NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
614740 | 5u9s | 30213 | cing | 4-filtered-FRED | STAR | entry | full | 275 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5u9s # This FRED archive file contains, for PDB entry <5u9s>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_5u9s _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 5u9s _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2551.08 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 $Ocellatin_F1 A . 1 1 stop_ save_ save_Ocellatin_F1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Ocellatin F1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GVVDILKGAAKDIAGHLASKVMNKLX _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 GLY . 1 1 2 VAL . 1 1 3 VAL . 1 1 4 ASP . 1 1 5 ILE . 1 1 6 LEU . 1 1 7 LYS . 1 1 8 GLY . 1 1 9 ALA . 1 1 10 ALA . 1 1 11 LYS . 1 1 12 ASP . 1 1 13 ILE . 1 1 14 ALA . 1 1 15 GLY . 1 1 16 HIS . 1 1 17 LEU . 1 1 18 ALA . 1 1 19 SER . 1 1 20 LYS . 1 1 21 VAL . 1 1 22 MET . 1 1 23 ASN . 1 1 24 LYS . 1 1 25 LEU . 1 1 26 NH2 $NH2 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 VAL 2 2 1 1 VAL 3 3 1 1 ASP 4 4 1 1 ILE 5 5 1 1 LEU 6 6 1 1 LYS 7 7 1 1 GLY 8 8 1 1 ALA 9 9 1 1 ALA 10 10 1 1 LYS 11 11 1 1 ASP 12 12 1 1 ILE 13 13 1 1 ALA 14 14 1 1 GLY 15 15 1 1 HIS 16 16 1 1 LEU 17 17 1 1 ALA 18 18 1 1 SER 19 19 1 1 LYS 20 20 1 1 VAL 21 21 1 1 MET 22 22 1 1 ASN 23 23 1 1 LYS 24 24 1 1 LEU 25 25 1 1 NH2 26 26 1 1 stop_ save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 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 VAL HA . 2 . HA 1 1 1 1 2 1 1 2 VAL HB . 2 . HB 1 1 2 1 1 1 1 2 VAL HA . 2 . HA 1 1 2 1 2 1 1 3 VAL H . 3 . HN 1 1 3 1 1 1 1 2 VAL HA . 2 . HA 1 1 3 1 2 1 1 4 ASP H . 4 . HN 1 1 4 1 1 1 1 2 VAL HA . 2 . HA 1 1 4 1 2 1 1 5 ILE H . 5 . HN 1 1 5 1 1 1 1 3 VAL H . 3 . HN 1 1 5 1 2 1 1 3 VAL HA . 3 . HA 1 1 6 1 1 1 1 3 VAL H . 3 . HN 1 1 6 1 2 1 1 3 VAL HB . 3 . HB 1 1 7 1 1 1 1 3 VAL H . 3 . HN 1 1 7 1 2 1 1 4 ASP H . 4 . HN 1 1 8 1 1 1 1 3 VAL H . 3 . HN 1 1 8 1 2 1 1 5 ILE H . 5 . HN 1 1 9 1 1 1 1 3 VAL HA . 3 . HA 1 1 9 1 2 1 1 4 ASP H . 4 . HN 1 1 10 1 1 1 1 3 VAL HA . 3 . HA 1 1 10 1 2 1 1 5 ILE H . 5 . HN 1 1 11 1 1 1 1 3 VAL HA . 3 . HA 1 1 11 1 2 1 1 6 LEU H . 6 . HN 1 1 12 1 1 1 1 3 VAL HA . 3 . HA 1 1 12 1 2 1 1 6 LEU HB2 . 6 . HB2 1 1 13 1 1 1 1 3 VAL HA . 3 . HA 1 1 13 1 2 1 1 6 LEU HB3 . 6 . HB1 1 1 14 1 1 1 1 3 VAL HA . 3 . HA 1 1 14 1 2 1 1 6 LEU MD1 . 6 . HD1# 1 1 15 1 1 1 1 3 VAL HA . 3 . HA 1 1 15 1 2 1 1 7 LYS H . 7 . HN 1 1 16 1 1 1 1 3 VAL HB . 3 . HB 1 1 16 1 2 1 1 4 ASP H . 4 . HN 1 1 17 1 1 1 1 4 ASP H . 4 . HN 1 1 17 1 2 1 1 4 ASP HB3 . 4 . HB1 1 1 18 1 1 1 1 4 ASP H . 4 . HN 1 1 18 1 2 1 1 5 ILE H . 5 . HN 1 1 19 1 1 1 1 4 ASP H . 4 . HN 1 1 19 1 2 1 1 6 LEU H . 6 . HN 1 1 20 1 1 1 1 4 ASP HA . 4 . HA 1 1 20 1 2 1 1 5 ILE H . 5 . HN 1 1 21 1 1 1 1 4 ASP HA . 4 . HA 1 1 21 1 2 1 1 6 LEU H . 6 . HN 1 1 22 1 1 1 1 4 ASP HA . 4 . HA 1 1 22 1 2 1 1 7 LYS H . 7 . HN 1 1 23 1 1 1 1 4 ASP HA . 4 . HA 1 1 23 1 2 1 1 7 LYS HB2 . 7 . HB2 1 1 24 1 1 1 1 4 ASP HA . 4 . HA 1 1 24 1 2 1 1 7 LYS HB3 . 7 . HB1 1 1 25 1 1 1 1 4 ASP HA . 4 . HA 1 1 25 1 2 1 1 8 GLY H . 8 . HN 1 1 26 1 1 1 1 4 ASP HB2 . 4 . HB2 1 1 26 1 2 1 1 5 ILE H . 5 . HN 1 1 27 1 1 1 1 4 ASP HB3 . 4 . HB1 1 1 27 1 2 1 1 5 ILE H . 5 . HN 1 1 28 1 1 1 1 5 ILE H . 5 . HN 1 1 28 1 2 1 1 5 ILE HB . 5 . HB 1 1 29 1 1 1 1 5 ILE H . 5 . HN 1 1 29 1 2 1 1 5 ILE MD . 5 . HD1# 1 1 30 1 1 1 1 5 ILE H . 5 . HN 1 1 30 1 2 1 1 5 ILE HG12 . 5 . HG12 1 1 31 1 1 1 1 5 ILE H . 5 . HN 1 1 31 1 2 1 1 5 ILE HG13 . 5 . HG11 1 1 32 1 1 1 1 5 ILE H . 5 . HN 1 1 32 1 2 1 1 6 LEU H . 6 . HN 1 1 33 1 1 1 1 5 ILE H . 5 . HN 1 1 33 1 2 1 1 7 LYS H . 7 . HN 1 1 34 1 1 1 1 5 ILE HA . 5 . HA 1 1 34 1 2 1 1 5 ILE HG12 . 5 . HG12 1 1 35 1 1 1 1 5 ILE HA . 5 . HA 1 1 35 1 2 1 1 5 ILE HG13 . 5 . HG11 1 1 36 1 1 1 1 5 ILE HA . 5 . HA 1 1 36 1 2 1 1 5 ILE MG . 5 . HG2# 1 1 37 1 1 1 1 5 ILE HA . 5 . HA 1 1 37 1 2 1 1 6 LEU H . 6 . HN 1 1 38 1 1 1 1 5 ILE HA . 5 . HA 1 1 38 1 2 1 1 7 LYS H . 7 . HN 1 1 39 1 1 1 1 5 ILE HB . 5 . HB 1 1 39 1 2 1 1 6 LEU H . 6 . HN 1 1 40 1 1 1 1 6 LEU H . 6 . HN 1 1 40 1 2 1 1 6 LEU HB3 . 6 . HB1 1 1 41 1 1 1 1 6 LEU H . 6 . HN 1 1 41 1 2 1 1 6 LEU MD1 . 6 . HD1# 1 1 42 1 1 1 1 6 LEU H . 6 . HN 1 1 42 1 2 1 1 6 LEU MD2 . 6 . HD2# 1 1 43 1 1 1 1 6 LEU H . 6 . HN 1 1 43 1 2 1 1 6 LEU HG . 6 . HG 1 1 44 1 1 1 1 6 LEU H . 6 . HN 1 1 44 1 2 1 1 7 LYS H . 7 . HN 1 1 45 1 1 1 1 6 LEU HA . 6 . HA 1 1 45 1 2 1 1 9 ALA H . 9 . HN 1 1 46 1 1 1 1 7 LYS H . 7 . HN 1 1 46 1 2 1 1 7 LYS HB2 . 7 . HB2 1 1 47 1 1 1 1 7 LYS H . 7 . HN 1 1 47 1 2 1 1 7 LYS HB3 . 7 . HB1 1 1 48 1 1 1 1 7 LYS H . 7 . HN 1 1 48 1 2 1 1 7 LYS HD3 . 7 . HD1 1 1 49 1 1 1 1 7 LYS H . 7 . HN 1 1 49 1 2 1 1 7 LYS HG2 . 7 . HG2 1 1 50 1 1 1 1 7 LYS H . 7 . HN 1 1 50 1 2 1 1 8 GLY H . 8 . HN 1 1 51 1 1 1 1 7 LYS HA . 7 . HA 1 1 51 1 2 1 1 7 LYS HD3 . 7 . HD1 1 1 52 1 1 1 1 7 LYS HA . 7 . HA 1 1 52 1 2 1 1 7 LYS HG2 . 7 . HG2 1 1 53 1 1 1 1 7 LYS HA . 7 . HA 1 1 53 1 2 1 1 8 GLY H . 8 . HN 1 1 54 1 1 1 1 7 LYS HA . 7 . HA 1 1 54 1 2 1 1 9 ALA H . 9 . HN 1 1 55 1 1 1 1 7 LYS HA . 7 . HA 1 1 55 1 2 1 1 10 ALA H . 10 . HN 1 1 56 1 1 1 1 7 LYS HB2 . 7 . HB2 1 1 56 1 2 1 1 8 GLY H . 8 . HN 1 1 57 1 1 1 1 7 LYS HB3 . 7 . HB1 1 1 57 1 2 1 1 8 GLY H . 8 . HN 1 1 58 1 1 1 1 7 LYS HD3 . 7 . HD1 1 1 58 1 2 1 1 7 LYS HG2 . 7 . HG2 1 1 59 1 1 1 1 8 GLY H . 8 . HN 1 1 59 1 2 1 1 8 GLY HA3 . 8 . HA1 1 1 60 1 1 1 1 8 GLY H . 8 . HN 1 1 60 1 2 1 1 9 ALA H . 9 . HN 1 1 61 1 1 1 1 8 GLY HA2 . 8 . HA2 1 1 61 1 2 1 1 9 ALA H . 9 . HN 1 1 62 1 1 1 1 8 GLY HA3 . 8 . HA1 1 1 62 1 2 1 1 9 ALA H . 9 . HN 1 1 63 1 1 1 1 9 ALA H . 9 . HN 1 1 63 1 2 1 1 9 ALA HA . 9 . HA 1 1 64 1 1 1 1 9 ALA H . 9 . HN 1 1 64 1 2 1 1 9 ALA MB . 9 . HB# 1 1 65 1 1 1 1 9 ALA H . 9 . HN 1 1 65 1 2 1 1 10 ALA H . 10 . HN 1 1 66 1 1 1 1 9 ALA HA . 9 . HA 1 1 66 1 2 1 1 10 ALA H . 10 . HN 1 1 67 1 1 1 1 9 ALA HA . 9 . HA 1 1 67 1 2 1 1 11 LYS H . 11 . HN 1 1 68 1 1 1 1 9 ALA HA . 9 . HA 1 1 68 1 2 1 1 12 ASP H . 12 . HN 1 1 69 1 1 1 1 9 ALA HA . 9 . HA 1 1 69 1 2 1 1 12 ASP HB2 . 12 . HB2 1 1 70 1 1 1 1 9 ALA HA . 9 . HA 1 1 70 1 2 1 1 12 ASP HB3 . 12 . HB1 1 1 71 1 1 1 1 9 ALA HA . 9 . HA 1 1 71 1 2 1 1 13 ILE H . 13 . HN 1 1 72 1 1 1 1 10 ALA H . 10 . HN 1 1 72 1 2 1 1 10 ALA HA . 10 . HA 1 1 73 1 1 1 1 10 ALA H . 10 . HN 1 1 73 1 2 1 1 10 ALA MB . 10 . HB# 1 1 74 1 1 1 1 10 ALA H . 10 . HN 1 1 74 1 2 1 1 11 LYS H . 11 . HN 1 1 75 1 1 1 1 10 ALA HA . 10 . HA 1 1 75 1 2 1 1 13 ILE H . 13 . HN 1 1 76 1 1 1 1 10 ALA MB . 10 . HB# 1 1 76 1 2 1 1 11 LYS H . 11 . HN 1 1 77 1 1 1 1 11 LYS H . 11 . HN 1 1 77 1 2 1 1 11 LYS HA . 11 . HA 1 1 78 1 1 1 1 11 LYS H . 11 . HN 1 1 78 1 2 1 1 11 LYS HB3 . 11 . HB1 1 1 79 1 1 1 1 11 LYS H . 11 . HN 1 1 79 1 2 1 1 11 LYS HD2 . 11 . HD2 1 1 80 1 1 1 1 11 LYS H . 11 . HN 1 1 80 1 2 1 1 11 LYS HG3 . 11 . HG1 1 1 81 1 1 1 1 11 LYS H . 11 . HN 1 1 81 1 2 1 1 12 ASP H . 12 . HN 1 1 82 1 1 1 1 11 LYS HA . 11 . HA 1 1 82 1 2 1 1 11 LYS HB3 . 11 . HB1 1 1 83 1 1 1 1 11 LYS HA . 11 . HA 1 1 83 1 2 1 1 11 LYS HD2 . 11 . HD2 1 1 84 1 1 1 1 11 LYS HA . 11 . HA 1 1 84 1 2 1 1 11 LYS HG3 . 11 . HG1 1 1 85 1 1 1 1 11 LYS HA . 11 . HA 1 1 85 1 2 1 1 12 ASP H . 12 . HN 1 1 86 1 1 1 1 11 LYS HA . 11 . HA 1 1 86 1 2 1 1 13 ILE HG12 . 13 . HG12 1 1 87 1 1 1 1 11 LYS HA . 11 . HA 1 1 87 1 2 1 1 13 ILE MG . 13 . HG2# 1 1 88 1 1 1 1 11 LYS HB2 . 11 . HB2 1 1 88 1 2 1 1 11 LYS HD2 . 11 . HD2 1 1 89 1 1 1 1 11 LYS HB3 . 11 . HB1 1 1 89 1 2 1 1 11 LYS HD2 . 11 . HD2 1 1 90 1 1 1 1 11 LYS HB3 . 11 . HB1 1 1 90 1 2 1 1 11 LYS HD3 . 11 . HD1 1 1 91 1 1 1 1 11 LYS HB3 . 11 . HB1 1 1 91 1 2 1 1 11 LYS HE2 . 11 . HE2 1 1 92 1 1 1 1 11 LYS HB3 . 11 . HB1 1 1 92 1 2 1 1 11 LYS HE3 . 11 . HE1 1 1 93 1 1 1 1 11 LYS HB3 . 11 . HB1 1 1 93 1 2 1 1 12 ASP H . 12 . HN 1 1 94 1 1 1 1 11 LYS HD3 . 11 . HD1 1 1 94 1 2 1 1 11 LYS HG3 . 11 . HG1 1 1 95 1 1 1 1 12 ASP H . 12 . HN 1 1 95 1 2 1 1 12 ASP HB2 . 12 . HB2 1 1 96 1 1 1 1 12 ASP H . 12 . HN 1 1 96 1 2 1 1 12 ASP HB3 . 12 . HB1 1 1 97 1 1 1 1 12 ASP H . 12 . HN 1 1 97 1 2 1 1 13 ILE H . 13 . HN 1 1 98 1 1 1 1 12 ASP HA . 12 . HA 1 1 98 1 2 1 1 13 ILE H . 13 . HN 1 1 99 1 1 1 1 12 ASP HA . 12 . HA 1 1 99 1 2 1 1 14 ALA H . 