . 12 LEU N 1 1 16 6702 1 1 12 LEU O O 1.024 -0.645 -0.524 1.00 . A A . 12 LEU O 1 1 16 6703 1 1 13 ALA C C 0.448 0.692 -2.718 1.00 . A A . 13 ALA C 1 1 16 6704 1 1 13 ALA CA C -0.178 -0.665 -2.999 1.00 . A A . 13 ALA CA 1 1 16 6705 1 1 13 ALA CB C -1.239 -0.533 -4.094 1.00 . A A . 13 ALA CB 1 1 16 6706 1 1 13 ALA H H -1.676 -1.544 -1.749 1.00 . A A . 13 ALA H 1 1 16 6707 1 1 13 ALA HA H 0.591 -1.348 -3.325 1.00 . A A . 13 ALA HA 1 1 16 6708 1 1 13 ALA HB1 H -1.781 0.391 -3.958 1.00 . A A . 13 ALA HB1 1 1 16 6709 1 1 13 ALA HB2 H -1.924 -1.366 -4.037 1.00 . A A . 13 ALA HB2 1 1 16 6710 1 1 13 ALA HB3 H -0.761 -0.529 -5.065 1.00 . A A . 13 ALA HB3 1 1 16 6711 1 1 13 ALA N N -0.767 -1.169 -1.759 1.00 . A A . 13 ALA N 1 1 16 6712 1 1 13 ALA O O 1.451 1.083 -3.315 1.00 . A A . 13 ALA O 1 1 16 6713 1 1 14 HIS C C 1.592 2.526 -0.561 1.00 . A A . 14 HIS C 1 1 16 6714 1 1 14 HIS CA C 0.304 2.691 -1.337 1.00 . A A . 14 HIS CA 1 1 16 6715 1 1 14 HIS CB C -0.773 3.322 -0.468 1.00 . A A . 14 HIS CB 1 1 16 6716 1 1 14 HIS CD2 C -0.140 4.426 1.821 1.00 . A A . 14 HIS CD2 1 1 16 6717 1 1 14 HIS CE1 C 0.832 6.213 1.070 1.00 . A A . 14 HIS CE1 1 1 16 6718 1 1 14 HIS CG C -0.192 4.361 0.452 1.00 . A A . 14 HIS CG 1 1 16 6719 1 1 14 HIS H H -0.946 0.989 -1.333 1.00 . A A . 14 HIS H 1 1 16 6720 1 1 14 HIS HA H 0.482 3.310 -2.195 1.00 . A A . 14 HIS HA 1 1 16 6721 1 1 14 HIS HB2 H -1.495 3.772 -1.107 1.00 . A A . 14 HIS HB2 1 1 16 6722 1 1 14 HIS HB3 H -1.250 2.556 0.121 1.00 . A A . 14 HIS HB3 1 1 16 6723 1 1 14 HIS HD1 H 0.556 5.767 -0.952 1.00 . A A . 14 HIS HD1 1 1 16 6724 1 1 14 HIS HD2 H -0.541 3.678 2.492 1.00 . A A . 14 HIS HD2 1 1 16 6725 1 1 14 HIS HE1 H 1.351 7.159 1.020 1.00 . A A . 14 HIS HE1 1 1 16 6726 1 1 14 HIS HE2 H 0.691 5.901 3.132 1.00 . A A . 14 HIS HE2 1 1 16 6727 1 1 14 HIS N N -0.161 1.384 -1.770 1.00 . A A . 14 HIS N 1 1 16 6728 1 1 14 HIS ND1 N 0.432 5.510 -0.010 1.00 . A A . 14 HIS ND1 1 1 16 6729 1 1 14 HIS NE2 N 0.507 5.596 2.212 1.00 . A A . 14 HIS NE2 1 1 16 6730 1 1 14 HIS O O 2.639 3.083 -0.917 1.00 . A A . 14 HIS O 1 1 16 6731 1 1 15 LEU C C 3.747 0.916 0.298 1.00 . A A . 15 LEU C 1 1 16 6732 1 1 15 LEU CA C 2.714 1.442 1.251 1.00 . A A . 15 LEU CA 1 1 16 6733 1 1 15 LEU CB C 2.441 0.361 2.299 1.00 . A A . 15 LEU CB 1 1 16 6734 1 1 15 LEU CD1 C 1.560 2.425 3.471 1.00 . A A . 15 LEU CD1 1 1 16 6735 1 1 15 LEU CD2 C 0.730 0.155 4.088 1.00 . A A . 15 LEU CD2 1 1 16 6736 1 1 15 LEU CG C 1.949 0.952 3.626 1.00 . A A . 15 LEU CG 1 1 16 6737 1 1 15 LEU H H 0.677 1.262 0.681 1.00 . A A . 15 LEU H 1 1 16 6738 1 1 15 LEU HA H 3.064 2.345 1.712 1.00 . A A . 15 LEU HA 1 1 16 6739 1 1 15 LEU HB2 H 1.691 -0.316 1.915 1.00 . A A . 15 LEU HB2 1 1 16 6740 1 1 15 LEU HB3 H 3.353 -0.193 2.473 1.00 . A A . 15 LEU HB3 1 1 16 6741 1 1 15 LEU HD11 H 2.447 3.039 3.506 1.00 . A A . 15 LEU HD11 1 1 16 6742 1 1 15 LEU HD12 H 0.897 2.708 4.275 1.00 . A A . 15 LEU HD12 1 1 16 6743 1 1 15 LEU HD13 H 1.061 2.564 2.528 1.00 . A A . 15 LEU HD13 1 1 16 6744 1 1 15 LEU HD21 H 0.376 0.543 5.030 1.00 . A A . 15 LEU HD21 1 1 16 6745 1 1 15 LEU HD22 H 1.004 -0.884 4.203 1.00 . A A . 15 LEU HD22 1 1 16 6746 1 1 15 LEU HD23 H -0.053 0.236 3.349 1.00 . A A . 15 LEU HD23 1 1 16 6747 1 1 15 LEU HG H 2.732 0.867 4.362 1.00 . A A . 15 LEU HG 1 1 16 6748 1 1 15 LEU N N 1.525 1.716 0.473 1.00 . A A . 15 LEU N 1 1 16 6749 1 1 15 LEU O O 4.937 1.199 0.391 1.00 . A A . 15 LEU O 1 1 16 6750 1 1 16 ALA C C 4.766 0.581 -2.464 1.00 . A A . 16 ALA C 1 1 16 6751 1 1 16 ALA CA C 4.074 -0.481 -1.638 1.00 . A A . 16 ALA CA 1 1 16 6752 1 1 16 ALA CB C 3.220 -1.369 -2.544 1.00 . A A . 16 ALA CB 1 1 16 6753 1 1 16 ALA H H 2.263 -0.021 -0.624 1.00 . A A . 16 ALA H 1 1 16 6754 1 1 16 ALA HA H 4.813 -1.085 -1.151 1.00 . A A . 16 ALA HA 1 1 16 6755 1 1 16 ALA HB1 H 3.835 -2.141 -2.980 1.00 . A A . 16 ALA HB1 1 1 16 6756 1 1 16 ALA HB2 H 2.787 -0.767 -3.330 1.00 . A A . 16 ALA HB2 1 1 16 6757 1 1 16 ALA HB3 H 2.431 -1.822 -1.961 1.00 . A A . 16 ALA HB3 1 1 16 6758 1 1 16 ALA N N 3.242 0.139 -0.627 1.00 . A A . 16 ALA N 1 1 16 6759 1 1 16 ALA O O 5.879 0.379 -2.950 1.00 . A A . 16 ALA O 1 1 16 6760 1 1 17 LEU C C 5.938 3.290 -2.786 1.00 . A A . 17 LEU C 1 1 16 6761 1 1 17 LEU CA C 4.634 2.814 -3.385 1.00 . A A . 17 LEU CA 1 1 16 6762 1 1 17 LEU CB C 3.596 3.954 -3.473 1.00 . A A . 17 LEU CB 1 1 16 6763 1 1 17 LEU CD1 C 5.160 5.921 -3.559 1.00 . A A . 17 LEU CD1 1 1 16 6764 1 1 17 LEU CD2 C 2.878 6.175 -2.588 1.00 . A A . 17 LEU CD2 1 1 16 6765 1 1 17 LEU CG C 4.066 5.222 -2.747 1.00 . A A . 17 LEU CG 1 1 16 6766 1 1 17 LEU H H 3.211 1.798 -2.197 1.00 . A A . 17 LEU H 1 1 16 6767 1 1 17 LEU HA H 4.843 2.457 -4.373 1.00 . A A . 17 LEU HA 1 1 16 6768 1 1 17 LEU HB2 H 3.420 4.189 -4.507 1.00 . A A . 17 LEU HB2 1 1 16 6769 1 1 17 LEU HB3 H 2.673 3.618 -3.026 1.00 . A A . 17 LEU HB3 1 1 16 6770 1 1 17 LEU HD11 H 6.057 6.004 -2.960 1.00 . A A . 17 LEU HD11 1 1 16 6771 1 1 17 LEU HD12 H 4.822 6.907 -3.838 1.00 . A A . 17 LEU HD12 1 1 16 6772 1 1 17 LEU HD13 H 5.372 5.347 -4.450 1.00 . A A . 17 LEU HD13 1 1 16 6773 1 1 17 LEU HD21 H 3.199 7.066 -2.069 1.00 . A A . 17 LEU HD21 1 1 16 6774 1 1 17 LEU HD22 H 2.100 5.689 -2.019 1.00 . A A . 17 LEU HD22 1 1 16 6775 1 1 17 LEU HD23 H 2.498 6.444 -3.563 1.00 . A A . 17 LEU HD23 1 1 16 6776 1 1 17 LEU HG H 4.447 4.967 -1.773 1.00 . A A . 17 LEU HG 1 1 16 6777 1 1 17 LEU N N 4.093 1.708 -2.613 1.00 . A A . 17 LEU N 1 1 16 6778 1 1 17 LEU O O 6.954 3.386 -3.475 1.00 . A A . 17 LEU O 1 1 16 6779 1 1 18 HIS C C 8.024 2.827 -0.640 1.00 . A A . 18 HIS C 1 1 16 6780 1 1 18 HIS CA C 7.139 4.014 -0.861 1.00 . A A . 18 HIS CA 1 1 16 6781 1 1 18 HIS CB C 6.846 4.723 0.434 1.00 . A A . 18 HIS CB 1 1 16 6782 1 1 18 HIS CD2 C 5.035 3.429 1.775 1.00 . A A . 18 HIS CD2 1 1 16 6783 1 1 18 HIS CE1 C 6.336 2.371 3.147 1.00 . A A . 18 HIS CE1 1 1 16 6784 1 1 18 HIS CG C 6.315 3.779 1.460 1.00 . A A . 18 HIS CG 1 1 16 6785 1 1 18 HIS H H 5.080 3.460 -0.989 1.00 . A A . 18 HIS H 1 1 16 6786 1 1 18 HIS HA H 7.645 4.695 -1.525 1.00 . A A . 18 HIS HA 1 1 16 6787 1 1 18 HIS HB2 H 7.745 5.189 0.798 1.00 . A A . 18 HIS HB2 1 1 16 6788 1 1 18 HIS HB3 H 6.109 5.464 0.235 1.00 . A A . 18 HIS HB3 1 1 16 6789 1 1 18 HIS HD1 H 8.116 3.144 2.382 1.00 . A A . 18 HIS HD1 1 1 16 6790 1 1 18 HIS HD2 H 4.149 3.780 1.248 1.00 . A A . 18 HIS HD2 1 1 16 6791 1 1 18 HIS HE1 H 6.697 1.723 3.932 1.00 . A A . 18 HIS HE1 1 1 16 6792 1 1 18 HIS HE2 H 4.270 2.131 3.296 1.00 . A A . 18 HIS HE2 1 1 16 6793 1 1 18 HIS N N 5.921 3.568 -1.504 1.00 . A A . 18 HIS N 1 1 16 6794 1 1 18 HIS ND1 N 7.133 3.097 2.342 1.00 . A A . 18 HIS ND1 1 1 16 6795 1 1 18 HIS NE2 N 5.045 2.538 2.848 1.00 . A A . 18 HIS NE2 1 1 16 6796 1 1 18 HIS O O 9.228 2.882 -0.877 1.00 . A A . 18 HIS O 1 1 16 6797 1 1 19 LEU C C 8.973 0.298 -1.288 1.00 . A A . 19 LEU C 1 1 16 6798 1 1 19 LEU CA C 8.145 0.503 -0.047 1.00 . A A . 19 LEU CA 1 1 16 6799 1 1 19 LEU CB C 7.204 -0.695 0.112 1.00 . A A . 19 LEU CB 1 1 16 6800 1 1 19 LEU CD1 C 8.925 -1.709 1.619 1.00 . A A . 19 LEU CD1 1 1 16 6801 1 1 19 LEU CD2 C 6.990 -0.467 2.586 1.00 . A A . 19 LEU CD2 1 1 16 6802 1 1 19 LEU CG C 7.442 -1.381 1.450 1.00 . A A . 19 LEU CG 1 1 16 6803 1 1 19 LEU H H 6.427 1.766 -0.093 1.00 . A A . 19 LEU H 1 1 16 6804 1 1 19 LEU HA H 8.787 0.590 0.810 1.00 . A A . 19 LEU HA 1 1 16 6805 1 1 19 LEU HB2 H 6.186 -0.360 0.062 1.00 . A A . 19 LEU HB2 1 1 16 6806 1 1 19 LEU HB3 H 7.383 -1.401 -0.685 1.00 . A A . 19 LEU HB3 1 1 16 6807 1 1 19 LEU HD11 H 9.382 -0.984 2.278 1.00 . A A . 19 LEU HD11 1 1 16 6808 1 1 19 LEU HD12 H 9.416 -1.680 0.657 1.00 . A A . 19 LEU HD12 1 1 16 6809 1 1 19 LEU HD13 H 9.025 -2.695 2.045 1.00 . A A . 19 LEU HD13 1 1 16 6810 1 1 19 LEU HD21 H 7.615 0.413 2.607 1.00 . A A . 19 LEU HD21 1 1 16 6811 1 1 19 LEU HD22 H 7.075 -0.992 3.526 1.00 . A A . 19 LEU HD22 1 1 16 6812 1 1 19 LEU HD23 H 5.962 -0.175 2.427 1.00 . A A . 19 LEU HD23 1 1 16 6813 1 1 19 LEU HG H 6.872 -2.289 1.472 1.00 . A A . 19 LEU HG 1 1 16 6814 1 1 19 LEU N N 7.404 1.737 -0.232 1.00 . A A . 19 LEU N 1 1 16 6815 1 1 19 LEU O O 10.088 -0.214 -1.246 1.00 . A A . 19 LEU O 1 1 16 6816 1 1 20 ALA C C 10.375 1.428 -3.625 1.00 . A A . 20 ALA C 1 1 16 6817 1 1 20 ALA CA C 9.086 0.633 -3.684 1.00 . A A . 20 ALA CA 1 1 16 6818 1 1 20 ALA CB C 8.208 1.171 -4.813 1.00 . A A . 20 ALA CB 1 1 16 6819 1 1 20 ALA H H 7.504 1.160 -2.341 1.00 . A A . 20 ALA H 1 1 16 6820 1 1 20 ALA HA H 9.319 -0.397 -3.877 1.00 . A A . 20 ALA HA 1 1 16 6821 1 1 20 ALA HB1 H 8.570 2.141 -5.124 1.00 . A A . 20 ALA HB1 1 1 16 6822 1 1 20 ALA HB2 H 7.189 1.263 -4.471 1.00 . A A . 20 ALA HB2 1 1 16 6823 1 1 20 ALA HB3 H 8.247 0.492 -5.651 1.00 . A A . 20 ALA HB3 1 1 16 6824 1 1 20 ALA N N 8.403 0.739 -2.400 1.00 . A A . 20 ALA N 1 1 16 6825 1 1 20 ALA O O 11.473 0.889 -3.786 1.00 . A A . 20 ALA O 1 1 16 6826 1 1 21 LEU C C 12.293 3.061 -2.178 1.00 . A A . 21 LEU C 1 1 16 6827 1 1 21 LEU CA C 11.370 3.591 -3.260 1.00 . A A . 21 LEU CA 1 1 16 6828 1 1 21 LEU CB C 10.927 5.013 -2.899 1.00 . A A . 21 LEU CB 1 1 16 6829 1 1 21 LEU CD1 C 8.903 5.404 -4.331 1.00 . A A . 21 LEU CD1 1 1 16 6830 1 1 21 LEU CD2 C 10.556 7.236 -3.972 1.00 . A A . 21 LEU CD2 1 1 16 6831 1 1 21 LEU CG C 10.388 5.727 -4.145 1.00 . A A . 21 LEU CG 1 1 16 6832 1 1 21 LEU H H 9.312 3.064 -3.246 1.00 . A A . 21 LEU H 1 1 16 6833 1 1 21 LEU HA H 11.900 3.605 -4.194 1.00 . A A . 21 LEU HA 1 1 16 6834 1 1 21 LEU HB2 H 10.156 4.967 -2.140 1.00 . A A . 21 LEU HB2 1 1 16 6835 1 1 21 LEU HB3 H 11.773 5.560 -2.512 1.00 . A A . 21 LEU HB3 1 1 16 6836 1 1 21 LEU HD11 H 8.387 5.499 -3.387 1.00 . A A . 21 LEU HD11 1 1 16 6837 1 1 21 LEU HD12 H 8.796 4.395 -4.704 1.00 . A A . 21 LEU HD12 1 1 16 6838 1 1 21 LEU HD13 H 8.474 6.096 -5.042 1.00 . A A . 21 LEU HD13 1 1 16 6839 1 1 21 LEU HD21 H 10.132 7.745 -4.826 1.00 . A A . 21 LEU HD21 1 1 16 6840 1 1 21 LEU HD22 H 11.605 7.473 -3.895 1.00 . A A . 21 LEU HD22 1 1 16 6841 1 1 21 LEU HD23 H 10.048 7.556 -3.077 1.00 . A A . 21 LEU HD23 1 1 16 6842 1 1 21 LEU HG H 10.937 5.400 -5.019 1.00 . A A . 21 LEU HG 1 1 16 6843 1 1 21 LEU N N 10.221 2.711 -3.374 1.00 . A A . 21 LEU N 1 1 16 6844 1 1 21 LEU O O 13.508 2.982 -2.355 1.00 . A A . 21 LEU O 1 1 16 6845 1 1 22 ALA C C 13.205 0.900 -0.378 1.00 . A A . 22 ALA C 1 1 16 6846 1 1 22 ALA CA C 12.433 2.132 0.063 1.00 . A A . 22 ALA CA 1 1 16 6847 1 1 22 ALA CB C 11.477 1.759 1.198 1.00 . A A . 22 ALA CB 1 1 16 6848 1 1 22 ALA H H 10.711 2.765 -1.002 1.00 . A A . 22 ALA H 1 1 16 6849 1 1 22 ALA HA H 13.126 2.870 0.418 1.00 . A A . 22 ALA HA 1 1 16 6850 1 1 22 ALA HB1 H 10.856 0.933 0.888 1.00 . A A . 22 ALA HB1 1 1 16 6851 1 1 22 ALA HB2 H 10.855 2.608 1.441 1.00 . A A . 22 ALA HB2 1 1 16 6852 1 1 22 ALA HB3 H 12.047 1.471 2.069 1.00 . A A . 22 ALA HB3 1 1 16 6853 1 1 22 ALA N N 11.688 2.681 -1.063 1.00 . A A . 22 ALA N 1 1 16 6854 1 1 22 ALA O O 14.326 0.656 0.067 1.00 . A A . 22 ALA O 1 1 16 6855 1 1 23 LEU C C 14.578 -0.723 -2.361 1.00 . A A . 23 LEU C 1 1 16 6856 1 1 23 LEU CA C 13.231 -1.078 -1.769 1.00 . A A . 23 LEU CA 1 1 16 6857 1 1 23 LEU CB C 12.355 -1.731 -2.849 1.00 . A A . 23 LEU CB 1 1 16 6858 1 1 23 LEU CD1 C 13.540 -3.934 -2.666 1.00 . A A . 23 LEU CD1 1 1 16 6859 1 1 23 LEU CD2 C 11.621 -3.431 -1.145 1.00 . A A . 23 LEU CD2 1 1 16 6860 1 1 23 LEU CG C 12.184 -3.229 -2.558 1.00 . A A . 23 LEU CG 1 1 16 6861 1 1 23 LEU H H 11.700 0.376 -1.576 1.00 . A A . 23 LEU H 1 1 16 6862 1 1 23 LEU HA H 13.376 -1.765 -0.962 1.00 . A A . 23 LEU HA 1 1 16 6863 1 1 23 LEU HB2 H 11.387 -1.255 -2.862 1.00 . A A . 23 LEU HB2 1 1 16 6864 1 1 23 LEU HB3 H 12.825 -1.607 -3.815 1.00 . A A . 23 LEU HB3 1 1 16 6865 1 1 23 LEU HD11 H 13.456 -4.935 -2.278 1.00 . A A . 23 LEU HD11 1 1 16 6866 1 1 23 LEU HD12 H 14.276 -3.386 -2.098 1.00 . A A . 23 LEU HD12 1 1 16 6867 1 1 23 LEU HD13 H 13.842 -3.977 -3.700 1.00 . A A . 23 LEU HD13 1 1 16 6868 1 1 23 LEU HD21 H 11.230 -2.496 -0.769 1.00 . A A . 23 LEU HD21 1 1 16 6869 1 1 23 LEU HD22 H 12.408 -3.784 -0.493 1.00 . A A . 23 LEU HD22 1 1 16 6870 1 1 23 LEU HD23 H 10.830 -4.163 -1.177 1.00 . A A . 23 LEU HD23 1 1 16 6871 1 1 23 LEU HG H 11.504 -3.657 -3.280 1.00 . A A . 23 LEU HG 1 1 16 6872 1 1 23 LEU N N 12.593 0.128 -1.260 1.00 . A A . 23 LEU N 1 1 16 6873 1 1 23 LEU O O 15.578 -1.406 -2.124 1.00 . A A . 23 LEU O 1 1 16 6874 1 1 24 LYS C C 16.609 1.725 -2.835 1.00 . A A . 24 LYS C 1 1 16 6875 1 1 24 LYS CA C 15.829 0.805 -3.759 1.00 . A A . 24 LYS CA 1 1 16 6876 1 1 24 LYS CB C 15.524 1.539 -5.072 1.00 . A A . 24 LYS CB 1 1 16 6877 1 1 24 LYS CD C 17.317 3.284 -5.288 1.00 . A A . 24 LYS CD 1 1 16 6878 1 1 24 LYS CE C 18.835 3.286 -5.043 1.00 . A A . 24 LYS CE 1 1 16 6879 1 1 24 LYS CG C 16.838 1.907 -5.779 1.00 . A A . 24 LYS CG 1 1 16 6880 1 1 24 LYS H H 13.766 0.852 -3.276 1.00 . A A . 24 LYS H 1 1 16 6881 1 1 24 LYS HA H 16.438 -0.049 -3.979 1.00 . A A . 24 LYS HA 1 1 16 6882 1 1 24 LYS HB2 H 14.938 0.897 -5.715 1.00 . A A . 24 LYS HB2 1 1 16 6883 1 1 24 LYS HB3 H 14.969 2.441 -4.863 1.00 . A A . 24 LYS HB3 1 1 16 6884 1 1 24 LYS HD2 H 17.078 4.031 -6.033 1.00 . A A . 24 LYS HD2 1 1 16 6885 1 1 24 LYS HD3 H 16.812 3.533 -4.368 1.00 . A A . 24 LYS HD3 1 1 16 6886 1 1 24 LYS HE2 H 19.350 3.459 -5.975 1.00 . A A . 24 LYS HE2 1 1 16 6887 1 1 24 LYS HE3 H 19.077 4.078 -4.351 1.00 . A A . 24 LYS HE3 1 1 16 6888 1 1 24 LYS HG2 H 17.582 1.157 -5.562 1.00 . A A . 24 LYS HG2 1 1 16 6889 1 1 24 LYS HG3 H 16.674 1.945 -6.846 1.00 . A A . 24 LYS HG3 1 1 16 6890 1 1 24 LYS HZ1 H 20.257 2.067 -4.132 1.00 . A A . 24 LYS HZ1 1 1 16 6891 1 1 24 LYS HZ2 H 19.226 1.240 -5.193 1.00 . A A . 24 LYS HZ2 1 1 16 6892 1 1 24 LYS HZ3 H 18.658 1.729 -3.666 1.00 . A A . 24 LYS HZ3 1 1 16 6893 1 1 24 LYS N N 14.598 0.355 -3.129 1.00 . A A . 24 LYS N 1 1 16 6894 1 1 24 LYS NZ N 19.276 1.982 -4.470 1.00 . A A . 24 LYS NZ 1 1 16 6895 1 1 24 LYS O O 17.806 1.536 -2.627 1.00 . A A . 24 LYS O 1 1 16 6896 1 1 25 LYS C C 16.238 3.417 0.037 1.00 . A A . 25 LYS C 1 1 16 6897 1 1 25 LYS CA C 16.570 3.701 -1.424 1.00 . A A . 25 LYS CA 1 1 16 6898 1 1 25 LYS CB C 16.105 5.117 -1.789 1.00 . A A . 25 LYS CB 1 1 16 6899 1 1 25 LYS CD C 17.718 6.247 -0.232 1.00 . A A . 25 LYS CD 1 1 16 6900 1 1 25 LYS CE C 18.658 7.454 -0.088 1.00 . A A . 25 LYS CE 1 1 16 6901 1 1 25 LYS CG C 17.282 6.095 -1.697 1.00 . A A . 25 LYS CG 1 1 16 6902 1 1 25 LYS H H 14.983 2.830 -2.530 1.00 . A A . 25 LYS H 1 1 16 6903 1 1 25 LYS HA H 17.640 3.645 -1.554 1.00 . A A . 25 LYS HA 1 1 16 6904 1 1 25 LYS HB2 H 15.717 5.115 -2.796 1.00 . A A . 25 LYS HB2 1 1 16 6905 1 1 25 LYS HB3 H 15.326 5.431 -1.107 1.00 . A A . 25 LYS HB3 1 1 16 6906 1 1 25 LYS HD2 H 16.845 6.399 0.387 1.00 . A A . 25 LYS HD2 1 1 16 6907 1 1 25 LYS HD3 H 18.233 5.352 0.086 1.00 . A A . 25 LYS HD3 1 1 16 6908 1 1 25 LYS HE2 H 18.116 8.287 0.337 1.00 . A A . 25 LYS HE2 1 1 16 6909 1 1 25 LYS HE3 H 19.481 7.193 0.561 1.00 . A A . 25 LYS HE3 1 1 16 6910 1 1 25 LYS HG2 H 18.108 5.724 -2.288 1.00 . A A . 25 LYS HG2 1 1 16 6911 1 1 25 LYS HG3 H 16.975 7.059 -2.078 1.00 . A A . 25 LYS HG3 1 1 16 6912 1 1 25 LYS HZ1 H 18.456 8.350 -1.960 1.00 . A A . 25 LYS HZ1 1 1 16 6913 1 1 25 LYS HZ2 H 19.462 6.986 -1.949 1.00 . A A . 25 LYS HZ2 1 1 16 6914 1 1 25 LYS HZ3 H 20.017 8.449 -1.307 1.00 . A A . 25 LYS HZ3 1 1 16 6915 1 1 25 LYS N N 15.930 2.730 -2.307 1.00 . A A . 25 LYS N 1 1 16 6916 1 1 25 LYS NZ N 19.187 7.838 -1.425 1.00 . A A . 25 LYS NZ 1 1 16 6917 1 1 25 LYS O O 15.112 3.639 0.486 1.00 . A A . 25 LYS O 1 1 16 6918 1 1 26 ALA C C 18.414 2.388 2.847 1.00 . A A . 26 ALA C 1 1 16 6919 1 1 26 ALA CA C 17.061 2.649 2.196 1.00 . A A . 26 ALA CA 1 1 16 6920 1 1 26 ALA CB C 16.161 1.424 2.385 1.00 . A A . 26 ALA CB 1 1 16 6921 1 1 26 ALA H H 18.115 2.809 0.367 1.00 . A A . 26 ALA H 1 1 16 6922 1 1 26 ALA HA H 16.598 3.496 2.675 1.00 . A A . 26 ALA HA 1 1 16 6923 1 1 26 ALA HB1 H 15.193 1.619 1.945 1.00 . A A . 26 ALA HB1 1 1 16 6924 1 1 26 ALA HB2 H 16.041 1.226 3.440 1.00 . A A . 26 ALA HB2 1 1 16 6925 1 1 26 ALA HB3 H 16.611 0.566 1.906 1.00 . A A . 26 ALA HB3 1 1 16 6926 1 1 26 ALA N N 17.234 2.946 0.779 1.00 . A A . 26 ALA N 1 1 16 6927 1 1 26 ALA O O 18.475 2.401 4.060 1.00 . A A . 26 ALA O 1 1 16 6928 1 1 26 ALA OXT O 19.365 2.161 2.125 1.00 . A A . 26 ALA OXT 1 1 17 6929 1 1 1 LYS C C -24.721 -6.059 -4.080 1.00 . A A . 1 LYS C 1 1 17 6930 1 1 1 LYS CA C -25.405 -6.861 -5.183 1.00 . A A . 1 LYS CA 1 1 17 6931 1 1 1 LYS CB C -24.818 -6.484 -6.554 1.00 . A A . 1 LYS CB 1 1 17 6932 1 1 1 LYS CD C -24.012 -8.335 -8.039 1.00 . A A . 1 LYS CD 1 1 17 6933 1 1 1 LYS CE C -24.354 -9.177 -9.275 1.00 . A A . 1 LYS CE 1 1 17 6934 1 1 1 LYS CG C -25.232 -7.514 -7.609 1.00 . A A . 1 LYS CG 1 1 17 6935 1 1 1 LYS H1 H -27.092 -5.911 -5.943 1.00 . A A . 1 LYS H1 1 1 17 6936 1 1 1 LYS H2 H -27.118 -6.126 -4.261 1.00 . A A . 1 LYS H2 1 1 17 6937 1 1 1 LYS H3 H -27.400 -7.442 -5.293 1.00 . A A . 1 LYS H3 1 1 17 6938 1 1 1 LYS HA H -25.253 -7.914 -5.004 1.00 . A A . 1 LYS HA 1 1 17 6939 1 1 1 LYS HB2 H -25.187 -5.511 -6.844 1.00 . A A . 1 LYS HB2 1 1 17 6940 1 1 1 LYS HB3 H -23.740 -6.452 -6.486 1.00 . A A . 1 LYS HB3 1 1 17 6941 1 1 1 LYS HD2 H -23.192 -7.667 -8.274 1.00 . A A . 1 LYS HD2 1 1 17 6942 1 1 1 LYS HD3 H -23.716 -8.989 -7.232 1.00 . A A . 1 LYS HD3 1 1 17 6943 1 1 1 LYS HE2 H -23.439 -9.485 -9.758 1.00 . A A . 1 LYS HE2 1 1 17 6944 1 1 1 LYS HE3 H -24.912 -10.049 -8.974 1.00 . A A . 1 LYS HE3 1 1 17 6945 1 1 1 LYS HG2 H -25.981 -8.174 -7.198 1.00 . A A . 1 LYS HG2 1 1 17 6946 1 1 1 LYS HG3 H -25.638 -6.999 -8.465 1.00 . A A . 1 LYS HG3 1 1 17 6947 1 1 1 LYS HZ1 H -26.163 -8.369 -9.933 1.00 . A A . 1 LYS HZ1 1 1 17 6948 1 1 1 LYS HZ2 H -25.086 -8.764 -11.180 1.00 . A A . 1 LYS HZ2 1 1 17 6949 1 1 1 LYS HZ3 H -24.811 -7.385 -10.238 1.00 . A A . 1 LYS HZ3 1 1 17 6950 1 1 1 LYS N N -26.864 -6.563 -5.169 1.00 . A A . 1 LYS N 1 1 17 6951 1 1 1 LYS NZ N -25.163 -8.362 -10.225 1.00 . A A . 1 LYS NZ 1 1 17 6952 1 1 1 LYS O O -24.593 -6.528 -2.945 1.00 . A A . 1 LYS O 1 1 17 6953 1 1 2 LYS C C -23.225 -2.683 -4.164 1.00 . A A . 2 LYS C 1 1 17 6954 1 1 2 LYS CA C -23.609 -3.979 -3.468 1.00 . A A . 2 LYS CA 1 1 17 6955 1 1 2 LYS CB C -22.346 -4.659 -2.922 1.00 . A A . 2 LYS CB 1 1 17 6956 1 1 2 LYS CD C -20.051 -5.458 -3.544 1.00 . A A . 2 LYS CD 1 1 17 6957 1 1 2 LYS CE C -18.967 -4.906 -4.477 1.00 . A A . 2 LYS CE 1 1 17 6958 1 1 2 LYS CG C -21.433 -5.074 -4.084 1.00 . A A . 2 LYS CG 1 1 17 6959 1 1 2 LYS H H -24.419 -4.535 -5.339 1.00 . A A . 2 LYS H 1 1 17 6960 1 1 2 LYS HA H -24.277 -3.760 -2.648 1.00 . A A . 2 LYS HA 1 1 17 6961 1 1 2 LYS HB2 H -21.818 -3.972 -2.278 1.00 . A A . 2 LYS HB2 1 1 17 6962 1 1 2 LYS HB3 H -22.626 -5.535 -2.358 1.00 . A A . 2 LYS HB3 1 1 17 6963 1 1 2 LYS HD2 H -19.920 -5.046 -2.553 1.00 . A A . 2 LYS HD2 1 1 17 6964 1 1 2 LYS HD3 H -19.970 -6.536 -3.499 1.00 . A A . 2 LYS HD3 1 1 17 6965 1 1 2 LYS HE2 H -18.006 -5.300 -4.185 1.00 . A A . 2 LYS HE2 1 1 17 6966 1 1 2 LYS HE3 H -19.181 -5.199 -5.493 1.00 . A A . 2 LYS HE3 1 1 17 6967 1 1 2 LYS HG2 H -21.868 -5.920 -4.596 1.00 . A A . 2 LYS HG2 1 1 17 6968 1 1 2 LYS HG3 H -21.333 -4.251 -4.773 1.00 . A A . 2 LYS HG3 1 1 17 6969 1 1 2 LYS HZ1 H -19.062 -3.129 -3.394 1.00 . A A . 2 LYS HZ1 1 1 17 6970 1 1 2 LYS HZ2 H -19.710 -3.016 -4.959 1.00 . A A . 2 LYS HZ2 1 1 17 6971 1 1 2 LYS HZ3 H -18.024 -3.068 -4.735 1.00 . A A . 2 LYS HZ3 1 1 17 6972 1 1 2 LYS N N -24.283 -4.852 -4.421 1.00 . A A . 2 LYS N 1 1 17 6973 1 1 2 LYS NZ N -18.939 -3.420 -4.382 1.00 . A A . 2 LYS NZ 1 1 17 6974 1 1 2 LYS O O -23.695 -2.401 -5.268 1.00 . A A . 2 LYS O 1 1 17 6975 1 1 3 ALA C C -20.937 -0.967 -5.270 1.00 . A A . 3 ALA C 1 1 17 6976 1 1 3 ALA CA C -21.902 -0.663 -4.131 1.00 . A A . 3 ALA CA 1 1 17 6977 1 1 3 ALA CB C -21.201 0.205 -3.081 1.00 . A A . 3 ALA CB 1 1 17 6978 1 1 3 ALA H H -21.991 -2.196 -2.667 1.00 . A A . 3 ALA H 1 1 17 6979 1 1 3 ALA HA H -22.756 -0.127 -4.521 1.00 . A A . 3 ALA HA 1 1 17 6980 1 1 3 ALA HB1 H -21.834 0.304 -2.212 1.00 . A A . 3 ALA HB1 1 1 17 6981 1 1 3 ALA HB2 H -21.009 1.183 -3.497 1.00 . A A . 3 ALA HB2 1 1 17 6982 1 1 3 ALA HB3 H -20.268 -0.254 -2.799 1.00 . A A . 3 ALA HB3 1 1 17 6983 1 1 3 ALA N N -22.352 -1.911 -3.534 1.00 . A A . 3 ALA N 1 1 17 6984 1 1 3 ALA O O -20.619 -2.132 -5.526 1.00 . A A . 3 ALA O 1 1 17 6985 1 1 4 LEU C C -18.186 -0.609 -6.503 1.00 . A A . 4 LEU C 1 1 17 6986 1 1 4 LEU CA C -19.527 -0.137 -7.048 1.00 . A A . 4 LEU CA 1 1 17 6987 1 1 4 LEU CB C -19.333 1.157 -7.847 1.00 . A A . 4 LEU CB 1 1 17 6988 1 1 4 LEU CD1 C -20.503 1.205 -10.069 1.00 . A A . 4 LEU CD1 1 1 17 6989 1 1 4 LEU CD2 C -18.034 1.592 -9.955 1.00 . A A . 4 LEU CD2 1 1 17 6990 1 1 4 LEU CG C -19.210 0.824 -9.341 1.00 . A A . 4 LEU CG 1 1 17 6991 1 1 4 LEU H H -20.737 0.975 -5.702 1.00 . A A . 4 LEU H 1 1 17 6992 1 1 4 LEU HA H -19.923 -0.899 -7.705 1.00 . A A . 4 LEU HA 1 1 17 6993 1 1 4 LEU HB2 H -20.181 1.807 -7.692 1.00 . A A . 4 LEU HB2 1 1 17 6994 1 1 4 LEU HB3 H -18.436 1.655 -7.514 1.00 . A A . 4 LEU HB3 1 1 17 6995 1 1 4 LEU HD11 H -20.320 1.250 -11.136 1.00 . A A . 4 LEU HD11 1 1 17 6996 1 1 4 LEU HD12 H -20.840 2.172 -9.723 1.00 . A A . 4 LEU HD12 1 1 17 6997 1 1 4 LEU HD13 H -21.264 0.466 -9.867 1.00 . A A . 4 LEU HD13 1 1 17 6998 1 1 4 LEU HD21 H -18.367 2.109 -10.840 1.00 . A A . 4 LEU HD21 1 1 17 6999 1 1 4 LEU HD22 H -17.251 0.896 -10.224 1.00 . A A . 4 LEU HD22 1 1 17 7000 1 1 4 LEU HD23 H -17.654 2.304 -9.242 1.00 . A A . 4 LEU HD23 1 1 17 7001 1 1 4 LEU HG H -19.041 -0.234 -9.456 1.00 . A A . 4 LEU HG 1 1 17 7002 1 1 4 LEU N N -20.464 0.067 -5.949 1.00 . A A . 4 LEU N 1 1 17 7003 1 1 4 LEU O O -18.090 -1.013 -5.341 1.00 . A A . 4 LEU O 1 1 17 7004 1 1 5 LEU C C -15.414 -0.271 -5.647 1.00 . A A . 5 LEU C 1 1 17 7005 1 1 5 LEU CA C -15.826 -0.982 -6.929 1.00 . A A . 5 LEU CA 1 1 17 7006 1 1 5 LEU CB C -14.804 -0.689 -8.038 1.00 . A A . 5 LEU CB 1 1 17 7007 1 1 5 LEU CD1 C -14.121 -3.103 -8.213 1.00 . A A . 5 LEU CD1 1 1 17 7008 1 1 5 LEU CD2 C -16.069 -2.249 -9.532 1.00 . A A . 5 LEU CD2 1 1 17 7009 1 1 5 LEU CG C -14.687 -1.898 -8.976 1.00 . A A . 5 LEU CG 1 1 17 7010 1 1 5 LEU H H -17.300 -0.225 -8.252 1.00 . A A . 5 LEU H 1 1 17 7011 1 1 5 LEU HA H -15.843 -2.045 -6.743 1.00 . A A . 5 LEU HA 1 1 17 7012 1 1 5 LEU HB2 H -15.127 0.174 -8.604 1.00 . A A . 5 LEU HB2 1 1 17 7013 1 1 5 LEU HB3 H -13.840 -0.486 -7.598 1.00 . A A . 5 LEU HB3 1 1 17 7014 1 1 5 LEU HD11 H -13.612 -3.760 -8.902 1.00 . A A . 5 LEU HD11 1 1 17 7015 1 1 5 LEU HD12 H -14.928 -3.640 -7.737 1.00 . A A . 5 LEU HD12 1 1 17 7016 1 1 5 LEU HD13 H -13.425 -2.762 -7.461 1.00 . A A . 5 LEU HD13 1 1 17 7017 1 1 5 LEU HD21 H -16.454 -1.406 -10.087 1.00 . A A . 5 LEU HD21 1 1 17 7018 1 1 5 LEU HD22 H -16.742 -2.484 -8.717 1.00 . A A . 5 LEU HD22 1 1 17 7019 1 1 5 LEU HD23 H -15.990 -3.104 -10.187 1.00 . A A . 5 LEU HD23 1 1 17 7020 1 1 5 LEU HG H -14.024 -1.650 -9.795 1.00 . A A . 5 LEU HG 1 1 17 7021 1 1 5 LEU N N -17.159 -0.556 -7.341 1.00 . A A . 5 LEU N 1 1 17 7022 1 1 5 LEU O O -15.836 0.859 -5.387 1.00 . A A . 5 LEU O 1 1 17 7023 1 1 6 ALA C C -12.631 -0.721 -3.418 1.00 . A A . 6 ALA C 1 1 17 7024 1 1 6 ALA CA C -14.102 -0.381 -3.598 1.00 . A A . 6 ALA CA 1 1 17 7025 1 1 6 ALA CB C -14.909 -0.942 -2.419 1.00 . A A . 6 ALA CB 1 1 17 7026 1 1 6 ALA H H -14.283 -1.835 -5.129 1.00 . A A . 6 ALA H 1 1 17 7027 1 1 6 ALA HA H -14.216 0.693 -3.622 1.00 . A A . 6 ALA HA 1 1 17 7028 1 1 6 ALA HB1 H -15.953 -1.007 -2.689 1.00 . A A . 6 ALA HB1 1 1 17 7029 1 1 6 ALA HB2 H -14.802 -0.286 -1.566 1.00 . A A . 6 ALA HB2 1 1 17 7030 1 1 6 ALA HB3 H -14.542 -1.927 -2.163 1.00 . A A . 6 ALA HB3 1 1 17 7031 1 1 6 ALA N N -14.584 -0.940 -4.857 1.00 . A A . 6 ALA N 1 1 17 7032 1 1 6 ALA O O -12.230 -1.867 -3.619 1.00 . A A . 6 ALA O 1 1 17 7033 1 1 7 LEU C C -10.164 -0.772 -1.599 1.00 . A A . 7 LEU C 1 1 17 7034 1 1 7 LEU CA C -10.405 0.048 -2.858 1.00 . A A . 7 LEU CA 1 1 17 7035 1 1 7 LEU CB C -9.655 1.382 -2.733 1.00 . A A . 7 LEU CB 1 1 17 7036 1 1 7 LEU CD1 C -8.792 3.323 -4.046 1.00 . A A . 7 LEU CD1 1 1 17 7037 1 1 7 LEU CD2 C -9.797 1.388 -5.249 1.00 . A A . 7 LEU CD2 1 1 17 7038 1 1 7 LEU CG C -9.875 2.245 -3.980 1.00 . A A . 7 LEU CG 1 1 17 7039 1 1 7 LEU H H -12.205 1.170 -2.913 1.00 . A A . 7 LEU H 1 1 17 7040 1 1 7 LEU HA H -10.022 -0.496 -3.707 1.00 . A A . 7 LEU HA 1 1 17 7041 1 1 7 LEU HB2 H -10.022 1.911 -1.864 1.00 . A A . 7 LEU HB2 1 1 17 7042 1 1 7 LEU HB3 H -8.598 1.188 -2.611 1.00 . A A . 7 LEU HB3 1 1 17 7043 1 1 7 LEU HD11 H -9.196 4.206 -4.514 1.00 . A A . 7 LEU HD11 1 1 17 7044 1 1 7 LEU HD12 H -7.955 2.961 -4.624 1.00 . A A . 7 LEU HD12 1 1 17 7045 1 1 7 LEU HD13 H -8.461 3.565 -3.046 1.00 . A A . 7 LEU HD13 1 1 17 7046 1 1 7 LEU HD21 H -9.071 0.602 -5.110 1.00 . A A . 7 LEU HD21 1 1 17 7047 1 1 7 LEU HD22 H -9.502 2.010 -6.087 1.00 . A A . 7 LEU HD22 1 1 17 7048 1 1 7 LEU HD23 H -10.764 0.951 -5.452 1.00 . A A . 7 LEU HD23 1 1 17 7049 1 1 7 LEU HG H -10.844 2.718 -3.922 1.00 . A A . 7 LEU HG 1 1 17 7050 1 1 7 LEU N N -11.833 0.274 -3.052 1.00 . A A . 7 LEU N 1 1 17 7051 1 1 7 LEU O O -11.054 -0.921 -0.762 1.00 . A A . 7 LEU O 1 1 17 7052 1 1 8 ALA C C -7.148 -2.605 -0.476 1.00 . A A . 8 ALA C 1 1 17 7053 1 1 8 ALA CA C -8.563 -2.084 -0.310 1.00 . A A . 8 ALA CA 1 1 17 7054 1 1 8 ALA CB C -9.526 -3.258 -0.126 1.00 . A A . 8 ALA CB 1 1 17 7055 1 1 8 ALA H H -8.284 -1.111 -2.176 1.00 . A A . 8 ALA H 1 1 17 7056 1 1 8 ALA HA H -8.593 -1.459 0.565 1.00 . A A . 8 ALA HA 1 1 17 7057 1 1 8 ALA HB1 H -10.378 -2.934 0.451 1.00 . A A . 8 ALA HB1 1 1 17 7058 1 1 8 ALA HB2 H -9.021 -4.062 0.392 1.00 . A A . 8 ALA HB2 1 1 17 7059 1 1 8 ALA HB3 H -9.859 -3.605 -1.093 1.00 . A A . 8 ALA HB3 1 1 17 7060 1 1 8 ALA N N -8.947 -1.286 -1.472 1.00 . A A . 8 ALA N 1 1 17 7061 1 1 8 ALA O O -6.428 -2.821 0.498 1.00 . A A . 8 ALA O 1 1 17 7062 1 1 9 LEU C C -4.473 -2.135 -2.154 1.00 . A A . 9 LEU C 1 1 17 7063 1 1 9 LEU CA C -5.431 -3.292 -2.034 1.00 . A A . 9 LEU CA 1 1 17 7064 1 1 9 LEU CB C -5.457 -4.010 -3.363 1.00 . A A . 9 LEU CB 1 1 17 7065 1 1 9 LEU CD1 C -7.843 -4.778 -3.276 1.00 . A A . 9 LEU CD1 1 1 17 7066 1 1 9 LEU CD2 C -6.135 -6.095 -4.540 1.00 . A A . 9 LEU CD2 1 1 17 7067 1 1 9 LEU CG C -6.378 -5.230 -3.301 1.00 . A A . 9 LEU CG 1 1 17 7068 1 1 9 LEU H H -7.386 -2.609 -2.445 1.00 . A A . 9 LEU H 1 1 17 7069 1 1 9 LEU HA H -5.096 -3.967 -1.269 1.00 . A A . 9 LEU HA 1 1 17 7070 1 1 9 LEU HB2 H -5.808 -3.322 -4.118 1.00 . A A . 9 LEU HB2 1 1 17 7071 1 1 9 LEU HB3 H -4.457 -4.326 -3.603 1.00 . A A . 9 LEU HB3 1 1 17 7072 1 1 9 LEU HD11 H -7.920 -3.775 -3.666 1.00 . A A . 9 LEU HD11 1 1 17 7073 1 1 9 LEU HD12 H -8.209 -4.799 -2.260 1.00 . A A . 9 LEU HD12 1 1 17 7074 1 1 9 LEU HD13 H -8.434 -5.443 -3.884 1.00 . A A . 9 LEU HD13 1 1 17 7075 1 1 9 LEU HD21 H -5.710 -5.487 -5.329 1.00 . A A . 9 LEU HD21 1 1 17 7076 1 1 9 LEU HD22 H -7.074 -6.512 -4.877 1.00 . A A . 9 LEU HD22 1 1 17 7077 1 1 9 LEU HD23 H -5.452 -6.896 -4.299 1.00 . A A . 9 LEU HD23 1 1 17 7078 1 1 9 LEU HG H -6.160 -5.805 -2.409 1.00 . A A . 9 LEU HG 1 1 17 7079 1 1 9 LEU N N -6.761 -2.801 -1.719 1.00 . A A . 9 LEU N 1 1 17 7080 1 1 9 LEU O O -3.482 -2.047 -1.434 1.00 . A A . 9 LEU O 1 1 17 7081 1 1 10 HIS C C -3.494 0.450 -1.991 1.00 . A A . 10 HIS C 1 1 17 7082 1 1 10 HIS CA C -3.982 -0.057 -3.320 1.00 . A A . 10 HIS CA 1 1 17 7083 1 1 10 HIS CB C -4.817 1.043 -3.960 1.00 . A A . 10 HIS CB 1 1 17 7084 1 1 10 HIS CD2 C -4.684 -0.291 -6.224 1.00 . A A . 10 HIS CD2 1 1 17 7085 1 1 10 HIS CE1 C -5.848 1.068 -7.452 1.00 . A A . 10 HIS CE1 1 1 17 7086 1 1 10 HIS CG C -5.055 0.756 -5.418 1.00 . A A . 10 HIS CG 1 1 17 7087 1 1 10 HIS H H -5.613 -1.391 -3.606 1.00 . A A . 10 HIS H 1 1 17 7088 1 1 10 HIS HA H -3.148 -0.303 -3.952 1.00 . A A . 10 HIS HA 1 1 17 7089 1 1 10 HIS HB2 H -5.768 1.106 -3.448 1.00 . A A . 10 HIS HB2 1 1 17 7090 1 1 10 HIS HB3 H -4.293 1.976 -3.852 1.00 . A A . 10 HIS HB3 1 1 17 7091 1 1 10 HIS HD1 H -6.212 2.460 -5.946 1.00 . A A . 10 HIS HD1 1 1 17 7092 1 1 10 HIS HD2 H -4.107 -1.148 -5.908 1.00 . A A . 10 HIS HD2 1 1 17 7093 1 1 10 HIS HE1 H -6.368 1.514 -8.288 1.00 . A A . 10 HIS HE1 1 1 17 7094 1 1 10 HIS HE2 H -5.068 -0.673 -8.295 1.00 . A A . 10 HIS HE2 1 1 17 7095 1 1 10 HIS N N -4.797 -1.245 -3.082 1.00 . A A . 10 HIS N 1 1 17 7096 1 1 10 HIS ND1 N -5.796 1.612 -6.223 1.00 . A A . 10 HIS ND1 1 1 17 7097 1 1 10 HIS NE2 N -5.186 -0.092 -7.509 1.00 . A A . 10 HIS NE2 1 1 17 7098 1 1 10 HIS O O -2.339 0.816 -1.809 1.00 . A A . 10 HIS O 1 1 17 7099 1 1 11 HIS C C -2.827 0.355 0.756 1.00 . A A . 11 HIS C 1 1 17 7100 1 1 11 HIS CA C -4.198 0.815 0.294 1.00 . A A . 11 HIS CA 1 1 17 7101 1 1 11 HIS CB C -5.261 0.100 1.108 1.00 . A A . 11 HIS CB 1 1 17 7102 1 1 11 HIS CD2 C -7.062 1.797 0.213 1.00 . A A . 11 HIS CD2 1 1 17 7103 1 1 11 HIS CE1 C -8.422 1.753 1.899 1.00 . A A . 11 HIS CE1 1 1 17 7104 1 1 11 HIS CG C -6.521 0.928 1.133 1.00 . A A . 11 HIS CG 1 1 17 7105 1 1 11 HIS H H -5.307 0.081 -1.320 1.00 . A A . 11 HIS H 1 1 17 7106 1 1 11 HIS HA H -4.302 1.878 0.405 1.00 . A A . 11 HIS HA 1 1 17 7107 1 1 11 HIS HB2 H -5.464 -0.864 0.628 1.00 . A A . 11 HIS HB2 1 1 17 7108 1 1 11 HIS HB3 H -4.897 -0.064 2.108 1.00 . A A . 11 HIS HB3 1 1 17 7109 1 1 11 HIS HD1 H -7.311 0.395 3.031 1.00 . A A . 11 HIS HD1 1 1 17 7110 1 1 11 HIS HD2 H -6.619 2.049 -0.740 1.00 . A A . 11 HIS HD2 1 1 17 7111 1 1 11 HIS HE1 H -9.259 1.953 2.554 1.00 . A A . 11 HIS HE1 1 1 17 7112 1 1 11 HIS HE2 H -8.865 2.950 0.245 1.00 . A A . 11 HIS HE2 1 1 17 7113 1 1 11 HIS N N -4.423 0.421 -1.072 1.00 . A A . 11 HIS N 1 1 17 7114 1 1 11 HIS ND1 N -7.408 0.916 2.202 1.00 . A A . 11 HIS ND1 1 1 17 7115 1 1 11 HIS NE2 N -8.260 2.314 0.697 1.00 . A A . 11 HIS NE2 1 1 17 7116 1 1 11 HIS O O -2.029 1.106 1.334 1.00 . A A . 11 HIS O 1 1 17 7117 1 1 12 LEU C C -0.290 -1.205 -0.242 1.00 . A A . 12 LEU C 1 1 17 7118 1 1 12 LEU CA C -1.307 -1.510 0.828 1.00 . A A . 12 LEU CA 1 1 17 7119 1 1 12 LEU CB C -1.480 -3.027 0.950 1.00 . A A . 12 LEU CB 1 1 17 7120 1 1 12 LEU CD1 C -1.119 -2.894 3.435 1.00 . A A . 12 LEU CD1 1 1 17 7121 1 1 12 LEU CD2 C -3.436 -2.769 2.499 1.00 . A A . 12 LEU CD2 1 1 17 7122 1 1 12 LEU CG C -2.048 -3.397 2.328 1.00 . A A . 12 LEU CG 1 1 17 7123 1 1 12 LEU H H -3.246 -1.412 -0.018 1.00 . A A . 12 LEU H 1 1 17 7124 1 1 12 LEU HA H -0.971 -1.106 1.770 1.00 . A A . 12 LEU HA 1 1 17 7125 1 1 12 LEU HB2 H -2.160 -3.368 0.181 1.00 . A A . 12 LEU HB2 1 1 17 7126 1 1 12 LEU HB3 H -0.522 -3.504 0.816 1.00 . A A . 12 LEU HB3 1 1 17 7127 1 1 12 LEU HD11 H -0.104 -2.864 3.070 1.00 . A A . 12 LEU HD11 1 1 17 7128 1 1 12 LEU HD12 H -1.177 -3.560 4.284 1.00 . A A . 12 LEU HD12 1 1 17 7129 1 1 12 LEU HD13 H -1.423 -1.902 3.738 1.00 . A A . 12 LEU HD13 1 1 17 7130 1 1 12 LEU HD21 H -4.022 -3.372 3.175 1.00 . A A . 12 LEU HD21 1 1 17 7131 1 1 12 LEU HD22 H -3.931 -2.721 1.540 1.00 . A A . 12 LEU HD22 1 1 17 7132 1 1 12 LEU HD23 H -3.335 -1.773 2.901 1.00 . A A . 12 LEU HD23 1 1 17 7133 1 1 12 LEU HG H -2.132 -4.470 2.398 1.00 . A A . 12 LEU HG 1 1 17 7134 1 1 12 LEU N N -2.568 -0.894 0.470 1.00 . A A . 12 LEU N 1 1 17 7135 1 1 12 LEU O O 0.862 -0.881 0.047 1.00 . A A . 12 LEU O 1 1 17 7136 1 1 13 ALA C C 0.741 0.375 -2.386 1.00 . A A . 13 ALA C 1 1 17 7137 1 1 13 ALA CA C 0.124 -0.992 -2.612 1.00 . A A . 13 ALA CA 1 1 17 7138 1 1 13 ALA CB C -0.668 -0.995 -3.919 1.00 . A A . 13 ALA CB 1 1 17 7139 1 1 13 ALA H H -1.685 -1.534 -1.621 1.00 . A A . 13 ALA H 1 1 17 7140 1 1 13 ALA HA H 0.907 -1.734 -2.665 1.00 . A A . 13 ALA HA 1 1 17 7141 1 1 13 ALA HB1 H -1.130 -0.028 -4.060 1.00 . A A . 13 ALA HB1 1 1 17 7142 1 1 13 ALA HB2 H -1.433 -1.757 -3.879 1.00 . A A . 13 ALA HB2 1 1 17 7143 1 1 13 ALA HB3 H 0.000 -1.198 -4.743 1.00 . A A . 13 ALA HB3 1 1 17 7144 1 1 13 ALA N N -0.743 -1.290 -1.477 1.00 . A A . 13 ALA N 1 1 17 7145 1 1 13 ALA O O 1.858 0.657 -2.805 1.00 . A A . 13 ALA O 1 1 17 7146 1 1 14 HIS C C 1.557 2.469 -0.372 1.00 . A A . 14 HIS C 1 1 17 7147 1 1 14 HIS CA C 0.408 2.547 -1.353 1.00 . A A . 14 HIS CA 1 1 17 7148 1 1 14 HIS CB C -0.770 3.306 -0.758 1.00 . A A . 14 HIS CB 1 1 17 7149 1 1 14 HIS CD2 C -0.745 4.514 1.565 1.00 . A A . 14 HIS CD2 1 1 17 7150 1 1 14 HIS CE1 C 0.877 5.902 1.204 1.00 . A A . 14 HIS CE1 1 1 17 7151 1 1 14 HIS CG C -0.310 4.286 0.286 1.00 . A A . 14 HIS CG 1 1 17 7152 1 1 14 HIS H H -0.896 0.892 -1.385 1.00 . A A . 14 HIS H 1 1 17 7153 1 1 14 HIS HA H 0.740 3.048 -2.245 1.00 . A A . 14 HIS HA 1 1 17 7154 1 1 14 HIS HB2 H -1.271 3.822 -1.546 1.00 . A A . 14 HIS HB2 1 1 17 7155 1 1 14 HIS HB3 H -1.453 2.602 -0.305 1.00 . A A . 14 HIS HB3 1 1 17 7156 1 1 14 HIS HD1 H 1.279 5.262 -0.741 1.00 . A A . 14 HIS HD1 1 1 17 7157 1 1 14 HIS HD2 H -1.530 3.956 2.057 1.00 . A A . 14 HIS HD2 1 1 17 7158 1 1 14 HIS HE1 H 1.615 6.683 1.335 1.00 . A A . 14 HIS HE1 1 1 17 7159 1 1 14 HIS HE2 H -0.089 5.902 3.054 1.00 . A A . 14 HIS HE2 1 1 17 7160 1 1 14 HIS N N -0.018 1.205 -1.692 1.00 . A A . 14 HIS N 1 1 17 7161 1 1 14 HIS ND1 N 0.731 5.182 0.073 1.00 . A A . 14 HIS ND1 1 1 17 7162 1 1 14 HIS NE2 N 0.002 5.535 2.145 1.00 . A A . 14 HIS NE2 1 1 17 7163 1 1 14 HIS O O 2.645 2.995 -0.612 1.00 . A A . 14 HIS O 1 1 17 7164 1 1 15 LEU C C 3.546 0.963 0.941 1.00 . A A . 15 LEU C 1 1 17 7165 1 1 15 LEU CA C 2.399 1.585 1.684 1.00 . A A . 15 LEU CA 1 1 17 7166 1 1 15 LEU CB C 1.977 0.614 2.782 1.00 . A A . 15 LEU CB 1 1 17 7167 1 1 15 LEU CD1 C 0.331 2.471 3.243 1.00 . A A . 15 LEU CD1 1 1 17 7168 1 1 15 LEU CD2 C 0.100 0.264 4.367 1.00 . A A . 15 LEU CD2 1 1 17 7169 1 1 15 LEU CG C 1.098 1.292 3.838 1.00 . A A . 15 LEU CG 1 1 17 7170 1 1 15 LEU H H 0.459 1.329 0.844 1.00 . A A . 15 LEU H 1 1 17 7171 1 1 15 LEU HA H 2.704 2.533 2.091 1.00 . A A . 15 LEU HA 1 1 17 7172 1 1 15 LEU HB2 H 1.428 -0.200 2.332 1.00 . A A . 15 LEU HB2 1 1 17 7173 1 1 15 LEU HB3 H 2.863 0.219 3.255 1.00 . A A . 15 LEU HB3 1 1 17 7174 1 1 15 LEU HD11 H -0.319 2.891 3.996 1.00 . A A . 15 LEU HD11 1 1 17 7175 1 1 15 LEU HD12 H -0.263 2.132 2.408 1.00 . A A . 15 LEU HD12 1 1 17 7176 1 1 15 LEU HD13 H 1.029 3.226 2.910 1.00 . A A . 15 LEU HD13 1 1 17 7177 1 1 15 LEU HD21 H -0.780 0.263 3.739 1.00 . A A . 15 LEU HD21 1 1 17 7178 1 1 15 LEU HD22 H -0.179 0.518 5.375 1.00 . A A . 15 LEU HD22 1 1 17 7179 1 1 15 LEU HD23 H 0.552 -0.716 4.353 1.00 . A A . 15 LEU HD23 1 1 17 7180 1 1 15 LEU HG H 1.716 1.637 4.648 1.00 . A A . 15 LEU HG 1 1 17 7181 1 1 15 LEU N N 1.333 1.765 0.714 1.00 . A A . 15 LEU N 1 1 17 7182 1 1 15 LEU O O 4.720 1.213 1.199 1.00 . A A . 15 LEU O 1 1 17 7183 1 1 16 ALA C C 4.829 0.421 -1.748 1.00 . A A . 16 ALA C 1 1 17 7184 1 1 16 ALA CA C 4.122 -0.559 -0.829 1.00 . A A . 16 ALA CA 1 1 17 7185 1 1 16 ALA CB C 3.427 -1.636 -1.660 1.00 . A A . 16 ALA CB 1 1 17 7186 1 1 16 ALA H H 2.182 0.008 -0.135 1.00 . A A . 16 ALA H 1 1 17 7187 1 1 16 ALA HA H 4.851 -1.024 -0.189 1.00 . A A . 16 ALA HA 1 1 17 7188 1 1 16 ALA HB1 H 2.646 -2.095 -1.072 1.00 . A A . 16 ALA HB1 1 1 17 7189 1 1 16 ALA HB2 H 4.146 -2.385 -1.949 1.00 . A A . 16 ALA HB2 1 1 17 7190 1 1 16 ALA HB3 H 2.998 -1.189 -2.542 1.00 . A A . 16 ALA HB3 1 1 17 7191 1 1 16 ALA N N 3.158 0.141 0.000 1.00 . A A . 