14 . HN 1 1 100 1 1 1 1 12 ASP HA . 12 . HA 1 1 100 1 2 1 1 15 GLY H . 15 . HN 1 1 101 1 1 1 1 12 ASP HB2 . 12 . HB2 1 1 101 1 2 1 1 13 ILE H . 13 . HN 1 1 102 1 1 1 1 12 ASP HB3 . 12 . HB1 1 1 102 1 2 1 1 13 ILE H . 13 . HN 1 1 103 1 1 1 1 13 ILE H . 13 . HN 1 1 103 1 2 1 1 13 ILE HB . 13 . HB 1 1 104 1 1 1 1 13 ILE H . 13 . HN 1 1 104 1 2 1 1 13 ILE MD . 13 . HD1# 1 1 105 1 1 1 1 13 ILE H . 13 . HN 1 1 105 1 2 1 1 13 ILE HG12 . 13 . HG12 1 1 106 1 1 1 1 13 ILE H . 13 . HN 1 1 106 1 2 1 1 13 ILE HG13 . 13 . HG11 1 1 107 1 1 1 1 13 ILE H . 13 . HN 1 1 107 1 2 1 1 14 ALA H . 14 . HN 1 1 108 1 1 1 1 13 ILE HA . 13 . HA 1 1 108 1 2 1 1 13 ILE HG12 . 13 . HG12 1 1 109 1 1 1 1 13 ILE HA . 13 . HA 1 1 109 1 2 1 1 13 ILE HG13 . 13 . HG11 1 1 110 1 1 1 1 13 ILE HA . 13 . HA 1 1 110 1 2 1 1 14 ALA H . 14 . HN 1 1 111 1 1 1 1 13 ILE HA . 13 . HA 1 1 111 1 2 1 1 15 GLY H . 15 . HN 1 1 112 1 1 1 1 13 ILE HA . 13 . HA 1 1 112 1 2 1 1 16 HIS H . 16 . HN 1 1 113 1 1 1 1 13 ILE HA . 13 . HA 1 1 113 1 2 1 1 16 HIS HB3 . 16 . HB1 1 1 114 1 1 1 1 13 ILE HA . 13 . HA 1 1 114 1 2 1 1 16 HIS HD2 . 16 . HD2 1 1 115 1 1 1 1 13 ILE HA . 13 . HA 1 1 115 1 2 1 1 17 LEU H . 17 . HN 1 1 116 1 1 1 1 13 ILE HB . 13 . HB 1 1 116 1 2 1 1 14 ALA H . 14 . HN 1 1 117 1 1 1 1 13 ILE MD . 13 . HD1# 1 1 117 1 2 1 1 14 ALA H . 14 . HN 1 1 118 1 1 1 1 13 ILE HG13 . 13 . HG11 1 1 118 1 2 1 1 13 ILE MG . 13 . HG2# 1 1 119 1 1 1 1 14 ALA H . 14 . HN 1 1 119 1 2 1 1 14 ALA HA . 14 . HA 1 1 120 1 1 1 1 14 ALA H . 14 . HN 1 1 120 1 2 1 1 14 ALA MB . 14 . HB# 1 1 121 1 1 1 1 14 ALA H . 14 . HN 1 1 121 1 2 1 1 15 GLY H . 15 . HN 1 1 122 1 1 1 1 14 ALA HA . 14 . HA 1 1 122 1 2 1 1 15 GLY H . 15 . HN 1 1 123 1 1 1 1 14 ALA HA . 14 . HA 1 1 123 1 2 1 1 16 HIS H . 16 . HN 1 1 124 1 1 1 1 14 ALA HA . 14 . HA 1 1 124 1 2 1 1 18 ALA H . 18 . HN 1 1 125 1 1 1 1 14 ALA MB . 14 . HB# 1 1 125 1 2 1 1 15 GLY H . 15 . HN 1 1 126 1 1 1 1 15 GLY H . 15 . HN 1 1 126 1 2 1 1 15 GLY HA3 . 15 . HA1 1 1 127 1 1 1 1 15 GLY H . 15 . HN 1 1 127 1 2 1 1 16 HIS H . 16 . HN 1 1 128 1 1 1 1 15 GLY H . 15 . HN 1 1 128 1 2 1 1 17 LEU H . 17 . HN 1 1 129 1 1 1 1 15 GLY HA3 . 15 . HA1 1 1 129 1 2 1 1 16 HIS H . 16 . HN 1 1 130 1 1 1 1 15 GLY HA3 . 15 . HA1 1 1 130 1 2 1 1 18 ALA MB . 18 . HB# 1 1 131 1 1 1 1 15 GLY HA3 . 15 . HA1 1 1 131 1 2 1 1 19 SER H . 19 . HN 1 1 132 1 1 1 1 16 HIS H . 16 . HN 1 1 132 1 2 1 1 16 HIS HB3 . 16 . HB1 1 1 133 1 1 1 1 16 HIS H . 16 . HN 1 1 133 1 2 1 1 16 HIS HD2 . 16 . HD2 1 1 134 1 1 1 1 16 HIS H . 16 . HN 1 1 134 1 2 1 1 17 LEU H . 17 . HN 1 1 135 1 1 1 1 16 HIS H . 16 . HN 1 1 135 1 2 1 1 18 ALA H . 18 . HN 1 1 136 1 1 1 1 16 HIS HA . 16 . HA 1 1 136 1 2 1 1 16 HIS HD2 . 16 . HD2 1 1 137 1 1 1 1 16 HIS HA . 16 . HA 1 1 137 1 2 1 1 17 LEU H . 17 . HN 1 1 138 1 1 1 1 16 HIS HA . 16 . HA 1 1 138 1 2 1 1 18 ALA H . 18 . HN 1 1 139 1 1 1 1 16 HIS HA . 16 . HA 1 1 139 1 2 1 1 19 SER H . 19 . HN 1 1 140 1 1 1 1 16 HIS HB3 . 16 . HB1 1 1 140 1 2 1 1 16 HIS HD2 . 16 . HD2 1 1 141 1 1 1 1 16 HIS HB3 . 16 . HB1 1 1 141 1 2 1 1 17 LEU H . 17 . HN 1 1 142 1 1 1 1 17 LEU H . 17 . HN 1 1 142 1 2 1 1 17 LEU HA . 17 . HA 1 1 143 1 1 1 1 17 LEU H . 17 . HN 1 1 143 1 2 1 1 17 LEU HB2 . 17 . HB2 1 1 144 1 1 1 1 17 LEU H . 17 . HN 1 1 144 1 2 1 1 17 LEU HB3 . 17 . HB1 1 1 145 1 1 1 1 17 LEU H . 17 . HN 1 1 145 1 2 1 1 17 LEU MD1 . 17 . HD1# 1 1 146 1 1 1 1 17 LEU H . 17 . HN 1 1 146 1 2 1 1 17 LEU MD2 . 17 . HD2# 1 1 147 1 1 1 1 17 LEU H . 17 . HN 1 1 147 1 2 1 1 17 LEU HG . 17 . HG 1 1 148 1 1 1 1 17 LEU H . 17 . HN 1 1 148 1 2 1 1 18 ALA H . 18 . HN 1 1 149 1 1 1 1 17 LEU H . 17 . HN 1 1 149 1 2 1 1 19 SER H . 19 . HN 1 1 150 1 1 1 1 17 LEU HA . 17 . HA 1 1 150 1 2 1 1 17 LEU HB2 . 17 . HB2 1 1 151 1 1 1 1 17 LEU HA . 17 . HA 1 1 151 1 2 1 1 17 LEU HB3 . 17 . HB1 1 1 152 1 1 1 1 17 LEU HA . 17 . HA 1 1 152 1 2 1 1 18 ALA H . 18 . HN 1 1 153 1 1 1 1 17 LEU HA . 17 . HA 1 1 153 1 2 1 1 20 LYS H . 20 . HN 1 1 154 1 1 1 1 17 LEU HA . 17 . HA 1 1 154 1 2 1 1 20 LYS HB3 . 20 . HB1 1 1 155 1 1 1 1 17 LEU HB2 . 17 . HB2 1 1 155 1 2 1 1 18 ALA H . 18 . HN 1 1 156 1 1 1 1 17 LEU HB3 . 17 . HB1 1 1 156 1 2 1 1 18 ALA H . 18 . HN 1 1 157 1 1 1 1 18 ALA H . 18 . HN 1 1 157 1 2 1 1 18 ALA MB . 18 . HB# 1 1 158 1 1 1 1 18 ALA H . 18 . HN 1 1 158 1 2 1 1 19 SER H . 19 . HN 1 1 159 1 1 1 1 18 ALA H . 18 . HN 1 1 159 1 2 1 1 20 LYS H . 20 . HN 1 1 160 1 1 1 1 18 ALA HA . 18 . HA 1 1 160 1 2 1 1 21 VAL H . 21 . HN 1 1 161 1 1 1 1 18 ALA HA . 18 . HA 1 1 161 1 2 1 1 21 VAL HB . 21 . HB 1 1 162 1 1 1 1 18 ALA HA . 18 . HA 1 1 162 1 2 1 1 22 MET H . 22 . HN 1 1 163 1 1 1 1 18 ALA MB . 18 . HB# 1 1 163 1 2 1 1 19 SER H . 19 . HN 1 1 164 1 1 1 1 19 SER H . 19 . HN 1 1 164 1 2 1 1 19 SER HA . 19 . HA 1 1 165 1 1 1 1 19 SER H . 19 . HN 1 1 165 1 2 1 1 19 SER HB2 . 19 . HB2 1 1 166 1 1 1 1 19 SER H . 19 . HN 1 1 166 1 2 1 1 19 SER HB3 . 19 . HB1 1 1 167 1 1 1 1 19 SER H . 19 . HN 1 1 167 1 2 1 1 20 LYS H . 20 . HN 1 1 168 1 1 1 1 19 SER HA . 19 . HA 1 1 168 1 2 1 1 19 SER HB2 . 19 . HB2 1 1 169 1 1 1 1 19 SER HA . 19 . HA 1 1 169 1 2 1 1 19 SER HB3 . 19 . HB1 1 1 170 1 1 1 1 19 SER HA . 19 . HA 1 1 170 1 2 1 1 22 MET H . 22 . HN 1 1 171 1 1 1 1 19 SER HA . 19 . HA 1 1 171 1 2 1 1 22 MET HB3 . 22 . HB1 1 1 172 1 1 1 1 19 SER HA . 19 . HA 1 1 172 1 2 1 1 23 ASN H . 23 . HN 1 1 173 1 1 1 1 19 SER HB2 . 19 . HB2 1 1 173 1 2 1 1 20 LYS H . 20 . HN 1 1 174 1 1 1 1 19 SER HB3 . 19 . HB1 1 1 174 1 2 1 1 20 LYS H . 20 . HN 1 1 175 1 1 1 1 20 LYS H . 20 . HN 1 1 175 1 2 1 1 20 LYS HA . 20 . HA 1 1 176 1 1 1 1 20 LYS H . 20 . HN 1 1 176 1 2 1 1 20 LYS HB2 . 20 . HB2 1 1 177 1 1 1 1 20 LYS H . 20 . HN 1 1 177 1 2 1 1 20 LYS HD2 . 20 . HD2 1 1 178 1 1 1 1 20 LYS H . 20 . HN 1 1 178 1 2 1 1 20 LYS HD3 . 20 . HD1 1 1 179 1 1 1 1 20 LYS H . 20 . HN 1 1 179 1 2 1 1 20 LYS HG2 . 20 . HG2 1 1 180 1 1 1 1 20 LYS H . 20 . HN 1 1 180 1 2 1 1 21 VAL H . 21 . HN 1 1 181 1 1 1 1 20 LYS HA . 20 . HA 1 1 181 1 2 1 1 20 LYS HD3 . 20 . HD1 1 1 182 1 1 1 1 20 LYS HA . 20 . HA 1 1 182 1 2 1 1 20 LYS HE2 . 20 . HE2 1 1 183 1 1 1 1 20 LYS HA . 20 . HA 1 1 183 1 2 1 1 20 LYS HE3 . 20 . HE1 1 1 184 1 1 1 1 20 LYS HA . 20 . HA 1 1 184 1 2 1 1 20 LYS HG2 . 20 . HG2 1 1 185 1 1 1 1 20 LYS HA . 20 . HA 1 1 185 1 2 1 1 20 LYS HG3 . 20 . HG1 1 1 186 1 1 1 1 20 LYS HA . 20 . HA 1 1 186 1 2 1 1 21 VAL H . 21 . HN 1 1 187 1 1 1 1 20 LYS HA . 20 . HA 1 1 187 1 2 1 1 23 ASN H . 23 . HN 1 1 188 1 1 1 1 20 LYS HA . 20 . HA 1 1 188 1 2 1 1 23 ASN HB2 . 23 . HB2 1 1 189 1 1 1 1 20 LYS HA . 20 . HA 1 1 189 1 2 1 1 23 ASN HB3 . 23 . HB1 1 1 190 1 1 1 1 20 LYS HB2 . 20 . HB2 1 1 190 1 2 1 1 21 VAL H . 21 . HN 1 1 191 1 1 1 1 20 LYS HB3 . 20 . HB1 1 1 191 1 2 1 1 21 VAL H . 21 . HN 1 1 192 1 1 1 1 21 VAL H . 21 . HN 1 1 192 1 2 1 1 21 VAL HA . 21 . HA 1 1 193 1 1 1 1 21 VAL H . 21 . HN 1 1 193 1 2 1 1 21 VAL HB . 21 . HB 1 1 194 1 1 1 1 21 VAL H . 21 . HN 1 1 194 1 2 1 1 22 MET H . 22 . HN 1 1 195 1 1 1 1 21 VAL HA . 21 . HA 1 1 195 1 2 1 1 21 VAL MG1 . 21 . HG1# 1 1 196 1 1 1 1 21 VAL HA . 21 . HA 1 1 196 1 2 1 1 21 VAL MG2 . 21 . HG2# 1 1 197 1 1 1 1 21 VAL HA . 21 . HA 1 1 197 1 2 1 1 22 MET H . 22 . HN 1 1 198 1 1 1 1 21 VAL HA . 21 . HA 1 1 198 1 2 1 1 24 LYS H . 24 . HN 1 1 199 1 1 1 1 21 VAL HA . 21 . HA 1 1 199 1 2 1 1 24 LYS HB3 . 24 . HB1 1 1 200 1 1 1 1 21 VAL HA . 21 . HA 1 1 200 1 2 1 1 25 LEU H . 25 . HN 1 1 201 1 1 1 1 22 MET H . 22 . HN 1 1 201 1 2 1 1 22 MET HA . 22 . HA 1 1 202 1 1 1 1 22 MET H . 22 . HN 1 1 202 1 2 1 1 22 MET HB2 . 22 . HB2 1 1 203 1 1 1 1 22 MET H . 22 . HN 1 1 203 1 2 1 1 22 MET HB3 . 22 . HB1 1 1 204 1 1 1 1 22 MET H . 22 . HN 1 1 204 1 2 1 1 22 MET HG2 . 22 . HG2 1 1 205 1 1 1 1 22 MET H . 22 . HN 1 1 205 1 2 1 1 22 MET HG3 . 22 . HG1 1 1 206 1 1 1 1 22 MET H . 22 . HN 1 1 206 1 2 1 1 23 ASN H . 23 . HN 1 1 207 1 1 1 1 22 MET HA . 22 . HA 1 1 207 1 2 1 1 22 MET HB2 . 22 . HB2 1 1 208 1 1 1 1 22 MET HA . 22 . HA 1 1 208 1 2 1 1 22 MET HB3 . 22 . HB1 1 1 209 1 1 1 1 22 MET HA . 22 . HA 1 1 209 1 2 1 1 23 ASN H . 23 . HN 1 1 210 1 1 1 1 22 MET HB2 . 22 . HB2 1 1 210 1 2 1 1 23 ASN H . 23 . HN 1 1 211 1 1 1 1 22 MET HB3 . 22 . HB1 1 1 211 1 2 1 1 23 ASN H . 23 . HN 1 1 212 1 1 1 1 22 MET HG2 . 22 . HG2 1 1 212 1 2 1 1 23 ASN H . 23 . HN 1 1 213 1 1 1 1 22 MET HG3 . 22 . HG1 1 1 213 1 2 1 1 23 ASN H . 