16 ALA N 1 1 17 7192 1 1 16 ALA O O 5.983 0.213 -2.123 1.00 . A A . 16 ALA O 1 1 17 7193 1 1 17 LEU C C 5.913 3.114 -2.402 1.00 . A A . 17 LEU C 1 1 17 7194 1 1 17 LEU CA C 4.663 2.499 -2.996 1.00 . A A . 17 LEU CA 1 1 17 7195 1 1 17 LEU CB C 3.596 3.583 -3.293 1.00 . A A . 17 LEU CB 1 1 17 7196 1 1 17 LEU CD1 C 3.562 5.909 -4.232 1.00 . A A . 17 LEU CD1 1 1 17 7197 1 1 17 LEU CD2 C 3.842 5.580 -1.780 1.00 . A A . 17 LEU CD2 1 1 17 7198 1 1 17 LEU CG C 4.176 5.008 -3.162 1.00 . A A . 17 LEU CG 1 1 17 7199 1 1 17 LEU H H 3.204 1.567 -1.775 1.00 . A A . 17 LEU H 1 1 17 7200 1 1 17 LEU HA H 4.938 2.026 -3.918 1.00 . A A . 17 LEU HA 1 1 17 7201 1 1 17 LEU HB2 H 3.234 3.444 -4.297 1.00 . A A . 17 LEU HB2 1 1 17 7202 1 1 17 LEU HB3 H 2.774 3.469 -2.607 1.00 . A A . 17 LEU HB3 1 1 17 7203 1 1 17 LEU HD11 H 3.790 5.513 -5.210 1.00 . A A . 17 LEU HD11 1 1 17 7204 1 1 17 LEU HD12 H 3.971 6.904 -4.143 1.00 . A A . 17 LEU HD12 1 1 17 7205 1 1 17 LEU HD13 H 2.490 5.948 -4.101 1.00 . A A . 17 LEU HD13 1 1 17 7206 1 1 17 LEU HD21 H 4.559 6.346 -1.528 1.00 . A A . 17 LEU HD21 1 1 17 7207 1 1 17 LEU HD22 H 3.880 4.795 -1.040 1.00 . A A . 17 LEU HD22 1 1 17 7208 1 1 17 LEU HD23 H 2.851 6.008 -1.798 1.00 . A A . 17 LEU HD23 1 1 17 7209 1 1 17 LEU HG H 5.244 4.980 -3.291 1.00 . A A . 17 LEU HG 1 1 17 7210 1 1 17 LEU N N 4.120 1.478 -2.106 1.00 . A A . 17 LEU N 1 1 17 7211 1 1 17 LEU O O 6.943 3.215 -3.071 1.00 . A A . 17 LEU O 1 1 17 7212 1 1 18 HIS C C 8.005 3.044 -0.237 1.00 . A A . 18 HIS C 1 1 17 7213 1 1 18 HIS CA C 7.015 4.124 -0.537 1.00 . A A . 18 HIS CA 1 1 17 7214 1 1 18 HIS CB C 6.653 4.904 0.706 1.00 . A A . 18 HIS CB 1 1 17 7215 1 1 18 HIS CD2 C 4.784 3.717 2.074 1.00 . A A . 18 HIS CD2 1 1 17 7216 1 1 18 HIS CE1 C 6.032 2.750 3.560 1.00 . A A . 18 HIS CE1 1 1 17 7217 1 1 18 HIS CG C 6.078 4.025 1.771 1.00 . A A . 18 HIS CG 1 1 17 7218 1 1 18 HIS H H 4.988 3.420 -0.647 1.00 . A A . 18 HIS H 1 1 17 7219 1 1 18 HIS HA H 7.463 4.801 -1.249 1.00 . A A . 18 HIS HA 1 1 17 7220 1 1 18 HIS HB2 H 7.531 5.399 1.088 1.00 . A A . 18 HIS HB2 1 1 17 7221 1 1 18 HIS HB3 H 5.928 5.627 0.430 1.00 . A A . 18 HIS HB3 1 1 17 7222 1 1 18 HIS HD1 H 7.842 3.421 2.778 1.00 . A A . 18 HIS HD1 1 1 17 7223 1 1 18 HIS HD2 H 3.916 4.042 1.509 1.00 . A A . 18 HIS HD2 1 1 17 7224 1 1 18 HIS HE1 H 6.362 2.173 4.413 1.00 . A A . 18 HIS HE1 1 1 17 7225 1 1 18 HIS HE2 H 3.957 2.546 3.657 1.00 . A A . 18 HIS HE2 1 1 17 7226 1 1 18 HIS N N 5.837 3.527 -1.153 1.00 . A A . 18 HIS N 1 1 17 7227 1 1 18 HIS ND1 N 6.862 3.398 2.723 1.00 . A A . 18 HIS ND1 1 1 17 7228 1 1 18 HIS NE2 N 4.751 2.911 3.209 1.00 . A A . 18 HIS NE2 1 1 17 7229 1 1 18 HIS O O 9.198 3.161 -0.534 1.00 . A A . 18 HIS O 1 1 17 7230 1 1 19 LEU C C 9.118 0.517 -0.671 1.00 . A A . 19 LEU C 1 1 17 7231 1 1 19 LEU CA C 8.312 0.808 0.577 1.00 . A A . 19 LEU CA 1 1 17 7232 1 1 19 LEU CB C 7.432 -0.408 0.887 1.00 . A A . 19 LEU CB 1 1 17 7233 1 1 19 LEU CD1 C 9.208 -1.108 2.499 1.00 . A A . 19 LEU CD1 1 1 17 7234 1 1 19 LEU CD2 C 7.179 0.092 3.312 1.00 . A A . 19 LEU CD2 1 1 17 7235 1 1 19 LEU CG C 7.707 -0.918 2.297 1.00 . A A . 19 LEU CG 1 1 17 7236 1 1 19 LEU H H 6.518 1.942 0.467 1.00 . A A . 19 LEU H 1 1 17 7237 1 1 19 LEU HA H 8.973 1.014 1.403 1.00 . A A . 19 LEU HA 1 1 17 7238 1 1 19 LEU HB2 H 6.395 -0.128 0.804 1.00 . A A . 19 LEU HB2 1 1 17 7239 1 1 19 LEU HB3 H 7.645 -1.195 0.179 1.00 . A A . 19 LEU HB3 1 1 17 7240 1 1 19 LEU HD11 H 9.688 -1.228 1.538 1.00 . A A . 19 LEU HD11 1 1 17 7241 1 1 19 LEU HD12 H 9.377 -1.989 3.098 1.00 . A A . 19 LEU HD12 1 1 17 7242 1 1 19 LEU HD13 H 9.616 -0.243 3.004 1.00 . A A . 19 LEU HD13 1 1 17 7243 1 1 19 LEU HD21 H 7.754 1.005 3.245 1.00 . A A . 19 LEU HD21 1 1 17 7244 1 1 19 LEU HD22 H 7.269 -0.317 4.307 1.00 . A A . 19 LEU HD22 1 1 17 7245 1 1 19 LEU HD23 H 6.139 0.304 3.102 1.00 . A A . 19 LEU HD23 1 1 17 7246 1 1 19 LEU HG H 7.205 -1.860 2.428 1.00 . A A . 19 LEU HG 1 1 17 7247 1 1 19 LEU N N 7.486 1.966 0.297 1.00 . A A . 19 LEU N 1 1 17 7248 1 1 19 LEU O O 10.263 0.067 -0.618 1.00 . A A . 19 LEU O 1 1 17 7249 1 1 20 ALA C C 10.358 1.442 -3.209 1.00 . A A . 20 ALA C 1 1 17 7250 1 1 20 ALA CA C 9.109 0.595 -3.102 1.00 . A A . 20 ALA CA 1 1 17 7251 1 1 20 ALA CB C 8.147 0.984 -4.224 1.00 . A A . 20 ALA CB 1 1 17 7252 1 1 20 ALA H H 7.571 1.176 -1.741 1.00 . A A . 20 ALA H 1 1 17 7253 1 1 20 ALA HA H 9.376 -0.441 -3.208 1.00 . A A . 20 ALA HA 1 1 17 7254 1 1 20 ALA HB1 H 8.275 2.030 -4.457 1.00 . A A . 20 ALA HB1 1 1 17 7255 1 1 20 ALA HB2 H 7.133 0.809 -3.903 1.00 . A A . 20 ALA HB2 1 1 17 7256 1 1 20 ALA HB3 H 8.357 0.392 -5.100 1.00 . A A . 20 ALA HB3 1 1 17 7257 1 1 20 ALA N N 8.486 0.802 -1.799 1.00 . A A . 20 ALA N 1 1 17 7258 1 1 20 ALA O O 11.456 0.940 -3.447 1.00 . A A . 20 ALA O 1 1 17 7259 1 1 21 LEU C C 12.436 3.126 -2.266 1.00 . A A . 21 LEU C 1 1 17 7260 1 1 21 LEU CA C 11.278 3.681 -3.073 1.00 . A A . 21 LEU CA 1 1 17 7261 1 1 21 LEU CB C 10.856 5.034 -2.493 1.00 . A A . 21 LEU CB 1 1 17 7262 1 1 21 LEU CD1 C 9.112 6.829 -2.537 1.00 . A A . 21 LEU CD1 1 1 17 7263 1 1 21 LEU CD2 C 9.934 5.834 -4.683 1.00 . A A . 21 LEU CD2 1 1 17 7264 1 1 21 LEU CG C 9.603 5.545 -3.212 1.00 . A A . 21 LEU CG 1 1 17 7265 1 1 21 LEU H H 9.263 3.053 -2.829 1.00 . A A . 21 LEU H 1 1 17 7266 1 1 21 LEU HA H 11.586 3.811 -4.094 1.00 . A A . 21 LEU HA 1 1 17 7267 1 1 21 LEU HB2 H 10.645 4.918 -1.439 1.00 . A A . 21 LEU HB2 1 1 17 7268 1 1 21 LEU HB3 H 11.661 5.745 -2.622 1.00 . A A . 21 LEU HB3 1 1 17 7269 1 1 21 LEU HD11 H 9.912 7.553 -2.518 1.00 . A A . 21 LEU HD11 1 1 17 7270 1 1 21 LEU HD12 H 8.798 6.611 -1.525 1.00 . A A . 21 LEU HD12 1 1 17 7271 1 1 21 LEU HD13 H 8.278 7.233 -3.092 1.00 . A A . 21 LEU HD13 1 1 17 7272 1 1 21 LEU HD21 H 9.237 6.565 -5.069 1.00 . A A . 21 LEU HD21 1 1 17 7273 1 1 21 LEU HD22 H 9.857 4.920 -5.257 1.00 . A A . 21 LEU HD22 1 1 17 7274 1 1 21 LEU HD23 H 10.940 6.223 -4.757 1.00 . A A . 21 LEU HD23 1 1 17 7275 1 1 21 LEU HG H 8.829 4.794 -3.156 1.00 . A A . 21 LEU HG 1 1 17 7276 1 1 21 LEU N N 10.168 2.735 -3.018 1.00 . A A . 21 LEU N 1 1 17 7277 1 1 21 LEU O O 13.575 3.060 -2.737 1.00 . A A . 21 LEU O 1 1 17 7278 1 1 22 ALA C C 13.745 0.923 -0.831 1.00 . A A . 22 ALA C 1 1 17 7279 1 1 22 ALA CA C 13.110 2.129 -0.161 1.00 . A A . 22 ALA CA 1 1 17 7280 1 1 22 ALA CB C 12.463 1.709 1.167 1.00 . A A . 22 ALA CB 1 1 17 7281 1 1 22 ALA H H 11.180 2.782 -0.764 1.00 . A A . 22 ALA H 1 1 17 7282 1 1 22 ALA HA H 13.873 2.860 0.035 1.00 . A A . 22 ALA HA 1 1 17 7283 1 1 22 ALA HB1 H 12.615 0.652 1.324 1.00 . A A . 22 ALA HB1 1 1 17 7284 1 1 22 ALA HB2 H 11.405 1.919 1.134 1.00 . A A . 22 ALA HB2 1 1 17 7285 1 1 22 ALA HB3 H 12.912 2.262 1.978 1.00 . A A . 22 ALA HB3 1 1 17 7286 1 1 22 ALA N N 12.116 2.709 -1.053 1.00 . A A . 22 ALA N 1 1 17 7287 1 1 22 ALA O O 14.963 0.754 -0.819 1.00 . A A . 22 ALA O 1 1 17 7288 1 1 23 LEU C C 14.334 -0.665 -3.228 1.00 . A A . 23 LEU C 1 1 17 7289 1 1 23 LEU CA C 13.372 -1.087 -2.135 1.00 . A A . 23 LEU CA 1 1 17 7290 1 1 23 LEU CB C 12.184 -1.840 -2.752 1.00 . A A . 23 LEU CB 1 1 17 7291 1 1 23 LEU CD1 C 13.506 -3.931 -3.129 1.00 . A A . 23 LEU CD1 1 1 17 7292 1 1 23 LEU CD2 C 12.374 -3.550 -0.932 1.00 . A A . 23 LEU CD2 1 1 17 7293 1 1 23 LEU CG C 12.274 -3.338 -2.444 1.00 . A A . 23 LEU CG 1 1 17 7294 1 1 23 LEU H H 11.941 0.308 -1.413 1.00 . A A . 23 LEU H 1 1 17 7295 1 1 23 LEU HA H 13.884 -1.725 -1.442 1.00 . A A . 23 LEU HA 1 1 17 7296 1 1 23 LEU HB2 H 11.265 -1.447 -2.341 1.00 . A A . 23 LEU HB2 1 1 17 7297 1 1 23 LEU HB3 H 12.186 -1.693 -3.821 1.00 . A A . 23 LEU HB3 1 1 17 7298 1 1 23 LEU HD11 H 14.395 -3.615 -2.608 1.00 . A A . 23 LEU HD11 1 1 17 7299 1 1 23 LEU HD12 H 13.548 -3.596 -4.157 1.00 . A A . 23 LEU HD12 1 1 17 7300 1 1 23 LEU HD13 H 13.442 -5.008 -3.105 1.00 . A A . 23 LEU HD13 1 1 17 7301 1 1 23 LEU HD21 H 11.823 -4.437 -0.656 1.00 . A A . 23 LEU HD21 1 1 17 7302 1 1 23 LEU HD22 H 11.959 -2.696 -0.418 1.00 . A A . 23 LEU HD22 1 1 17 7303 1 1 23 LEU HD23 H 13.412 -3.670 -0.653 1.00 . A A . 23 LEU HD23 1 1 17 7304 1 1 23 LEU HG H 11.388 -3.832 -2.819 1.00 . A A . 23 LEU HG 1 1 17 7305 1 1 23 LEU N N 12.901 0.100 -1.433 1.00 . A A . 23 LEU N 1 1 17 7306 1 1 23 LEU O O 15.422 -1.227 -3.379 1.00 . A A . 23 LEU O 1 1 17 7307 1 1 24 LYS C C 16.071 1.368 -4.467 1.00 . A A . 24 LYS C 1 1 17 7308 1 1 24 LYS CA C 14.756 0.873 -5.050 1.00 . A A . 24 LYS CA 1 1 17 7309 1 1 24 LYS CB C 14.026 2.022 -5.759 1.00 . A A . 24 LYS CB 1 1 17 7310 1 1 24 LYS CD C 15.057 3.130 -7.769 1.00 . A A . 24 LYS CD 1 1 17 7311 1 1 24 LYS CE C 14.201 4.399 -7.697 1.00 . A A . 24 LYS CE 1 1 17 7312 1 1 24 LYS CG C 14.239 1.929 -7.278 1.00 . A A . 24 LYS CG 1 1 17 7313 1 1 24 LYS H H 13.056 0.755 -3.789 1.00 . A A . 24 LYS H 1 1 17 7314 1 1 24 LYS HA H 14.959 0.090 -5.759 1.00 . A A . 24 LYS HA 1 1 17 7315 1 1 24 LYS HB2 H 12.968 1.956 -5.543 1.00 . A A . 24 LYS HB2 1 1 17 7316 1 1 24 LYS HB3 H 14.407 2.968 -5.399 1.00 . A A . 24 LYS HB3 1 1 17 7317 1 1 24 LYS HD2 H 15.933 3.251 -7.147 1.00 . A A . 24 LYS HD2 1 1 17 7318 1 1 24 LYS HD3 H 15.367 2.964 -8.791 1.00 . A A . 24 LYS HD3 1 1 17 7319 1 1 24 LYS HE2 H 13.471 4.295 -6.908 1.00 . A A . 24 LYS HE2 1 1 17 7320 1 1 24 LYS HE3 H 14.837 5.247 -7.488 1.00 . A A . 24 LYS HE3 1 1 17 7321 1 1 24 LYS HG2 H 14.765 1.013 -7.511 1.00 . A A . 24 LYS HG2 1 1 17 7322 1 1 24 LYS HG3 H 13.280 1.924 -7.772 1.00 . A A . 24 LYS HG3 1 1 17 7323 1 1 24 LYS HZ1 H 13.725 3.837 -9.646 1.00 . A A . 24 LYS HZ1 1 1 17 7324 1 1 24 LYS HZ2 H 13.815 5.512 -9.409 1.00 . A A . 24 LYS HZ2 1 1 17 7325 1 1 24 LYS HZ3 H 12.475 4.643 -8.831 1.00 . A A . 24 LYS HZ3 1 1 17 7326 1 1 24 LYS N N 13.927 0.347 -3.977 1.00 . A A . 24 LYS N 1 1 17 7327 1 1 24 LYS NZ N 13.501 4.612 -8.993 1.00 . A A . 24 LYS NZ 1 1 17 7328 1 1 24 LYS O O 17.153 0.958 -4.895 1.00 . A A . 24 LYS O 1 1 17 7329 1 1 25 LYS C C 16.681 3.747 -1.682 1.00 . A A . 25 LYS C 1 1 17 7330 1 1 25 LYS CA C 17.116 2.799 -2.798 1.00 . A A . 25 LYS CA 1 1 17 7331 1 1 25 LYS CB C 18.018 3.545 -3.792 1.00 . A A . 25 LYS CB 1 1 17 7332 1 1 25 LYS CD C 17.714 5.742 -4.986 1.00 . A A . 25 LYS CD 1 1 17 7333 1 1 25 LYS CE C 18.999 5.725 -5.836 1.00 . A A . 25 LYS CE 1 1 17 7334 1 1 25 LYS CG C 17.173 4.315 -4.821 1.00 . A A . 25 LYS CG 1 1 17 7335 1 1 25 LYS H H 15.051 2.502 -3.186 1.00 . A A . 25 LYS H 1 1 17 7336 1 1 25 LYS HA H 17.683 1.988 -2.363 1.00 . A A . 25 LYS HA 1 1 17 7337 1 1 25 LYS HB2 H 18.646 4.233 -3.250 1.00 . A A . 25 LYS HB2 1 1 17 7338 1 1 25 LYS HB3 H 18.640 2.828 -4.311 1.00 . A A . 25 LYS HB3 1 1 17 7339 1 1 25 LYS HD2 H 16.966 6.354 -5.476 1.00 . A A . 25 LYS HD2 1 1 17 7340 1 1 25 LYS HD3 H 17.932 6.160 -4.016 1.00 . A A . 25 LYS HD3 1 1 17 7341 1 1 25 LYS HE2 H 18.806 5.214 -6.766 1.00 . A A . 25 LYS HE2 1 1 17 7342 1 1 25 LYS HE3 H 19.299 6.743 -6.047 1.00 . A A . 25 LYS HE3 1 1 17 7343 1 1 25 LYS HG2 H 17.219 3.805 -5.770 1.00 . A A . 25 LYS HG2 1 1 17 7344 1 1 25 LYS HG3 H 16.145 4.358 -4.488 1.00 . A A . 25 LYS HG3 1 1 17 7345 1 1 25 LYS HZ1 H 20.111 5.335 -4.114 1.00 . A A . 25 LYS HZ1 1 1 17 7346 1 1 25 LYS HZ2 H 21.009 5.256 -5.551 1.00 . A A . 25 LYS HZ2 1 1 17 7347 1 1 25 LYS HZ3 H 19.941 3.997 -5.149 1.00 . A A . 25 LYS HZ3 1 1 17 7348 1 1 25 LYS N N 15.951 2.240 -3.476 1.00 . A A . 25 LYS N 1 1 17 7349 1 1 25 LYS NZ N 20.094 5.027 -5.105 1.00 . A A . 25 LYS NZ 1 1 17 7350 1 1 25 LYS O O 16.379 3.313 -0.568 1.00 . A A . 25 LYS O 1 1 17 7351 1 1 26 ALA C C 16.171 7.402 -1.688 1.00 . A A . 26 ALA C 1 1 17 7352 1 1 26 ALA CA C 16.263 6.045 -1.012 1.00 . A A . 26 ALA CA 1 1 17 7353 1 1 26 ALA CB C 17.281 6.114 0.131 1.00 . A A . 26 ALA CB 1 1 17 7354 1 1 26 ALA H H 16.913 5.324 -2.887 1.00 . A A . 26 ALA H 1 1 17 7355 1 1 26 ALA HA H 15.297 5.782 -0.604 1.00 . A A . 26 ALA HA 1 1 17 7356 1 1 26 ALA HB1 H 16.785 6.437 1.035 1.00 . A A . 26 ALA HB1 1 1 17 7357 1 1 26 ALA HB2 H 18.061 6.814 -0.121 1.00 . A A . 26 ALA HB2 1 1 17 7358 1 1 26 ALA HB3 H 17.714 5.134 0.288 1.00 . A A . 26 ALA HB3 1 1 17 7359 1 1 26 ALA N N 16.657 5.039 -1.986 1.00 . A A . 26 ALA N 1 1 17 7360 1 1 26 ALA O O 15.113 7.988 -1.648 1.00 . A A . 26 ALA O 1 1 17 7361 1 1 26 ALA OXT O 17.168 7.840 -2.225 1.00 . A A . 26 ALA OXT 1 1 18 7362 1 1 1 LYS C C -23.522 -3.532 0.227 1.00 . A A . 1 LYS C 1 1 18 7363 1 1 1 LYS CA C -23.583 -5.052 0.116 1.00 . A A . 1 LYS CA 1 1 18 7364 1 1 1 LYS CB C -25.019 -5.506 -0.184 1.00 . A A . 1 LYS CB 1 1 18 7365 1 1 1 LYS CD C -26.357 -3.647 -1.237 1.00 . A A . 1 LYS CD 1 1 18 7366 1 1 1 LYS CE C -27.746 -3.823 -1.852 1.00 . A A . 1 LYS CE 1 1 18 7367 1 1 1 LYS CG C -25.505 -4.896 -1.513 1.00 . A A . 1 LYS CG 1 1 18 7368 1 1 1 LYS H1 H -23.808 -6.353 1.722 1.00 . A A . 1 LYS H1 1 1 18 7369 1 1 1 LYS H2 H -23.052 -4.885 2.114 1.00 . A A . 1 LYS H2 1 1 18 7370 1 1 1 LYS H3 H -22.200 -6.089 1.274 1.00 . A A . 1 LYS H3 1 1 18 7371 1 1 1 LYS HA H -22.928 -5.378 -0.675 1.00 . A A . 1 LYS HA 1 1 18 7372 1 1 1 LYS HB2 H -25.043 -6.581 -0.257 1.00 . A A . 1 LYS HB2 1 1 18 7373 1 1 1 LYS HB3 H -25.669 -5.187 0.617 1.00 . A A . 1 LYS HB3 1 1 18 7374 1 1 1 LYS HD2 H -26.454 -3.502 -0.171 1.00 . A A . 1 LYS HD2 1 1 18 7375 1 1 1 LYS HD3 H -25.879 -2.780 -1.671 1.00 . A A . 1 LYS HD3 1 1 18 7376 1 1 1 LYS HE2 H -28.199 -4.725 -1.464 1.00 . A A . 1 LYS HE2 1 1 18 7377 1 1 1 LYS HE3 H -28.362 -2.974 -1.595 1.00 . A A . 1 LYS HE3 1 1 18 7378 1 1 1 LYS HG2 H -24.651 -4.622 -2.117 1.00 . A A . 1 LYS HG2 1 1 18 7379 1 1 1 LYS HG3 H -26.099 -5.621 -2.043 1.00 . A A . 1 LYS HG3 1 1 18 7380 1 1 1 LYS HZ1 H -26.779 -4.469 -3.578 1.00 . A A . 1 LYS HZ1 1 1 18 7381 1 1 1 LYS HZ2 H -27.559 -2.968 -3.740 1.00 . A A . 1 LYS HZ2 1 1 18 7382 1 1 1 LYS HZ3 H -28.471 -4.398 -3.712 1.00 . A A . 1 LYS HZ3 1 1 18 7383 1 1 1 LYS N N -23.128 -5.641 1.403 1.00 . A A . 1 LYS N 1 1 18 7384 1 1 1 LYS NZ N -27.628 -3.922 -3.331 1.00 . A A . 1 LYS NZ 1 1 18 7385 1 1 1 LYS O O -24.331 -2.919 0.928 1.00 . A A . 1 LYS O 1 1 18 7386 1 1 2 LYS C C -21.276 -1.061 -1.384 1.00 . A A . 2 LYS C 1 1 18 7387 1 1 2 LYS CA C -22.408 -1.482 -0.450 1.00 . A A . 2 LYS CA 1 1 18 7388 1 1 2 LYS CB C -22.105 -1.000 0.979 1.00 . A A . 2 LYS CB 1 1 18 7389 1 1 2 LYS CD C -21.561 1.364 1.637 1.00 . A A . 2 LYS CD 1 1 18 7390 1 1 2 LYS CE C -21.677 2.693 0.881 1.00 . A A . 2 LYS CE 1 1 18 7391 1 1 2 LYS CG C -22.674 0.411 1.183 1.00 . A A . 2 LYS CG 1 1 18 7392 1 1 2 LYS H H -21.956 -3.469 -1.015 1.00 . A A . 2 LYS H 1 1 18 7393 1 1 2 LYS HA H -23.330 -1.026 -0.783 1.00 . A A . 2 LYS HA 1 1 18 7394 1 1 2 LYS HB2 H -22.556 -1.676 1.692 1.00 . A A . 2 LYS HB2 1 1 18 7395 1 1 2 LYS HB3 H -21.035 -0.984 1.134 1.00 . A A . 2 LYS HB3 1 1 18 7396 1 1 2 LYS HD2 H -21.657 1.545 2.697 1.00 . A A . 2 LYS HD2 1 1 18 7397 1 1 2 LYS HD3 H -20.598 0.920 1.435 1.00 . A A . 2 LYS HD3 1 1 18 7398 1 1 2 LYS HE2 H -20.882 3.354 1.190 1.00 . A A . 2 LYS HE2 1 1 18 7399 1 1 2 LYS HE3 H -21.600 2.513 -0.182 1.00 . A A . 2 LYS HE3 1 1 18 7400 1 1 2 LYS HG2 H -23.098 0.766 0.254 1.00 . A A . 2 LYS HG2 1 1 18 7401 1 1 2 LYS HG3 H -23.446 0.381 1.939 1.00 . A A . 2 LYS HG3 1 1 18 7402 1 1 2 LYS HZ1 H -23.742 2.600 1.151 1.00 . A A . 2 LYS HZ1 1 1 18 7403 1 1 2 LYS HZ2 H -23.199 4.056 0.476 1.00 . A A . 2 LYS HZ2 1 1 18 7404 1 1 2 LYS HZ3 H -22.964 3.751 2.130 1.00 . A A . 2 LYS HZ3 1 1 18 7405 1 1 2 LYS N N -22.568 -2.929 -0.472 1.00 . A A . 2 LYS N 1 1 18 7406 1 1 2 LYS NZ N -22.994 3.321 1.182 1.00 . A A . 2 LYS NZ 1 1 18 7407 1 1 2 LYS O O -20.924 -1.786 -2.316 1.00 . A A . 2 LYS O 1 1 18 7408 1 1 3 ALA C C -18.387 0.851 -1.018 1.00 . A A . 3 ALA C 1 1 18 7409 1 1 3 ALA CA C -19.595 0.619 -1.914 1.00 . A A . 3 ALA CA 1 1 18 7410 1 1 3 ALA CB C -19.990 1.929 -2.604 1.00 . A A . 3 ALA CB 1 1 18 7411 1 1 3 ALA H H -21.017 0.621 -0.348 1.00 . A A . 3 ALA H 1 1 18 7412 1 1 3 ALA HA H -19.335 -0.111 -2.667 1.00 . A A . 3 ALA HA 1 1 18 7413 1 1 3 ALA HB1 H -20.785 1.744 -3.309 1.00 . A A . 3 ALA HB1 1 1 18 7414 1 1 3 ALA HB2 H -19.134 2.331 -3.127 1.00 . A A . 3 ALA HB2 1 1 18 7415 1 1 3 ALA HB3 H -20.322 2.643 -1.865 1.00 . A A . 3 ALA HB3 1 1 18 7416 1 1 3 ALA N N -20.699 0.104 -1.113 1.00 . A A . 3 ALA N 1 1 18 7417 1 1 3 ALA O O -18.522 1.384 0.088 1.00 . A A . 3 ALA O 1 1 18 7418 1 1 4 LEU C C -15.586 2.083 -0.687 1.00 . A A . 4 LEU C 1 1 18 7419 1 1 4 LEU CA C -15.994 0.614 -0.721 1.00 . A A . 4 LEU CA 1 1 18 7420 1 1 4 LEU CB C -14.870 -0.219 -1.349 1.00 . A A . 4 LEU CB 1 1 18 7421 1 1 4 LEU CD1 C -13.974 -1.224 0.768 1.00 . A A . 4 LEU CD1 1 1 18 7422 1 1 4 LEU CD2 C -12.444 -0.795 -1.162 1.00 . A A . 4 LEU CD2 1 1 18 7423 1 1 4 LEU CG C -13.668 -0.283 -0.399 1.00 . A A . 4 LEU CG 1 1 18 7424 1 1 4 LEU H H -17.180 0.030 -2.375 1.00 . A A . 4 LEU H 1 1 18 7425 1 1 4 LEU HA H -16.167 0.269 0.287 1.00 . A A . 4 LEU HA 1 1 18 7426 1 1 4 LEU HB2 H -15.227 -1.220 -1.545 1.00 . A A . 4 LEU HB2 1 1 18 7427 1 1 4 LEU HB3 H -14.563 0.237 -2.278 1.00 . A A . 4 LEU HB3 1 1 18 7428 1 1 4 LEU HD11 H -14.675 -0.750 1.437 1.00 . A A . 4 LEU HD11 1 1 18 7429 1 1 4 LEU HD12 H -13.060 -1.442 1.302 1.00 . A A . 4 LEU HD12 1 1 18 7430 1 1 4 LEU HD13 H -14.396 -2.143 0.392 1.00 . A A . 4 LEU HD13 1 1 18 7431 1 1 4 LEU HD21 H -12.765 -1.416 -1.985 1.00 . A A . 4 LEU HD21 1 1 18 7432 1 1 4 LEU HD22 H -11.820 -1.374 -0.497 1.00 . A A . 4 LEU HD22 1 1 18 7433 1 1 4 LEU HD23 H -11.882 0.047 -1.542 1.00 . A A . 4 LEU HD23 1 1 18 7434 1 1 4 LEU HG H -13.460 0.703 -0.016 1.00 . A A . 4 LEU HG 1 1 18 7435 1 1 4 LEU N N -17.219 0.450 -1.492 1.00 . A A . 4 LEU N 1 1 18 7436 1 1 4 LEU O O -15.650 2.776 -1.704 1.00 . A A . 4 LEU O 1 1 18 7437 1 1 5 LEU C C -13.300 4.076 0.095 1.00 . A A . 5 LEU C 1 1 18 7438 1 1 5 LEU CA C -14.723 3.938 0.617 1.00 . A A . 5 LEU CA 1 1 18 7439 1 1 5 LEU CB C -14.777 4.367 2.085 1.00 . A A . 5 LEU CB 1 1 18 7440 1 1 5 LEU CD1 C -15.714 6.635 1.566 1.00 . A A . 5 LEU CD1 1 1 18 7441 1 1 5 LEU CD2 C -17.257 4.678 1.790 1.00 . A A . 5 LEU CD2 1 1 18 7442 1 1 5 LEU CG C -15.962 5.319 2.307 1.00 . A A . 5 LEU CG 1 1 18 7443 1 1 5 LEU H H -15.114 1.953 1.255 1.00 . A A . 5 LEU H 1 1 18 7444 1 1 5 LEU HA H -15.377 4.570 0.036 1.00 . A A . 5 LEU HA 1 1 18 7445 1 1 5 LEU HB2 H -14.892 3.493 2.712 1.00 . A A . 5 LEU HB2 1 1 18 7446 1 1 5 LEU HB3 H -13.858 4.872 2.344 1.00 . A A . 5 LEU HB3 1 1 18 7447 1 1 5 LEU HD11 H -14.717 6.990 1.784 1.00 . A A . 5 LEU HD11 1 1 18 7448 1 1 5 LEU HD12 H -16.432 7.369 1.890 1.00 . A A . 5 LEU HD12 1 1 18 7449 1 1 5 LEU HD13 H -15.817 6.479 0.502 1.00 . A A . 5 LEU HD13 1 1 18 7450 1 1 5 LEU HD21 H -17.231 3.612 1.969 1.00 . A A . 5 LEU HD21 1 1 18 7451 1 1 5 LEU HD22 H -17.356 4.865 0.729 1.00 . A A . 5 LEU HD22 1 1 18 7452 1 1 5 LEU HD23 H -18.100 5.106 2.309 1.00 . A A . 5 LEU HD23 1 1 18 7453 1 1 5 LEU HG H -16.059 5.521 3.363 1.00 . A A . 5 LEU HG 1 1 18 7454 1 1 5 LEU N N -15.154 2.552 0.479 1.00 . A A . 5 LEU N 1 1 18 7455 1 1 5 LEU O O -12.433 3.268 0.430 1.00 . A A . 5 LEU O 1 1 18 7456 1 1 6 ALA C C -11.178 3.972 -1.814 1.00 . A A . 6 ALA C 1 1 18 7457 1 1 6 ALA CA C -11.736 5.297 -1.298 1.00 . A A . 6 ALA CA 1 1 18 7458 1 1 6 ALA CB C -10.794 5.895 -0.242 1.00 . A A . 6 ALA CB 1 1 18 7459 1 1 6 ALA H H -13.792 5.695 -0.975 1.00 . A A . 6 ALA H 1 1 18 7460 1 1 6 ALA HA H -11.813 5.987 -2.127 1.00 . A A . 6 ALA HA 1 1 18 7461 1 1 6 ALA HB1 H -9.792 5.947 -0.639 1.00 . A A . 6 ALA HB1 1 1 18 7462 1 1 6 ALA HB2 H -10.801 5.274 0.641 1.00 . A A . 6 ALA HB2 1 1 18 7463 1 1 6 ALA HB3 H -11.130 6.891 0.016 1.00 . A A . 6 ALA HB3 1 1 18 7464 1 1 6 ALA N N -13.063 5.088 -0.733 1.00 . A A . 6 ALA N 1 1 18 7465 1 1 6 ALA O O -11.670 3.432 -2.806 1.00 . A A . 6 ALA O 1 1 18 7466 1 1 7 LEU C C -9.200 1.351 -0.297 1.00 . A A . 7 LEU C 1 1 18 7467 1 1 7 LEU CA C -9.572 2.169 -1.527 1.00 . A A . 7 LEU CA 1 1 18 7468 1 1 7 LEU CB C -8.319 2.411 -2.378 1.00 . A A . 7 LEU CB 1 1 18 7469 1 1 7 LEU CD1 C -7.446 3.141 -4.606 1.00 . A A . 7 LEU CD1 1 1 18 7470 1 1 7 LEU CD2 C -9.626 1.925 -4.478 1.00 . A A . 7 LEU CD2 1 1 18 7471 1 1 7 LEU CG C -8.711 2.934 -3.768 1.00 . A A . 7 LEU CG 1 1 18 7472 1 1 7 LEU H H -9.827 3.902 -0.336 1.00 . A A . 7 LEU H 1 1 18 7473 1 1 7 LEU HA H -10.289 1.615 -2.109 1.00 . A A . 7 LEU HA 1 1 18 7474 1 1 7 LEU HB2 H -7.690 3.140 -1.885 1.00 . A A . 7 LEU HB2 1 1 18 7475 1 1 7 LEU HB3 H -7.772 1.485 -2.483 1.00 . A A . 7 LEU HB3 1 1 18 7476 1 1 7 LEU HD11 H -7.079 2.186 -4.953 1.00 . A A . 7 LEU HD11 1 1 18 7477 1 1 7 LEU HD12 H -6.687 3.622 -4.004 1.00 . A A . 7 LEU HD12 1 1 18 7478 1 1 7 LEU HD13 H -7.679 3.765 -5.454 1.00 . A A . 7 LEU HD13 1 1 18 7479 1 1 7 LEU HD21 H -10.595 2.374 -4.637 1.00 . A A . 7 LEU HD21 1 1 18 7480 1 1 7 LEU HD22 H -9.739 1.043 -3.869 1.00 . A A . 7 LEU HD22 1 1 18 7481 1 1 7 LEU HD23 H -9.196 1.656 -5.431 1.00 . A A . 7 LEU HD23 1 1 18 7482 1 1 7 LEU HG H -9.227 3.879 -3.663 1.00 . A A . 7 LEU HG 1 1 18 7483 1 1 7 LEU N N -10.168 3.441 -1.130 1.00 . A A . 7 LEU N 1 1 18 7484 1 1 7 LEU O O -9.254 1.842 0.833 1.00 . A A . 7 LEU O 1 1 18 7485 1 1 8 ALA C C -7.269 -1.673 0.198 1.00 . A A . 8 ALA C 1 1 18 7486 1 1 8 ALA CA C -8.445 -0.792 0.579 1.00 . A A . 8 ALA CA 1 1 18 7487 1 1 8 ALA CB C -9.627 -1.669 0.985 1.00 . A A . 8 ALA CB 1 1 18 7488 1 1 8 ALA H H -8.804 -0.237 -1.447 1.00 . A A . 8 ALA H 1 1 18 7489 1 1 8 ALA HA H -8.155 -0.188 1.415 1.00 . A A . 8 ALA HA 1 1 18 7490 1 1 8 ALA HB1 H -9.805 -2.410 0.220 1.00 . A A . 8 ALA HB1 1 1 18 7491 1 1 8 ALA HB2 H -10.508 -1.055 1.105 1.00 . A A . 8 ALA HB2 1 1 18 7492 1 1 8 ALA HB3 H -9.402 -2.164 1.918 1.00 . A A . 8 ALA HB3 1 1 18 7493 1 1 8 ALA N N -8.825 0.095 -0.524 1.00 . A A . 8 ALA N 1 1 18 7494 1 1 8 ALA O O -6.466 -2.053 1.052 1.00 . A A . 8 ALA O 1 1 18 7495 1 1 9 LEU C C -4.921 -1.954 -1.962 1.00 . A A . 9 LEU C 1 1 18 7496 1 1 9 LEU CA C -6.097 -2.827 -1.577 1.00 . A A . 9 LEU CA 1 1 18 7497 1 1 9 LEU CB C -6.589 -3.587 -2.794 1.00 . A A . 9 LEU CB 1 1 18 7498 1 1 9 LEU CD1 C -4.387 -3.952 -3.965 1.00 . A A . 9 LEU CD1 1 1 18 7499 1 1 9 LEU CD2 C -5.038 -5.418 -2.041 1.00 . A A . 9 LEU CD2 1 1 18 7500 1 1 9 LEU CG C -5.562 -4.635 -3.251 1.00 . A A . 9 LEU CG 1 1 18 7501 1 1 9 LEU H H -7.856 -1.661 -1.697 1.00 . A A . 9 LEU H 1 1 18 7502 1 1 9 LEU HA H -5.794 -3.519 -0.817 1.00 . A A . 9 LEU HA 1 1 18 7503 1 1 9 LEU HB2 H -7.514 -4.074 -2.538 1.00 . A A . 9 LEU HB2 1 1 18 7504 1 1 9 LEU HB3 H -6.766 -2.882 -3.590 1.00 . A A . 9 LEU HB3 1 1 18 7505 1 1 9 LEU HD11 H -3.594 -3.765 -3.258 1.00 . A A . 9 LEU HD11 1 1 18 7506 1 1 9 LEU HD12 H -4.715 -3.015 -4.394 1.00 . A A . 9 LEU HD12 1 1 18 7507 1 1 9 LEU HD13 H -4.019 -4.596 -4.748 1.00 . A A . 9 LEU HD13 1 1 18 7508 1 1 9 LEU HD21 H -4.302 -4.827 -1.517 1.00 . A A . 9 LEU HD21 1 1 18 7509 1 1 9 LEU HD22 H -4.582 -6.338 -2.380 1.00 . A A . 9 LEU HD22 1 1 18 7510 1 1 9 LEU HD23 H -5.859 -5.649 -1.377 1.00 . A A . 9 LEU HD23 1 1 18 7511 1 1 9 LEU HG H -6.043 -5.317 -3.939 1.00 . A A . 9 LEU HG 1 1 18 7512 1 1 9 LEU N N -7.178 -1.994 -1.075 1.00 . A A . 9 LEU N 1 1 18 7513 1 1 9 LEU O O -3.819 -2.092 -1.424 1.00 . A A . 9 LEU O 1 1 18 7514 1 1 10 HIS C C -3.483 0.455 -2.078 1.00 . A A . 10 HIS C 1 1 18 7515 1 1 10 HIS CA C -4.145 -0.096 -3.318 1.00 . A A . 10 HIS CA 1 1 18 7516 1 1 10 HIS CB C -4.769 1.051 -4.101 1.00 . A A . 10 HIS CB 1 1 18 7517 1 1 10 HIS CD2 C -5.513 -0.461 -6.108 1.00 . A A . 10 HIS CD2 1 1 18 7518 1 1 10 HIS CE1 C -4.905 0.845 -7.732 1.00 . A A . 10 HIS CE1 1 1 18 7519 1 1 10 HIS CG C -4.963 0.655 -5.536 1.00 . A A . 10 HIS CG 1 1 18 7520 1 1 10 HIS H H -6.081 -0.957 -3.235 1.00 . A A . 10 HIS H 1 1 18 7521 1 1 10 HIS HA H -3.412 -0.608 -3.928 1.00 . A A . 10 HIS HA 1 1 18 7522 1 1 10 HIS HB2 H -5.723 1.296 -3.670 1.00 . A A . 10 HIS HB2 1 1 18 7523 1 1 10 HIS HB3 H -4.121 1.907 -4.044 1.00 . A A . 10 HIS HB3 1 1 18 7524 1 1 10 HIS HD1 H -4.160 2.371 -6.509 1.00 . A A . 10 HIS HD1 1 1 18 7525 1 1 10 HIS HD2 H -5.930 -1.294 -5.565 1.00 . A A . 10 HIS HD2 1 1 18 7526 1 1 10 HIS HE1 H -4.732 1.255 -8.721 1.00 . A A . 10 HIS HE1 1 1 18 7527 1 1 10 HIS HE2 H -5.800 -0.993 -8.157 1.00 . A A . 10 HIS HE2 1 1 18 7528 1 1 10 HIS N N -5.176 -1.029 -2.877 1.00 . A A . 10 HIS N 1 1 18 7529 1 1 10 HIS ND1 N -4.580 1.477 -6.587 1.00 . A A . 10 HIS ND1 1 1 18 7530 1 1 10 HIS NE2 N -5.476 -0.344 -7.497 1.00 . A A . 10 HIS NE2 1 1 18 7531 1 1 10 HIS O O -2.285 0.739 -2.040 1.00 . A A . 10 HIS O 1 1 18 7532 1 1 11 HIS C C -2.567 0.364 0.622 1.00 . A A . 11 HIS C 1 1 18 7533 1 1 11 HIS CA C -3.879 1.026 0.244 1.00 . A A . 11 HIS CA 1 1 18 7534 1 1 11 HIS CB C -4.955 0.623 1.245 1.00 . A A . 11 HIS CB 1 1 18 7535 1 1 11 HIS CD2 C -6.382 2.811 1.074 1.00 . A A . 11 HIS CD2 1 1 18 7536 1 1 11 HIS CE1 C -6.398 3.352 3.173 1.00 . A A . 11 HIS CE1 1 1 18 7537 1 1 11 HIS CG C -5.667 1.847 1.736 1.00 . A A . 11 HIS CG 1 1 18 7538 1 1 11 HIS H H -5.237 0.293 -1.181 1.00 . A A . 11 HIS H 1 1 18 7539 1 1 11 HIS HA H -3.765 2.094 0.240 1.00 . A A . 11 HIS HA 1 1 18 7540 1 1 11 HIS HB2 H -5.662 -0.042 0.750 1.00 . A A . 11 HIS HB2 1 1 18 7541 1 1 11 HIS HB3 H -4.494 0.105 2.075 1.00 . A A . 11 HIS HB3 1 1 18 7542 1 1 11 HIS HD1 H -5.264 1.720 3.820 1.00 . A A . 11 HIS HD1 1 1 18 7543 1 1 11 HIS HD2 H -6.554 2.833 0.006 1.00 . A A . 11 HIS HD2 1 1 18 7544 1 1 11 HIS HE1 H -6.578 3.879 4.103 1.00 . A A . 11 HIS HE1 1 1 18 7545 1 1 11 HIS HE2 H -7.376 4.567 1.782 1.00 . A A . 11 HIS HE2 1 1 18 7546 1 1 11 HIS N N -4.304 0.563 -1.057 1.00 . A A . 11 HIS N 1 1 18 7547 1 1 11 HIS ND1 N -5.689 2.209 3.075 1.00 . A A . 11 HIS ND1 1 1 18 7548 1 1 11 HIS NE2 N -6.843 3.764 1.980 1.00 . A A . 11 HIS NE2 1 1 18 7549 1 1 11 HIS O O -1.653 0.996 1.156 1.00 . A A . 11 HIS O 1 1 18 7550 1 1 12 LEU C C -0.236 -1.367 -0.440 1.00 . A A . 12 LEU C 1 1 18 7551 1 1 12 LEU CA C -1.279 -1.683 0.605 1.00 . A A . 12 LEU CA 1 1 18 7552 1 1 12 LEU CB C -1.581 -3.185 0.590 1.00 . A A . 12 LEU CB 1 1 18 7553 1 1 12 LEU CD1 C -1.208 -3.406 3.064 1.00 . A A . 12 LEU CD1 1 1 18 7554 1 1 12 LEU CD2 C -3.471 -2.794 2.194 1.00 . A A . 12 LEU CD2 1 1 18 7555 1 1 12 LEU CG C -2.210 -3.615 1.923 1.00 . A A . 12 LEU CG 1 1 18 7556 1 1 12 LEU H H -3.244 -1.346 -0.137 1.00 . A A . 12 LEU H 1 1 18 7557 1 1 12 LEU HA H -0.906 -1.399 1.572 1.00 . A A . 12 LEU HA 1 1 18 7558 1 1 12 LEU HB2 H -2.263 -3.404 -0.219 1.00 . A A . 12 LEU HB2 1 1 18 7559 1 1 12 LEU HB3 H -0.662 -3.733 0.437 1.00 . A A . 12 LEU HB3 1 1 18 7560 1 1 12 LEU HD11 H -0.226 -3.214 2.658 1.00 . A A . 12 LEU HD11 1 1 18 7561 1 1 12 LEU HD12 H -1.172 -4.295 3.679 1.00 . A A . 12 LEU HD12 1 1 18 7562 1 1 12 LEU HD13 H -1.521 -2.565 3.665 1.00 . A A . 12 LEU HD13 1 1 18 7563 1 1 12 LEU HD21 H -3.195 -1.783 2.454 1.00 . A A . 12 LEU HD21 1 1 18 7564 1 1 12 LEU HD22 H -4.019 -3.237 3.010 1.00 . A A . 12 LEU HD22 1 1 18 7565 1 1 12 LEU HD23 H -4.091 -2.783 1.310 1.00 . A A . 12 LEU HD23 1 1 18 7566 1 1 12 LEU HG H -2.470 -4.665 1.873 1.00 . A A . 12 LEU HG 1 1 18 7567 1 1 12 LEU N N -2.481 -0.915 0.315 1.00 . A A . 12 LEU N 1 1 18 7568 1 1 12 LEU O O 0.930 -1.110 -0.131 1.00 . A A . 12 LEU O 1 1 18 7569 1 1 13 ALA C C 0.857 0.314 -2.499 1.00 . A A . 13 ALA C 1 1 18 7570 1 1 13 ALA CA C 0.203 -1.023 -2.791 1.00 . A A . 13 ALA CA 1 1 18 7571 1 1 13 ALA CB C -0.581 -0.947 -4.102 1.00 . A A . 13 ALA CB 1 1 18 7572 1 1 13 ALA H H -1.634 -1.534 -1.843 1.00 . A A . 13 ALA H 1 1 18 7573 1 1 13 ALA HA H 0.965 -1.781 -2.872 1.00 . A A . 13 ALA HA 1 1 18 7574 1 1 13 ALA HB1 H 0.103 -0.768 -4.920 1.00 . A A . 13 ALA HB1 1 1 18 7575 1 1 13 ALA HB2 H -1.293 -0.139 -4.052 1.00 . A A . 13 ALA HB2 1 1 18 7576 1 1 13 ALA HB3 H -1.103 -1.876 -4.267 1.00 . A A . 13 ALA HB3 1 1 18 7577 1 1 13 ALA N N -0.685 -1.350 -1.681 1.00 . A A . 13 ALA N 1 1 18 7578 1 1 13 ALA O O 1.987 0.581 -2.906 1.00 . A A . 13 ALA O 1 1 18 7579 1 1 14 HIS C C 1.765 2.295 -0.407 1.00 . A A . 14 HIS C 1 1 18 7580 1 1 14 HIS CA C 0.621 2.452 -1.387 1.00 . A A . 14 HIS CA 1 1 18 7581 1 1 14 HIS CB C -0.518 3.258 -0.781 1.00 . A A . 14 HIS CB 1 1 18 7582 1 1 14 HIS CD2 C -0.664 4.101 1.696 1.00 . A A . 14 HIS CD2 1 1 18 7583 1 1 14 HIS CE1 C 1.178 5.245 1.756 1.00 . A A . 14 HIS CE1 1 1 18 7584 1 1 14 HIS CG C -0.081 3.984 0.462 1.00 . A A . 14 HIS CG 1 1 18 7585 1 1 14 HIS H H -0.762 0.855 -1.476 1.00 . A A . 14 HIS H 1 1 18 7586 1 1 14 HIS HA H 0.979 2.960 -2.262 1.00 . A A . 14 HIS HA 1 1 18 7587 1 1 14 HIS HB2 H -0.839 3.966 -1.505 1.00 . A A . 14 HIS HB2 1 1 18 7588 1 1 14 HIS HB3 H -1.339 2.596 -0.540 1.00 . A A . 14 HIS HB3 1 1 18 7589 1 1 14 HIS HD1 H 1.742 4.835 -0.210 1.00 . A A . 14 HIS HD1 1 1 18 7590 1 1 14 HIS HD2 H -1.587 3.619 1.998 1.00 . A A . 14 HIS HD2 1 1 18 7591 1 1 14 HIS HE1 H 1.999 5.859 2.100 1.00 . A A . 14 HIS HE1 1 1 18 7592 1 1 14 HIS HE2 H -0.047 5.162 3.447 1.00 . A A . 14 HIS HE2 1 1 18 7593 1 1 14 HIS N N 0.131 1.141 -1.770 1.00 . A A . 14 HIS N 1 1 18 7594 1 1 14 HIS ND1 N 1.093 4.719 0.518 1.00 . A A . 14 HIS ND1 1 1 18 7595 1 1 14 HIS NE2 N 0.130 4.901 2.514 1.00 . A A . 14 HIS NE2 1 1 18 7596 1 1 14 HIS O O 2.851 2.849 -0.593 1.00 . A A . 14 HIS O 1 1 18 7597 1 1 15 LEU C C 3.722 0.654 0.820 1.00 . A A . 15 LEU C 1 1 18 7598 1 1 15 LEU CA C 2.573 1.227 1.585 1.00 . A A . 15 LEU CA 1 1 18 7599 1 1 15 LEU CB C 2.112 0.176 2.597 1.00 . A A . 15 LEU CB 1 1 18 7600 1 1 15 LEU CD1 C 0.662 2.122 3.279 1.00 . A A . 15 LEU CD1 1 1 18 7601 1 1 15 LEU CD2 C 0.091 -0.188 4.012 1.00 . A A . 15 LEU CD2 1 1 18 7602 1 1 15 LEU CG C 1.241 0.777 3.706 1.00 . A A . 15 LEU CG 1 1 18 7603 1 1 15 LEU H H 0.663 1.055 0.688 1.00 . A A . 15 LEU H 1 1 18 7604 1 1 15 LEU HA H 2.882 2.135 2.075 1.00 . A A . 15 LEU HA 1 1 18 7605 1 1 15 LEU HB2 H 1.545 -0.581 2.075 1.00 . A A . 15 LEU HB2 1 1 18 7606 1 1 15 LEU HB3 H 2.983 -0.285 3.040 1.00 . A A . 15 LEU HB3 1 1 18 7607 1 1 15 LEU HD11 H 1.459 2.831 3.123 1.00 . A A . 15 LEU HD11 1 1 18 7608 1 1 15 LEU HD12 H 0.003 2.490 4.052 1.00 . A A . 15 LEU HD12 1 1 18 7609 1 1 15 LEU HD13 H 0.106 1.995 2.365 1.00 . A A . 15 LEU HD13 1 1 18 7610 1 1 15 LEU HD21 H -0.293 0.010 5.000 1.00 . A A . 15 LEU HD21 1 1 18 7611 1 1 15 LEU HD22 H 0.449 -1.205 3.962 1.00 . A A . 15 LEU HD22 1 1 18 7612 1 1 15 LEU HD23 H -0.697 -0.050 3.286 1.00 . A A . 15 LEU HD23 1 1 18 7613 1 1 15 LEU HG H 1.839 0.911 4.590 1.00 . A A . 15 LEU HG 1 1 18 7614 1 1 15 LEU N N 1.532 1.498 0.613 1.00 . A A . 15 LEU N 1 1 18 7615 1 1 15 LEU O O 4.890 0.877 1.118 1.00 . A A . 15 LEU O 1 1 18 7616 1 1 16 ALA C C 5.008 0.350 -1.896 1.00 . A A . 16 ALA C 1 1 18 7617 1 1 16 ALA CA C 4.323 -0.709 -1.055 1.00 . A A . 16 ALA CA 1 1 18 7618 1 1 16 ALA CB C 3.645 -1.738 -1.956 1.00 . A A . 16 ALA CB 1 1 18 7619 1 1 16 ALA H H 2.374 -0.187 -0.357 1.00 . A A . 16 ALA H 1 1 18 7620 1 1 16 ALA HA H 5.060 -1.202 -0.447 1.00 . A A . 16 ALA HA 1 1 18 7621 1 1 16 ALA HB1 H 2.635 -1.907 -1.614 1.00 . A A . 16 ALA HB1 1 1 18 7622 1 1 16 ALA HB2 H 4.197 -2.663 -1.919 1.00 . A A . 16 ALA HB2 1 1 18 7623 1 1 16 ALA HB3 H 3.623 -1.369 -2.971 1.00 . A A . 16 ALA HB3 1 1 18 7624 1 1 16 ALA N N 3.347 -0.081 -0.189 1.00 . A A . 16 ALA N 1 1 18 7625 1 1 16 ALA O O 6.165 0.214 -2.266 1.00 . A A . 16 ALA O 1 1 18 7626 1 1 17 LEU C C 6.048 3.071 -2.395 1.00 . A A . 17 LEU C 1 1 18 7627 1 1 17 LEU CA C 4.789 2.495 -3.002 1.00 . A A . 17 LEU CA 1 1 18 7628 1 1 17 LEU CB C 3.706 3.577 -3.176 1.00 . A A . 17 LEU CB 1 1 18 7629 1 1 17 LEU CD1 C 5.132 5.649 -3.288 1.00 . A A . 17 LEU CD1 1 1 18 7630 1 1 17 LEU CD2 C 2.830 5.768 -2.338 1.00 . A A . 17 LEU CD2 1 1 18 7631 1 1 17 LEU CG C 4.080 4.892 -2.471 1.00 . A A . 17 LEU CG 1 1 18 7632 1 1 17 LEU H H 3.347 1.443 -1.867 1.00 . A A . 17 LEU H 1 1 18 7633 1 1 17 LEU HA H 5.045 2.102 -3.962 1.00 . A A . 17 LEU HA 1 1 18 7634 1 1 17 LEU HB2 H 3.573 3.773 -4.225 1.00 . A A . 17 LEU HB2 1 1 18 7635 1 1 17 LEU HB3 H 2.781 3.211 -2.764 1.00 . A A . 17 LEU HB3 1 1 18 7636 1 1 17 LEU HD11 H 4.714 6.585 -3.628 1.00 . A A . 17 LEU HD11 1 1 18 7637 1 1 17 LEU HD12 H 5.427 5.056 -4.143 1.00 . A A . 17 LEU HD12 1 1 18 7638 1 1 17 LEU HD13 H 5.996 5.845 -2.670 1.00 . A A . 17 LEU HD13 1 1 18 7639 1 1 17 LEU HD21 H 2.720 6.382 -3.223 1.00 . A A . 17 LEU HD21 1 1 18 7640 1 1 17 LEU HD22 H 2.926 6.402 -1.470 1.00 . A A . 17 LEU HD22 1 1 18 7641 1 1 17 LEU HD23 H 1.958 5.139 -2.229 1.00 . A A . 17 LEU HD23 1 1 18 7642 1 1 17 LEU HG H 4.469 4.682 -1.488 1.00 . A A . 17 LEU HG 1 1 18 7643 1 1 17 LEU N N 4.270 1.403 -2.193 1.00 . A A . 17 LEU N 1 1 18 7644 1 1 17 LEU O O 7.051 3.258 -3.088 1.00 . A A . 17 LEU O 1 1 18 7645 1 1 18 HIS C C 8.152 2.766 -0.199 1.00 . A A . 18 HIS C 1 1 18 7646 1 1 18 HIS CA C 7.192 3.886 -0.465 1.00 . A A . 18 HIS CA 1 1 18 7647 1 1 18 HIS CB C 6.836 4.615 0.812 1.00 . A A . 18 HIS CB 1 1 18 7648 1 1 18 HIS CD2 C 5.035 3.256 2.107 1.00 . A A . 18 HIS CD2 1 1 18 7649 1 1 18 HIS CE1 C 6.333 2.313 3.566 1.00 . A A . 18 HIS CE1 1 1 18 7650 1 1 18 HIS CG C 6.308 3.674 1.841 1.00 . A A . 18 HIS CG 1 1 18 7651 1 1 18 HIS H H 5.178 3.161 -0.594 1.00 . A A . 18 HIS H 1 1 18 7652 1 1 18 HIS HA H 7.660 4.581 -1.143 1.00 . A A . 18 HIS HA 1 1 18 7653 1 1 18 HIS HB2 H 7.711 5.111 1.193 1.00 . A A . 18 HIS HB2 1 1 18 7654 1 1 18 HIS HB3 H 6.085 5.331 0.582 1.00 . A A . 18 HIS HB3 1 1 18 7655 1 1 18 HIS HD1 H 8.102 3.149 2.844 1.00 . A A . 18 HIS HD1 1 1 18 7656 1 1 18 HIS HD2 H 4.156 3.543 1.539 1.00 . A A . 18 HIS HD2 1 1 18 7657 1 1 18 HIS HE1 H 6.694 1.719 4.394 1.00 . A A . 18 HIS HE1 1 1 18 7658 1 1 18 HIS HE2 H 4.279 1.935 3.608 1.00 . A A . 18 HIS HE2 1 1 18 7659 1 1 18 HIS N N 6.009 3.341 -1.109 1.00 . A A . 18 HIS N 1 1 18 7660 1 1 18 HIS ND1 N 7.123 3.061 2.776 1.00 . A A . 18 HIS ND1 1 1 18 7661 1 1 18 HIS NE2 N 5.047 2.395 3.201 1.00 . A A . 18 HIS NE2 1 1 18 7662 1 1 18 HIS O O 9.338 2.852 -0.524 1.00 . A A . 18 HIS O 1 1 18 7663 1 1 19 LEU C C 9.180 0.223 -0.694 1.00 . A A . 19 LEU C 1 1 18 7664 1 1 19 LEU CA C 8.420 0.512 0.581 1.00 . A A . 19 LEU CA 1 1 18 7665 1 1 19 LEU CB C 7.533 -0.691 0.913 1.00 . A A . 19 LEU CB 1 1 18 7666 1 1 19 LEU CD1 C 9.453 -1.534 2.295 1.00 . A A . 19 LEU CD1 1 1 18 7667 1 1 19 LEU CD2 C 7.533 -0.355 3.376 1.00 . A A . 19 LEU CD2 1 1 18 7668 1 1 19 LEU CG C 7.939 -1.300 2.251 1.00 . A A . 19 LEU CG 1 1 18 7669 1 1 19 LEU H H 6.650 1.692 0.531 1.00 . A A . 19 LEU H 1 1 18 7670 1 1 19 LEU HA H 9.109 0.699 1.387 1.00 . A A . 19 LEU HA 1 1 18 7671 1 1 19 LEU HB2 H 6.507 -0.373 0.967 1.00 . A A . 19 LEU HB2 1 1 18 7672 1 1 19 LEU HB3 H 7.632 -1.436 0.137 1.00 . A A . 19 LEU HB3 1 1 18 7673 1 1 19 LEU HD11 H 9.668 -2.369 2.946 1.00 . A A . 19 LEU HD11 1 1 18 7674 1 1 19 LEU HD12 H 9.943 -0.648 2.671 1.00 . A A . 19 LEU HD12 1 1 18 7675 1 1 19 LEU HD13 H 9.815 -1.752 1.301 1.00 . A A . 19 LEU HD13 1 1 18 7676 1 1 19 LEU HD21 H 6.475 -0.152 3.304 1.00 . A A . 19 LEU HD21 1 1 18 7677 1 1 19 LEU HD22 H 8.083 0.570 3.285 1.00 . A A . 19 LEU HD22 1 1 18 7678 1 1 19 LEU HD23 H 7.747 -0.813 4.328 1.00 . A A . 19 LEU HD23 1 1 18 7679 1 1 19 LEU HG H 7.429 -2.241 2.371 1.00 . A A . 19 LEU HG 1 1 18 7680 1 1 19 LEU N N 7.614 1.693 0.338 1.00 . A A . 19 LEU N 1 1 18 7681 1 1 19 LEU O O 10.330 -0.214 -0.678 1.00 . A A . 19 LEU O 1 1 18 7682 1 1 20 ALA C C 10.227 1.301 -3.301 1.00 . A A . 