23 . HN 1 1 214 1 1 1 1 23 ASN H . 23 . HN 1 1 214 1 2 1 1 23 ASN HA . 23 . HA 1 1 215 1 1 1 1 23 ASN H . 23 . HN 1 1 215 1 2 1 1 23 ASN HB2 . 23 . HB2 1 1 216 1 1 1 1 23 ASN H . 23 . HN 1 1 216 1 2 1 1 23 ASN HB3 . 23 . HB1 1 1 217 1 1 1 1 23 ASN HA . 23 . HA 1 1 217 1 2 1 1 23 ASN HB3 . 23 . HB1 1 1 218 1 1 1 1 24 LYS H . 24 . HN 1 1 218 1 2 1 1 24 LYS HA . 24 . HA 1 1 219 1 1 1 1 24 LYS H . 24 . HN 1 1 219 1 2 1 1 24 LYS HB3 . 24 . HB1 1 1 220 1 1 1 1 24 LYS H . 24 . HN 1 1 220 1 2 1 1 25 LEU H . 25 . HN 1 1 221 1 1 1 1 24 LYS HB2 . 24 . HB2 1 1 221 1 2 1 1 24 LYS HG3 . 24 . HG1 1 1 222 1 1 1 1 25 LEU H . 25 . HN 1 1 222 1 2 1 1 25 LEU HA . 25 . HA 1 1 223 1 1 1 1 25 LEU H . 25 . HN 1 1 223 1 2 1 1 25 LEU HB2 . 25 . HB2 1 1 224 1 1 1 1 25 LEU H . 25 . HN 1 1 224 1 2 1 1 25 LEU HB3 . 25 . HB1 1 1 225 1 1 1 1 25 LEU H . 25 . HN 1 1 225 1 2 1 1 25 LEU MD1 . 25 . HD1# 1 1 226 1 1 1 1 25 LEU H . 25 . HN 1 1 226 1 2 1 1 25 LEU MD2 . 25 . HD2# 1 1 227 1 1 1 1 25 LEU HA . 25 . HA 1 1 227 1 2 1 1 25 LEU HB2 . 25 . HB2 1 1 228 1 1 1 1 25 LEU HA . 25 . HA 1 1 228 1 2 1 1 25 LEU HB3 . 25 . HB1 1 1 229 1 1 1 1 25 LEU HA . 25 . HA 1 1 229 1 2 1 1 25 LEU MD2 . 25 . HD2# 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 . . . . . . 1.8 2.8 1 1 2 1 . . . . . 5.0 1.8 5.0 1 1 3 1 . . . . . 5.0 1.8 5.0 1 1 4 1 . . . . . 3.4 1.8 3.4 1 1 5 1 . . . . . 2.8 1.8 2.8 1 1 6 1 . . . . . 2.8 1.8 2.8 1 1 7 1 . . . . . 3.4 1.8 3.4 1 1 8 1 . . . . . 5.0 1.8 5.0 1 1 9 1 . . . . . 5.0 1.8 5.0 1 1 10 1 . . . . . 5.0 1.8 5.0 1 1 11 1 . . . . . 5.0 1.8 5.0 1 1 12 1 . . . . . 5.0 1.8 5.0 1 1 13 1 . . . . . 5.0 3.4 5.0 1 1 14 1 . . . . . 5.0 1.8 5.0 1 1 15 1 . . . . . 5.0 1.8 5.0 1 1 16 1 . . . . . 5.0 1.8 5.0 1 1 17 1 . . . . . 3.4 1.8 3.4 1 1 18 1 . . . . . 3.4 1.8 3.4 1 1 19 1 . . . . . 5.0 1.8 5.0 1 1 20 1 . . . . . 5.0 1.8 5.0 1 1 21 1 . . . . . 5.0 1.8 5.0 1 1 22 1 . . . . . 5.0 1.8 5.0 1 1 23 1 . . . . . 5.0 1.8 5.0 1 1 24 1 . . . . . 5.0 1.8 5.0 1 1 25 1 . . . . . 5.0 1.8 5.0 1 1 26 1 . . . . . 5.0 1.8 5.0 1 1 27 1 . . . . . 3.4 1.8 3.4 1 1 28 1 . . . . . 2.8 1.8 2.8 1 1 29 1 . . . . . 5.0 1.8 5.0 1 1 30 1 . . . . . 5.0 1.8 5.0 1 1 31 1 . . . . . . 1.8 3.4 1 1 32 1 . . . . . 3.4 1.8 3.4 1 1 33 1 . . . . . 5.0 1.8 5.0 1 1 34 1 . . . . . 3.4 1.8 3.4 1 1 35 1 . . . . . . 1.8 3.4 1 1 36 1 . . . . . 3.4 1.8 3.4 1 1 37 1 . . . . . 3.4 1.8 3.4 1 1 38 1 . . . . . 5.0 1.8 5.0 1 1 39 1 . . . . . 3.4 1.8 3.4 1 1 40 1 . . . . . 3.4 2.4 3.4 1 1 41 1 . . . . . 5.0 1.8 5.0 1 1 42 1 . . . . . 5.0 1.8 5.0 1 1 43 1 . . . . . 3.4 2.4 3.4 1 1 44 1 . . . . . 3.4 1.8 3.4 1 1 45 1 . . . . . 5.0 1.8 5.0 1 1 46 1 . . . . . 3.4 2.4 3.4 1 1 47 1 . . . . . 3.4 2.4 3.4 1 1 48 1 . . . . . 2.8 1.8 2.8 1 1 49 1 . . . . . 5.0 1.8 5.0 1 1 50 1 . . . . . 3.4 1.8 3.4 1 1 51 1 . . . . . 5.0 1.8 5.0 1 1 52 1 . . . . . 3.4 1.8 3.4 1 1 53 1 . . . . . 5.0 1.8 5.0 1 1 54 1 . . . . . 5.0 1.8 5.0 1 1 55 1 . . . . . 5.0 1.8 5.0 1 1 56 1 . . . . . 5.0 3.4 5.0 1 1 57 1 . . . . . 5.0 1.8 5.0 1 1 58 1 . . . . . 2.8 1.8 2.8 1 1 59 1 . . . . . 2.8 1.8 2.8 1 1 60 1 . . . . . 2.8 1.8 2.8 1 1 61 1 . . . . . 5.0 1.8 5.0 1 1 62 1 . . . . . 5.0 1.8 5.0 1 1 63 1 . . . . . 2.8 1.8 2.8 1 1 64 1 . . . . . 3.4 1.8 3.4 1 1 65 1 . . . . . 2.8 1.8 2.8 1 1 66 1 . . . . . 5.0 1.8 5.0 1 1 67 1 . . . . . 5.0 1.8 5.0 1 1 68 1 . . . . . 5.0 1.8 5.0 1 1 69 1 . . . . . 5.0 1.8 5.0 1 1 70 1 . . . . . 5.0 1.8 5.0 1 1 71 1 . . . . . 5.0 1.8 5.0 1 1 72 1 . . . . . 2.8 1.8 2.8 1 1 73 1 . . . . . 2.8 1.8 2.8 1 1 74 1 . . . . . . 1.8 2.8 1 1 75 1 . . . . . 5.0 1.8 5.0 1 1 76 1 . . . . . 5.0 1.8 5.0 1 1 77 1 . . . . . 2.8 1.8 2.8 1 1 78 1 . . . . . 2.8 1.8 2.8 1 1 79 1 . . . . . 5.0 1.8 5.0 1 1 80 1 . . . . . 5.0 1.8 5.0 1 1 81 1 . . . . . 2.8 1.8 2.8 1 1 82 1 . . . . . 2.8 1.8 2.8 1 1 83 1 . . . . . 3.4 1.8 3.4 1 1 84 1 . . . . . 3.4 2.4 3.4 1 1 85 1 . . . . . 5.0 1.8 5.0 1 1 86 1 . . . . . 5.0 1.8 5.0 1 1 87 1 . . . . . 5.0 1.8 5.0 1 1 88 1 . . . . . 3.4 1.8 3.4 1 1 89 1 . . . . . 3.4 1.8 3.4 1 1 90 1 . . . . . 2.8 1.8 2.8 1 1 91 1 . . . . . 5.0 1.8 5.0 1 1 92 1 . . . . . 5.0 1.8 5.0 1 1 93 1 . . . . . . 1.8 2.8 1 1 94 1 . . . . . 2.8 1.8 2.8 1 1 95 1 . . . . . 3.4 1.8 3.4 1 1 96 1 . . . . . 3.4 1.8 3.4 1 1 97 1 . . . . . . 1.8 2.8 1 1 98 1 . . . . . 5.0 1.8 5.0 1 1 99 1 . . . . . 5.0 1.8 5.0 1 1 100 1 . . . . . 5.0 1.8 5.0 1 1 101 1 . . . . . 5.0 1.8 5.0 1 1 102 1 . . . . . 5.0 1.8 5.0 1 1 103 1 . . . . . 2.8 1.8 2.8 1 1 104 1 . . . . . 5.0 1.8 5.0 1 1 105 1 . . . . . 5.0 1.8 5.0 1 1 106 1 . . . . . 3.4 2.4 3.4 1 1 107 1 . . . . . 2.8 1.8 2.8 1 1 108 1 . . . . . . 1.8 3.4 1 1 109 1 . . . . . 3.4 1.8 3.4 1 1 110 1 . . . . . 5.0 1.8 5.0 1 1 111 1 . . . . . 5.0 1.8 5.0 1 1 112 1 . . . . . . 1.8 3.4 1 1 113 1 . . . . . 3.4 1.8 3.4 1 1 114 1 . . . . . 5.0 1.8 5.0 1 1 115 1 . . . . . 5.0 1.8 5.0 1 1 116 1 . . . . . 2.8 1.8 2.8 1 1 117 1 . . . . . 5.0 1.8 5.0 1 1 118 1 . . . . . 5.0 3.4 5.0 1 1 119 1 . . . . . 2.8 1.8 2.8 1 1 120 1 . . . . . 3.4 1.8 3.4 1 1 121 1 . . . . . . 1.8 2.8 1 1 122 1 . . . . . 5.0 1.8 5.0 1 1 123 1 . . . . . 5.0 1.8 5.0 1 1 124 1 . . . . . 5.0 1.8 5.0 1 1 125 1 . . . . . 5.0 1.8 5.0 1 1 126 1 . . . . . 2.8 1.8 2.8 1 1 127 1 . . . . . 2.8 1.8 2.8 1 1 128 1 . . . . . 5.0 1.8 5.0 1 1 129 1 . . . . . 5.0 1.8 5.0 1 1 130 1 . . . . . 5.0 1.8 5.0 1 1 131 1 . . . . . 5.0 1.8 5.0 1 1 132 1 . . . . . 2.8 1.8 2.8 1 1 133 1 . . . . . 5.0 1.8 5.0 1 1 134 1 . . . . . . 1.8 2.8 1 1 135 1 . . . . . 5.0 1.8 5.0 1 1 136 1 . . . . . 5.0 1.8 5.0 1 1 137 1 . . . . . 5.0 1.8 5.0 1 1 138 1 . . . . . 5.0 1.8 5.0 1 1 139 1 . . . . . 5.0 1.8 5.0 1 1 140 1 . . . . . 3.4 1.8 3.4 1 1 141 1 . . . . . 3.4 1.8 3.4 1 1 142 1 . . . . . 2.8 1.8 2.8 1 1 143 1 . . . . . 3.4 1.8 3.4 1 1 144 1 . . . . . 2.8 1.8 2.8 1 1 145 1 . . . . . 5.0 1.8 5.0 1 1 146 1 . . . . . 5.0 1.8 5.0 1 1 147 1 . . . . . 5.0 1.8 5.0 1 1 148 1 . . . . . 2.8 1.8 2.8 1 1 149 1 . . . . . 5.0 1.8 5.0 1 1 150 1 . . . . . 2.8 1.8 2.8 1 1 151 1 . . . . . . 1.8 2.8 1 1 152 1 . . . . . 5.0 1.8 5.0 1 1 153 1 . . . . . . 1.8 3.4 1 1 154 1 . . . . . 3.4 1.8 3.4 1 1 155 1 . . . . . 5.0 1.8 5.0 1 1 156 1 . . . . . 5.0 1.8 5.0 1 1 157 1 . . . . . 3.4 1.8 3.4 1 1 158 1 . . . . . 2.8 1.8 2.8 1 1 159 1 . . . . . 5.0 1.8 5.0 1 1 160 1 . . . . . 5.0 1.8 5.0 1 1 161 1 . . . . . 5.0 1.8 5.0 1 1 162 1 . . . . . 3.4 1.8 3.4 1 1 163 1 . . . . . 5.0 1.8 5.0 1 1 164 1 . . . . . 2.8 1.8 2.8 1 1 165 1 . . . . . 3.4 2.4 3.4 1 1 166 1 . . . . . 2.8 1.8 2.8 1 1 167 1 . . . . . 2.8 1.8 2.8 1 1 168 1 . . . . . 2.8 1.8 2.8 1 1 169 1 . . . . . . 1.8 2.8 1 1 170 1 . . . . . 3.4 1.8 3.4 1 1 171 1 . . . . . 3.4 1.8 3.4 1 1 172 1 . . . . . 5.0 1.8 5.0 1 1 173 1 . . . . . 5.0 1.8 5.0 1 1 174 1 . . . . . 5.0 1.8 5.0 1 1 175 1 . . . . . 2.8 1.8 2.8 1 1 176 1 . . . . . 2.8 1.8 2.8 1 1 177 1 . . . . . 5.0 1.8 5.0 1 1 178 1 . . . . . 5.0 1.8 5.0 1 1 179 1 . . . . . 5.0 1.8 5.0 1 1 180 1 . . . . . 2.8 1.8 2.8 1 1 181 1 . . . . . 5.0 1.8 5.0 1 1 182 1 . . . . . 5.0 1.8 5.0 1 1 183 1 . . . . . 5.0 1.8 5.0 1 1 184 1 . . . . . 3.4 1.8 3.4 1 1 185 1 . . . . . 3.4 1.8 3.4 1 1 186 1 . . . . . 5.0 1.8 5.0 1 1 187 1 . . . . . 5.0 1.8 5.0 1 1 188 1 . . . . . 5.0 1.8 5.0 1 1 189 1 . . . . . 5.0 1.8 5.0 1 1 190 1 . . . . . 2.8 1.8 2.8 1 1 191 1 . . . . . 3.4 1.8 3.4 1 1 192 1 . . . . . . 1.8 2.8 1 1 193 1 . . . . . . 1.8 2.8 1 1 194 1 . . . . . . 1.8 2.8 1 1 195 1 . . . . . 2.8 1.8 2.8 1 1 196 1 . . . . . 3.4 1.8 3.4 1 1 197 1 . . . . . 3.4 1.8 3.4 1 1 198 1 . . . . . 3.4 1.8 3.4 1 1 199 1 . . . . . 3.4 1.8 3.4 1 1 200 1 . . . . . 5.0 1.8 5.0 1 1 201 1 . . . . . . 1.8 2.8 1 1 202 1 . . . . . . 1.8 2.8 1 1 203 1 . . . . . 3.4 1.8 3.4 1 1 204 1 . . . . . 5.0 1.8 5.0 1 1 205 1 . . . . . 5.0 1.8 5.0 1 1 206 1 . . . . . 2.8 1.8 2.8 1 1 207 1 . . . . . . 1.8 2.8 1 1 208 1 . . . . . 2.8 1.8 2.8 1 1 209 1 . . . . . 5.0 1.8 5.0 1 1 210 1 . . . . . 2.8 1.8 2.8 1 1 211 1 . . . . . 3.4 1.8 3.4 1 1 212 1 . . . . . 5.0 1.8 5.0 1 1 213 1 . . . . . 5.0 1.8 5.0 1 1 214 1 . . . . . . 1.8 2.8 1 1 215 1 . . . . . . 1.8 2.8 1 1 216 1 . . . . . . 1.8 2.8 1 1 217 1 . . . . . . 1.8 2.8 1 1 218 1 . . . . . 2.8 1.8 2.8 1 1 219 1 . . . . . 2.8 1.8 2.8 1 1 220 1 . . . . . 2.8 1.8 2.8 1 1 221 1 . . . . . 2.8 1.8 2.8 1 1 222 1 . . . . . 2.8 1.8 2.8 1 1 223 1 . . . . . . 1.8 3.4 1 1 224 1 . . . . . 