20 ALA C 1 1 18 7683 1 1 20 ALA CA C 9.105 0.308 -3.120 1.00 . A A . 20 ALA CA 1 1 18 7684 1 1 20 ALA CB C 8.069 0.520 -4.224 1.00 . A A . 20 ALA CB 1 1 18 7685 1 1 20 ALA H H 7.593 0.884 -1.717 1.00 . A A . 20 ALA H 1 1 18 7686 1 1 20 ALA HA H 9.496 -0.689 -3.188 1.00 . A A . 20 ALA HA 1 1 18 7687 1 1 20 ALA HB1 H 7.407 1.325 -3.948 1.00 . A A . 20 ALA HB1 1 1 18 7688 1 1 20 ALA HB2 H 7.499 -0.384 -4.361 1.00 . A A . 20 ALA HB2 1 1 18 7689 1 1 20 ALA HB3 H 8.575 0.771 -5.144 1.00 . A A . 20 ALA HB3 1 1 18 7690 1 1 20 ALA N N 8.509 0.507 -1.800 1.00 . A A . 20 ALA N 1 1 18 7691 1 1 20 ALA O O 11.382 0.938 -3.528 1.00 . A A . 20 ALA O 1 1 18 7692 1 1 21 LEU C C 12.043 3.293 -2.421 1.00 . A A . 21 LEU C 1 1 18 7693 1 1 21 LEU CA C 10.851 3.634 -3.294 1.00 . A A . 21 LEU CA 1 1 18 7694 1 1 21 LEU CB C 10.249 4.970 -2.848 1.00 . A A . 21 LEU CB 1 1 18 7695 1 1 21 LEU CD1 C 9.818 7.345 -3.488 1.00 . A A . 21 LEU CD1 1 1 18 7696 1 1 21 LEU CD2 C 11.980 6.267 -4.123 1.00 . A A . 21 LEU CD2 1 1 18 7697 1 1 21 LEU CG C 10.475 6.034 -3.928 1.00 . A A . 21 LEU CG 1 1 18 7698 1 1 21 LEU H H 8.934 2.777 -2.982 1.00 . A A . 21 LEU H 1 1 18 7699 1 1 21 LEU HA H 11.175 3.707 -4.314 1.00 . A A . 21 LEU HA 1 1 18 7700 1 1 21 LEU HB2 H 9.188 4.848 -2.681 1.00 . A A . 21 LEU HB2 1 1 18 7701 1 1 21 LEU HB3 H 10.719 5.287 -1.928 1.00 . A A . 21 LEU HB3 1 1 18 7702 1 1 21 LEU HD11 H 8.775 7.339 -3.770 1.00 . A A . 21 LEU HD11 1 1 18 7703 1 1 21 LEU HD12 H 10.316 8.176 -3.968 1.00 . A A . 21 LEU HD12 1 1 18 7704 1 1 21 LEU HD13 H 9.899 7.446 -2.418 1.00 . A A . 21 LEU HD13 1 1 18 7705 1 1 21 LEU HD21 H 12.402 5.450 -4.691 1.00 . A A . 21 LEU HD21 1 1 18 7706 1 1 21 LEU HD22 H 12.466 6.325 -3.159 1.00 . A A . 21 LEU HD22 1 1 18 7707 1 1 21 LEU HD23 H 12.135 7.191 -4.660 1.00 . A A . 21 LEU HD23 1 1 18 7708 1 1 21 LEU HG H 10.034 5.704 -4.856 1.00 . A A . 21 LEU HG 1 1 18 7709 1 1 21 LEU N N 9.871 2.565 -3.174 1.00 . A A . 21 LEU N 1 1 18 7710 1 1 21 LEU O O 13.191 3.361 -2.851 1.00 . A A . 21 LEU O 1 1 18 7711 1 1 22 ALA C C 13.550 1.326 -0.826 1.00 . A A . 22 ALA C 1 1 18 7712 1 1 22 ALA CA C 12.780 2.500 -0.255 1.00 . A A . 22 ALA CA 1 1 18 7713 1 1 22 ALA CB C 12.163 2.105 1.090 1.00 . A A . 22 ALA CB 1 1 18 7714 1 1 22 ALA H H 10.795 2.840 -0.931 1.00 . A A . 22 ALA H 1 1 18 7715 1 1 22 ALA HA H 13.451 3.324 -0.108 1.00 . A A . 22 ALA HA 1 1 18 7716 1 1 22 ALA HB1 H 12.951 1.871 1.792 1.00 . A A . 22 ALA HB1 1 1 18 7717 1 1 22 ALA HB2 H 11.530 1.239 0.958 1.00 . A A . 22 ALA HB2 1 1 18 7718 1 1 22 ALA HB3 H 11.576 2.926 1.472 1.00 . A A . 22 ALA HB3 1 1 18 7719 1 1 22 ALA N N 11.741 2.892 -1.196 1.00 . A A . 22 ALA N 1 1 18 7720 1 1 22 ALA O O 14.773 1.340 -0.889 1.00 . A A . 22 ALA O 1 1 18 7721 1 1 23 LEU C C 14.394 -0.472 -2.932 1.00 . A A . 23 LEU C 1 1 18 7722 1 1 23 LEU CA C 13.396 -0.868 -1.860 1.00 . A A . 23 LEU CA 1 1 18 7723 1 1 23 LEU CB C 12.302 -1.727 -2.504 1.00 . A A . 23 LEU CB 1 1 18 7724 1 1 23 LEU CD1 C 13.594 -3.839 -2.166 1.00 . A A . 23 LEU CD1 1 1 18 7725 1 1 23 LEU CD2 C 12.094 -2.991 -0.353 1.00 . A A . 23 LEU CD2 1 1 18 7726 1 1 23 LEU CG C 12.278 -3.120 -1.867 1.00 . A A . 23 LEU CG 1 1 18 7727 1 1 23 LEU H H 11.829 0.395 -1.192 1.00 . A A . 23 LEU H 1 1 18 7728 1 1 23 LEU HA H 13.899 -1.435 -1.097 1.00 . A A . 23 LEU HA 1 1 18 7729 1 1 23 LEU HB2 H 11.344 -1.248 -2.364 1.00 . A A . 23 LEU HB2 1 1 18 7730 1 1 23 LEU HB3 H 12.501 -1.819 -3.564 1.00 . A A . 23 LEU HB3 1 1 18 7731 1 1 23 LEU HD11 H 13.499 -4.882 -1.908 1.00 . A A . 23 LEU HD11 1 1 18 7732 1 1 23 LEU HD12 H 14.387 -3.396 -1.583 1.00 . A A . 23 LEU HD12 1 1 18 7733 1 1 23 LEU HD13 H 13.826 -3.748 -3.219 1.00 . A A . 23 LEU HD13 1 1 18 7734 1 1 23 LEU HD21 H 13.060 -2.904 0.120 1.00 . A A . 23 LEU HD21 1 1 18 7735 1 1 23 LEU HD22 H 11.588 -3.867 0.024 1.00 . A A . 23 LEU HD22 1 1 18 7736 1 1 23 LEU HD23 H 11.508 -2.112 -0.131 1.00 . A A . 23 LEU HD23 1 1 18 7737 1 1 23 LEU HG H 11.458 -3.687 -2.281 1.00 . A A . 23 LEU HG 1 1 18 7738 1 1 23 LEU N N 12.806 0.324 -1.263 1.00 . A A . 23 LEU N 1 1 18 7739 1 1 23 LEU O O 15.417 -1.126 -3.132 1.00 . A A . 23 LEU O 1 1 18 7740 1 1 24 LYS C C 15.981 2.021 -4.222 1.00 . A A . 24 LYS C 1 1 18 7741 1 1 24 LYS CA C 14.899 1.070 -4.728 1.00 . A A . 24 LYS CA 1 1 18 7742 1 1 24 LYS CB C 14.030 1.790 -5.765 1.00 . A A . 24 LYS CB 1 1 18 7743 1 1 24 LYS CD C 15.791 2.320 -7.477 1.00 . A A . 24 LYS CD 1 1 18 7744 1 1 24 LYS CE C 17.027 1.418 -7.461 1.00 . A A . 24 LYS CE 1 1 18 7745 1 1 24 LYS CG C 14.536 1.486 -7.181 1.00 . A A . 24 LYS CG 1 1 18 7746 1 1 24 LYS H H 13.205 1.031 -3.444 1.00 . A A . 24 LYS H 1 1 18 7747 1 1 24 LYS HA H 15.374 0.232 -5.199 1.00 . A A . 24 LYS HA 1 1 18 7748 1 1 24 LYS HB2 H 13.009 1.444 -5.673 1.00 . A A . 24 LYS HB2 1 1 18 7749 1 1 24 LYS HB3 H 14.063 2.855 -5.588 1.00 . A A . 24 LYS HB3 1 1 18 7750 1 1 24 LYS HD2 H 15.694 2.781 -8.452 1.00 . A A . 24 LYS HD2 1 1 18 7751 1 1 24 LYS HD3 H 15.898 3.089 -6.726 1.00 . A A . 24 LYS HD3 1 1 18 7752 1 1 24 LYS HE2 H 17.910 2.027 -7.343 1.00 . A A . 24 LYS HE2 1 1 18 7753 1 1 24 LYS HE3 H 16.957 0.725 -6.635 1.00 . A A . 24 LYS HE3 1 1 18 7754 1 1 24 LYS HG2 H 14.771 0.432 -7.260 1.00 . A A . 24 LYS HG2 1 1 18 7755 1 1 24 LYS HG3 H 13.767 1.734 -7.895 1.00 . A A . 24 LYS HG3 1 1 18 7756 1 1 24 LYS HZ1 H 16.179 0.264 -8.977 1.00 . A A . 24 LYS HZ1 1 1 18 7757 1 1 24 LYS HZ2 H 17.793 -0.117 -8.642 1.00 . A A . 24 LYS HZ2 1 1 18 7758 1 1 24 LYS HZ3 H 17.422 1.293 -9.506 1.00 . A A . 24 LYS HZ3 1 1 18 7759 1 1 24 LYS N N 14.058 0.582 -3.642 1.00 . A A . 24 LYS N 1 1 18 7760 1 1 24 LYS NZ N 17.108 0.659 -8.741 1.00 . A A . 24 LYS NZ 1 1 18 7761 1 1 24 LYS O O 17.126 1.978 -4.679 1.00 . A A . 24 LYS O 1 1 18 7762 1 1 25 LYS C C 17.382 3.366 -1.622 1.00 . A A . 25 LYS C 1 1 18 7763 1 1 25 LYS CA C 16.527 3.895 -2.780 1.00 . A A . 25 LYS CA 1 1 18 7764 1 1 25 LYS CB C 15.724 5.113 -2.307 1.00 . A A . 25 LYS CB 1 1 18 7765 1 1 25 LYS CD C 16.654 6.287 -0.294 1.00 . A A . 25 LYS CD 1 1 18 7766 1 1 25 LYS CE C 15.405 7.035 0.182 1.00 . A A . 25 LYS CE 1 1 18 7767 1 1 25 LYS CG C 16.671 6.222 -1.826 1.00 . A A . 25 LYS CG 1 1 18 7768 1 1 25 LYS H H 14.669 2.894 -3.020 1.00 . A A . 25 LYS H 1 1 18 7769 1 1 25 LYS HA H 17.187 4.211 -3.575 1.00 . A A . 25 LYS HA 1 1 18 7770 1 1 25 LYS HB2 H 15.128 5.483 -3.128 1.00 . A A . 25 LYS HB2 1 1 18 7771 1 1 25 LYS HB3 H 15.074 4.815 -1.497 1.00 . A A . 25 LYS HB3 1 1 18 7772 1 1 25 LYS HD2 H 16.645 5.284 0.108 1.00 . A A . 25 LYS HD2 1 1 18 7773 1 1 25 LYS HD3 H 17.536 6.803 0.054 1.00 . A A . 25 LYS HD3 1 1 18 7774 1 1 25 LYS HE2 H 14.520 6.517 -0.155 1.00 . A A . 25 LYS HE2 1 1 18 7775 1 1 25 LYS HE3 H 15.408 7.081 1.259 1.00 . A A . 25 LYS HE3 1 1 18 7776 1 1 25 LYS HG2 H 17.677 6.010 -2.167 1.00 . A A . 25 LYS HG2 1 1 18 7777 1 1 25 LYS HG3 H 16.347 7.168 -2.230 1.00 . A A . 25 LYS HG3 1 1 18 7778 1 1 25 LYS HZ1 H 16.260 8.555 -0.957 1.00 . A A . 25 LYS HZ1 1 1 18 7779 1 1 25 LYS HZ2 H 15.420 9.108 0.405 1.00 . A A . 25 LYS HZ2 1 1 18 7780 1 1 25 LYS HZ3 H 14.563 8.563 -0.956 1.00 . A A . 25 LYS HZ3 1 1 18 7781 1 1 25 LYS N N 15.603 2.896 -3.315 1.00 . A A . 25 LYS N 1 1 18 7782 1 1 25 LYS NZ N 15.412 8.416 -0.375 1.00 . A A . 25 LYS NZ 1 1 18 7783 1 1 25 LYS O O 18.571 3.684 -1.536 1.00 . A A . 25 LYS O 1 1 18 7784 1 1 26 ALA C C 18.228 0.763 0.084 1.00 . A A . 26 ALA C 1 1 18 7785 1 1 26 ALA CA C 17.514 2.064 0.429 1.00 . A A . 26 ALA CA 1 1 18 7786 1 1 26 ALA CB C 16.548 1.819 1.592 1.00 . A A . 26 ALA CB 1 1 18 7787 1 1 26 ALA H H 15.829 2.375 -0.829 1.00 . A A . 26 ALA H 1 1 18 7788 1 1 26 ALA HA H 18.247 2.794 0.739 1.00 . A A . 26 ALA HA 1 1 18 7789 1 1 26 ALA HB1 H 16.221 2.766 1.996 1.00 . A A . 26 ALA HB1 1 1 18 7790 1 1 26 ALA HB2 H 17.048 1.256 2.366 1.00 . A A . 26 ALA HB2 1 1 18 7791 1 1 26 ALA HB3 H 15.693 1.264 1.240 1.00 . A A . 26 ALA HB3 1 1 18 7792 1 1 26 ALA N N 16.783 2.590 -0.725 1.00 . A A . 26 ALA N 1 1 18 7793 1 1 26 ALA O O 19.362 0.602 0.488 1.00 . A A . 26 ALA O 1 1 18 7794 1 1 26 ALA OXT O 17.625 -0.062 -0.571 1.00 . A A . 26 ALA OXT 1 1 19 7795 1 1 1 LYS C C -19.940 -12.867 3.623 1.00 . A A . 1 LYS C 1 1 19 7796 1 1 1 LYS CA C -19.194 -13.990 4.321 1.00 . A A . 1 LYS CA 1 1 19 7797 1 1 1 LYS CB C -18.194 -14.634 3.350 1.00 . A A . 1 LYS CB 1 1 19 7798 1 1 1 LYS CD C -16.307 -15.651 4.665 1.00 . A A . 1 LYS CD 1 1 19 7799 1 1 1 LYS CE C -15.143 -16.292 3.897 1.00 . A A . 1 LYS CE 1 1 19 7800 1 1 1 LYS CG C -17.635 -15.934 3.950 1.00 . A A . 1 LYS CG 1 1 19 7801 1 1 1 LYS H1 H -19.987 -15.267 5.750 1.00 . A A . 1 LYS H1 1 1 19 7802 1 1 1 LYS H2 H -20.132 -15.835 4.156 1.00 . A A . 1 LYS H2 1 1 19 7803 1 1 1 LYS H3 H -21.136 -14.587 4.714 1.00 . A A . 1 LYS H3 1 1 19 7804 1 1 1 LYS HA H -18.667 -13.597 5.176 1.00 . A A . 1 LYS HA 1 1 19 7805 1 1 1 LYS HB2 H -18.691 -14.855 2.416 1.00 . A A . 1 LYS HB2 1 1 19 7806 1 1 1 LYS HB3 H -17.381 -13.941 3.165 1.00 . A A . 1 LYS HB3 1 1 19 7807 1 1 1 LYS HD2 H -16.152 -14.585 4.733 1.00 . A A . 1 LYS HD2 1 1 19 7808 1 1 1 LYS HD3 H -16.345 -16.068 5.660 1.00 . A A . 1 LYS HD3 1 1 19 7809 1 1 1 LYS HE2 H -14.208 -15.969 4.331 1.00 . A A . 1 LYS HE2 1 1 19 7810 1 1 1 LYS HE3 H -15.216 -17.368 3.966 1.00 . A A . 1 LYS HE3 1 1 19 7811 1 1 1 LYS HG2 H -18.342 -16.338 4.659 1.00 . A A . 1 LYS HG2 1 1 19 7812 1 1 1 LYS HG3 H -17.471 -16.653 3.161 1.00 . A A . 1 LYS HG3 1 1 19 7813 1 1 1 LYS HZ1 H -15.273 -14.849 2.399 1.00 . A A . 1 LYS HZ1 1 1 19 7814 1 1 1 LYS HZ2 H -16.000 -16.333 1.995 1.00 . A A . 1 LYS HZ2 1 1 19 7815 1 1 1 LYS HZ3 H -14.314 -16.187 1.993 1.00 . A A . 1 LYS HZ3 1 1 19 7816 1 1 1 LYS N N -20.185 -14.998 4.768 1.00 . A A . 1 LYS N 1 1 19 7817 1 1 1 LYS NZ N -15.188 -15.885 2.465 1.00 . A A . 1 LYS NZ 1 1 19 7818 1 1 1 LYS O O -20.812 -13.120 2.790 1.00 . A A . 1 LYS O 1 1 19 7819 1 1 2 LYS C C -19.322 -9.266 3.401 1.00 . A A . 2 LYS C 1 1 19 7820 1 1 2 LYS CA C -20.250 -10.473 3.354 1.00 . A A . 2 LYS CA 1 1 19 7821 1 1 2 LYS CB C -21.559 -10.145 4.084 1.00 . A A . 2 LYS CB 1 1 19 7822 1 1 2 LYS CD C -23.844 -9.226 3.605 1.00 . A A . 2 LYS CD 1 1 19 7823 1 1 2 LYS CE C -24.679 -8.736 2.417 1.00 . A A . 2 LYS CE 1 1 19 7824 1 1 2 LYS CG C -22.356 -9.119 3.267 1.00 . A A . 2 LYS CG 1 1 19 7825 1 1 2 LYS H H -18.896 -11.493 4.633 1.00 . A A . 2 LYS H 1 1 19 7826 1 1 2 LYS HA H -20.473 -10.703 2.323 1.00 . A A . 2 LYS HA 1 1 19 7827 1 1 2 LYS HB2 H -22.144 -11.048 4.197 1.00 . A A . 2 LYS HB2 1 1 19 7828 1 1 2 LYS HB3 H -21.339 -9.733 5.059 1.00 . A A . 2 LYS HB3 1 1 19 7829 1 1 2 LYS HD2 H -24.093 -10.254 3.817 1.00 . A A . 2 LYS HD2 1 1 19 7830 1 1 2 LYS HD3 H -24.063 -8.618 4.469 1.00 . A A . 2 LYS HD3 1 1 19 7831 1 1 2 LYS HE2 H -25.686 -8.522 2.751 1.00 . A A . 2 LYS HE2 1 1 19 7832 1 1 2 LYS HE3 H -24.239 -7.836 2.014 1.00 . A A . 2 LYS HE3 1 1 19 7833 1 1 2 LYS HG2 H -22.007 -8.124 3.506 1.00 . A A . 2 LYS HG2 1 1 19 7834 1 1 2 LYS HG3 H -22.213 -9.306 2.213 1.00 . A A . 2 LYS HG3 1 1 19 7835 1 1 2 LYS HZ1 H -23.881 -10.397 1.453 1.00 . A A . 2 LYS HZ1 1 1 19 7836 1 1 2 LYS HZ2 H -24.721 -9.343 0.423 1.00 . A A . 2 LYS HZ2 1 1 19 7837 1 1 2 LYS HZ3 H -25.579 -10.364 1.479 1.00 . A A . 2 LYS HZ3 1 1 19 7838 1 1 2 LYS N N -19.600 -11.631 3.962 1.00 . A A . 2 LYS N 1 1 19 7839 1 1 2 LYS NZ N -24.716 -9.789 1.365 1.00 . A A . 2 LYS NZ 1 1 19 7840 1 1 2 LYS O O -18.525 -9.128 4.331 1.00 . A A . 2 LYS O 1 1 19 7841 1 1 3 ALA C C -18.987 -6.374 1.117 1.00 . A A . 3 ALA C 1 1 19 7842 1 1 3 ALA CA C -18.591 -7.208 2.325 1.00 . A A . 3 ALA CA 1 1 19 7843 1 1 3 ALA CB C -17.114 -7.602 2.212 1.00 . A A . 3 ALA CB 1 1 19 7844 1 1 3 ALA H H -20.076 -8.570 1.684 1.00 . A A . 3 ALA H 1 1 19 7845 1 1 3 ALA HA H -18.730 -6.622 3.222 1.00 . A A . 3 ALA HA 1 1 19 7846 1 1 3 ALA HB1 H -17.024 -8.487 1.598 1.00 . A A . 3 ALA HB1 1 1 19 7847 1 1 3 ALA HB2 H -16.719 -7.806 3.196 1.00 . A A . 3 ALA HB2 1 1 19 7848 1 1 3 ALA HB3 H -16.556 -6.793 1.762 1.00 . A A . 3 ALA HB3 1 1 19 7849 1 1 3 ALA N N -19.425 -8.402 2.397 1.00 . A A . 3 ALA N 1 1 19 7850 1 1 3 ALA O O -19.420 -6.914 0.102 1.00 . A A . 3 ALA O 1 1 19 7851 1 1 4 LEU C C -17.947 -3.946 -0.750 1.00 . A A . 4 LEU C 1 1 19 7852 1 1 4 LEU CA C -19.174 -4.177 0.120 1.00 . A A . 4 LEU CA 1 1 19 7853 1 1 4 LEU CB C -19.689 -2.823 0.637 1.00 . A A . 4 LEU CB 1 1 19 7854 1 1 4 LEU CD1 C -21.551 -4.183 1.685 1.00 . A A . 4 LEU CD1 1 1 19 7855 1 1 4 LEU CD2 C -19.712 -3.237 3.107 1.00 . A A . 4 LEU CD2 1 1 19 7856 1 1 4 LEU CG C -20.590 -2.999 1.874 1.00 . A A . 4 LEU CG 1 1 19 7857 1 1 4 LEU H H -18.475 -4.682 2.055 1.00 . A A . 4 LEU H 1 1 19 7858 1 1 4 LEU HA H -19.945 -4.642 -0.474 1.00 . A A . 4 LEU HA 1 1 19 7859 1 1 4 LEU HB2 H -18.844 -2.203 0.900 1.00 . A A . 4 LEU HB2 1 1 19 7860 1 1 4 LEU HB3 H -20.252 -2.338 -0.148 1.00 . A A . 4 LEU HB3 1 1 19 7861 1 1 4 LEU HD11 H -21.219 -5.018 2.281 1.00 . A A . 4 LEU HD11 1 1 19 7862 1 1 4 LEU HD12 H -21.578 -4.469 0.645 1.00 . A A . 4 LEU HD12 1 1 19 7863 1 1 4 LEU HD13 H -22.543 -3.892 2.001 1.00 . A A . 4 LEU HD13 1 1 19 7864 1 1 4 LEU HD21 H -19.714 -4.286 3.355 1.00 . A A . 4 LEU HD21 1 1 19 7865 1 1 4 LEU HD22 H -20.102 -2.669 3.939 1.00 . A A . 4 LEU HD22 1 1 19 7866 1 1 4 LEU HD23 H -18.702 -2.917 2.898 1.00 . A A . 4 LEU HD23 1 1 19 7867 1 1 4 LEU HG H -21.168 -2.099 2.020 1.00 . A A . 4 LEU HG 1 1 19 7868 1 1 4 LEU N N -18.831 -5.062 1.225 1.00 . A A . 4 LEU N 1 1 19 7869 1 1 4 LEU O O -16.977 -4.709 -0.695 1.00 . A A . 4 LEU O 1 1 19 7870 1 1 5 LEU C C -16.207 -1.275 -1.964 1.00 . A A . 5 LEU C 1 1 19 7871 1 1 5 LEU CA C -16.876 -2.564 -2.419 1.00 . A A . 5 LEU CA 1 1 19 7872 1 1 5 LEU CB C -17.365 -2.411 -3.861 1.00 . A A . 5 LEU CB 1 1 19 7873 1 1 5 LEU CD1 C -16.499 -4.244 -5.322 1.00 . A A . 5 LEU CD1 1 1 19 7874 1 1 5 LEU CD2 C -16.201 -1.867 -6.009 1.00 . A A . 5 LEU CD2 1 1 19 7875 1 1 5 LEU CG C -16.248 -2.825 -4.821 1.00 . A A . 5 LEU CG 1 1 19 7876 1 1 5 LEU H H -18.784 -2.316 -1.537 1.00 . A A . 5 LEU H 1 1 19 7877 1 1 5 LEU HA H -16.154 -3.367 -2.378 1.00 . A A . 5 LEU HA 1 1 19 7878 1 1 5 LEU HB2 H -18.230 -3.042 -4.013 1.00 . A A . 5 LEU HB2 1 1 19 7879 1 1 5 LEU HB3 H -17.635 -1.379 -4.045 1.00 . A A . 5 LEU HB3 1 1 19 7880 1 1 5 LEU HD11 H -16.106 -4.346 -6.323 1.00 . A A . 5 LEU HD11 1 1 19 7881 1 1 5 LEU HD12 H -17.561 -4.443 -5.328 1.00 . A A . 5 LEU HD12 1 1 19 7882 1 1 5 LEU HD13 H -16.005 -4.945 -4.669 1.00 . A A . 5 LEU HD13 1 1 19 7883 1 1 5 LEU HD21 H -17.187 -1.777 -6.443 1.00 . A A . 5 LEU HD21 1 1 19 7884 1 1 5 LEU HD22 H -15.515 -2.248 -6.751 1.00 . A A . 5 LEU HD22 1 1 19 7885 1 1 5 LEU HD23 H -15.866 -0.899 -5.673 1.00 . A A . 5 LEU HD23 1 1 19 7886 1 1 5 LEU HG H -15.300 -2.799 -4.300 1.00 . A A . 5 LEU HG 1 1 19 7887 1 1 5 LEU N N -17.990 -2.890 -1.545 1.00 . A A . 5 LEU N 1 1 19 7888 1 1 5 LEU O O -16.843 -0.219 -1.909 1.00 . A A . 5 LEU O 1 1 19 7889 1 1 6 ALA C C -12.685 -0.467 -1.487 1.00 . A A . 6 ALA C 1 1 19 7890 1 1 6 ALA CA C -14.159 -0.221 -1.197 1.00 . A A . 6 ALA CA 1 1 19 7891 1 1 6 ALA CB C -14.370 0.008 0.305 1.00 . A A . 6 ALA CB 1 1 19 7892 1 1 6 ALA H H -14.482 -2.243 -1.713 1.00 . A A . 6 ALA H 1 1 19 7893 1 1 6 ALA HA H -14.489 0.655 -1.738 1.00 . A A . 6 ALA HA 1 1 19 7894 1 1 6 ALA HB1 H -15.127 0.764 0.454 1.00 . A A . 6 ALA HB1 1 1 19 7895 1 1 6 ALA HB2 H -13.444 0.337 0.754 1.00 . A A . 6 ALA HB2 1 1 19 7896 1 1 6 ALA HB3 H -14.685 -0.915 0.772 1.00 . A A . 6 ALA HB3 1 1 19 7897 1 1 6 ALA N N -14.929 -1.374 -1.642 1.00 . A A . 6 ALA N 1 1 19 7898 1 1 6 ALA O O -12.339 -1.470 -2.114 1.00 . A A . 6 ALA O 1 1 19 7899 1 1 7 LEU C C -9.754 -0.476 -0.102 1.00 . A A . 7 LEU C 1 1 19 7900 1 1 7 LEU CA C -10.395 0.287 -1.259 1.00 . A A . 7 LEU CA 1 1 19 7901 1 1 7 LEU CB C -9.727 1.664 -1.409 1.00 . A A . 7 LEU CB 1 1 19 7902 1 1 7 LEU CD1 C -10.372 2.264 -3.745 1.00 . A A . 7 LEU CD1 1 1 19 7903 1 1 7 LEU CD2 C -8.106 2.878 -2.887 1.00 . A A . 7 LEU CD2 1 1 19 7904 1 1 7 LEU CG C -9.221 1.823 -2.846 1.00 . A A . 7 LEU CG 1 1 19 7905 1 1 7 LEU H H -12.166 1.216 -0.539 1.00 . A A . 7 LEU H 1 1 19 7906 1 1 7 LEU HA H -10.248 -0.272 -2.170 1.00 . A A . 7 LEU HA 1 1 19 7907 1 1 7 LEU HB2 H -10.447 2.442 -1.185 1.00 . A A . 7 LEU HB2 1 1 19 7908 1 1 7 LEU HB3 H -8.896 1.738 -0.727 1.00 . A A . 7 LEU HB3 1 1 19 7909 1 1 7 LEU HD11 H -11.134 1.497 -3.760 1.00 . A A . 7 LEU HD11 1 1 19 7910 1 1 7 LEU HD12 H -10.005 2.425 -4.744 1.00 . A A . 7 LEU HD12 1 1 19 7911 1 1 7 LEU HD13 H -10.792 3.183 -3.363 1.00 . A A . 7 LEU HD13 1 1 19 7912 1 1 7 LEU HD21 H -7.339 2.620 -2.168 1.00 . A A . 7 LEU HD21 1 1 19 7913 1 1 7 LEU HD22 H -8.520 3.847 -2.648 1.00 . A A . 7 LEU HD22 1 1 19 7914 1 1 7 LEU HD23 H -7.672 2.912 -3.876 1.00 . A A . 7 LEU HD23 1 1 19 7915 1 1 7 LEU HG H -8.839 0.877 -3.198 1.00 . A A . 7 LEU HG 1 1 19 7916 1 1 7 LEU N N -11.828 0.437 -1.033 1.00 . A A . 7 LEU N 1 1 19 7917 1 1 7 LEU O O -10.203 -0.376 1.041 1.00 . A A . 7 LEU O 1 1 19 7918 1 1 8 ALA C C -6.685 -2.546 0.083 1.00 . A A . 8 ALA C 1 1 19 7919 1 1 8 ALA CA C -8.007 -2.016 0.619 1.00 . A A . 8 ALA CA 1 1 19 7920 1 1 8 ALA CB C -8.879 -3.186 1.077 1.00 . A A . 8 ALA CB 1 1 19 7921 1 1 8 ALA H H -8.397 -1.270 -1.336 1.00 . A A . 8 ALA H 1 1 19 7922 1 1 8 ALA HA H -7.810 -1.378 1.458 1.00 . A A . 8 ALA HA 1 1 19 7923 1 1 8 ALA HB1 H -9.901 -2.857 1.169 1.00 . A A . 8 ALA HB1 1 1 19 7924 1 1 8 ALA HB2 H -8.527 -3.543 2.033 1.00 . A A . 8 ALA HB2 1 1 19 7925 1 1 8 ALA HB3 H -8.822 -3.984 0.352 1.00 . A A . 8 ALA HB3 1 1 19 7926 1 1 8 ALA N N -8.708 -1.238 -0.405 1.00 . A A . 