2.8 1.8 2.8 1 1 225 1 . . . . . 5.0 1.8 5.0 1 1 226 1 . . . . . 5.0 1.8 5.0 1 1 227 1 . . . . . . 1.8 2.8 1 1 228 1 . . . . . . 1.8 2.8 1 1 229 1 . . . . . 3.4 1.8 3.4 1 1 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 1 GLY C 1 1 2 VAL N 1 1 2 VAL CA 1 1 2 VAL C -75.8 -41.54 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 2 . 1 1 2 VAL C 1 1 3 VAL N 1 1 3 VAL CA 1 1 3 VAL C -84.23 -48.609997 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 3 . 1 1 3 VAL C 1 1 4 ASP N 1 1 4 ASP CA 1 1 4 ASP C -74.01 -49.23 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 4 . 1 1 4 ASP C 1 1 5 ILE N 1 1 5 ILE CA 1 1 5 ILE C -85.65 -46.709995 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 5 . 1 1 5 ILE C 1 1 6 LEU N 1 1 6 LEU CA 1 1 6 LEU C -75.1 -55.34 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 6 . 1 1 6 LEU C 1 1 7 LYS N 1 1 7 LYS CA 1 1 7 LYS C -75.49999 -49.32 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 7 . 1 1 7 LYS C 1 1 8 GLY N 1 1 8 GLY CA 1 1 8 GLY C -74.52 -50.76 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 8 . 1 1 8 GLY C 1 1 9 ALA N 1 1 9 ALA CA 1 1 9 ALA C -74.29 -48.609997 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 9 . 1 1 9 ALA C 1 1 10 ALA N 1 1 10 ALA CA 1 1 10 ALA C -74.48 -51.32 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 10 . 1 1 10 ALA C 1 1 11 LYS N 1 1 11 LYS CA 1 1 11 LYS C -78.65 -50.11 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 11 . 1 1 11 LYS C 1 1 12 ASP N 1 1 12 ASP CA 1 1 12 ASP C -83.6 -43.6 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 12 . 1 1 12 ASP C 1 1 13 ILE N 1 1 13 ILE CA 1 1 13 ILE C -76.5 -57.32 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 13 . 1 1 13 ILE C 1 1 14 ALA N 1 1 14 ALA CA 1 1 14 ALA C -72.5 -47.6 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 14 . 1 1 14 ALA C 1 1 15 GLY N 1 1 15 GLY CA 1 1 15 GLY C -72.31 -50.63 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 15 . 1 1 15 GLY C 1 1 16 HIS N 1 1 16 HIS CA 1 1 16 HIS C -72.619995 -53.64 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 16 . 1 1 16 HIS C 1 1 17 LEU N 1 1 17 LEU CA 1 1 17 LEU C -71.85999 -57.259995 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 17 . 1 1 17 LEU C 1 1 18 ALA N 1 1 18 ALA CA 1 1 18 ALA C -69.85 -55.57 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 18 . 1 1 18 ALA C 1 1 19 SER N 1 1 19 SER CA 1 1 19 SER C -96.39 -42.55 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 19 . 1 1 19 SER C 1 1 20 LYS N 1 1 20 LYS CA 1 1 20 LYS C -70.96 -56.34 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 20 . 1 1 20 LYS C 1 1 21 VAL N 1 1 21 VAL CA 1 1 21 VAL C -72.51 -58.189995 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 21 . 1 1 21 VAL C 1 1 22 MET N 1 1 22 MET CA 1 1 22 MET C -71.24 -51.339996 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 22 . 1 1 22 MET C 1 1 23 ASN N 1 1 23 ASN CA 1 1 23 ASN C -88.17 -47.61 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 23 . 1 1 23 ASN C 1 1 24 LYS N 1 1 24 LYS CA 1 1 24 LYS C -87.75 -47.69 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 24 . 1 1 2 VAL N 1 1 2 VAL CA 1 1 2 VAL C 1 1 3 VAL N -66.2 -29.079998 . 2 . N . 2 . CA . 2 . C . 3 . N 1 1 25 . 1 1 3 VAL N 1 1 3 VAL CA 1 1 3 VAL C 1 1 4 ASP N -62.63 -22.63 . 3 . N . 3 . CA . 3 . C . 4 . N 1 1 26 . 1 1 4 ASP N 1 1 4 ASP CA 1 1 4 ASP C 1 1 5 ILE N -57.49 -23.57 . 4 . N . 4 . CA . 4 . C . 5 . N 1 1 27 . 1 1 5 ILE N 1 1 5 ILE CA 1 1 5 ILE C 1 1 6 LEU N -59.35 -28.13 . 5 . N . 5 . CA . 5 . C . 6 . N 1 1 28 . 1 1 6 LEU N 1 1 6 LEU CA 1 1 6 LEU C 1 1 7 LYS N -55.66 -18.16 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1 29 . 1 1 7 LYS N 1 1 7 LYS CA 1 1 7 LYS C 1 1 8 GLY N -59.99 -31.05 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1 30 . 1 1 8 GLY N 1 1 8 GLY CA 1 1 8 GLY C 1 1 9 ALA N -58.56 -25.519999 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1 31 . 1 1 9 ALA N 1 1 9 ALA CA 1 1 9 ALA C 1 1 10 ALA N -53.91 -30.610003 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1 32 . 1 1 10 ALA N 1 1 10 ALA CA 1 1 10 ALA C 1 1 11 LYS N -51.529995 -32.25 . 10 . N . 10 . CA . 10 . C . 11 . N 1 1 33 . 1 1 11 LYS N 1 1 11 LYS CA 1 1 11 LYS C 1 1 12 ASP N -56.65 -25.01 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1 34 . 1 1 12 ASP N 1 1 12 ASP CA 1 1 12 ASP C 1 1 13 ILE N -81.36 -1.3599999 . 12 . N . 12 . CA . 12 . C . 13 . N 1 1 35 . 1 1 13 ILE N 1 1 13 ILE CA 1 1 13 ILE C 1 1 14 ALA N -52.22 -31.299997 . 13 . N . 13 . CA . 13 . C . 14 . N 1 1 36 . 1 1 14 ALA N 1 1 14 ALA CA 1 1 14 ALA C 1 1 15 GLY N -63.54 -20.7 . 14 . N . 14 . CA . 14 . C . 15 . N 1 1 37 . 1 1 15 GLY N 1 1 15 GLY CA 1 1 15 GLY C 1 1 16 HIS N -61.33 -31.169998 . 15 . N . 15 . CA . 15 . C . 16 . N 1 1 38 . 1 1 16 HIS N 1 1 16 HIS CA 1 1 16 HIS C 1 1 17 LEU N -49.5 -32.42 . 16 . N . 16 . CA . 16 . C . 17 . N 1 1 39 . 1 1 17 LEU N 1 1 17 LEU CA 1 1 17 LEU C 1 1 18 ALA N -51.63 -30.270002 . 17 . N . 17 . CA . 17 . C . 18 . N 1 1 40 . 1 1 18 ALA N 1 1 18 ALA CA 1 1 18 ALA C 1 1 19 SER N -58.14 -13.659998 . 18 . N . 18 . CA . 18 . C . 19 . N 1 1 41 . 1 1 19 SER N 1 1 19 SER CA 1 1 19 SER C 1 1 20 LYS N -61.079998 -7.5799994 . 19 . N . 19 . CA . 19 . C . 20 . N 1 1 42 . 1 1 20 LYS N 1 1 20 LYS CA 1 1 20 LYS C 1 1 21 VAL N -52.439995 -31.639997 . 20 . N . 20 . CA . 20 . C . 21 . N 1 1 43 . 1 1 21 VAL N 1 1 21 VAL CA 1 1 21 VAL C 1 1 22 MET N -52.24 -35.7 . 21 . N . 21 . CA . 21 . C . 22 . N 1 1 44 . 1 1 22 MET N 1 1 22 MET CA 1 1 22 MET C 1 1 23 ASN N -56.74 -28.2 . 22 . N . 22 . CA . 22 . C . 23 . N 1 1 45 . 1 1 23 ASN N 1 1 23 ASN CA 1 1 23 ASN C 1 1 24 LYS N -57.69 -23.53 . 23 . N . 23 . CA . 23 . C . 24 . N 1 1 46 . 1 1 24 LYS N 1 1 24 LYS CA 1 1 24 LYS C 1 1 25 LEU N -56.51 -30.85 . 24 . N . 24 . CA . 24 . C . 25 . N 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C 5.230 15.166 0.321 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 5.809 16.476 -0.201 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 7.312 17.383 0.921 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H 5.980 16.863 1.839 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H 5.860 18.258 0.877 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H 5.049 17.015 -0.749 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H 6.642 16.263 -0.853 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N 6.275 17.308 0.945 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O 4.403 14.536 -0.338 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 VAL C C 3.662 13.514 2.163 1.00 . A A . 2 VAL C 1 1 1 11 1 1 2 VAL CA C 5.185 13.525 2.111 1.00 . A A . 2 VAL CA 1 1 1 12 1 1 2 VAL CB C 5.748 13.376 3.525 1.00 . A A . 2 VAL CB 1 1 1 13 1 1 2 VAL CG1 C 7.257 13.139 3.453 1.00 . A A . 2 VAL CG1 1 1 1 14 1 1 2 VAL CG2 C 5.472 14.654 4.320 1.00 . A A . 2 VAL CG2 1 1 1 15 1 1 2 VAL H H 6.328 15.307 1.989 1.00 . A A . 2 VAL H 1 1 1 16 1 1 2 VAL HA H 5.520 12.691 1.513 1.00 . A A . 2 VAL HA 1 1 1 17 1 1 2 VAL HB H 5.276 12.536 4.014 1.00 . A A . 2 VAL HB 1 1 1 18 1 1 2 VAL HG11 H 7.706 13.873 2.799 1.00 . A A . 2 VAL HG11 1 1 1 19 1 1 2 VAL HG12 H 7.448 12.149 3.066 1.00 . A A . 2 VAL HG12 1 1 1 20 1 1 2 VAL HG13 H 7.684 13.228 4.440 1.00 . A A . 2 VAL HG13 1 1 1 21 1 1 2 VAL HG21 H 4.422 14.896 4.258 1.00 . A A . 2 VAL HG21 1 1 1 22 1 1 2 VAL HG22 H 6.053 15.466 3.910 1.00 . A A . 2 VAL HG22 1 1 1 23 1 1 2 VAL HG23 H 5.746 14.501 5.354 1.00 . A A . 2 VAL HG23 1 1 1 24 1 1 2 VAL N N 5.669 14.762 1.510 1.00 . A A . 2 VAL N 1 1 1 25 1 1 2 VAL O O 3.038 12.455 2.117 1.00 . A A . 2 VAL O 1 1 1 26 1 1 3 VAL C C 0.978 13.969 1.209 1.00 . A A . 3 VAL C 1 1 1 27 1 1 3 VAL CA C 1.616 14.804 2.314 1.00 . A A . 3 VAL CA 1 1 1 28 1 1 3 VAL CB C 1.194 16.267 2.160 1.00 . A A . 3 VAL CB 1 1 1 29 1 1 3 VAL CG1 C -0.272 16.422 2.572 1.00 . A A . 3 VAL CG1 1 1 1 30 1 1 3 VAL CG2 C 2.070 17.145 3.056 1.00 . A A . 3 VAL CG2 1 1 1 31 1 1 3 VAL H H 3.615 15.510 2.290 1.00 . A A . 3 VAL H 1 1 1 32 1 1 3 VAL HA H 1.274 14.441 3.272 1.00 . A A . 3 VAL HA 1 1 1 33 1 1 3 VAL HB H 1.312 16.569 1.129 1.00 . A A . 3 VAL HB 1 1 1 34 1 1 3 VAL HG11 H -0.362 16.283 3.639 1.00 . A A . 3 VAL HG11 1 1 1 35 1 1 3 VAL HG12 H -0.869 15.682 2.060 1.00 . A A . 3 VAL HG12 1 1 1 36 1 1 3 VAL HG13 H -0.617 17.410 2.307 1.00 . A A . 3 VAL HG13 1 1 1 37 1 1 3 VAL HG21 H 3.067 17.200 2.644 1.00 . A A . 3 VAL HG21 1 1 1 38 1 1 3 VAL HG22 H 2.113 16.719 4.047 1.00 . A A . 3 VAL HG22 1 1 1 39 1 1 3 VAL HG23 H 1.647 18.139 3.110 1.00 . A A . 3 VAL HG23 1 1 1 40 1 1 3 VAL N N 3.068 14.698 2.259 1.00 . A A . 3 VAL N 1 1 1 41 1 1 3 VAL O O 0.066 13.184 1.459 1.00 . A A . 3 VAL O 1 1 1 42 1 1 4 ASP C C 0.859 11.903 -0.827 1.00 . A A . 4 ASP C 1 1 1 43 1 1 4 ASP CA C 0.935 13.392 -1.147 1.00 . A A . 4 ASP CA 1 1 1 44 1 1 4 ASP CB C 1.823 13.608 -2.375 1.00 . A A . 4 ASP CB 1 1 1 45 1 1 4 ASP CG C 1.181 12.963 -3.599 1.00 . A A . 4 ASP CG 1 1 1 46 1 1 4 ASP H H 2.196 14.777 -0.156 1.00 . A A . 4 ASP H 1 1 1 47 1 1 4 ASP HA H -0.058 13.754 -1.370 1.00 . A A . 4 ASP HA 1 1 1 48 1 1 4 ASP HB2 H 1.942 14.669 -2.549 1.00 . A A . 4 ASP HB2 1 1 1 49 1 1 4 ASP HB3 H 2.791 13.157 -2.199 1.00 . A A . 4 ASP HB3 1 1 1 50 1 1 4 ASP N N 1.466 14.139 -0.013 1.00 . A A . 4 ASP N 1 1 1 51 1 1 4 ASP O O 0.079 11.169 -1.435 1.00 . A A . 4 ASP O 1 1 1 52 1 1 4 ASP OD1 O 0.434 13.645 -4.281 1.00 . A A . 4 ASP OD1 1 1 1 53 1 1 4 ASP OD2 O 1.448 11.797 -3.839 1.00 . A A . 4 ASP OD2 1 1 1 54 1 1 5 ILE C C 0.503 9.715 1.405 1.00 . A A . 5 ILE C 1 1 1 55 1 1 5 ILE CA C 1.687 10.049 0.505 1.00 . A A . 5 ILE CA 1 1 1 56 1 1 5 ILE CB C 2.992 9.708 1.227 1.00 . A A . 5 ILE CB 1 1 1 57 1 1 5 ILE CD1 C 5.474 9.989 1.191 1.00 . A A . 5 ILE CD1 1 1 1 58 1 1 5 ILE CG1 C 4.175 10.269 0.433 1.00 . A A . 5 ILE CG1 1 1 1 59 1 1 5 ILE CG2 C 3.132 8.189 1.339 1.00 . A A . 5 ILE CG2 1 1 1 60 1 1 5 ILE H H 2.280 12.085 0.575 1.00 . A A . 5 ILE H 1 1 1 61 1 1 5 ILE HA H 1.620 9.450 -0.387 1.00 . A A . 5 ILE HA 1 1 1 62 1 1 5 ILE HB H 2.980 10.141 2.216 1.00 . A A . 5 ILE HB 1 1 1 63 1 1 5 ILE HD11 H 5.714 8.938 1.119 1.00 . A A . 5 ILE HD11 1 1 1 64 1 1 5 ILE HD12 H 5.353 10.261 2.229 1.00 . A A . 5 ILE HD12 1 1 1 65 1 1 5 ILE HD13 H 6.275 10.571 0.759 1.00 . A A . 5 ILE HD13 1 1 1 66 1 1 5 ILE HG12 H 4.214 9.792 -0.538 1.00 . A A . 5 ILE HG12 1 1 1 67 1 1 5 ILE HG13 H 4.054 11.337 0.311 1.00 . A A . 5 ILE HG13 1 1 1 68 1 1 5 ILE HG21 H 2.241 7.777 1.792 1.00 . A A . 5 ILE HG21 1 1 1 69 1 1 5 ILE HG22 H 3.990 7.949 1.949 1.00 . A A . 5 ILE HG22 1 1 1 70 1 1 5 ILE HG23 H 3.261 7.766 0.354 1.00 . A A . 5 ILE HG23 1 1 1 71 1 1 5 ILE N N 1.675 11.457 0.124 1.00 . A A . 5 ILE N 1 1 1 72 1 1 5 ILE O O 0.032 8.577 1.430 1.00 . A A . 5 ILE O 1 1 1 73 1 1 6 LEU C C -2.370 10.199 2.240 1.00 . A A . 6 LEU C 1 1 1 74 1 1 6 LEU CA C -1.104 10.502 3.040 1.00 . A A . 6 LEU CA 1 1 1 75 1 1 6 LEU CB C -1.321 11.751 3.909 1.00 . A A . 6 LEU CB 1 1 1 76 1 1 6 LEU CD1 C -0.373 12.925 5.909 1.00 . A A . 6 LEU CD1 1 1 1 77 1 1 6 LEU CD2 C -1.600 10.771 6.201 1.00 . A A . 6 LEU CD2 1 1 1 78 1 1 6 LEU CG C -0.660 11.559 5.283 1.00 . A A . 6 LEU CG 1 1 1 79 1 1 6 LEU H H 0.439 11.593 2.083 1.00 . A A . 6 LEU H 1 1 1 80 1 1 6 LEU HA H -0.890 9.661 3.681 1.00 . A A . 6 LEU HA 1 1 1 81 1 1 6 LEU HB2 H -0.878 12.608 3.418 1.00 . A A . 6 LEU HB2 1 1 1 82 1 1 6 LEU HB3 H -2.380 11.921 4.042 1.00 . A A . 6 LEU HB3 1 1 1 83 1 1 6 LEU HD11 H -1.281 13.511 5.927 1.00 . A A . 6 LEU HD11 1 1 1 84 1 1 6 LEU HD12 H 0.375 13.440 5.324 1.00 . A A . 6 LEU HD12 1 1 1 85 1 1 6 LEU HD13 H -0.012 12.790 6.918 1.00 . A A . 6 LEU HD13 1 1 1 86 1 1 6 LEU HD21 H -2.545 11.287 6.279 1.00 . A A . 6 LEU HD21 1 1 1 87 1 1 6 LEU HD22 H -1.156 10.685 7.181 1.00 . A A . 6 LEU HD22 1 1 1 88 1 1 6 LEU HD23 H -1.762 9.784 5.793 1.00 . A A . 6 LEU HD23 1 1 1 89 1 1 6 LEU HG H 0.268 11.019 5.164 1.00 . A A . 6 LEU HG 1 1 1 90 1 1 6 LEU N N 0.025 10.708 2.143 1.00 . A A . 6 LEU N 1 1 1 91 1 1 6 LEU O O -3.014 9.172 2.452 1.00 . A A . 6 LEU O 1 1 1 92 1 1 7 LYS C C -3.804 9.585 -0.272 1.00 . A A . 7 LYS C 1 1 1 93 1 1 7 LYS CA C -3.902 10.900 0.497 1.00 . A A . 7 LYS CA 1 1 1 94 1 1 7 LYS CB C -4.073 12.074 -0.482 1.00 . A A . 7 LYS CB 1 1 1 95 1 1 7 LYS CD C -2.586 13.922 0.347 1.00 . A A . 7 LYS CD 1 1 1 96 1 1 7 LYS CE C -3.596 15.041 0.059 1.00 . A A . 7 LYS CE 1 1 1 97 1 1 7 LYS CG C -2.736 12.794 -0.684 1.00 . A A . 7 LYS CG 1 1 1 98 1 1 7 LYS H H -2.170 11.891 1.188 1.00 . A A . 7 LYS H 1 1 1 99 1 1 7 LYS HA H -4.762 10.861 1.141 1.00 . A A . 7 LYS HA 1 1 1 100 1 1 7 LYS HB2 H -4.420 11.697 -1.429 1.00 . A A . 7 LYS HB2 1 1 1 101 1 1 7 LYS HB3 H -4.798 12.768 -0.087 1.00 . A A . 7 LYS HB3 1 1 1 102 1 1 7 LYS HD2 H -2.762 13.528 1.337 1.00 . A A . 7 LYS HD2 1 1 1 103 1 1 7 LYS HD3 H -1.584 14.322 0.294 1.00 . A A . 7 LYS HD3 1 1 1 104 1 1 7 LYS HE2 H -3.127 16.002 0.222 1.00 . A A . 7 LYS HE2 1 1 1 105 1 1 7 LYS HE3 H -3.933 14.978 -0.966 1.00 . A A . 7 LYS HE3 1 1 1 106 1 1 7 LYS HG2 H -1.930 12.087 -0.567 1.00 . A A . 7 LYS HG2 1 1 1 107 1 1 7 LYS HG3 H -2.700 13.213 -1.680 1.00 . A A . 7 LYS HG3 1 1 1 108 1 1 7 LYS HZ1 H -4.813 13.927 1.329 1.00 . A A . 7 LYS HZ1 1 1 1 109 1 1 7 LYS HZ2 H -5.640 15.127 0.454 1.00 . A A . 7 LYS HZ2 1 1 1 110 1 1 7 LYS HZ3 H -4.660 15.556 1.773 1.00 . A A . 7 LYS HZ3 1 1 1 111 1 1 7 LYS N N -2.717 11.093 1.319 1.00 . A A . 7 LYS N 1 1 1 112 1 1 7 LYS NZ N -4.765 14.902 0.973 1.00 . A A . 7 LYS NZ 1 1 1 113 1 1 7 LYS O O -4.811 8.921 -0.514 1.00 . A A . 7 LYS O 1 1 1 114 1 1 8 GLY C C -2.492 6.768 -0.464 1.00 . A A . 8 GLY C 1 1 1 115 1 1 8 GLY CA C -2.368 7.975 -1.387 1.00 . A A . 8 GLY CA 1 1 1 116 1 1 8 GLY H H -1.817 9.782 -0.425 1.00 . A A . 8 GLY H 1 1 1 117 1 1 8 GLY HA2 H -3.102 7.898 -2.175 1.00 . A A . 8 GLY HA2 1 1 1 118 1 1 8 GLY HA3 H -1.379 7.988 -1.820 1.00 . A A . 8 GLY HA3 1 1 1 119 1 1 8 GLY N N -2.585 9.215 -0.650 1.00 . A A . 8 GLY N 1 1 1 120 1 1 8 GLY O O -2.964 5.707 -0.872 1.00 . A A . 8 GLY O 1 1 1 121 1 1 9 ALA C C -3.555 5.354 1.913 1.00 . A A . 9 ALA C 1 1 1 122 1 1 9 ALA CA C -2.127 5.859 1.760 1.00 . A A . 9 ALA CA 1 1 1 123 1 1 9 ALA CB C -1.608 6.345 3.114 1.00 . A A . 9 ALA CB 1 1 1 124 1 1 9 ALA H H -1.695 7.808 1.050 1.00 . A A . 9 ALA H 1 1 1 125 1 1 9 ALA HA H -1.507 5.044 1.422 1.00 . A A . 9 ALA HA 1 1 1 126 1 1 9 ALA HB1 H -0.671 6.866 2.975 1.00 . A A . 9 ALA HB1 1 1 1 127 1 1 9 ALA HB2 H -1.455 5.499 3.767 1.00 . A A . 9 ALA HB2 1 1 1 128 1 1 9 ALA HB3 H -2.329 7.015 3.557 1.00 . A A . 9 ALA HB3 1 1 1 129 1 1 9 ALA N N -2.062 6.939 0.783 1.00 . A A . 9 ALA N 1 1 1 130 1 1 9 ALA O O -3.780 4.180 2.206 1.00 . A A . 9 ALA O 1 1 1 131 1 1 10 ALA C C -6.227 4.702 0.900 1.00 . A A . 10 ALA C 1 1 1 132 1 1 10 ALA CA C -5.919 5.867 1.830 1.00 . A A . 10 ALA CA 1 1 1 133 1 1 10 ALA CB C -6.814 7.057 1.478 1.00 . A A . 10 ALA CB 1 1 1 134 1 1 10 ALA H H -4.285 7.166 1.476 1.00 . A A . 10 ALA H 1 1 1 135 1 1 10 ALA HA H -6.118 5.569 2.847 1.00 . A A . 10 ALA HA 1 1 1 136 1 1 10 ALA HB1 H -6.478 7.932 2.016 1.00 . A A . 10 ALA HB1 1 1 1 137 1 1 10 ALA HB2 H -7.834 6.834 1.753 1.00 . A A . 10 ALA HB2 1 1 1 138 1 1 10 ALA HB3 H -6.760 7.246 0.415 1.00 . A A . 10 ALA HB3 1 1 1 139 1 1 10 ALA N N -4.519 6.245 1.711 1.00 . A A . 10 ALA N 1 1 1 140 1 1 10 ALA O O -6.780 3.691 1.322 1.00 . A A . 10 ALA O 1 1 1 141 1 1 11 LYS C C -5.054 2.726 -1.290 1.00 . A A . 11 LYS C 1 1 1 142 1 1 11 LYS CA C -6.108 3.816 -1.357 1.00 . A A . 11 LYS CA 1 1 1 143 1 1 11 LYS CB C -6.119 4.417 -2.739 1.00 . A A . 11 LYS CB 1 1 1 144 1 1 11 LYS CD C -7.252 3.886 -4.864 1.00 . A A . 11 LYS CD 1 1 1 145 1 1 11 LYS CE C -7.486 2.835 -5.951 1.00 . A A . 11 LYS CE 1 1 1 146 1 1 11 LYS CG C -6.354 3.324 -3.786 1.00 . A A . 11 LYS CG 1 1 1 147 1 1 11 LYS H H -5.437 5.683 -0.645 1.00 . A A . 11 LYS H 1 1 1 148 1 1 11 LYS HA H -7.063 3.377 -1.171 1.00 . A A . 11 LYS HA 1 1 1 149 1 1 11 LYS HB2 H -6.899 5.162 -2.800 1.00 . A A . 11 LYS HB2 1 1 1 150 1 1 11 LYS HB3 H -5.178 4.875 -2.915 1.00 . A A . 11 LYS HB3 1 1 1 151 1 1 11 LYS HD2 H -8.192 4.172 -4.419 1.00 . A A . 11 LYS HD2 1 1 1 152 1 1 11 LYS HD3 H -6.777 4.748 -5.288 1.00 . A A . 11 LYS HD3 1 1 1 153 1 1 11 LYS HE2 H -6.589 2.722 -6.542 1.00 . A A . 11 LYS HE2 1 1 1 154 1 1 11 LYS HE3 H -7.735 1.891 -5.490 1.00 . A A . 11 LYS HE3 1 1 1 155 1 1 11 LYS HG2 H -5.412 3.022 -4.218 1.00 . A A . 11 LYS HG2 1 1 1 156 1 1 11 LYS HG3 H -6.834 2.479 -3.336 1.00 . A A . 11 LYS HG3 1 1 1 157 1 1 11 LYS HZ1 H -8.779 2.549 -7.559 1.00 . A A . 11 LYS HZ1 1 1 1 158 1 1 11 LYS HZ2 H -8.362 4.173 -7.285 1.00 . A A . 