8 ALA N 1 1 19 7927 1 1 8 ALA O O -5.716 -2.718 0.827 1.00 . A A . 8 ALA O 1 1 19 7928 1 1 9 LEU C C -4.493 -2.186 -2.130 1.00 . A A . 9 LEU C 1 1 19 7929 1 1 9 LEU CA C -5.477 -3.309 -1.875 1.00 . A A . 9 LEU CA 1 1 19 7930 1 1 9 LEU CB C -5.892 -3.889 -3.213 1.00 . A A . 9 LEU CB 1 1 19 7931 1 1 9 LEU CD1 C -5.971 -5.938 -4.638 1.00 . A A . 9 LEU CD1 1 1 19 7932 1 1 9 LEU CD2 C -3.874 -5.386 -3.376 1.00 . A A . 9 LEU CD2 1 1 19 7933 1 1 9 LEU CG C -5.410 -5.338 -3.348 1.00 . A A . 9 LEU CG 1 1 19 7934 1 1 9 LEU H H -7.469 -2.644 -1.733 1.00 . A A . 9 LEU H 1 1 19 7935 1 1 9 LEU HA H -5.016 -4.072 -1.276 1.00 . A A . 9 LEU HA 1 1 19 7936 1 1 9 LEU HB2 H -6.969 -3.859 -3.279 1.00 . A A . 9 LEU HB2 1 1 19 7937 1 1 9 LEU HB3 H -5.467 -3.286 -3.999 1.00 . A A . 9 LEU HB3 1 1 19 7938 1 1 9 LEU HD11 H -5.423 -6.835 -4.889 1.00 . A A . 9 LEU HD11 1 1 19 7939 1 1 9 LEU HD12 H -5.877 -5.224 -5.443 1.00 . A A . 9 LEU HD12 1 1 19 7940 1 1 9 LEU HD13 H -7.013 -6.180 -4.493 1.00 . A A . 9 LEU HD13 1 1 19 7941 1 1 9 LEU HD21 H -3.522 -5.982 -2.548 1.00 . A A . 9 LEU HD21 1 1 19 7942 1 1 9 LEU HD22 H -3.475 -4.386 -3.292 1.00 . A A . 9 LEU HD22 1 1 19 7943 1 1 9 LEU HD23 H -3.540 -5.827 -4.304 1.00 . A A . 9 LEU HD23 1 1 19 7944 1 1 9 LEU HG H -5.770 -5.913 -2.510 1.00 . A A . 9 LEU HG 1 1 19 7945 1 1 9 LEU N N -6.663 -2.801 -1.208 1.00 . A A . 9 LEU N 1 1 19 7946 1 1 9 LEU O O -3.366 -2.197 -1.630 1.00 . A A . 9 LEU O 1 1 19 7947 1 1 10 HIS C C -3.538 0.465 -1.945 1.00 . A A . 10 HIS C 1 1 19 7948 1 1 10 HIS CA C -4.103 -0.069 -3.235 1.00 . A A . 10 HIS CA 1 1 19 7949 1 1 10 HIS CB C -4.927 1.015 -3.917 1.00 . A A . 10 HIS CB 1 1 19 7950 1 1 10 HIS CD2 C -5.384 0.163 -6.355 1.00 . A A . 10 HIS CD2 1 1 19 7951 1 1 10 HIS CE1 C -3.836 1.288 -7.377 1.00 . A A . 10 HIS CE1 1 1 19 7952 1 1 10 HIS CG C -4.739 0.911 -5.403 1.00 . A A . 10 HIS CG 1 1 19 7953 1 1 10 HIS H H -5.852 -1.279 -3.258 1.00 . A A . 10 HIS H 1 1 19 7954 1 1 10 HIS HA H -3.300 -0.378 -3.883 1.00 . A A . 10 HIS HA 1 1 19 7955 1 1 10 HIS HB2 H -5.970 0.879 -3.669 1.00 . A A . 10 HIS HB2 1 1 19 7956 1 1 10 HIS HB3 H -4.598 1.983 -3.577 1.00 . A A . 10 HIS HB3 1 1 19 7957 1 1 10 HIS HD1 H -3.108 2.242 -5.668 1.00 . A A . 10 HIS HD1 1 1 19 7958 1 1 10 HIS HD2 H -6.215 -0.509 -6.166 1.00 . A A . 10 HIS HD2 1 1 19 7959 1 1 10 HIS HE1 H -3.190 1.690 -8.146 1.00 . A A . 10 HIS HE1 1 1 19 7960 1 1 10 HIS HE2 H -5.059 -0.008 -8.465 1.00 . A A . 10 HIS HE2 1 1 19 7961 1 1 10 HIS N N -4.940 -1.218 -2.909 1.00 . A A . 10 HIS N 1 1 19 7962 1 1 10 HIS ND1 N -3.757 1.621 -6.074 1.00 . A A . 10 HIS ND1 1 1 19 7963 1 1 10 HIS NE2 N -4.812 0.401 -7.604 1.00 . A A . 10 HIS NE2 1 1 19 7964 1 1 10 HIS O O -2.387 0.886 -1.857 1.00 . A A . 10 HIS O 1 1 19 7965 1 1 11 HIS C C -2.646 0.271 0.730 1.00 . A A . 11 HIS C 1 1 19 7966 1 1 11 HIS CA C -4.033 0.789 0.403 1.00 . A A . 11 HIS CA 1 1 19 7967 1 1 11 HIS CB C -5.043 0.146 1.341 1.00 . A A . 11 HIS CB 1 1 19 7968 1 1 11 HIS CD2 C -7.296 1.450 1.571 1.00 . A A . 11 HIS CD2 1 1 19 7969 1 1 11 HIS CE1 C -6.677 2.881 3.076 1.00 . A A . 11 HIS CE1 1 1 19 7970 1 1 11 HIS CG C -5.986 1.183 1.864 1.00 . A A . 11 HIS CG 1 1 19 7971 1 1 11 HIS H H -5.267 0.004 -1.103 1.00 . A A . 11 HIS H 1 1 19 7972 1 1 11 HIS HA H -4.067 1.859 0.494 1.00 . A A . 11 HIS HA 1 1 19 7973 1 1 11 HIS HB2 H -5.602 -0.607 0.787 1.00 . A A . 11 HIS HB2 1 1 19 7974 1 1 11 HIS HB3 H -4.521 -0.321 2.162 1.00 . A A . 11 HIS HB3 1 1 19 7975 1 1 11 HIS HD1 H -4.720 2.179 3.243 1.00 . A A . 11 HIS HD1 1 1 19 7976 1 1 11 HIS HD2 H -7.895 0.904 0.854 1.00 . A A . 11 HIS HD2 1 1 19 7977 1 1 11 HIS HE1 H -6.682 3.693 3.789 1.00 . A A . 11 HIS HE1 1 1 19 7978 1 1 11 HIS HE2 H -8.631 2.930 2.335 1.00 . A A . 11 HIS HE2 1 1 19 7979 1 1 11 HIS N N -4.381 0.385 -0.939 1.00 . A A . 11 HIS N 1 1 19 7980 1 1 11 HIS ND1 N -5.608 2.105 2.822 1.00 . A A . 11 HIS ND1 1 1 19 7981 1 1 11 HIS NE2 N -7.735 2.526 2.335 1.00 . A A . 11 HIS NE2 1 1 19 7982 1 1 11 HIS O O -1.799 0.971 1.293 1.00 . A A . 11 HIS O 1 1 19 7983 1 1 12 LEU C C -0.190 -1.155 -0.519 1.00 . A A . 12 LEU C 1 1 19 7984 1 1 12 LEU CA C -1.143 -1.607 0.558 1.00 . A A . 12 LEU CA 1 1 19 7985 1 1 12 LEU CB C -1.287 -3.128 0.497 1.00 . A A . 12 LEU CB 1 1 19 7986 1 1 12 LEU CD1 C -2.667 -5.067 1.261 1.00 . A A . 12 LEU CD1 1 1 19 7987 1 1 12 LEU CD2 C -1.815 -3.400 2.931 1.00 . A A . 12 LEU CD2 1 1 19 7988 1 1 12 LEU CG C -2.344 -3.588 1.503 1.00 . A A . 12 LEU CG 1 1 19 7989 1 1 12 LEU H H -3.143 -1.450 -0.128 1.00 . A A . 12 LEU H 1 1 19 7990 1 1 12 LEU HA H -0.758 -1.315 1.518 1.00 . A A . 12 LEU HA 1 1 19 7991 1 1 12 LEU HB2 H -1.588 -3.416 -0.501 1.00 . A A . 12 LEU HB2 1 1 19 7992 1 1 12 LEU HB3 H -0.339 -3.588 0.732 1.00 . A A . 12 LEU HB3 1 1 19 7993 1 1 12 LEU HD11 H -3.555 -5.144 0.652 1.00 . A A . 12 LEU HD11 1 1 19 7994 1 1 12 LEU HD12 H -2.833 -5.558 2.208 1.00 . A A . 12 LEU HD12 1 1 19 7995 1 1 12 LEU HD13 H -1.839 -5.539 0.752 1.00 . A A . 12 LEU HD13 1 1 19 7996 1 1 12 LEU HD21 H -0.734 -3.382 2.920 1.00 . A A . 12 LEU HD21 1 1 19 7997 1 1 12 LEU HD22 H -2.153 -4.216 3.552 1.00 . A A . 12 LEU HD22 1 1 19 7998 1 1 12 LEU HD23 H -2.186 -2.468 3.329 1.00 . A A . 12 LEU HD23 1 1 19 7999 1 1 12 LEU HG H -3.242 -3.004 1.371 1.00 . A A . 12 LEU HG 1 1 19 8000 1 1 12 LEU N N -2.425 -0.966 0.341 1.00 . A A . 12 LEU N 1 1 19 8001 1 1 12 LEU O O 0.927 -0.726 -0.243 1.00 . A A . 12 LEU O 1 1 19 8002 1 1 13 ALA C C 0.730 0.573 -2.574 1.00 . A A . 13 ALA C 1 1 19 8003 1 1 13 ALA CA C 0.132 -0.789 -2.891 1.00 . A A . 13 ALA CA 1 1 19 8004 1 1 13 ALA CB C -0.740 -0.694 -4.146 1.00 . A A . 13 ALA CB 1 1 19 8005 1 1 13 ALA H H -1.582 -1.556 -1.880 1.00 . A A . 13 ALA H 1 1 19 8006 1 1 13 ALA HA H 0.928 -1.496 -3.062 1.00 . A A . 13 ALA HA 1 1 19 8007 1 1 13 ALA HB1 H -0.120 -0.811 -5.026 1.00 . A A . 13 ALA HB1 1 1 19 8008 1 1 13 ALA HB2 H -1.226 0.270 -4.175 1.00 . A A . 13 ALA HB2 1 1 19 8009 1 1 13 ALA HB3 H -1.487 -1.475 -4.128 1.00 . A A . 13 ALA HB3 1 1 19 8010 1 1 13 ALA N N -0.666 -1.225 -1.748 1.00 . A A . 13 ALA N 1 1 19 8011 1 1 13 ALA O O 1.825 0.914 -3.017 1.00 . A A . 13 ALA O 1 1 19 8012 1 1 14 HIS C C 1.603 2.512 -0.422 1.00 . A A . 14 HIS C 1 1 19 8013 1 1 14 HIS CA C 0.423 2.650 -1.356 1.00 . A A . 14 HIS CA 1 1 19 8014 1 1 14 HIS CB C -0.742 3.349 -0.667 1.00 . A A . 14 HIS CB 1 1 19 8015 1 1 14 HIS CD2 C -0.623 4.343 1.754 1.00 . A A . 14 HIS CD2 1 1 19 8016 1 1 14 HIS CE1 C 0.947 5.800 1.429 1.00 . A A . 14 HIS CE1 1 1 19 8017 1 1 14 HIS CG C -0.256 4.246 0.437 1.00 . A A . 14 HIS CG 1 1 19 8018 1 1 14 HIS H H -0.869 0.976 -1.461 1.00 . A A . 14 HIS H 1 1 19 8019 1 1 14 HIS HA H 0.718 3.221 -2.215 1.00 . A A . 14 HIS HA 1 1 19 8020 1 1 14 HIS HB2 H -1.260 3.929 -1.393 1.00 . A A . 14 HIS HB2 1 1 19 8021 1 1 14 HIS HB3 H -1.414 2.610 -0.258 1.00 . A A . 14 HIS HB3 1 1 19 8022 1 1 14 HIS HD1 H 1.221 5.364 -0.591 1.00 . A A . 14 HIS HD1 1 1 19 8023 1 1 14 HIS HD2 H -1.382 3.734 2.234 1.00 . A A . 14 HIS HD2 1 1 19 8024 1 1 14 HIS HE1 H 1.673 6.582 1.589 1.00 . A A . 14 HIS HE1 1 1 19 8025 1 1 14 HIS HE2 H 0.101 5.595 3.328 1.00 . A A . 14 HIS HE2 1 1 19 8026 1 1 14 HIS N N -0.008 1.329 -1.782 1.00 . A A . 14 HIS N 1 1 19 8027 1 1 14 HIS ND1 N 0.747 5.183 0.249 1.00 . A A . 14 HIS ND1 1 1 19 8028 1 1 14 HIS NE2 N 0.138 5.324 2.382 1.00 . A A . 14 HIS NE2 1 1 19 8029 1 1 14 HIS O O 2.688 3.036 -0.676 1.00 . A A . 14 HIS O 1 1 19 8030 1 1 15 LEU C C 3.615 0.937 0.774 1.00 . A A . 15 LEU C 1 1 19 8031 1 1 15 LEU CA C 2.490 1.519 1.570 1.00 . A A . 15 LEU CA 1 1 19 8032 1 1 15 LEU CB C 2.089 0.484 2.624 1.00 . A A . 15 LEU CB 1 1 19 8033 1 1 15 LEU CD1 C 0.544 2.351 3.310 1.00 . A A . 15 LEU CD1 1 1 19 8034 1 1 15 LEU CD2 C 0.283 0.079 4.277 1.00 . A A . 15 LEU CD2 1 1 19 8035 1 1 15 LEU CG C 1.294 1.109 3.775 1.00 . A A . 15 LEU CG 1 1 19 8036 1 1 15 LEU H H 0.535 1.329 0.770 1.00 . A A . 15 LEU H 1 1 19 8037 1 1 15 LEU HA H 2.805 2.436 2.029 1.00 . A A . 15 LEU HA 1 1 19 8038 1 1 15 LEU HB2 H 1.486 -0.278 2.149 1.00 . A A . 15 LEU HB2 1 1 19 8039 1 1 15 LEU HB3 H 2.983 0.024 3.020 1.00 . A A . 15 LEU HB3 1 1 19 8040 1 1 15 LEU HD11 H -0.119 2.686 4.096 1.00 . A A . 15 LEU HD11 1 1 19 8041 1 1 15 LEU HD12 H -0.033 2.109 2.432 1.00 . A A . 15 LEU HD12 1 1 19 8042 1 1 15 LEU HD13 H 1.247 3.135 3.078 1.00 . A A . 15 LEU HD13 1 1 19 8043 1 1 15 LEU HD21 H 0.798 -0.824 4.566 1.00 . A A . 15 LEU HD21 1 1 19 8044 1 1 15 LEU HD22 H -0.417 -0.149 3.486 1.00 . A A . 15 LEU HD22 1 1 19 8045 1 1 15 LEU HD23 H -0.250 0.479 5.125 1.00 . A A . 15 LEU HD23 1 1 19 8046 1 1 15 LEU HG H 1.965 1.374 4.575 1.00 . A A . 15 LEU HG 1 1 19 8047 1 1 15 LEU N N 1.405 1.760 0.638 1.00 . A A . 15 LEU N 1 1 19 8048 1 1 15 LEU O O 4.794 1.200 1.005 1.00 . A A . 15 LEU O 1 1 19 8049 1 1 16 ALA C C 4.848 0.474 -1.929 1.00 . A A . 16 ALA C 1 1 19 8050 1 1 16 ALA CA C 4.132 -0.534 -1.053 1.00 . A A . 16 ALA CA 1 1 19 8051 1 1 16 ALA CB C 3.396 -1.549 -1.928 1.00 . A A . 16 ALA CB 1 1 19 8052 1 1 16 ALA H H 2.223 -0.001 -0.281 1.00 . A A . 16 ALA H 1 1 19 8053 1 1 16 ALA HA H 4.859 -1.050 -0.454 1.00 . A A . 16 ALA HA 1 1 19 8054 1 1 16 ALA HB1 H 4.020 -2.416 -2.074 1.00 . A A . 16 ALA HB1 1 1 19 8055 1 1 16 ALA HB2 H 3.170 -1.103 -2.887 1.00 . A A . 16 ALA HB2 1 1 19 8056 1 1 16 ALA HB3 H 2.477 -1.843 -1.443 1.00 . A A . 16 ALA HB3 1 1 19 8057 1 1 16 ALA N N 3.202 0.137 -0.173 1.00 . A A . 16 ALA N 1 1 19 8058 1 1 16 ALA O O 5.996 0.271 -2.314 1.00 . A A . 16 ALA O 1 1 19 8059 1 1 17 LEU C C 5.964 3.182 -2.459 1.00 . A A . 17 LEU C 1 1 19 8060 1 1 17 LEU CA C 4.727 2.588 -3.098 1.00 . A A . 17 LEU CA 1 1 19 8061 1 1 17 LEU CB C 3.675 3.674 -3.409 1.00 . A A . 17 LEU CB 1 1 19 8062 1 1 17 LEU CD1 C 3.747 5.926 -4.507 1.00 . A A . 17 LEU CD1 1 1 19 8063 1 1 17 LEU CD2 C 3.909 5.763 -2.027 1.00 . A A . 17 LEU CD2 1 1 19 8064 1 1 17 LEU CG C 4.287 5.086 -3.348 1.00 . A A . 17 LEU CG 1 1 19 8065 1 1 17 LEU H H 3.241 1.647 -1.915 1.00 . A A . 17 LEU H 1 1 19 8066 1 1 17 LEU HA H 5.029 2.127 -4.016 1.00 . A A . 17 LEU HA 1 1 19 8067 1 1 17 LEU HB2 H 3.280 3.501 -4.399 1.00 . A A . 17 LEU HB2 1 1 19 8068 1 1 17 LEU HB3 H 2.869 3.603 -2.697 1.00 . A A . 17 LEU HB3 1 1 19 8069 1 1 17 LEU HD11 H 3.907 6.973 -4.297 1.00 . A A . 17 LEU HD11 1 1 19 8070 1 1 17 LEU HD12 H 2.688 5.742 -4.624 1.00 . A A . 17 LEU HD12 1 1 19 8071 1 1 17 LEU HD13 H 4.263 5.658 -5.415 1.00 . A A . 17 LEU HD13 1 1 19 8072 1 1 17 LEU HD21 H 4.751 6.328 -1.661 1.00 . A A . 17 LEU HD21 1 1 19 8073 1 1 17 LEU HD22 H 3.634 5.016 -1.301 1.00 . A A . 17 LEU HD22 1 1 19 8074 1 1 17 LEU HD23 H 3.076 6.430 -2.190 1.00 . A A . 17 LEU HD23 1 1 19 8075 1 1 17 LEU HG H 5.360 5.025 -3.426 1.00 . A A . 17 LEU HG 1 1 19 8076 1 1 17 LEU N N 4.157 1.553 -2.249 1.00 . A A . 17 LEU N 1 1 19 8077 1 1 17 LEU O O 6.996 3.327 -3.119 1.00 . A A . 17 LEU O 1 1 19 8078 1 1 18 HIS C C 7.993 2.971 -0.170 1.00 . A A . 18 HIS C 1 1 19 8079 1 1 18 HIS CA C 7.050 4.080 -0.529 1.00 . A A . 18 HIS CA 1 1 19 8080 1 1 18 HIS CB C 6.671 4.917 0.678 1.00 . A A . 18 HIS CB 1 1 19 8081 1 1 18 HIS CD2 C 4.727 3.788 1.998 1.00 . A A . 18 HIS CD2 1 1 19 8082 1 1 18 HIS CE1 C 5.863 3.075 3.697 1.00 . A A . 18 HIS CE1 1 1 19 8083 1 1 18 HIS CG C 6.034 4.114 1.767 1.00 . A A . 18 HIS CG 1 1 19 8084 1 1 18 HIS H H 5.029 3.374 -0.693 1.00 . A A . 18 HIS H 1 1 19 8085 1 1 18 HIS HA H 7.551 4.720 -1.240 1.00 . A A . 18 HIS HA 1 1 19 8086 1 1 18 HIS HB2 H 7.547 5.406 1.064 1.00 . A A . 18 HIS HB2 1 1 19 8087 1 1 18 HIS HB3 H 5.976 5.647 0.348 1.00 . A A . 18 HIS HB3 1 1 19 8088 1 1 18 HIS HD1 H 7.718 3.708 2.992 1.00 . A A . 18 HIS HD1 1 1 19 8089 1 1 18 HIS HD2 H 3.904 4.007 1.328 1.00 . A A . 18 HIS HD2 1 1 19 8090 1 1 18 HIS HE1 H 6.130 2.619 4.639 1.00 . A A . 18 HIS HE1 1 1 19 8091 1 1 18 HIS HE2 H 3.803 2.795 3.648 1.00 . A A . 18 HIS HE2 1 1 19 8092 1 1 18 HIS N N 5.878 3.519 -1.187 1.00 . A A . 18 HIS N 1 1 19 8093 1 1 18 HIS ND1 N 6.746 3.646 2.858 1.00 . A A . 18 HIS ND1 1 1 19 8094 1 1 18 HIS NE2 N 4.618 3.134 3.221 1.00 . A A . 18 HIS NE2 1 1 19 8095 1 1 18 HIS O O 9.200 3.053 -0.415 1.00 . A A . 18 HIS O 1 1 19 8096 1 1 19 LEU C C 9.039 0.395 -0.561 1.00 . A A . 19 LEU C 1 1 19 8097 1 1 19 LEU CA C 8.226 0.732 0.666 1.00 . A A . 19 LEU CA 1 1 19 8098 1 1 19 LEU CB C 7.333 -0.468 0.995 1.00 . A A . 19 LEU CB 1 1 19 8099 1 1 19 LEU CD1 C 7.136 0.596 3.226 1.00 . A A . 19 LEU CD1 1 1 19 8100 1 1 19 LEU CD2 C 6.154 -1.658 2.833 1.00 . A A . 19 LEU CD2 1 1 19 8101 1 1 19 LEU CG C 7.318 -0.723 2.497 1.00 . A A . 19 LEU CG 1 1 19 8102 1 1 19 LEU H H 6.448 1.902 0.470 1.00 . A A . 19 LEU H 1 1 19 8103 1 1 19 LEU HA H 8.884 0.947 1.491 1.00 . A A . 19 LEU HA 1 1 19 8104 1 1 19 LEU HB2 H 6.331 -0.272 0.657 1.00 . A A . 19 LEU HB2 1 1 19 8105 1 1 19 LEU HB3 H 7.714 -1.342 0.491 1.00 . A A . 19 LEU HB3 1 1 19 8106 1 1 19 LEU HD11 H 8.092 1.085 3.330 1.00 . A A . 19 LEU HD11 1 1 19 8107 1 1 19 LEU HD12 H 6.714 0.415 4.202 1.00 . A A . 19 LEU HD12 1 1 19 8108 1 1 19 LEU HD13 H 6.473 1.225 2.653 1.00 . A A . 19 LEU HD13 1 1 19 8109 1 1 19 LEU HD21 H 5.219 -1.138 2.678 1.00 . A A . 19 LEU HD21 1 1 19 8110 1 1 19 LEU HD22 H 6.227 -1.974 3.861 1.00 . A A . 19 LEU HD22 1 1 19 8111 1 1 19 LEU HD23 H 6.194 -2.522 2.186 1.00 . A A . 19 LEU HD23 1 1 19 8112 1 1 19 LEU HG H 8.248 -1.176 2.793 1.00 . A A . 19 LEU HG 1 1 19 8113 1 1 19 LEU N N 7.426 1.906 0.347 1.00 . A A . 19 LEU N 1 1 19 8114 1 1 19 LEU O O 10.157 -0.115 -0.483 1.00 . A A . 19 LEU O 1 1 19 8115 1 1 20 ALA C C 10.343 1.299 -3.098 1.00 . A A . 20 ALA C 1 1 19 8116 1 1 20 ALA CA C 9.100 0.451 -2.982 1.00 . A A . 20 ALA CA 1 1 19 8117 1 1 20 ALA CB C 8.163 0.783 -4.146 1.00 . A A . 20 ALA CB 1 1 19 8118 1 1 20 ALA H H 7.550 1.124 -1.676 1.00 . A A . 20 ALA H 1 1 19 8119 1 1 20 ALA HA H 9.375 -0.586 -3.038 1.00 . A A . 20 ALA HA 1 1 19 8120 1 1 20 ALA HB1 H 8.651 1.482 -4.810 1.00 . A A . 20 ALA HB1 1 1 19 8121 1 1 20 ALA HB2 H 7.258 1.224 -3.766 1.00 . A A . 20 ALA HB2 1 1 19 8122 1 1 20 ALA HB3 H 7.925 -0.117 -4.687 1.00 . A A . 20 ALA HB3 1 1 19 8123 1 1 20 ALA N N 8.448 0.705 -1.703 1.00 . A A . 20 ALA N 1 1 19 8124 1 1 20 ALA O O 11.445 0.788 -3.255 1.00 . A A . 20 ALA O 1 1 19 8125 1 1 21 LEU C C 12.378 3.086 -2.194 1.00 . A A . 21 LEU C 1 1 19 8126 1 1 21 LEU CA C 11.250 3.541 -3.100 1.00 . A A . 21 LEU CA 1 1 19 8127 1 1 21 LEU CB C 10.790 4.943 -2.691 1.00 . A A . 21 LEU CB 1 1 19 8128 1 1 21 LEU CD1 C 10.758 7.097 -3.969 1.00 . A A . 21 LEU CD1 1 1 19 8129 1 1 21 LEU CD2 C 12.636 6.614 -2.398 1.00 . A A . 21 LEU CD2 1 1 19 8130 1 1 21 LEU CG C 11.654 5.998 -3.399 1.00 . A A . 21 LEU CG 1 1 19 8131 1 1 21 LEU H H 9.232 2.927 -2.884 1.00 . A A . 21 LEU H 1 1 19 8132 1 1 21 LEU HA H 11.603 3.566 -4.112 1.00 . A A . 21 LEU HA 1 1 19 8133 1 1 21 LEU HB2 H 9.755 5.074 -2.974 1.00 . A A . 21 LEU HB2 1 1 19 8134 1 1 21 LEU HB3 H 10.885 5.056 -1.621 1.00 . A A . 21 LEU HB3 1 1 19 8135 1 1 21 LEU HD11 H 10.102 6.672 -4.717 1.00 . A A . 21 LEU HD11 1 1 19 8136 1 1 21 LEU HD12 H 11.368 7.865 -4.420 1.00 . A A . 21 LEU HD12 1 1 19 8137 1 1 21 LEU HD13 H 10.168 7.527 -3.173 1.00 . A A . 21 LEU HD13 1 1 19 8138 1 1 21 LEU HD21 H 12.095 7.219 -1.687 1.00 . A A . 21 LEU HD21 1 1 19 8139 1 1 21 LEU HD22 H 13.345 7.234 -2.927 1.00 . A A . 21 LEU HD22 1 1 19 8140 1 1 21 LEU HD23 H 13.162 5.830 -1.877 1.00 . A A . 21 LEU HD23 1 1 19 8141 1 1 21 LEU HG H 12.206 5.531 -4.203 1.00 . A A . 21 LEU HG 1 1 19 8142 1 1 21 LEU N N 10.144 2.599 -3.012 1.00 . A A . 21 LEU N 1 1 19 8143 1 1 21 LEU O O 13.540 3.037 -2.599 1.00 . A A . 21 LEU O 1 1 19 8144 1 1 22 ALA C C 13.813 1.139 -0.556 1.00 . A A . 22 ALA C 1 1 19 8145 1 1 22 ALA CA C 12.994 2.290 0.013 1.00 . A A . 22 ALA CA 1 1 19 8146 1 1 22 ALA CB C 12.288 1.842 1.296 1.00 . A A . 22 ALA CB 1 1 19 8147 1 1 22 ALA H H 11.064 2.809 -0.722 1.00 . A A . 22 ALA H 1 1 19 8148 1 1 22 ALA HA H 13.655 3.103 0.244 1.00 . A A . 22 ALA HA 1 1 19 8149 1 1 22 ALA HB1 H 12.978 1.283 1.910 1.00 . A A . 22 ALA HB1 1 1 19 8150 1 1 22 ALA HB2 H 11.442 1.218 1.045 1.00 . A A . 22 ALA HB2 1 1 19 8151 1 1 22 ALA HB3 H 11.947 2.710 1.842 1.00 . A A . 22 ALA HB3 1 1 19 8152 1 1 22 ALA N N 12.015 2.751 -0.968 1.00 . A A . 22 ALA N 1 1 19 8153 1 1 22 ALA O O 15.040 1.121 -0.447 1.00 . A A . 22 ALA O 1 1 19 8154 1 1 23 LEU C C 14.448 -0.542 -3.065 1.00 . A A . 23 LEU C 1 1 19 8155 1 1 23 LEU CA C 13.782 -0.960 -1.770 1.00 . A A . 23 LEU CA 1 1 19 8156 1 1 23 LEU CB C 12.755 -2.051 -2.067 1.00 . A A . 23 LEU CB 1 1 19 8157 1 1 23 LEU CD1 C 10.883 -3.341 -1.041 1.00 . A A . 23 LEU CD1 1 1 19 8158 1 1 23 LEU CD2 C 13.193 -3.527 -0.106 1.00 . A A . 23 LEU CD2 1 1 19 8159 1 1 23 LEU CG C 12.181 -2.583 -0.757 1.00 . A A . 23 LEU CG 1 1 19 8160 1 1 23 LEU H H 12.148 0.276 -1.221 1.00 . A A . 23 LEU H 1 1 19 8161 1 1 23 LEU HA H 14.526 -1.341 -1.093 1.00 . A A . 23 LEU HA 1 1 19 8162 1 1 23 LEU HB2 H 11.959 -1.637 -2.668 1.00 . A A . 23 LEU HB2 1 1 19 8163 1 1 23 LEU HB3 H 13.231 -2.857 -2.604 1.00 . A A . 23 LEU HB3 1 1 19 8164 1 1 23 LEU HD11 H 10.484 -3.727 -0.119 1.00 . A A . 23 LEU HD11 1 1 19 8165 1 1 23 LEU HD12 H 11.083 -4.155 -1.718 1.00 . A A . 23 LEU HD12 1 1 19 8166 1 1 23 LEU HD13 H 10.166 -2.667 -1.492 1.00 . A A . 23 LEU HD13 1 1 19 8167 1 1 23 LEU HD21 H 12.669 -4.344 0.368 1.00 . A A . 23 LEU HD21 1 1 19 8168 1 1 23 LEU HD22 H 13.760 -2.985 0.635 1.00 . A A . 23 LEU HD22 1 1 19 8169 1 1 23 LEU HD23 H 13.860 -3.914 -0.860 1.00 . A A . 23 LEU HD23 1 1 19 8170 1 1 23 LEU HG H 11.973 -1.756 -0.091 1.00 . A A . 23 LEU HG 1 1 19 8171 1 1 23 LEU N N 13.123 0.191 -1.167 1.00 . A A . 