11 LYS HZ2 1 1 1 159 1 1 11 LYS HZ3 H -9.469 3.393 -6.258 1.00 . A A . 11 LYS HZ3 1 1 1 160 1 1 11 LYS N N -5.869 4.855 -0.368 1.00 . A A . 11 LYS N 1 1 1 161 1 1 11 LYS NZ N -8.609 3.270 -6.830 1.00 . A A . 11 LYS NZ 1 1 1 162 1 1 11 LYS O O -5.317 1.584 -1.669 1.00 . A A . 11 LYS O 1 1 1 163 1 1 12 ASP C C -3.374 0.790 -0.119 1.00 . A A . 12 ASP C 1 1 1 164 1 1 12 ASP CA C -2.790 2.081 -0.681 1.00 . A A . 12 ASP CA 1 1 1 165 1 1 12 ASP CB C -1.686 2.596 0.242 1.00 . A A . 12 ASP CB 1 1 1 166 1 1 12 ASP CG C -0.627 1.517 0.436 1.00 . A A . 12 ASP CG 1 1 1 167 1 1 12 ASP H H -3.710 3.997 -0.518 1.00 . A A . 12 ASP H 1 1 1 168 1 1 12 ASP HA H -2.375 1.887 -1.660 1.00 . A A . 12 ASP HA 1 1 1 169 1 1 12 ASP HB2 H -1.232 3.470 -0.198 1.00 . A A . 12 ASP HB2 1 1 1 170 1 1 12 ASP HB3 H -2.113 2.853 1.200 1.00 . A A . 12 ASP HB3 1 1 1 171 1 1 12 ASP N N -3.863 3.071 -0.803 1.00 . A A . 12 ASP N 1 1 1 172 1 1 12 ASP O O -2.710 -0.243 -0.044 1.00 . A A . 12 ASP O 1 1 1 173 1 1 12 ASP OD1 O -0.069 1.451 1.519 1.00 . A A . 12 ASP OD1 1 1 1 174 1 1 12 ASP OD2 O -0.387 0.775 -0.501 1.00 . A A . 12 ASP OD2 1 1 1 175 1 1 13 ILE C C -5.339 -1.409 -0.179 1.00 . A A . 13 ILE C 1 1 1 176 1 1 13 ILE CA C -5.398 -0.231 0.784 1.00 . A A . 13 ILE CA 1 1 1 177 1 1 13 ILE CB C -6.852 0.228 0.917 1.00 . A A . 13 ILE CB 1 1 1 178 1 1 13 ILE CD1 C -8.353 1.813 2.119 1.00 . A A . 13 ILE CD1 1 1 1 179 1 1 13 ILE CG1 C -7.019 1.066 2.182 1.00 . A A . 13 ILE CG1 1 1 1 180 1 1 13 ILE CG2 C -7.794 -0.970 0.969 1.00 . A A . 13 ILE CG2 1 1 1 181 1 1 13 ILE H H -5.095 1.744 0.141 1.00 . A A . 13 ILE H 1 1 1 182 1 1 13 ILE HA H -5.014 -0.517 1.749 1.00 . A A . 13 ILE HA 1 1 1 183 1 1 13 ILE HB H -7.103 0.832 0.056 1.00 . A A . 13 ILE HB 1 1 1 184 1 1 13 ILE HD11 H -8.336 2.637 2.815 1.00 . A A . 13 ILE HD11 1 1 1 185 1 1 13 ILE HD12 H -9.154 1.137 2.378 1.00 . A A . 13 ILE HD12 1 1 1 186 1 1 13 ILE HD13 H -8.512 2.190 1.118 1.00 . A A . 13 ILE HD13 1 1 1 187 1 1 13 ILE HG12 H -7.012 0.417 3.041 1.00 . A A . 13 ILE HG12 1 1 1 188 1 1 13 ILE HG13 H -6.210 1.778 2.256 1.00 . A A . 13 ILE HG13 1 1 1 189 1 1 13 ILE HG21 H -7.371 -1.731 1.605 1.00 . A A . 13 ILE HG21 1 1 1 190 1 1 13 ILE HG22 H -7.927 -1.363 -0.028 1.00 . A A . 13 ILE HG22 1 1 1 191 1 1 13 ILE HG23 H -8.749 -0.657 1.363 1.00 . A A . 13 ILE HG23 1 1 1 192 1 1 13 ILE N N -4.643 0.884 0.247 1.00 . A A . 13 ILE N 1 1 1 193 1 1 13 ILE O O -4.967 -2.521 0.195 1.00 . A A . 13 ILE O 1 1 1 194 1 1 14 ALA C C -4.317 -2.816 -2.549 1.00 . A A . 14 ALA C 1 1 1 195 1 1 14 ALA CA C -5.699 -2.176 -2.452 1.00 . A A . 14 ALA CA 1 1 1 196 1 1 14 ALA CB C -6.081 -1.573 -3.803 1.00 . A A . 14 ALA CB 1 1 1 197 1 1 14 ALA H H -5.997 -0.232 -1.651 1.00 . A A . 14 ALA H 1 1 1 198 1 1 14 ALA HA H -6.419 -2.937 -2.192 1.00 . A A . 14 ALA HA 1 1 1 199 1 1 14 ALA HB1 H -5.459 -0.713 -4.003 1.00 . A A . 14 ALA HB1 1 1 1 200 1 1 14 ALA HB2 H -7.117 -1.271 -3.782 1.00 . A A . 14 ALA HB2 1 1 1 201 1 1 14 ALA HB3 H -5.937 -2.310 -4.581 1.00 . A A . 14 ALA HB3 1 1 1 202 1 1 14 ALA N N -5.709 -1.143 -1.423 1.00 . A A . 14 ALA N 1 1 1 203 1 1 14 ALA O O -4.190 -4.039 -2.614 1.00 . A A . 14 ALA O 1 1 1 204 1 1 15 GLY C C -1.479 -3.122 -1.340 1.00 . A A . 15 GLY C 1 1 1 205 1 1 15 GLY CA C -1.915 -2.470 -2.648 1.00 . A A . 15 GLY CA 1 1 1 206 1 1 15 GLY H H -3.448 -1.014 -2.504 1.00 . A A . 15 GLY H 1 1 1 207 1 1 15 GLY HA2 H -1.850 -3.195 -3.446 1.00 . A A . 15 GLY HA2 1 1 1 208 1 1 15 GLY HA3 H -1.255 -1.644 -2.866 1.00 . A A . 15 GLY HA3 1 1 1 209 1 1 15 GLY N N -3.285 -1.979 -2.558 1.00 . A A . 15 GLY N 1 1 1 210 1 1 15 GLY O O -0.670 -4.050 -1.338 1.00 . A A . 15 GLY O 1 1 1 211 1 1 16 HIS C C -2.049 -4.650 1.162 1.00 . A A . 16 HIS C 1 1 1 212 1 1 16 HIS CA C -1.673 -3.173 1.080 1.00 . A A . 16 HIS CA 1 1 1 213 1 1 16 HIS CB C -2.401 -2.393 2.177 1.00 . A A . 16 HIS CB 1 1 1 214 1 1 16 HIS CD2 C -2.794 -4.046 4.181 1.00 . A A . 16 HIS CD2 1 1 1 215 1 1 16 HIS CE1 C -1.141 -3.422 5.435 1.00 . A A . 16 HIS CE1 1 1 1 216 1 1 16 HIS CG C -2.145 -3.040 3.510 1.00 . A A . 16 HIS CG 1 1 1 217 1 1 16 HIS H H -2.656 -1.888 -0.290 1.00 . A A . 16 HIS H 1 1 1 218 1 1 16 HIS HA H -0.609 -3.074 1.231 1.00 . A A . 16 HIS HA 1 1 1 219 1 1 16 HIS HB2 H -2.040 -1.376 2.195 1.00 . A A . 16 HIS HB2 1 1 1 220 1 1 16 HIS HB3 H -3.462 -2.395 1.976 1.00 . A A . 16 HIS HB3 1 1 1 221 1 1 16 HIS HD2 H -3.665 -4.573 3.819 1.00 . A A . 16 HIS HD2 1 1 1 222 1 1 16 HIS HE1 H -0.441 -3.346 6.254 1.00 . A A . 16 HIS HE1 1 1 1 223 1 1 16 HIS HE2 H -2.406 -4.946 6.077 1.00 . A A . 16 HIS HE2 1 1 1 224 1 1 16 HIS N N -2.018 -2.630 -0.228 1.00 . A A . 16 HIS N 1 1 1 225 1 1 16 HIS ND1 N -1.094 -2.657 4.329 1.00 . A A . 16 HIS ND1 1 1 1 226 1 1 16 HIS NE2 N -2.159 -4.285 5.396 1.00 . A A . 16 HIS NE2 1 1 1 227 1 1 16 HIS O O -1.326 -5.451 1.752 1.00 . A A . 16 HIS O 1 1 1 228 1 1 17 LEU C C -2.727 -7.247 -0.282 1.00 . A A . 17 LEU C 1 1 1 229 1 1 17 LEU CA C -3.643 -6.380 0.574 1.00 . A A . 17 LEU CA 1 1 1 230 1 1 17 LEU CB C -5.076 -6.438 0.044 1.00 . A A . 17 LEU CB 1 1 1 231 1 1 17 LEU CD1 C -5.060 -8.894 0.546 1.00 . A A . 17 LEU CD1 1 1 1 232 1 1 17 LEU CD2 C -6.072 -7.296 2.192 1.00 . A A . 17 LEU CD2 1 1 1 233 1 1 17 LEU CG C -5.848 -7.591 0.700 1.00 . A A . 17 LEU CG 1 1 1 234 1 1 17 LEU H H -3.719 -4.326 0.108 1.00 . A A . 17 LEU H 1 1 1 235 1 1 17 LEU HA H -3.625 -6.745 1.580 1.00 . A A . 17 LEU HA 1 1 1 236 1 1 17 LEU HB2 H -5.575 -5.504 0.258 1.00 . A A . 17 LEU HB2 1 1 1 237 1 1 17 LEU HB3 H -5.048 -6.587 -1.018 1.00 . A A . 17 LEU HB3 1 1 1 238 1 1 17 LEU HD11 H -4.642 -8.946 -0.448 1.00 . A A . 17 LEU HD11 1 1 1 239 1 1 17 LEU HD12 H -5.721 -9.733 0.702 1.00 . A A . 17 LEU HD12 1 1 1 240 1 1 17 LEU HD13 H -4.265 -8.922 1.275 1.00 . A A . 17 LEU HD13 1 1 1 241 1 1 17 LEU HD21 H -7.022 -7.706 2.500 1.00 . A A . 17 LEU HD21 1 1 1 242 1 1 17 LEU HD22 H -6.073 -6.229 2.358 1.00 . A A . 17 LEU HD22 1 1 1 243 1 1 17 LEU HD23 H -5.283 -7.748 2.775 1.00 . A A . 17 LEU HD23 1 1 1 244 1 1 17 LEU HG H -6.807 -7.698 0.210 1.00 . A A . 17 LEU HG 1 1 1 245 1 1 17 LEU N N -3.183 -5.002 0.564 1.00 . A A . 17 LEU N 1 1 1 246 1 1 17 LEU O O -2.334 -8.340 0.125 1.00 . A A . 17 LEU O 1 1 1 247 1 1 18 ALA C C -0.172 -7.747 -1.647 1.00 . A A . 18 ALA C 1 1 1 248 1 1 18 ALA CA C -1.493 -7.491 -2.348 1.00 . A A . 18 ALA CA 1 1 1 249 1 1 18 ALA CB C -1.252 -6.705 -3.639 1.00 . A A . 18 ALA CB 1 1 1 250 1 1 18 ALA H H -2.705 -5.868 -1.735 1.00 . A A . 18 ALA H 1 1 1 251 1 1 18 ALA HA H -1.945 -8.441 -2.591 1.00 . A A . 18 ALA HA 1 1 1 252 1 1 18 ALA HB1 H -0.783 -5.762 -3.403 1.00 . A A . 18 ALA HB1 1 1 1 253 1 1 18 ALA HB2 H -2.196 -6.524 -4.131 1.00 . A A . 18 ALA HB2 1 1 1 254 1 1 18 ALA HB3 H -0.608 -7.274 -4.292 1.00 . A A . 18 ALA HB3 1 1 1 255 1 1 18 ALA N N -2.376 -6.750 -1.463 1.00 . A A . 18 ALA N 1 1 1 256 1 1 18 ALA O O 0.230 -8.893 -1.468 1.00 . A A . 18 ALA O 1 1 1 257 1 1 19 SER C C 1.612 -7.810 0.604 1.00 . A A . 19 SER C 1 1 1 258 1 1 19 SER CA C 1.758 -6.810 -0.535 1.00 . A A . 19 SER CA 1 1 1 259 1 1 19 SER CB C 2.205 -5.452 0.011 1.00 . A A . 19 SER CB 1 1 1 260 1 1 19 SER H H 0.115 -5.783 -1.390 1.00 . A A . 19 SER H 1 1 1 261 1 1 19 SER HA H 2.500 -7.178 -1.227 1.00 . A A . 19 SER HA 1 1 1 262 1 1 19 SER HB2 H 3.262 -5.326 -0.147 1.00 . A A . 19 SER HB2 1 1 1 263 1 1 19 SER HB3 H 1.671 -4.666 -0.506 1.00 . A A . 19 SER HB3 1 1 1 264 1 1 19 SER HG H 2.765 -5.282 1.868 1.00 . A A . 19 SER HG 1 1 1 265 1 1 19 SER N N 0.490 -6.675 -1.234 1.00 . A A . 19 SER N 1 1 1 266 1 1 19 SER O O 2.526 -8.584 0.887 1.00 . A A . 19 SER O 1 1 1 267 1 1 19 SER OG O 1.930 -5.390 1.406 1.00 . A A . 19 SER OG 1 1 1 268 1 1 20 LYS C C 0.247 -10.153 1.817 1.00 . A A . 20 LYS C 1 1 1 269 1 1 20 LYS CA C 0.179 -8.719 2.333 1.00 . A A . 20 LYS CA 1 1 1 270 1 1 20 LYS CB C -1.212 -8.434 2.917 1.00 . A A . 20 LYS CB 1 1 1 271 1 1 20 LYS CD C -2.472 -7.669 4.938 1.00 . A A . 20 LYS CD 1 1 1 272 1 1 20 LYS CE C -2.354 -7.475 6.450 1.00 . A A . 20 LYS CE 1 1 1 273 1 1 20 LYS CG C -1.079 -7.876 4.337 1.00 . A A . 20 LYS CG 1 1 1 274 1 1 20 LYS H H -0.252 -7.169 0.963 1.00 . A A . 20 LYS H 1 1 1 275 1 1 20 LYS HA H 0.925 -8.582 3.100 1.00 . A A . 20 LYS HA 1 1 1 276 1 1 20 LYS HB2 H -1.712 -7.711 2.293 1.00 . A A . 20 LYS HB2 1 1 1 277 1 1 20 LYS HB3 H -1.794 -9.342 2.942 1.00 . A A . 20 LYS HB3 1 1 1 278 1 1 20 LYS HD2 H -2.928 -6.796 4.496 1.00 . A A . 20 LYS HD2 1 1 1 279 1 1 20 LYS HD3 H -3.083 -8.537 4.735 1.00 . A A . 20 LYS HD3 1 1 1 280 1 1 20 LYS HE2 H -1.829 -8.316 6.882 1.00 . A A . 20 LYS HE2 1 1 1 281 1 1 20 LYS HE3 H -1.806 -6.567 6.654 1.00 . A A . 20 LYS HE3 1 1 1 282 1 1 20 LYS HG2 H -0.523 -8.573 4.947 1.00 . A A . 20 LYS HG2 1 1 1 283 1 1 20 LYS HG3 H -0.560 -6.930 4.305 1.00 . A A . 20 LYS HG3 1 1 1 284 1 1 20 LYS HZ1 H -4.363 -6.936 6.366 1.00 . A A . 20 LYS HZ1 1 1 1 285 1 1 20 LYS HZ2 H -3.674 -6.805 7.914 1.00 . A A . 20 LYS HZ2 1 1 1 286 1 1 20 LYS HZ3 H -4.061 -8.333 7.279 1.00 . A A . 20 LYS HZ3 1 1 1 287 1 1 20 LYS N N 0.446 -7.799 1.241 1.00 . A A . 20 LYS N 1 1 1 288 1 1 20 LYS NZ N -3.715 -7.380 7.047 1.00 . A A . 20 LYS NZ 1 1 1 289 1 1 20 LYS O O 0.955 -10.994 2.370 1.00 . A A . 20 LYS O 1 1 1 290 1 1 21 VAL C C 0.774 -12.035 -0.591 1.00 . A A . 21 VAL C 1 1 1 291 1 1 21 VAL CA C -0.524 -11.742 0.153 1.00 . A A . 21 VAL CA 1 1 1 292 1 1 21 VAL CB C -1.704 -11.867 -0.810 1.00 . A A . 21 VAL CB 1 1 1 293 1 1 21 VAL CG1 C -1.799 -13.313 -1.294 1.00 . A A . 21 VAL CG1 1 1 1 294 1 1 21 VAL CG2 C -3.000 -11.490 -0.086 1.00 . A A . 21 VAL CG2 1 1 1 295 1 1 21 VAL H H -1.040 -9.701 0.357 1.00 . A A . 21 VAL H 1 1 1 296 1 1 21 VAL HA H -0.640 -12.468 0.931 1.00 . A A . 21 VAL HA 1 1 1 297 1 1 21 VAL HB H -1.554 -11.211 -1.655 1.00 . A A . 21 VAL HB 1 1 1 298 1 1 21 VAL HG11 H -1.849 -13.974 -0.442 1.00 . A A . 21 VAL HG11 1 1 1 299 1 1 21 VAL HG12 H -0.927 -13.551 -1.885 1.00 . A A . 21 VAL HG12 1 1 1 300 1 1 21 VAL HG13 H -2.687 -13.432 -1.896 1.00 . A A . 21 VAL HG13 1 1 1 301 1 1 21 VAL HG21 H -2.843 -10.591 0.491 1.00 . A A . 21 VAL HG21 1 1 1 302 1 1 21 VAL HG22 H -3.291 -12.294 0.574 1.00 . A A . 21 VAL HG22 1 1 1 303 1 1 21 VAL HG23 H -3.781 -11.319 -0.812 1.00 . A A . 21 VAL HG23 1 1 1 304 1 1 21 VAL N N -0.498 -10.415 0.750 1.00 . A A . 21 VAL N 1 1 1 305 1 1 21 VAL O O 1.306 -13.142 -0.515 1.00 . A A . 21 VAL O 1 1 1 306 1 1 22 MET C C 3.650 -11.606 -1.115 1.00 . A A . 22 MET C 1 1 1 307 1 1 22 MET CA C 2.518 -11.212 -2.057 1.00 . A A . 22 MET CA 1 1 1 308 1 1 22 MET CB C 2.877 -9.916 -2.792 1.00 . A A . 22 MET CB 1 1 1 309 1 1 22 MET CE C 1.517 -8.782 -6.413 1.00 . A A . 22 MET CE 1 1 1 310 1 1 22 MET CG C 2.617 -10.075 -4.293 1.00 . A A . 22 MET CG 1 1 1 311 1 1 22 MET H H 0.811 -10.177 -1.329 1.00 . A A . 22 MET H 1 1 1 312 1 1 22 MET HA H 2.378 -11.996 -2.781 1.00 . A A . 22 MET HA 1 1 1 313 1 1 22 MET HB2 H 2.269 -9.117 -2.408 1.00 . A A . 22 MET HB2 1 1 1 314 1 1 22 MET HB3 H 3.919 -9.682 -2.634 1.00 . A A . 22 MET HB3 1 1 1 315 1 1 22 MET HE1 H 1.688 -9.771 -6.816 1.00 . A A . 22 MET HE1 1 1 1 316 1 1 22 MET HE2 H 1.634 -8.052 -7.197 1.00 . A A . 22 MET HE2 1 1 1 317 1 1 22 MET HE3 H 0.514 -8.718 -6.012 1.00 . A A . 22 MET HE3 1 1 1 318 1 1 22 MET HG2 H 3.362 -10.733 -4.719 1.00 . A A . 22 MET HG2 1 1 1 319 1 1 22 MET HG3 H 1.630 -10.495 -4.445 1.00 . A A . 22 MET HG3 1 1 1 320 1 1 22 MET N N 1.279 -11.039 -1.306 1.00 . A A . 22 MET N 1 1 1 321 1 1 22 MET O O 4.345 -12.597 -1.342 1.00 . A A . 22 MET O 1 1 1 322 1 1 22 MET SD S 2.713 -8.455 -5.095 1.00 . A A . 22 MET SD 1 1 1 323 1 1 23 ASN C C 4.694 -12.486 1.522 1.00 . A A . 23 ASN C 1 1 1 324 1 1 23 ASN CA C 4.874 -11.097 0.917 1.00 . A A . 23 ASN CA 1 1 1 325 1 1 23 ASN CB C 4.847 -10.049 2.024 1.00 . A A . 23 ASN CB 1 1 1 326 1 1 23 ASN CG C 6.153 -10.083 2.811 1.00 . A A . 23 ASN CG 1 1 1 327 1 1 23 ASN H H 3.239 -10.048 0.070 1.00 . A A . 23 ASN H 1 1 1 328 1 1 23 ASN HA H 5.827 -11.052 0.428 1.00 . A A . 23 ASN HA 1 1 1 329 1 1 23 ASN HB2 H 4.715 -9.070 1.588 1.00 . A A . 23 ASN HB2 1 1 1 330 1 1 23 ASN HB3 H 4.030 -10.262 2.684 1.00 . A A . 23 ASN HB3 1 1 1 331 1 1 23 ASN HD21 H 5.455 -8.972 4.301 1.00 . A A . 23 ASN HD21 1 1 1 332 1 1 23 ASN HD22 H 7.068 -9.475 4.465 1.00 . A A . 23 ASN HD22 1 1 1 333 1 1 23 ASN N N 3.826 -10.823 -0.057 1.00 . A A . 23 ASN N 1 1 1 334 1 1 23 ASN ND2 N 6.232 -9.459 3.953 1.00 . A A . 23 ASN ND2 1 1 1 335 1 1 23 ASN O O 5.666 -13.210 1.739 1.00 . A A . 23 ASN O 1 1 1 336 1 1 23 ASN OD1 O 7.128 -10.695 2.372 1.00 . A A . 23 ASN OD1 1 1 1 337 1 1 24 LYS C C 3.539 -15.270 1.404 1.00 . A A . 24 LYS C 1 1 1 338 1 1 24 LYS CA C 3.152 -14.156 2.371 1.00 . A A . 24 LYS CA 1 1 1 339 1 1 24 LYS CB C 1.662 -14.258 2.705 1.00 . A A . 24 LYS CB 1 1 1 340 1 1 24 LYS CD C 0.060 -15.529 4.148 1.00 . A A . 24 LYS CD 1 1 1 341 1 1 24 LYS CE C -0.409 -16.939 4.511 1.00 . A A . 24 LYS CE 1 1 1 342 1 1 24 LYS CG C 1.376 -15.609 3.368 1.00 . A A . 24 LYS CG 1 1 1 343 1 1 24 LYS H H 2.708 -12.237 1.599 1.00 . A A . 24 LYS H 1 1 1 344 1 1 24 LYS HA H 3.721 -14.268 3.279 1.00 . A A . 24 LYS HA 1 1 1 345 1 1 24 LYS HB2 H 1.391 -13.459 3.380 1.00 . A A . 24 LYS HB2 1 1 1 346 1 1 24 LYS HB3 H 1.083 -14.175 1.798 1.00 . A A . 24 LYS HB3 1 1 1 347 1 1 24 LYS HD2 H 0.214 -14.956 5.052 1.00 . A A . 24 LYS HD2 1 1 1 348 1 1 24 LYS HD3 H -0.690 -15.046 3.540 1.00 . A A . 24 LYS HD3 1 1 1 349 1 1 24 LYS HE2 H 0.440 -17.541 4.801 1.00 . A A . 24 LYS HE2 1 1 1 350 1 1 24 LYS HE3 H -1.109 -16.886 5.332 1.00 . A A . 24 LYS HE3 1 1 1 351 1 1 24 LYS HG2 H 1.297 -16.373 2.608 1.00 . A A . 24 LYS HG2 1 1 1 352 1 1 24 LYS HG3 H 2.178 -15.857 4.046 1.00 . A A . 24 LYS HG3 1 1 1 353 1 1 24 LYS HZ1 H -0.868 -18.577 3.310 1.00 . A A . 24 LYS HZ1 1 1 1 354 1 1 24 LYS HZ2 H -0.721 -17.114 2.459 1.00 . A A . 24 LYS HZ2 1 1 1 355 1 1 24 LYS HZ3 H -2.103 -17.419 3.399 1.00 . A A . 24 LYS HZ3 1 1 1 356 1 1 24 LYS N N 3.445 -12.852 1.792 1.00 . A A . 24 LYS N 1 1 1 357 1 1 24 LYS NZ N -1.076 -17.559 3.331 1.00 . A A . 24 LYS NZ 1 1 1 358 1 1 24 LYS O O 3.925 -16.362 1.820 1.00 . A A . 24 LYS O 1 1 1 359 1 1 25 LEU C C 5.273 -16.244 -0.901 1.00 . A A . 25 LEU C 1 1 1 360 1 1 25 LEU CA C 3.772 -15.966 -0.910 1.00 . A A . 25 LEU CA 1 1 1 361 1 1 25 LEU CB C 3.344 -15.446 -2.282 1.00 . A A . 25 LEU CB 1 1 1 362 1 1 25 LEU CD1 C 4.278 -17.552 -3.272 1.00 . A A . 25 LEU CD1 1 1 1 363 1 1 25 LEU CD2 C 1.825 -17.395 -2.777 1.00 . A A . 25 LEU CD2 1 1 1 364 1 1 25 LEU CG C 3.067 -16.615 -3.238 1.00 . A A . 25 LEU CG 1 1 1 365 1 1 25 LEU H H 3.119 -14.103 -0.165 1.00 . A A . 25 LEU H 1 1 1 366 1 1 25 LEU HA H 3.246 -16.873 -0.705 1.00 . A A . 25 LEU HA 1 1 1 367 1 1 25 LEU HB2 H 2.447 -14.848 -2.175 1.00 . A A . 25 LEU HB2 1 1 1 368 1 1 25 LEU HB3 H 4.134 -14.837 -2.685 1.00 . A A . 25 LEU HB3 1 1 1 369 1 1 25 LEU HD11 H 5.182 -16.968 -3.363 1.00 . A A . 25 LEU HD11 1 1 1 370 1 1 25 LEU HD12 H 4.193 -18.217 -4.118 1.00 . A A . 25 LEU HD12 1 1 1 371 1 1 25 LEU HD13 H 4.312 -18.130 -2.360 1.00 . A A . 25 LEU HD13 1 1 1 372 1 1 25 LEU HD21 H 1.300 -17.773 -3.643 1.00 . A A . 25 LEU HD21 1 1 1 373 1 1 25 LEU HD22 H 1.170 -16.741 -2.220 1.00 . A A . 25 LEU HD22 1 1 1 374 1 1 25 LEU HD23 H 2.125 -18.222 -2.151 1.00 . A A . 25 LEU HD23 1 1 1 375 1 1 25 LEU HG H 2.896 -16.225 -4.232 1.00 . A A . 25 LEU HG 1 1 1 376 1 1 25 LEU N N 3.432 -14.986 0.110 1.00 . A A . 25 LEU N 1 1 1 377 1 1 25 LEU O O 5.706 -17.321 -0.488 1.00 . A A . 25 LEU O 1 1 1 378 1 1 26 NH2 HN1 H 5.749 -14.472 -1.663 1.00 . A A . 26 NH2 HN1 1 1 1 379 1 1 26 NH2 HN2 H 7.066 -15.503 -1.332 1.00 . A A . 26 NH2 HN2 1 1 1 380 1 1 26 NH2 N N 6.098 -15.332 -1.334 1.00 . A A . 26 NH2 N 1 1 2 381 1 1 1 GLY C C 4.054 16.403 -0.372 1.00 . A A . 1 GLY C 1 1 2 382 1 1 1 GLY CA C 4.291 17.501 -1.403 1.00 . A A . 1 GLY CA 1 1 2 383 1 1 1 GLY H1 H 3.143 18.778 -0.225 1.00 . A A . 1 GLY H1 1 1 2 384 1 1 1 GLY H2 H 2.363 18.251 -1.639 1.00 . A A . 1 GLY H2 1 1 2 385 1 1 1 GLY H3 H 3.582 19.432 -1.728 1.00 . A A . 1 GLY H3 1 1 2 386 1 1 1 GLY HA2 H 4.217 17.084 -2.398 1.00 . A A . 1 GLY HA2 1 1 2 387 1 1 1 GLY HA3 H 5.276 17.918 -1.260 1.00 . A A . 1 GLY HA3 1 1 2 388 1 1 1 GLY N N 3.268 18.571 -1.236 1.00 . A A . 1 GLY N 1 1 2 389 1 1 1 GLY O O 3.635 15.297 -0.713 1.00 . A A . 1 GLY O 1 1 2 390 1 1 2 VAL C C 2.657 15.408 2.125 1.00 . A A . 2 VAL C 1 1 2 391 1 1 2 VAL CA C 4.134 15.746 1.964 1.00 . A A . 2 VAL CA 1 1 2 392 1 1 2 VAL CB C 4.678 16.308 3.280 1.00 . A A . 2 VAL CB 1 1 2 393 1 1 2 VAL CG1 C 6.207 16.345 3.226 1.00 . A A . 2 VAL CG1 1 1 2 394 1 1 2 VAL CG2 C 4.143 17.726 3.489 1.00 . A A . 