23 LEU N 1 1 19 8172 1 1 23 LEU O O 15.609 -0.863 -3.327 1.00 . A A . 23 LEU O 1 1 19 8173 1 1 24 LYS C C 15.502 1.396 -4.921 1.00 . A A . 24 LYS C 1 1 19 8174 1 1 24 LYS CA C 14.175 0.686 -5.133 1.00 . A A . 24 LYS CA 1 1 19 8175 1 1 24 LYS CB C 13.146 1.654 -5.738 1.00 . A A . 24 LYS CB 1 1 19 8176 1 1 24 LYS CD C 14.228 3.745 -6.604 1.00 . A A . 24 LYS CD 1 1 19 8177 1 1 24 LYS CE C 15.646 3.942 -7.145 1.00 . A A . 24 LYS CE 1 1 19 8178 1 1 24 LYS CG C 13.727 2.346 -6.976 1.00 . A A . 24 LYS CG 1 1 19 8179 1 1 24 LYS H H 12.778 0.398 -3.570 1.00 . A A . 24 LYS H 1 1 19 8180 1 1 24 LYS HA H 14.322 -0.142 -5.802 1.00 . A A . 24 LYS HA 1 1 19 8181 1 1 24 LYS HB2 H 12.260 1.102 -6.020 1.00 . A A . 24 LYS HB2 1 1 19 8182 1 1 24 LYS HB3 H 12.882 2.397 -5.004 1.00 . A A . 24 LYS HB3 1 1 19 8183 1 1 24 LYS HD2 H 13.570 4.486 -7.036 1.00 . A A . 24 LYS HD2 1 1 19 8184 1 1 24 LYS HD3 H 14.238 3.853 -5.531 1.00 . A A . 24 LYS HD3 1 1 19 8185 1 1 24 LYS HE2 H 16.017 4.902 -6.829 1.00 . A A . 24 LYS HE2 1 1 19 8186 1 1 24 LYS HE3 H 16.287 3.166 -6.760 1.00 . A A . 24 LYS HE3 1 1 19 8187 1 1 24 LYS HG2 H 14.546 1.760 -7.364 1.00 . A A . 24 LYS HG2 1 1 19 8188 1 1 24 LYS HG3 H 12.959 2.433 -7.732 1.00 . A A . 24 LYS HG3 1 1 19 8189 1 1 24 LYS HZ1 H 15.764 4.836 -9.021 1.00 . A A . 24 LYS HZ1 1 1 19 8190 1 1 24 LYS HZ2 H 14.721 3.503 -8.965 1.00 . A A . 24 LYS HZ2 1 1 19 8191 1 1 24 LYS HZ3 H 16.400 3.263 -8.966 1.00 . A A . 24 LYS HZ3 1 1 19 8192 1 1 24 LYS N N 13.690 0.188 -3.858 1.00 . A A . 24 LYS N 1 1 19 8193 1 1 24 LYS NZ N 15.629 3.880 -8.634 1.00 . A A . 24 LYS NZ 1 1 19 8194 1 1 24 LYS O O 16.464 1.177 -5.661 1.00 . A A . 24 LYS O 1 1 19 8195 1 1 25 LYS C C 17.588 2.150 -2.584 1.00 . A A . 25 LYS C 1 1 19 8196 1 1 25 LYS CA C 16.757 2.964 -3.569 1.00 . A A . 25 LYS CA 1 1 19 8197 1 1 25 LYS CB C 16.408 4.324 -2.949 1.00 . A A . 25 LYS CB 1 1 19 8198 1 1 25 LYS CD C 18.902 4.798 -3.181 1.00 . A A . 25 LYS CD 1 1 19 8199 1 1 25 LYS CE C 19.413 4.902 -1.736 1.00 . A A . 25 LYS CE 1 1 19 8200 1 1 25 LYS CG C 17.477 5.378 -3.302 1.00 . A A . 25 LYS CG 1 1 19 8201 1 1 25 LYS H H 14.740 2.348 -3.341 1.00 . A A . 25 LYS H 1 1 19 8202 1 1 25 LYS HA H 17.326 3.121 -4.474 1.00 . A A . 25 LYS HA 1 1 19 8203 1 1 25 LYS HB2 H 15.449 4.650 -3.327 1.00 . A A . 25 LYS HB2 1 1 19 8204 1 1 25 LYS HB3 H 16.344 4.221 -1.876 1.00 . A A . 25 LYS HB3 1 1 19 8205 1 1 25 LYS HD2 H 18.907 3.766 -3.487 1.00 . A A . 25 LYS HD2 1 1 19 8206 1 1 25 LYS HD3 H 19.563 5.356 -3.828 1.00 . A A . 25 LYS HD3 1 1 19 8207 1 1 25 LYS HE2 H 20.205 4.184 -1.589 1.00 . A A . 25 LYS HE2 1 1 19 8208 1 1 25 LYS HE3 H 19.798 5.898 -1.565 1.00 . A A . 25 LYS HE3 1 1 19 8209 1 1 25 LYS HG2 H 17.321 5.714 -4.318 1.00 . A A . 25 LYS HG2 1 1 19 8210 1 1 25 LYS HG3 H 17.376 6.221 -2.633 1.00 . A A . 25 LYS HG3 1 1 19 8211 1 1 25 LYS HZ1 H 17.953 3.649 -0.920 1.00 . A A . 25 LYS HZ1 1 1 19 8212 1 1 25 LYS HZ2 H 17.536 5.300 -0.916 1.00 . A A . 25 LYS HZ2 1 1 19 8213 1 1 25 LYS HZ3 H 18.673 4.713 0.200 1.00 . A A . 25 LYS HZ3 1 1 19 8214 1 1 25 LYS N N 15.545 2.232 -3.897 1.00 . A A . 25 LYS N 1 1 19 8215 1 1 25 LYS NZ N 18.309 4.621 -0.772 1.00 . A A . 25 LYS NZ 1 1 19 8216 1 1 25 LYS O O 17.571 2.406 -1.374 1.00 . A A . 25 LYS O 1 1 19 8217 1 1 26 ALA C C 20.577 0.868 -2.218 1.00 . A A . 26 ALA C 1 1 19 8218 1 1 26 ALA CA C 19.153 0.326 -2.276 1.00 . A A . 26 ALA CA 1 1 19 8219 1 1 26 ALA CB C 19.173 -1.094 -2.840 1.00 . A A . 26 ALA CB 1 1 19 8220 1 1 26 ALA H H 18.285 1.031 -4.077 1.00 . A A . 26 ALA H 1 1 19 8221 1 1 26 ALA HA H 18.745 0.299 -1.276 1.00 . A A . 26 ALA HA 1 1 19 8222 1 1 26 ALA HB1 H 18.175 -1.504 -2.821 1.00 . A A . 26 ALA HB1 1 1 19 8223 1 1 26 ALA HB2 H 19.826 -1.709 -2.237 1.00 . A A . 26 ALA HB2 1 1 19 8224 1 1 26 ALA HB3 H 19.530 -1.072 -3.855 1.00 . A A . 26 ALA HB3 1 1 19 8225 1 1 26 ALA N N 18.313 1.177 -3.108 1.00 . A A . 26 ALA N 1 1 19 8226 1 1 26 ALA O O 20.819 1.910 -2.792 1.00 . A A . 26 ALA O 1 1 19 8227 1 1 26 ALA OXT O 21.409 0.230 -1.606 1.00 . A A . 26 ALA OXT 1 1 20 8228 1 1 1 LYS C C -19.767 -0.339 1.386 1.00 . A A . 1 LYS C 1 1 20 8229 1 1 1 LYS CA C -19.975 0.240 2.770 1.00 . A A . 1 LYS CA 1 1 20 8230 1 1 1 LYS CB C -19.766 1.758 2.729 1.00 . A A . 1 LYS CB 1 1 20 8231 1 1 1 LYS CD C -20.480 3.905 3.794 1.00 . A A . 1 LYS CD 1 1 20 8232 1 1 1 LYS CE C -20.364 4.630 5.139 1.00 . A A . 1 LYS CE 1 1 20 8233 1 1 1 LYS CG C -20.316 2.396 4.008 1.00 . A A . 1 LYS CG 1 1 20 8234 1 1 1 LYS H1 H -19.230 -1.384 3.829 1.00 . A A . 1 LYS H1 1 1 20 8235 1 1 1 LYS H2 H -19.032 0.106 4.612 1.00 . A A . 1 LYS H2 1 1 20 8236 1 1 1 LYS H3 H -18.040 -0.300 3.297 1.00 . A A . 1 LYS H3 1 1 20 8237 1 1 1 LYS HA H -20.977 0.019 3.103 1.00 . A A . 1 LYS HA 1 1 20 8238 1 1 1 LYS HB2 H -18.710 1.975 2.646 1.00 . A A . 1 LYS HB2 1 1 20 8239 1 1 1 LYS HB3 H -20.283 2.168 1.874 1.00 . A A . 1 LYS HB3 1 1 20 8240 1 1 1 LYS HD2 H -19.709 4.258 3.124 1.00 . A A . 1 LYS HD2 1 1 20 8241 1 1 1 LYS HD3 H -21.450 4.104 3.363 1.00 . A A . 1 LYS HD3 1 1 20 8242 1 1 1 LYS HE2 H -19.414 4.395 5.596 1.00 . A A . 1 LYS HE2 1 1 20 8243 1 1 1 LYS HE3 H -20.431 5.696 4.984 1.00 . A A . 1 LYS HE3 1 1 20 8244 1 1 1 LYS HG2 H -21.275 1.958 4.245 1.00 . A A . 1 LYS HG2 1 1 20 8245 1 1 1 LYS HG3 H -19.628 2.221 4.821 1.00 . A A . 1 LYS HG3 1 1 20 8246 1 1 1 LYS HZ1 H -21.093 3.547 6.766 1.00 . A A . 1 LYS HZ1 1 1 20 8247 1 1 1 LYS HZ2 H -22.192 3.686 5.481 1.00 . A A . 1 LYS HZ2 1 1 20 8248 1 1 1 LYS HZ3 H -21.901 5.015 6.491 1.00 . A A . 1 LYS HZ3 1 1 20 8249 1 1 1 LYS N N -18.995 -0.380 3.696 1.00 . A A . 1 LYS N 1 1 20 8250 1 1 1 LYS NZ N -21.469 4.187 6.034 1.00 . A A . 1 LYS NZ 1 1 20 8251 1 1 1 LYS O O -18.673 -0.798 1.054 1.00 . A A . 1 LYS O 1 1 20 8252 1 1 2 LYS C C -20.018 0.172 -1.675 1.00 . A A . 2 LYS C 1 1 20 8253 1 1 2 LYS CA C -20.726 -0.832 -0.773 1.00 . A A . 2 LYS CA 1 1 20 8254 1 1 2 LYS CB C -22.124 -1.138 -1.311 1.00 . A A . 2 LYS CB 1 1 20 8255 1 1 2 LYS CD C -23.574 -3.181 -1.183 1.00 . A A . 2 LYS CD 1 1 20 8256 1 1 2 LYS CE C -24.955 -2.644 -1.556 1.00 . A A . 2 LYS CE 1 1 20 8257 1 1 2 LYS CG C -22.816 -2.128 -0.368 1.00 . A A . 2 LYS CG 1 1 20 8258 1 1 2 LYS H H -21.660 0.078 0.893 1.00 . A A . 2 LYS H 1 1 20 8259 1 1 2 LYS HA H -20.154 -1.745 -0.751 1.00 . A A . 2 LYS HA 1 1 20 8260 1 1 2 LYS HB2 H -22.697 -0.226 -1.366 1.00 . A A . 2 LYS HB2 1 1 20 8261 1 1 2 LYS HB3 H -22.041 -1.573 -2.295 1.00 . A A . 2 LYS HB3 1 1 20 8262 1 1 2 LYS HD2 H -23.021 -3.407 -2.084 1.00 . A A . 2 LYS HD2 1 1 20 8263 1 1 2 LYS HD3 H -23.686 -4.082 -0.595 1.00 . A A . 2 LYS HD3 1 1 20 8264 1 1 2 LYS HE2 H -24.842 -1.799 -2.219 1.00 . A A . 2 LYS HE2 1 1 20 8265 1 1 2 LYS HE3 H -25.521 -3.418 -2.053 1.00 . A A . 2 LYS HE3 1 1 20 8266 1 1 2 LYS HG2 H -22.072 -2.617 0.247 1.00 . A A . 2 LYS HG2 1 1 20 8267 1 1 2 LYS HG3 H -23.508 -1.596 0.268 1.00 . A A . 2 LYS HG3 1 1 20 8268 1 1 2 LYS HZ1 H -25.662 -1.177 -0.257 1.00 . A A . 2 LYS HZ1 1 1 20 8269 1 1 2 LYS HZ2 H -25.219 -2.621 0.514 1.00 . A A . 2 LYS HZ2 1 1 20 8270 1 1 2 LYS HZ3 H -26.661 -2.544 -0.372 1.00 . A A . 2 LYS HZ3 1 1 20 8271 1 1 2 LYS N N -20.816 -0.308 0.577 1.00 . A A . 2 LYS N 1 1 20 8272 1 1 2 LYS NZ N -25.676 -2.215 -0.325 1.00 . A A . 2 LYS NZ 1 1 20 8273 1 1 2 LYS O O -19.390 1.115 -1.185 1.00 . A A . 2 LYS O 1 1 20 8274 1 1 3 ALA C C -18.030 1.143 -3.480 1.00 . A A . 3 ALA C 1 1 20 8275 1 1 3 ALA CA C -19.456 0.864 -3.938 1.00 . A A . 3 ALA CA 1 1 20 8276 1 1 3 ALA CB C -20.230 2.182 -4.049 1.00 . A A . 3 ALA CB 1 1 20 8277 1 1 3 ALA H H -20.621 -0.806 -3.320 1.00 . A A . 3 ALA H 1 1 20 8278 1 1 3 ALA HA H -19.427 0.390 -4.909 1.00 . A A . 3 ALA HA 1 1 20 8279 1 1 3 ALA HB1 H -20.598 2.469 -3.075 1.00 . A A . 3 ALA HB1 1 1 20 8280 1 1 3 ALA HB2 H -21.061 2.059 -4.725 1.00 . A A . 3 ALA HB2 1 1 20 8281 1 1 3 ALA HB3 H -19.575 2.954 -4.424 1.00 . A A . 3 ALA HB3 1 1 20 8282 1 1 3 ALA N N -20.110 -0.034 -2.986 1.00 . A A . 3 ALA N 1 1 20 8283 1 1 3 ALA O O -17.546 2.273 -3.562 1.00 . A A . 3 ALA O 1 1 20 8284 1 1 4 LEU C C -15.008 0.092 -3.612 1.00 . A A . 4 LEU C 1 1 20 8285 1 1 4 LEU CA C -16.018 0.241 -2.481 1.00 . A A . 4 LEU CA 1 1 20 8286 1 1 4 LEU CB C -15.750 -0.829 -1.419 1.00 . A A . 4 LEU CB 1 1 20 8287 1 1 4 LEU CD1 C -15.662 0.308 0.807 1.00 . A A . 4 LEU CD1 1 1 20 8288 1 1 4 LEU CD2 C -13.923 -1.382 0.202 1.00 . A A . 4 LEU CD2 1 1 20 8289 1 1 4 LEU CG C -14.825 -0.265 -0.338 1.00 . A A . 4 LEU CG 1 1 20 8290 1 1 4 LEU H H -17.826 -0.764 -2.924 1.00 . A A . 4 LEU H 1 1 20 8291 1 1 4 LEU HA H -15.902 1.215 -2.032 1.00 . A A . 4 LEU HA 1 1 20 8292 1 1 4 LEU HB2 H -16.686 -1.137 -0.969 1.00 . A A . 4 LEU HB2 1 1 20 8293 1 1 4 LEU HB3 H -15.278 -1.683 -1.884 1.00 . A A . 4 LEU HB3 1 1 20 8294 1 1 4 LEU HD11 H -16.472 0.906 0.412 1.00 . A A . 4 LEU HD11 1 1 20 8295 1 1 4 LEU HD12 H -15.034 0.924 1.434 1.00 . A A . 4 LEU HD12 1 1 20 8296 1 1 4 LEU HD13 H -16.068 -0.500 1.394 1.00 . A A . 4 LEU HD13 1 1 20 8297 1 1 4 LEU HD21 H -13.884 -1.325 1.280 1.00 . A A . 4 LEU HD21 1 1 20 8298 1 1 4 LEU HD22 H -12.926 -1.271 -0.202 1.00 . A A . 4 LEU HD22 1 1 20 8299 1 1 4 LEU HD23 H -14.323 -2.341 -0.089 1.00 . A A . 4 LEU HD23 1 1 20 8300 1 1 4 LEU HG H -14.215 0.519 -0.761 1.00 . A A . 4 LEU HG 1 1 20 8301 1 1 4 LEU N N -17.378 0.108 -2.977 1.00 . A A . 4 LEU N 1 1 20 8302 1 1 4 LEU O O -15.335 -0.397 -4.699 1.00 . A A . 4 LEU O 1 1 20 8303 1 1 5 LEU C C -11.602 -0.490 -3.747 1.00 . A A . 5 LEU C 1 1 20 8304 1 1 5 LEU CA C -12.696 0.407 -4.307 1.00 . A A . 5 LEU CA 1 1 20 8305 1 1 5 LEU CB C -12.122 1.801 -4.591 1.00 . A A . 5 LEU CB 1 1 20 8306 1 1 5 LEU CD1 C -11.668 1.291 -7.008 1.00 . A A . 5 LEU CD1 1 1 20 8307 1 1 5 LEU CD2 C -13.919 2.144 -6.313 1.00 . A A . 5 LEU CD2 1 1 20 8308 1 1 5 LEU CG C -12.413 2.216 -6.040 1.00 . A A . 5 LEU CG 1 1 20 8309 1 1 5 LEU H H -13.579 0.868 -2.447 1.00 . A A . 5 LEU H 1 1 20 8310 1 1 5 LEU HA H -13.073 -0.022 -5.225 1.00 . A A . 5 LEU HA 1 1 20 8311 1 1 5 LEU HB2 H -12.573 2.515 -3.917 1.00 . A A . 5 LEU HB2 1 1 20 8312 1 1 5 LEU HB3 H -11.052 1.789 -4.431 1.00 . A A . 5 LEU HB3 1 1 20 8313 1 1 5 LEU HD11 H -10.621 1.264 -6.747 1.00 . A A . 5 LEU HD11 1 1 20 8314 1 1 5 LEU HD12 H -11.776 1.667 -8.014 1.00 . A A . 5 LEU HD12 1 1 20 8315 1 1 5 LEU HD13 H -12.079 0.295 -6.954 1.00 . A A . 5 LEU HD13 1 1 20 8316 1 1 5 LEU HD21 H -14.186 1.144 -6.610 1.00 . A A . 5 LEU HD21 1 1 20 8317 1 1 5 LEU HD22 H -14.173 2.834 -7.105 1.00 . A A . 5 LEU HD22 1 1 20 8318 1 1 5 LEU HD23 H -14.462 2.413 -5.416 1.00 . A A . 5 LEU HD23 1 1 20 8319 1 1 5 LEU HG H -12.074 3.231 -6.191 1.00 . A A . 5 LEU HG 1 1 20 8320 1 1 5 LEU N N -13.775 0.501 -3.336 1.00 . A A . 5 LEU N 1 1 20 8321 1 1 5 LEU O O -11.723 -0.996 -2.633 1.00 . A A . 5 LEU O 1 1 20 8322 1 1 6 ALA C C -8.670 -0.793 -2.926 1.00 . A A . 6 ALA C 1 1 20 8323 1 1 6 ALA CA C -9.419 -1.499 -4.051 1.00 . A A . 6 ALA CA 1 1 20 8324 1 1 6 ALA CB C -8.465 -1.774 -5.211 1.00 . A A . 6 ALA CB 1 1 20 8325 1 1 6 ALA H H -10.477 -0.232 -5.379 1.00 . A A . 6 ALA H 1 1 20 8326 1 1 6 ALA HA H -9.806 -2.437 -3.683 1.00 . A A . 6 ALA HA 1 1 20 8327 1 1 6 ALA HB1 H -7.697 -2.463 -4.891 1.00 . A A . 6 ALA HB1 1 1 20 8328 1 1 6 ALA HB2 H -8.009 -0.847 -5.525 1.00 . A A . 6 ALA HB2 1 1 20 8329 1 1 6 ALA HB3 H -9.015 -2.202 -6.034 1.00 . A A . 6 ALA HB3 1 1 20 8330 1 1 6 ALA N N -10.530 -0.670 -4.504 1.00 . A A . 6 ALA N 1 1 20 8331 1 1 6 ALA O O -7.444 -0.697 -2.949 1.00 . A A . 6 ALA O 1 1 20 8332 1 1 7 LEU C C -7.729 -0.368 -0.172 1.00 . A A . 7 LEU C 1 1 20 8333 1 1 7 LEU CA C -8.863 0.424 -0.812 1.00 . A A . 7 LEU CA 1 1 20 8334 1 1 7 LEU CB C -9.955 0.688 0.237 1.00 . A A . 7 LEU CB 1 1 20 8335 1 1 7 LEU CD1 C -12.171 1.766 0.644 1.00 . A A . 7 LEU CD1 1 1 20 8336 1 1 7 LEU CD2 C -10.330 3.066 -0.428 1.00 . A A . 7 LEU CD2 1 1 20 8337 1 1 7 LEU CG C -10.977 1.685 -0.312 1.00 . A A . 7 LEU CG 1 1 20 8338 1 1 7 LEU H H -10.401 -0.407 -2.011 1.00 . A A . 7 LEU H 1 1 20 8339 1 1 7 LEU HA H -8.475 1.371 -1.152 1.00 . A A . 7 LEU HA 1 1 20 8340 1 1 7 LEU HB2 H -10.455 -0.239 0.485 1.00 . A A . 7 LEU HB2 1 1 20 8341 1 1 7 LEU HB3 H -9.503 1.099 1.128 1.00 . A A . 7 LEU HB3 1 1 20 8342 1 1 7 LEU HD11 H -12.946 2.379 0.205 1.00 . A A . 7 LEU HD11 1 1 20 8343 1 1 7 LEU HD12 H -11.855 2.203 1.575 1.00 . A A . 7 LEU HD12 1 1 20 8344 1 1 7 LEU HD13 H -12.554 0.772 0.827 1.00 . A A . 7 LEU HD13 1 1 20 8345 1 1 7 LEU HD21 H -9.807 3.142 -1.366 1.00 . A A . 7 LEU HD21 1 1 20 8346 1 1 7 LEU HD22 H -9.631 3.205 0.382 1.00 . A A . 7 LEU HD22 1 1 20 8347 1 1 7 LEU HD23 H -11.094 3.828 -0.376 1.00 . A A . 7 LEU HD23 1 1 20 8348 1 1 7 LEU HG H -11.315 1.356 -1.285 1.00 . A A . 7 LEU HG 1 1 20 8349 1 1 7 LEU N N -9.429 -0.293 -1.954 1.00 . A A . 7 LEU N 1 1 20 8350 1 1 7 LEU O O -6.565 -0.186 -0.521 1.00 . A A . 7 LEU O 1 1 20 8351 1 1 8 ALA C C -6.022 -2.567 0.565 1.00 . A A . 8 ALA C 1 1 20 8352 1 1 8 ALA CA C -7.110 -2.061 1.492 1.00 . A A . 8 ALA CA 1 1 20 8353 1 1 8 ALA CB C -7.811 -3.254 2.147 1.00 . A A . 8 ALA CB 1 1 20 8354 1 1 8 ALA H H -9.035 -1.317 1.002 1.00 . A A . 8 ALA H 1 1 20 8355 1 1 8 ALA HA H -6.652 -1.462 2.256 1.00 . A A . 8 ALA HA 1 1 20 8356 1 1 8 ALA HB1 H -8.028 -4.001 1.398 1.00 . A A . 8 ALA HB1 1 1 20 8357 1 1 8 ALA HB2 H -8.733 -2.924 2.603 1.00 . A A . 8 ALA HB2 1 1 20 8358 1 1 8 ALA HB3 H -7.168 -3.678 2.900 1.00 . A A . 8 ALA HB3 1 1 20 8359 1 1 8 ALA N N -8.088 -1.238 0.773 1.00 . A A . 8 ALA N 1 1 20 8360 1 1 8 ALA O O -4.883 -2.790 0.979 1.00 . A A . 8 ALA O 1 1 20 8361 1 1 9 LEU C C -4.467 -2.070 -2.023 1.00 . A A . 9 LEU C 1 1 20 8362 1 1 9 LEU CA C -5.427 -3.187 -1.678 1.00 . A A . 9 LEU CA 1 1 20 8363 1 1 9 LEU CB C -6.173 -3.588 -2.937 1.00 . A A . 9 LEU CB 1 1 20 8364 1 1 9 LEU CD1 C -7.258 -5.657 -2.042 1.00 . A A . 9 LEU CD1 1 1 20 8365 1 1 9 LEU CD2 C -6.674 -5.515 -4.456 1.00 . A A . 9 LEU CD2 1 1 20 8366 1 1 9 LEU CG C -6.238 -5.114 -3.046 1.00 . A A . 9 LEU CG 1 1 20 8367 1 1 9 LEU H H -7.296 -2.519 -0.948 1.00 . A A . 9 LEU H 1 1 20 8368 1 1 9 LEU HA H -4.876 -4.026 -1.300 1.00 . A A . 9 LEU HA 1 1 20 8369 1 1 9 LEU HB2 H -7.171 -3.176 -2.895 1.00 . A A . 9 LEU HB2 1 1 20 8370 1 1 9 LEU HB3 H -5.653 -3.183 -3.791 1.00 . A A . 9 LEU HB3 1 1 20 8371 1 1 9 LEU HD11 H -7.246 -6.738 -2.062 1.00 . A A . 9 LEU HD11 1 1 20 8372 1 1 9 LEU HD12 H -8.242 -5.309 -2.309 1.00 . A A . 9 LEU HD12 1 1 20 8373 1 1 9 LEU HD13 H -7.014 -5.311 -1.049 1.00 . A A . 9 LEU HD13 1 1 20 8374 1 1 9 LEU HD21 H -6.008 -5.074 -5.184 1.00 . A A . 9 LEU HD21 1 1 20 8375 1 1 9 LEU HD22 H -7.679 -5.166 -4.632 1.00 . A A . 9 LEU HD22 1 1 20 8376 1 1 9 LEU HD23 H -6.646 -6.592 -4.546 1.00 . A A . 9 LEU HD23 1 1 20 8377 1 1 9 LEU HG H -5.262 -5.535 -2.833 1.00 . A A . 9 LEU HG 1 1 20 8378 1 1 9 LEU N N -6.376 -2.725 -0.684 1.00 . A A . 9 LEU N 1 1 20 8379 1 1 9 LEU O O -3.277 -2.120 -1.699 1.00 . A A . 9 LEU O 1 1 20 8380 1 1 10 HIS C C -3.495 0.588 -1.807 1.00 . A A . 10 HIS C 1 1 20 8381 1 1 10 HIS CA C -4.214 0.103 -3.039 1.00 . A A . 10 HIS CA 1 1 20 8382 1 1 10 HIS CB C -5.112 1.217 -3.561 1.00 . A A . 10 HIS CB 1 1 20 8383 1 1 10 HIS CD2 C -5.535 -0.279 -5.677 1.00 . A A . 10 HIS CD2 1 1 20 8384 1 1 10 HIS CE1 C -6.481 1.211 -6.935 1.00 . A A . 10 HIS CE1 1 1 20 8385 1 1 10 HIS CG C -5.576 0.885 -4.953 1.00 . A A . 10 HIS CG 1 1 20 8386 1 1 10 HIS H H -5.974 -1.074 -2.855 1.00 . A A . 10 HIS H 1 1 20 8387 1 1 10 HIS HA H -3.498 -0.177 -3.793 1.00 . A A . 10 HIS HA 1 1 20 8388 1 1 10 HIS HB2 H -5.969 1.324 -2.915 1.00 . A A . 10 HIS HB2 1 1 20 8389 1 1 10 HIS HB3 H -4.554 2.134 -3.572 1.00 . A A . 10 HIS HB3 1 1 20 8390 1 1 10 HIS HD1 H -6.395 2.754 -5.537 1.00 . A A . 10 HIS HD1 1 1 20 8391 1 1 10 HIS HD2 H -5.131 -1.215 -5.325 1.00 . A A . 10 HIS HD2 1 1 20 8392 1 1 10 HIS HE1 H -6.954 1.701 -7.775 1.00 . A A . 10 HIS HE1 1 1 20 8393 1 1 10 HIS HE2 H -6.235 -0.733 -7.641 1.00 . A A . 10 HIS HE2 1 1 20 8394 1 1 10 HIS N N -5.010 -1.053 -2.659 1.00 . A A . 10 HIS N 1 1 20 8395 1 1 10 HIS ND1 N -6.187 1.822 -5.774 1.00 . A A . 10 HIS ND1 1 1 20 8396 1 1 10 HIS NE2 N -6.109 -0.073 -6.928 1.00 . A A . 10 HIS NE2 1 1 20 8397 1 1 10 HIS O O -2.326 0.958 -1.834 1.00 . A A . 10 HIS O 1 1 20 8398 1 1 11 HIS C C -2.369 0.297 0.795 1.00 . A A . 11 HIS C 1 1 20 8399 1 1 11 HIS CA C -3.738 0.904 0.578 1.00 . A A . 11 HIS CA 1 1 20 8400 1 1 11 HIS CB C -4.701 0.333 1.603 1.00 . A A . 11 HIS CB 1 1 20 8401 1 1 11 HIS CD2 C -6.439 2.263 1.263 1.00 . A A . 11 HIS CD2 1 1 20 8402 1 1 11 HIS CE1 C -6.878 2.673 3.341 1.00 . A A . 11 HIS CE1 1 1 20 8403 1 1 11 HIS CG C -5.685 1.391 2.007 1.00 . A A . 11 HIS CG 1 1 20 8404 1 1 11 HIS H H -5.154 0.195 -0.802 1.00 . A A . 11 HIS H 1 1 20 8405 1 1 11 HIS HA H -3.691 1.971 0.672 1.00 . A A . 11 HIS HA 1 1 20 8406 1 1 11 HIS HB2 H -5.227 -0.507 1.151 1.00 . A A . 11 HIS HB2 1 1 20 8407 1 1 11 HIS HB3 H -4.145 -0.007 2.462 1.00 . A A . 11 HIS HB3 1 1 20 8408 1 1 11 HIS HD1 H -5.604 1.221 4.116 1.00 . A A . 11 HIS HD1 1 1 20 8409 1 1 11 HIS HD2 H -6.457 2.307 0.181 1.00 . A A . 11 HIS HD2 1 1 20 8410 1 1 11 HIS HE1 H -7.296 3.104 4.238 1.00 . A A . 11 HIS HE1 1 1 20 8411 1 1 11 HIS HE2 H -7.793 3.804 1.844 1.00 . A A . 11 HIS HE2 1 1 20 8412 1 1 11 HIS N N -4.232 0.530 -0.724 1.00 . A A . 11 HIS N 1 1 20 8413 1 1 11 HIS ND1 N -5.983 1.667 3.330 1.00 . A A . 11 HIS ND1 1 1 20 8414 1 1 11 HIS NE2 N -7.189 3.074 2.104 1.00 . A A . 11 HIS NE2 1 1 20 8415 1 1 11 HIS O O -1.451 0.935 1.312 1.00 . A A . 11 HIS O 1 1 20 8416 1 1 12 LEU C C -0.106 -1.270 -0.656 1.00 . A A . 12 LEU C 1 1 20 8417 1 1 12 LEU CA C -0.994 -1.662 0.490 1.00 . A A . 12 LEU CA 1 1 20 8418 1 1 12 LEU CB C -1.232 -3.175 0.465 1.00 . A A . 12 LEU CB 1 1 20 8419 1 1 12 LEU CD1 C 0.319 -3.610 2.384 1.00 . A A . 12 LEU CD1 1 1 20 8420 1 1 12 LEU CD2 C -2.057 -2.971 2.825 1.00 . A A . 12 LEU CD2 1 1 20 8421 1 1 12 LEU CG C -1.121 -3.742 1.883 1.00 . A A . 12 LEU CG 1 1 20 8422 1 1 12 LEU H H -3.024 -1.380 -0.056 1.00 . A A . 12 LEU H 1 1 20 8423 1 1 12 LEU HA H -0.516 -1.385 1.417 1.00 . A A . 12 LEU HA 1 1 20 8424 1 1 12 LEU HB2 H -2.216 -3.377 0.071 1.00 . A A . 12 LEU HB2 1 1 20 8425 1 1 12 LEU HB3 H -0.491 -3.647 -0.165 1.00 . A A . 12 LEU HB3 1 1 20 8426 1 1 12 LEU HD11 H 0.494 -4.335 3.164 1.00 . A A . 12 LEU HD11 1 1 20 8427 1 1 12 LEU HD12 H 0.474 -2.616 2.773 1.00 . A A . 12 LEU HD12 1 1 20 8428 1 1 12 LEU HD13 H 1.003 -3.790 1.571 1.00 . A A . 12 LEU HD13 1 1 20 8429 1 1 12 LEU HD21 H -2.409 -3.632 3.600 1.00 . A A . 12 LEU HD21 1 1 20 8430 1 1 12 LEU HD22 H -2.900 -2.591 2.268 1.00 . A A . 12 LEU HD22 1 1 20 8431 1 1 12 LEU HD23 H -1.521 -2.144 3.271 1.00 . A A . 12 LEU HD23 1 1 20 8432 1 1 12 LEU HG H -1.398 -4.784 1.870 1.00 . A A . 12 LEU HG 1 1 20 8433 1 1 12 LEU N N -2.249 -0.945 0.369 1.00 . A A . 12 LEU N 1 1 20 8434 1 1 12 LEU O O 1.077 -0.992 -0.481 1.00 . A A . 12 LEU O 1 1 20 8435 1 1 13 ALA C C 0.663 0.542 -2.742 1.00 . A A . 13 ALA C 1 1 20 8436 1 1 13 ALA CA C 0.019 -0.805 -3.018 1.00 . A A . 13 ALA CA 1 1 20 8437 1 1 13 ALA CB C -0.924 -0.700 -4.221 1.00 . A A . 13 ALA CB 1 1 20 8438 1 1 13 ALA H H -1.671 -1.419 -1.869 1.00 . A A . 13 ALA H 1 1 20 8439 1 1 13 ALA HA H 0.789 -1.530 -3.227 1.00 . A A . 13 ALA HA 1 1 20 8440 1 1 13 ALA HB1 H -0.409 -1.031 -5.110 1.00 . A A . 13 ALA HB1 1 1 20 8441 1 1 13 ALA HB2 H -1.235 0.326 -4.349 1.00 . A A . 13 ALA HB2 1 1 20 8442 1 1 13 ALA HB3 H -1.790 -1.322 -4.056 1.00 . A A . 13 ALA HB3 1 1 20 8443 1 1 13 ALA N N -0.708 -1.210 -1.823 1.00 . A A . 13 ALA N 1 1 20 8444 1 1 13 ALA O O 1.724 0.874 -3.273 1.00 . A A . 13 ALA O 1 1 20 8445 1 1 14 HIS C C 1.655 2.459 -0.559 1.00 . A A . 14 HIS C 1 1 20 8446 1 1 14 HIS CA C 0.470 2.613 -1.489 1.00 . A A . 14 HIS CA 1 1 20 8447 1 1 14 HIS CB C -0.672 3.353 -0.803 1.00 . A A . 14 HIS CB 1 1 20 8448 1 1 14 HIS CD2 C -0.334 4.339 1.602 1.00 . A A . 14 HIS CD2 1 1 20 8449 1 1 14 HIS CE1 C 0.958 6.002 1.092 1.00 . A A . 14 HIS CE1 1 1 20 8450 1 1 14 HIS CG C -0.153 4.300 0.244 1.00 . A A . 14 HIS CG 1 1 20 8451 1 1 14 HIS H H -0.839 0.958 -1.506 1.00 . A A . 14 HIS H 1 1 20 8452 1 1 14 HIS HA H 0.773 3.158 -2.361 1.00 . A A . 14 HIS HA 1 1 20 8453 1 1 14 HIS HB2 H -1.204 3.899 -1.544 1.00 . A A . 14 HIS HB2 1 1 20 8454 1 1 14 HIS HB3 H -1.335 2.637 -0.342 1.00 . A A . 14 HIS HB3 1 1 20 8455 1 1 14 HIS HD1 H 0.988 5.621 -0.958 1.00 . A A . 14 HIS HD1 1 1 20 8456 1 1 14 HIS HD2 H -0.947 3.645 2.169 1.00 . A A . 14 HIS HD2 1 1 20 8457 1 1 14 HIS HE1 H 1.573 6.886 1.159 1.00 . A A . 14 HIS HE1 1 1 20 8458 1 1 14 HIS HE2 H 0.449 5.663 3.090 1.00 . A A . 14 HIS HE2 1 1 20 8459 1 1 14 HIS N N 0.000 1.301 -1.888 1.00 . A A . 14 HIS N 1 1 20 8460 1 1 14 HIS ND1 N 0.669 5.370 -0.063 1.00 . A A . 14 HIS ND1 1 1 20 8461 1 1 14 HIS NE2 N 0.370 5.412 2.139 1.00 . A A . 14 HIS NE2 1 1 20 8462 1 1 14 HIS O O 2.732 3.012 -0.794 1.00 . A A . 14 HIS O 1 1 20 8463 1 1 15 LEU C C 3.668 0.827 0.574 1.00 . A A . 15 LEU C 1 1 20 8464 1 1 15 LEU CA C 2.551 1.383 1.395 1.00 . A A . 15 LEU CA 1 1 20 8465 1 1 15 LEU CB C 2.147 0.321 2.422 1.00 . A A . 15 LEU CB 1 1 20 8466 1 1 15 LEU CD1 C 0.899 2.316 3.324 1.00 . A A . 15 LEU CD1 1 1 20 8467 1 1 15 LEU CD2 C 0.360 0.024 4.110 1.00 . A A . 15 LEU CD2 1 1 20 8468 1 1 15 LEU CG C 1.486 0.943 3.654 1.00 . A A . 15 LEU CG 1 1 20 8469 1 1 15 LEU H H 0.607 1.208 0.582 1.00 . A A . 15 LEU H 1 1 20 8470 1 1 15 LEU HA H 2.864 2.288 1.879 1.00 . A A . 15 LEU HA 1 1 20 8471 1 1 15 LEU HB2 H 1.457 -0.371 1.959 1.00 . A A . 15 LEU HB2 1 1 20 8472 1 1 15 LEU HB3 H 3.029 -0.222 2.732 1.00 . A A . 15 LEU HB3 1 1 20 8473 1 1 15 LEU HD11 H 0.218 2.615 4.110 1.00 . A A . 15 LEU HD11 1 1 20 8474 1 1 15 LEU HD12 H 0.362 2.258 2.391 1.00 . A A . 15 LEU HD12 1 1 20 8475 1 1 15 LEU HD13 H 1.691 3.044 3.243 1.00 . A A . 15 LEU HD13 1 1 20 8476 1 1 15 LEU HD21 H 0.715 -0.997 4.133 1.00 . A A . 15 LEU HD21 1 1 20 8477 1 1 15 LEU HD22 H -0.466 0.101 3.416 1.00 . A A . 15 LEU HD22 1 1 20 8478 1 1 15 LEU HD23 H 0.034 0.317 5.094 1.00 . A A . 15 LEU HD23 1 1 20 8479 1 1 15 LEU HG H 2.213 1.040 4.441 1.00 . A A . 15 LEU HG 1 1 20 8480 1 1 15 LEU N N 1.469 1.655 0.471 1.00 . A A . 15 LEU N 1 1 20 8481 1 1 15 LEU O O 4.846 1.099 0.794 1.00 . A A . 15 LEU O 1 1 20 8482 1 1 16 ALA C C 4.872 0.470 -2.139 1.00 . A A . 16 ALA C 1 1 20 8483 1 1 16 ALA CA C 4.170 -0.588 -1.313 1.00 . A A . 16 ALA CA 1 1 20 8484 1 1 16 ALA CB C 3.432 -1.557 -2.238 1.00 . A A . 16 ALA CB 1 1 20 8485 1 1 16 ALA H H 2.264 -0.092 -0.493 1.00 . A A . 16 ALA H 1 1 20 8486 1 1 16 ALA HA H 4.900 -1.134 -0.746 1.00 . A A . 16 ALA HA 1 1 20 8487 1 1 16 ALA HB1 H 2.867 -0.997 -2.965 1.00 . A A . 16 ALA HB1 1 1 20 8488 1 1 16 ALA HB2 H 2.765 -2.175 -1.657 1.00 . A A . 16 ALA HB2 1 1 20 8489 1 1 16 ALA HB3 H 4.152 -2.182 -2.745 1.00 . A A . 16 ALA HB3 1 1 20 8490 1 1 16 ALA N N 3.245 0.046 -0.394 1.00 . A A . 16 ALA N 1 1 20 8491 1 1 16 ALA O O 6.022 0.309 -2.532 1.00 . A A . 16 ALA O 1 1 20 8492 1 1 17 LEU C C 5.977 3.178 -2.549 1.00 . A A . 17 LEU C 1 1 20 8493 1 1 17 LEU CA C 4.720 2.639 -3.191 1.00 . A A . 17 LEU CA 1 1 20 8494 1 1 17 LEU CB C 3.660 3.740 -3.382 1.00 . A A . 17 LEU CB 1 1 20 8495 1 1 17 LEU CD1 C 5.205 5.732 -3.367 1.00 . A A . 17 LEU CD1 1 1 20 8496 1 1 17 LEU CD2 C 2.830 5.989 -2.651 1.00 . A A . 17 LEU CD2 1 1 20 8497 1 1 17 LEU CG C 4.036 5.045 -2.651 1.00 . A A . 17 LEU CG 1 1 20 8498 1 1 17 LEU H H 3.252 1.621 -2.062 1.00 . A A . 17 LEU H 1 1 20 8499 1 1 17 LEU HA H 4.989 2.244 -4.149 1.00 . A A . 17 LEU HA 1 1 20 8500 1 1 17 LEU HB2 H 3.557 3.944 -4.432 1.00 . A A . 17 LEU HB2 1 1 20 8501 1 1 17 LEU HB3 H 2.723 3.379 -2.997 1.00 . A A . 17 LEU HB3 1 1 20 8502 1 1 17 LEU HD11 H 4.889 6.704 -3.714 1.00 . A A . 17 LEU HD11 1 1 20 8503 1 1 17 LEU HD12 H 5.518 5.135 -4.211 1.00 . A A . 17 LEU HD12 1 1 20 8504 1 1 17 LEU HD13 H 6.031 5.848 -2.681 1.00 . A A . 17 LEU HD13 1 1 20 8505 1 1 17 LEU HD21 H 2.783 6.516 -3.595 1.00 . A A . 17 LEU HD21 1 1 20 8506 1 1 17 LEU HD22 H 2.933 6.705 -1.845 1.00 . A A . 17 LEU HD22 1 1 20 8507 1 1 17 LEU HD23 H 1.922 5.420 -2.513 1.00 . A A . 17 LEU HD23 1 1 20 8508 1 1 17 LEU HG H 4.313 4.825 -1.632 1.00 . A A . 17 LEU HG 1 1 20 8509 1 1 17 LEU N N 4.165 1.555 -2.401 1.00 . A A . 17 LEU N 1 1 20 8510 1 1 17 LEU O O 7.003 3.341 -3.217 1.00 . A A . 17 LEU O 1 1 20 8511 1 1 18 HIS C C 8.003 2.782 -0.276 1.00 . A A . 18 HIS C 1 1 20 8512 1 1 18 HIS CA C 7.099 3.939 -0.578 1.00 . A A . 18 HIS CA 1 1 20 8513 1 1 18 HIS CB C 6.744 4.718 0.675 1.00 . A A . 18 HIS CB 1 1 20 8514 1 1 18 HIS CD2 C 4.789 3.529 1.941 1.00 . A A . 18 HIS CD2 1 1 20 8515 1 1 18 HIS CE1 C 5.934 2.652 3.558 1.00 . A A . 18 HIS CE1 1 1 20 8516 1 1 18 HIS CG C 6.100 3.859 1.723 1.00 . A A . 18 HIS CG 1 1 20 8517 1 1 18 HIS H H 5.071 3.275 -0.769 1.00 . A A . 18 HIS H 1 1 20 8518 1 1 18 HIS HA H 7.620 4.597 -1.255 1.00 . A A . 18 HIS HA 1 1 20 8519 1 1 18 HIS HB2 H 7.637 5.162 1.078 1.00 . A A . 18 HIS HB2 1 1 20 8520 1 1 18 HIS HB3 H 6.061 5.479 0.394 1.00 . A A . 18 HIS HB3 1 1 20 8521 1 1 18 HIS HD1 H 7.792 3.349 2.900 1.00 . A A . 18 HIS HD1 1 1 20 8522 1 1 18 HIS HD2 H 3.963 3.807 1.295 1.00 . A A . 18 HIS HD2 1 1 20 8523 1 1 18 HIS HE1 H 6.209 2.104 4.449 1.00 . A A . 18 HIS HE1 1 1 20 8524 1 1 18 HIS HE2 H 3.863 2.406 3.510 1.00 . A A . 18 HIS HE2 1 1 20 8525 1 1 18 HIS N N 5.914 3.438 -1.260 1.00 . A A . 18 HIS N 1 1 20 8526 1 1 18 HIS ND1 N 6.816 3.291 2.763 1.00 . A A . 18 HIS ND1 1 1 20 8527 1 1 18 HIS NE2 N 4.682 2.769 3.105 1.00 . A A . 18 HIS NE2 1 1 20 8528 1 1 18 HIS O O 9.210 2.839 -0.510 1.00 . A A . 18 HIS O 1 1 20 8529 1 1 19 LEU C C 8.984 0.210 -0.782 1.00 . A A . 19 LEU C 1 1 20 8530 1 1 19 LEU CA C 8.142 0.486 0.438 1.00 . A A . 19 LEU CA 1 1 20 8531 1 1 19 LEU CB C 7.192 -0.695 0.645 1.00 . A A . 19 LEU CB 1 1 20 8532 1 1 19 LEU CD1 C 7.372 0.044 3.037 1.00 . A A . 19 LEU CD1 1 1 20 8533 1 1 19 LEU CD2 C 5.920 -1.888 2.410 1.00 . A A . 19 LEU CD2 1 1 20 8534 1 1 19 LEU CG C 7.223 -1.158 2.099 1.00 . A A . 19 LEU CG 1 1 20 8535 1 1 19 LEU H H 6.417 1.736 0.297 1.00 . A A . 19 LEU H 1 1 20 8536 1 1 19 LEU HA H 8.773 0.613 1.298 1.00 . A A . 19 LEU HA 1 1 20 8537 1 1 19 LEU HB2 H 6.194 -0.398 0.384 1.00 . A A . 19 LEU HB2 1 1 20 8538 1 1 19 LEU HB3 H 7.494 -1.514 0.006 1.00 . A A . 19 LEU HB3 1 1 20 8539 1 1 19 LEU HD11 H 7.017 0.933 2.535 1.00 . A A . 19 LEU HD11 1 1 20 8540 1 1 19 LEU HD12 H 8.411 0.167 3.302 1.00 . A A . 19 LEU HD12 1 1 20 8541 1 1 19 LEU HD13 H 6.790 -0.125 3.931 1.00 . A A . 19 LEU HD13 1 1 20 8542 1 1 19 LEU HD21 H 5.792 -2.706 1.714 1.00 . A A . 19 LEU HD21 1 1 20 8543 1 1 19 LEU HD22 H 5.093 -1.198 2.313 1.00 . A A . 19 LEU HD22 1 1 20 8544 1 1 19 LEU HD23 H 5.956 -2.271 3.417 1.00 . A A . 19 LEU HD23 1 1 20 8545 1 1 19 LEU HG H 8.056 -1.829 2.238 1.00 . A A . 19 LEU HG 1 1 20 8546 1 1 19 LEU N N 7.392 1.709 0.178 1.00 . A A . 19 LEU N 1 1 20 8547 1 1 19 LEU O O 10.102 -0.295 -0.695 1.00 . A A . 19 LEU O 1 1 20 8548 1 1 20 ALA C C 10.334 1.283 -3.213 1.00 . A A . 20 ALA C 1 1 20 8549 1 1 20 ALA CA C 9.116 0.397 -3.192 1.00 . A A . 20 ALA CA 1 1 20 8550 1 1 20 ALA CB C 8.213 0.742 -4.376 1.00 . A A . 20 ALA CB 1 1 20 8551 1 1 20 ALA H H 7.519 0.998 -1.898 1.00 . A A . 20 ALA H 1 1 20 8552 1 1 20 ALA HA H 9.433 -0.624 -3.275 1.00 . A A . 20 ALA HA 1 1 20 8553 1 1 20 ALA HB1 H 8.753 0.580 -5.297 1.00 . A A . 20 ALA HB1 1 1 20 8554 1 1 20 ALA HB2 H 7.916 1.775 -4.313 1.00 . A A . 20 ALA HB2 1 1 20 8555 1 1 20 ALA HB3 H 7.338 0.110 -4.358 1.00 . A A . 20 ALA HB3 1 1 20 8556 1 1 20 ALA N N 8.421 0.578 -1.922 1.00 . A A . 20 ALA N 1 1 20 8557 1 1 20 ALA O O 11.464 0.805 -3.273 1.00 . A A . 20 ALA O 1 1 20 8558 1 1 21 LEU C C 12.210 3.110 -2.074 1.00 . A A . 21 LEU C 1 1 20 8559 1 1 21 LEU CA C 11.192 3.536 -3.115 1.00 . A A . 21 LEU CA 1 1 20 8560 1 1 21 LEU CB C 10.669 4.935 -2.774 1.00 . A A . 21 LEU CB 1 1 20 8561 1 1 21 LEU CD1 C 9.255 6.837 -3.550 1.00 . A A . 21 LEU CD1 1 1 20 8562 1 1 21 LEU CD2 C 10.422 5.378 -5.215 1.00 . A A . 21 LEU CD2 1 1 20 8563 1 1 21 LEU CG C 9.705 5.409 -3.863 1.00 . A A . 21 LEU CG 1 1 20 8564 1 1 21 LEU H H 9.176 2.890 -3.069 1.00 . A A . 21 LEU H 1 1 20 8565 1 1 21 LEU HA H 11.666 3.554 -4.079 1.00 . A A . 21 LEU HA 1 1 20 8566 1 1 21 LEU HB2 H 10.155 4.903 -1.826 1.00 . A A . 21 LEU HB2 1 1 20 8567 1 1 21 LEU HB3 H 11.501 5.622 -2.709 1.00 . A A . 21 LEU HB3 1 1 20 8568 1 1 21 LEU HD11 H 8.177 6.894 -3.592 1.00 . A A . 21 LEU HD11 1 1 20 8569 1 1 21 LEU HD12 H 9.677 7.516 -4.275 1.00 . A A . 21 LEU HD12 1 1 20 8570 1 1 21 LEU HD13 H 9.594 7.112 -2.562 1.00 . A A . 21 LEU HD13 1 1 20 8571 1 1 21 LEU HD21 H 10.027 6.156 -5.850 1.00 . A A . 21 LEU HD21 1 1 20 8572 1 1 21 LEU HD22 H 10.270 4.416 -5.683 1.00 . A A . 21 LEU HD22 1 1 20 8573 1 1 21 LEU HD23 H 11.479 5.542 -5.066 1.00 . A A . 21 LEU HD23 1 1 20 8574 1 1 21 LEU HG H 8.843 4.757 -3.892 1.00 . A A . 21 LEU HG 1 1 20 8575 1 1 21 LEU N N 10.098 2.578 -3.134 1.00 . A A . 21 LEU N 1 1 20 8576 1 1 21 LEU O O 13.409 3.030 -2.348 1.00 . A A . 21 LEU O 1 1 20 8577 1 1 22 ALA C C 13.441 1.232 -0.215 1.00 . A A . 22 ALA C 1 1 20 8578 1 1 22 ALA CA C 12.564 2.395 0.217 1.00 . A A . 22 ALA CA 1 1 20 8579 1 1 22 ALA CB C 11.714 1.977 1.414 1.00 . A A . 22 ALA CB 1 1 20 8580 1 1 22 ALA H H 10.739 2.913 -0.750 1.00 . A A . 22 ALA H 1 1 20 8581 1 1 22 ALA HA H 13.197 3.215 0.504 1.00 . A A . 22 ALA HA 1 1 20 8582 1 1 22 ALA HB1 H 12.228 1.206 1.969 1.00 . A A . 22 ALA HB1 1 1 20 8583 1 1 22 ALA HB2 H 10.766 1.598 1.067 1.00 . A A . 22 ALA HB2 1 1 20 8584 1 1 22 ALA HB3 H 11.549 2.831 2.053 1.00 . A A . 22 ALA HB3 1 1 20 8585 1 1 22 ALA N N 11.710 2.829 -0.886 1.00 . A A . 22 ALA N 1 1 20 8586 1 1 22 ALA O O 14.605 1.137 0.172 1.00 . A A . 22 ALA O 1 1 20 8587 1 1 23 LEU C C 14.430 -0.389 -2.736 1.00 . A A . 23 LEU C 1 1 20 8588 1 1 23 LEU CA C 13.604 -0.799 -1.532 1.00 . A A . 23 LEU CA 1 1 20 8589 1 1 23 LEU CB C 12.633 -1.912 -1.942 1.00 . A A . 23 LEU CB 1 1 20 8590 1 1 23 LEU CD1 C 11.542 -2.634 0.189 1.00 . A A . 23 LEU CD1 1 1 20 8591 1 1 23 LEU CD2 C 12.231 -4.331 -1.498 1.00 . A A . 23 LEU CD2 1 1 20 8592 1 1 23 LEU CG C 12.595 -2.991 -0.862 1.00 . A A . 23 LEU CG 1 1 20 8593 1 1 23 LEU H H 11.942 0.497 -1.304 1.00 . A A . 23 LEU H 1 1 20 8594 1 1 23 LEU HA H 14.261 -1.164 -0.764 1.00 . A A . 23 LEU HA 1 1 20 8595 1 1 23 LEU HB2 H 11.642 -1.497 -2.070 1.00 . A A . 23 LEU HB2 1 1 20 8596 1 1 23 LEU HB3 H 12.961 -2.348 -2.874 1.00 . A A . 23 LEU HB3 1 1 20 8597 1 1 23 LEU HD11 H 11.585 -3.346 0.997 1.00 . A A . 23 LEU HD11 1 1 20 8598 1 1 23 LEU HD12 H 10.560 -2.662 -0.262 1.00 . A A . 23 LEU HD12 1 1 20 8599 1 1 23 LEU HD13 H 11.732 -1.641 0.570 1.00 . A A . 23 LEU HD13 1 1 20 8600 1 1 23 LEU HD21 H 12.310 -5.113 -0.759 1.00 . A A . 23 LEU HD21 1 1 20 8601 1 1 23 LEU HD22 H 12.904 -4.539 -2.319 1.00 . A A . 23 LEU HD22 1 1 20 8602 1 1 23 LEU HD23 H 11.217 -4.286 -1.868 1.00 . A A . 23 LEU HD23 1 1 20 8603 1 1 23 LEU HG H 13.563 -3.066 -0.391 1.00 . A A . 23 LEU HG 1 1 20 8604 1 1 23 LEU N N 12.872 0.357 -1.028 1.00 . A A . 23 LEU N 1 1 20 8605 1 1 23 LEU O O 15.642 -0.607 -2.784 1.00 . A A . 23 LEU O 1 1 20 8606 1 1 24 LYS C C 15.580 1.578 -4.591 1.00 . A A . 24 LYS C 1 1 20 8607 1 1 24 LYS CA C 14.412 0.661 -4.921 1.00 . A A . 24 LYS CA 1 1 20 8608 1 1 24 LYS CB C 13.408 1.412 -5.797 1.00 . A A . 24 LYS CB 1 1 20 8609 1 1 24 LYS CD C 12.894 0.863 -8.191 1.00 . A A . 24 LYS CD 1 1 20 8610 1 1 24 LYS CE C 14.391 0.897 -8.528 1.00 . A A . 24 LYS CE 1 1 20 8611 1 1 24 LYS CG C 12.693 0.430 -6.735 1.00 . A A . 24 LYS CG 1 1 20 8612 1 1 24 LYS H H 12.793 0.347 -3.586 1.00 . A A . 24 LYS H 1 1 20 8613 1 1 24 LYS HA H 14.782 -0.191 -5.461 1.00 . A A . 24 LYS HA 1 1 20 8614 1 1 24 LYS HB2 H 12.680 1.904 -5.164 1.00 . A A . 24 LYS HB2 1 1 20 8615 1 1 24 LYS HB3 H 13.930 2.155 -6.382 1.00 . A A . 24 LYS HB3 1 1 20 8616 1 1 24 LYS HD2 H 12.395 0.161 -8.844 1.00 . A A . 24 LYS HD2 1 1 20 8617 1 1 24 LYS HD3 H 12.475 1.846 -8.333 1.00 . A A . 24 LYS HD3 1 1 20 8618 1 1 24 LYS HE2 H 14.649 1.875 -8.907 1.00 . A A . 24 LYS HE2 1 1 20 8619 1 1 24 LYS HE3 H 14.971 0.697 -7.637 1.00 . A A . 24 LYS HE3 1 1 20 8620 1 1 24 LYS HG2 H 13.093 -0.563 -6.595 1.00 . A A . 24 LYS HG2 1 1 20 8621 1 1 24 LYS HG3 H 11.636 0.424 -6.509 1.00 . A A . 24 LYS HG3 1 1 20 8622 1 1 24 LYS HZ1 H 15.609 -0.575 -9.351 1.00 . A A . 24 LYS HZ1 1 1 20 8623 1 1 24 LYS HZ2 H 14.746 0.330 -10.493 1.00 . A A . 24 LYS HZ2 1 1 20 8624 1 1 24 LYS HZ3 H 13.952 -0.855 -9.566 1.00 . A A . 24 LYS HZ3 1 1 20 8625 1 1 24 LYS N N 13.759 0.206 -3.702 1.00 . A A . 24 LYS N 1 1 20 8626 1 1 24 LYS NZ N 14.697 -0.129 -9.560 1.00 . A A . 24 LYS NZ 1 1 20 8627 1 1 24 LYS O O 16.703 1.367 -5.054 1.00 . A A . 24 LYS O 1 1 20 8628 1 1 25 LYS C C 16.878 3.139 -2.023 1.00 . A A . 25 LYS C 1 1 20 8629 1 1 25 LYS CA C 16.321 3.546 -3.386 1.00 . A A . 25 LYS CA 1 1 20 8630 1 1 25 LYS CB C 15.706 4.960 -3.341 1.00 . A A . 25 LYS CB 1 1 20 8631 1 1 25 LYS CD C 18.161 5.613 -3.312 1.00 . A A . 25 LYS CD 1 1 20 8632 1 1 25 LYS CE C 19.163 6.608 -2.714 1.00 . A A . 25 LYS CE 1 1 20 8633 1 1 25 LYS CG C 16.739 6.026 -2.915 1.00 . A A . 25 LYS CG 1 1 20 8634 1 1 25 LYS H H 14.387 2.691 -3.456 1.00 . A A . 25 LYS H 1 1 20 8635 1 1 25 LYS HA H 17.119 3.533 -4.114 1.00 . A A . 25 LYS HA 1 1 20 8636 1 1 25 LYS HB2 H 15.327 5.211 -4.320 1.00 . A A . 25 LYS HB2 1 1 20 8637 1 1 25 LYS HB3 H 14.883 4.963 -2.637 1.00 . A A . 25 LYS HB3 1 1 20 8638 1 1 25 LYS HD2 H 18.375 4.623 -2.942 1.00 . A A . 25 LYS HD2 1 1 20 8639 1 1 25 LYS HD3 H 18.251 5.622 -4.389 1.00 . A A . 25 LYS HD3 1 1 20 8640 1 1 25 LYS HE2 H 20.167 6.266 -2.910 1.00 . A A . 25 LYS HE2 1 1 20 8641 1 1 25 LYS HE3 H 19.022 7.578 -3.171 1.00 . A A . 25 LYS HE3 1 1 20 8642 1 1 25 LYS HG2 H 16.497 6.959 -3.405 1.00 . A A . 25 LYS HG2 1 1 20 8643 1 1 25 LYS HG3 H 16.690 6.170 -1.848 1.00 . A A . 25 LYS HG3 1 1 20 8644 1 1 25 LYS HZ1 H 18.189 6.089 -0.927 1.00 . A A . 25 LYS HZ1 1 1 20 8645 1 1 25 LYS HZ2 H 18.707 7.702 -0.997 1.00 . A A . 25 LYS HZ2 1 1 20 8646 1 1 25 LYS HZ3 H 19.834 6.462 -0.744 1.00 . A A . 25 LYS HZ3 1 1 20 8647 1 1 25 LYS N N 15.303 2.590 -3.792 1.00 . A A . 25 LYS N 1 1 20 8648 1 1 25 LYS NZ N 18.956 6.720 -1.236 1.00 . A A . 25 LYS NZ 1 1 20 8649 1 1 25 LYS O O 17.503 2.082 -1.892 1.00 . A A . 25 LYS O 1 1 20 8650 1 1 26 ALA C C 16.887 4.954 1.193 1.00 . A A . 26 ALA C 1 1 20 8651 1 1 26 ALA CA C 17.105 3.715 0.342 1.00 . A A . 26 ALA CA 1 1 20 8652 1 1 26 ALA CB C 18.594 3.357 0.340 1.00 . A A . 26 ALA CB 1 1 20 8653 1 1 26 ALA H H 16.123 4.789 -1.189 1.00 . A A . 26 ALA H 1 1 20 8654 1 1 26 ALA HA H 16.545 2.893 0.762 1.00 . A A . 26 ALA HA 1 1 20 8655 1 1 26 ALA HB1 H 18.722 2.338 0.675 1.00 . A A . 26 ALA HB1 1 1 20 8656 1 1 26 ALA HB2 H 19.127 4.021 1.003 1.00 . A A . 26 ALA HB2 1 1 20 8657 1 1 26 ALA HB3 H 18.986 3.460 -0.658 1.00 . A A . 26 ALA HB3 1 1 20 8658 1 1 26 ALA N N 16.637 3.972 -1.016 1.00 . A A . 26 ALA N 1 1 20 8659 1 1 26 ALA O O 16.669 4.805 2.377 1.00 . A A . 26 ALA O 1 1 20 8660 1 1 26 ALA OXT O 16.949 6.038 0.645 1.00 . A A . 26 ALA OXT 1 1 stop_ save_
Contact the webmaster for help, if required. Friday, May 17, 2024 3:33:02 PM GMT (wattos1)