2 VAL CG2 1 1 2 395 1 1 2 VAL H H 4.655 17.613 1.106 1.00 . A A . 2 VAL H 1 1 2 396 1 1 2 VAL HA H 4.675 14.845 1.721 1.00 . A A . 2 VAL HA 1 1 2 397 1 1 2 VAL HB H 4.362 15.676 4.097 1.00 . A A . 2 VAL HB 1 1 2 398 1 1 2 VAL HG11 H 6.583 15.359 2.996 1.00 . A A . 2 VAL HG11 1 1 2 399 1 1 2 VAL HG12 H 6.592 16.663 4.184 1.00 . A A . 2 VAL HG12 1 1 2 400 1 1 2 VAL HG13 H 6.524 17.039 2.462 1.00 . A A . 2 VAL HG13 1 1 2 401 1 1 2 VAL HG21 H 4.560 18.382 2.739 1.00 . A A . 2 VAL HG21 1 1 2 402 1 1 2 VAL HG22 H 4.425 18.075 4.471 1.00 . A A . 2 VAL HG22 1 1 2 403 1 1 2 VAL HG23 H 3.067 17.721 3.404 1.00 . A A . 2 VAL HG23 1 1 2 404 1 1 2 VAL N N 4.324 16.716 0.891 1.00 . A A . 2 VAL N 1 1 2 405 1 1 2 VAL O O 2.303 14.285 2.484 1.00 . A A . 2 VAL O 1 1 2 406 1 1 3 VAL C C -0.074 14.988 1.114 1.00 . A A . 3 VAL C 1 1 2 407 1 1 3 VAL CA C 0.360 16.173 1.973 1.00 . A A . 3 VAL CA 1 1 2 408 1 1 3 VAL CB C -0.392 17.431 1.533 1.00 . A A . 3 VAL CB 1 1 2 409 1 1 3 VAL CG1 C -1.882 17.269 1.837 1.00 . A A . 3 VAL CG1 1 1 2 410 1 1 3 VAL CG2 C 0.153 18.642 2.295 1.00 . A A . 3 VAL CG2 1 1 2 411 1 1 3 VAL H H 2.134 17.259 1.571 1.00 . A A . 3 VAL H 1 1 2 412 1 1 3 VAL HA H 0.119 15.963 3.003 1.00 . A A . 3 VAL HA 1 1 2 413 1 1 3 VAL HB H -0.255 17.579 0.471 1.00 . A A . 3 VAL HB 1 1 2 414 1 1 3 VAL HG11 H -2.381 18.218 1.706 1.00 . A A . 3 VAL HG11 1 1 2 415 1 1 3 VAL HG12 H -2.007 16.935 2.857 1.00 . A A . 3 VAL HG12 1 1 2 416 1 1 3 VAL HG13 H -2.309 16.540 1.165 1.00 . A A . 3 VAL HG13 1 1 2 417 1 1 3 VAL HG21 H -0.036 18.518 3.351 1.00 . A A . 3 VAL HG21 1 1 2 418 1 1 3 VAL HG22 H -0.336 19.538 1.943 1.00 . A A . 3 VAL HG22 1 1 2 419 1 1 3 VAL HG23 H 1.217 18.723 2.127 1.00 . A A . 3 VAL HG23 1 1 2 420 1 1 3 VAL N N 1.797 16.384 1.855 1.00 . A A . 3 VAL N 1 1 2 421 1 1 3 VAL O O -0.929 14.201 1.514 1.00 . A A . 3 VAL O 1 1 2 422 1 1 4 ASP C C 0.426 12.427 -0.289 1.00 . A A . 4 ASP C 1 1 2 423 1 1 4 ASP CA C 0.190 13.773 -0.967 1.00 . A A . 4 ASP CA 1 1 2 424 1 1 4 ASP CB C 1.041 13.864 -2.236 1.00 . A A . 4 ASP CB 1 1 2 425 1 1 4 ASP CG C 0.532 12.872 -3.276 1.00 . A A . 4 ASP CG 1 1 2 426 1 1 4 ASP H H 1.201 15.523 -0.332 1.00 . A A . 4 ASP H 1 1 2 427 1 1 4 ASP HA H -0.852 13.849 -1.241 1.00 . A A . 4 ASP HA 1 1 2 428 1 1 4 ASP HB2 H 0.979 14.868 -2.637 1.00 . A A . 4 ASP HB2 1 1 2 429 1 1 4 ASP HB3 H 2.069 13.633 -1.994 1.00 . A A . 4 ASP HB3 1 1 2 430 1 1 4 ASP N N 0.523 14.867 -0.065 1.00 . A A . 4 ASP N 1 1 2 431 1 1 4 ASP O O -0.163 11.416 -0.674 1.00 . A A . 4 ASP O 1 1 2 432 1 1 4 ASP OD1 O -0.097 13.310 -4.225 1.00 . A A . 4 ASP OD1 1 1 2 433 1 1 4 ASP OD2 O 0.778 11.689 -3.107 1.00 . A A . 4 ASP OD2 1 1 2 434 1 1 5 ILE C C 0.421 10.747 2.299 1.00 . A A . 5 ILE C 1 1 2 435 1 1 5 ILE CA C 1.601 11.186 1.438 1.00 . A A . 5 ILE CA 1 1 2 436 1 1 5 ILE CB C 2.833 11.386 2.322 1.00 . A A . 5 ILE CB 1 1 2 437 1 1 5 ILE CD1 C 5.147 12.325 2.399 1.00 . A A . 5 ILE CD1 1 1 2 438 1 1 5 ILE CG1 C 3.967 11.985 1.487 1.00 . A A . 5 ILE CG1 1 1 2 439 1 1 5 ILE CG2 C 3.277 10.037 2.891 1.00 . A A . 5 ILE CG2 1 1 2 440 1 1 5 ILE H H 1.737 13.253 0.981 1.00 . A A . 5 ILE H 1 1 2 441 1 1 5 ILE HA H 1.811 10.412 0.721 1.00 . A A . 5 ILE HA 1 1 2 442 1 1 5 ILE HB H 2.588 12.056 3.134 1.00 . A A . 5 ILE HB 1 1 2 443 1 1 5 ILE HD11 H 5.563 11.415 2.804 1.00 . A A . 5 ILE HD11 1 1 2 444 1 1 5 ILE HD12 H 4.807 12.958 3.206 1.00 . A A . 5 ILE HD12 1 1 2 445 1 1 5 ILE HD13 H 5.904 12.845 1.829 1.00 . A A . 5 ILE HD13 1 1 2 446 1 1 5 ILE HG12 H 4.282 11.266 0.741 1.00 . A A . 5 ILE HG12 1 1 2 447 1 1 5 ILE HG13 H 3.619 12.886 0.999 1.00 . A A . 5 ILE HG13 1 1 2 448 1 1 5 ILE HG21 H 2.485 9.623 3.497 1.00 . A A . 5 ILE HG21 1 1 2 449 1 1 5 ILE HG22 H 4.160 10.176 3.498 1.00 . A A . 5 ILE HG22 1 1 2 450 1 1 5 ILE HG23 H 3.502 9.361 2.079 1.00 . A A . 5 ILE HG23 1 1 2 451 1 1 5 ILE N N 1.293 12.418 0.719 1.00 . A A . 5 ILE N 1 1 2 452 1 1 5 ILE O O 0.246 9.559 2.569 1.00 . A A . 5 ILE O 1 1 2 453 1 1 6 LEU C C -2.598 10.661 2.747 1.00 . A A . 6 LEU C 1 1 2 454 1 1 6 LEU CA C -1.544 11.410 3.557 1.00 . A A . 6 LEU CA 1 1 2 455 1 1 6 LEU CB C -2.137 12.712 4.114 1.00 . A A . 6 LEU CB 1 1 2 456 1 1 6 LEU CD1 C -1.644 14.500 5.797 1.00 . A A . 6 LEU CD1 1 1 2 457 1 1 6 LEU CD2 C -2.364 12.236 6.565 1.00 . A A . 6 LEU CD2 1 1 2 458 1 1 6 LEU CG C -1.560 13.000 5.507 1.00 . A A . 6 LEU CG 1 1 2 459 1 1 6 LEU H H -0.197 12.638 2.480 1.00 . A A . 6 LEU H 1 1 2 460 1 1 6 LEU HA H -1.229 10.786 4.379 1.00 . A A . 6 LEU HA 1 1 2 461 1 1 6 LEU HB2 H -1.891 13.529 3.448 1.00 . A A . 6 LEU HB2 1 1 2 462 1 1 6 LEU HB3 H -3.212 12.617 4.183 1.00 . A A . 6 LEU HB3 1 1 2 463 1 1 6 LEU HD11 H -1.247 14.699 6.781 1.00 . A A . 6 LEU HD11 1 1 2 464 1 1 6 LEU HD12 H -2.675 14.818 5.754 1.00 . A A . 6 LEU HD12 1 1 2 465 1 1 6 LEU HD13 H -1.069 15.041 5.060 1.00 . A A . 6 LEU HD13 1 1 2 466 1 1 6 LEU HD21 H -1.954 12.439 7.544 1.00 . A A . 6 LEU HD21 1 1 2 467 1 1 6 LEU HD22 H -2.310 11.176 6.365 1.00 . A A . 6 LEU HD22 1 1 2 468 1 1 6 LEU HD23 H -3.395 12.556 6.534 1.00 . A A . 6 LEU HD23 1 1 2 469 1 1 6 LEU HG H -0.527 12.685 5.542 1.00 . A A . 6 LEU HG 1 1 2 470 1 1 6 LEU N N -0.385 11.710 2.726 1.00 . A A . 6 LEU N 1 1 2 471 1 1 6 LEU O O -3.020 9.567 3.123 1.00 . A A . 6 LEU O 1 1 2 472 1 1 7 LYS C C -3.439 9.392 0.097 1.00 . A A . 7 LYS C 1 1 2 473 1 1 7 LYS CA C -4.019 10.625 0.784 1.00 . A A . 7 LYS CA 1 1 2 474 1 1 7 LYS CB C -4.512 11.625 -0.268 1.00 . A A . 7 LYS CB 1 1 2 475 1 1 7 LYS CD C -3.541 13.896 0.208 1.00 . A A . 7 LYS CD 1 1 2 476 1 1 7 LYS CE C -4.816 14.647 -0.204 1.00 . A A . 7 LYS CE 1 1 2 477 1 1 7 LYS CG C -3.392 12.611 -0.619 1.00 . A A . 7 LYS CG 1 1 2 478 1 1 7 LYS H H -2.651 12.120 1.374 1.00 . A A . 7 LYS H 1 1 2 479 1 1 7 LYS HA H -4.851 10.325 1.393 1.00 . A A . 7 LYS HA 1 1 2 480 1 1 7 LYS HB2 H -4.803 11.090 -1.154 1.00 . A A . 7 LYS HB2 1 1 2 481 1 1 7 LYS HB3 H -5.362 12.165 0.119 1.00 . A A . 7 LYS HB3 1 1 2 482 1 1 7 LYS HD2 H -3.595 13.642 1.257 1.00 . A A . 7 LYS HD2 1 1 2 483 1 1 7 LYS HD3 H -2.685 14.530 0.037 1.00 . A A . 7 LYS HD3 1 1 2 484 1 1 7 LYS HE2 H -5.120 14.337 -1.193 1.00 . A A . 7 LYS HE2 1 1 2 485 1 1 7 LYS HE3 H -5.607 14.431 0.500 1.00 . A A . 7 LYS HE3 1 1 2 486 1 1 7 LYS HG2 H -2.438 12.155 -0.406 1.00 . A A . 7 LYS HG2 1 1 2 487 1 1 7 LYS HG3 H -3.444 12.856 -1.670 1.00 . A A . 7 LYS HG3 1 1 2 488 1 1 7 LYS HZ1 H -5.447 16.632 -0.243 1.00 . A A . 7 LYS HZ1 1 1 2 489 1 1 7 LYS HZ2 H -3.970 16.357 -1.039 1.00 . A A . 7 LYS HZ2 1 1 2 490 1 1 7 LYS HZ3 H -4.033 16.374 0.658 1.00 . A A . 7 LYS HZ3 1 1 2 491 1 1 7 LYS N N -3.019 11.252 1.633 1.00 . A A . 7 LYS N 1 1 2 492 1 1 7 LYS NZ N -4.546 16.113 -0.207 1.00 . A A . 7 LYS NZ 1 1 2 493 1 1 7 LYS O O -4.148 8.417 -0.153 1.00 . A A . 7 LYS O 1 1 2 494 1 1 8 GLY C C -1.661 7.036 -0.056 1.00 . A A . 8 GLY C 1 1 2 495 1 1 8 GLY CA C -1.480 8.321 -0.858 1.00 . A A . 8 GLY CA 1 1 2 496 1 1 8 GLY H H -1.628 10.243 0.022 1.00 . A A . 8 GLY H 1 1 2 497 1 1 8 GLY HA2 H -1.901 8.187 -1.845 1.00 . A A . 8 GLY HA2 1 1 2 498 1 1 8 GLY HA3 H -0.426 8.535 -0.947 1.00 . A A . 8 GLY HA3 1 1 2 499 1 1 8 GLY N N -2.144 9.441 -0.202 1.00 . A A . 8 GLY N 1 1 2 500 1 1 8 GLY O O -1.840 5.958 -0.624 1.00 . A A . 8 GLY O 1 1 2 501 1 1 9 ALA C C -3.095 5.297 1.861 1.00 . A A . 9 ALA C 1 1 2 502 1 1 9 ALA CA C -1.771 6.001 2.139 1.00 . A A . 9 ALA CA 1 1 2 503 1 1 9 ALA CB C -1.722 6.440 3.602 1.00 . A A . 9 ALA CB 1 1 2 504 1 1 9 ALA H H -1.466 8.043 1.662 1.00 . A A . 9 ALA H 1 1 2 505 1 1 9 ALA HA H -0.962 5.311 1.955 1.00 . A A . 9 ALA HA 1 1 2 506 1 1 9 ALA HB1 H -1.697 5.568 4.240 1.00 . A A . 9 ALA HB1 1 1 2 507 1 1 9 ALA HB2 H -2.597 7.028 3.832 1.00 . A A . 9 ALA HB2 1 1 2 508 1 1 9 ALA HB3 H -0.834 7.034 3.771 1.00 . A A . 9 ALA HB3 1 1 2 509 1 1 9 ALA N N -1.612 7.159 1.266 1.00 . A A . 9 ALA N 1 1 2 510 1 1 9 ALA O O -3.210 4.082 2.026 1.00 . A A . 9 ALA O 1 1 2 511 1 1 10 ALA C C -5.282 4.395 0.098 1.00 . A A . 10 ALA C 1 1 2 512 1 1 10 ALA CA C -5.403 5.501 1.141 1.00 . A A . 10 ALA CA 1 1 2 513 1 1 10 ALA CB C -6.339 6.595 0.624 1.00 . A A . 10 ALA CB 1 1 2 514 1 1 10 ALA H H -3.945 7.027 1.323 1.00 . A A . 10 ALA H 1 1 2 515 1 1 10 ALA HA H -5.820 5.085 2.046 1.00 . A A . 10 ALA HA 1 1 2 516 1 1 10 ALA HB1 H -7.353 6.223 0.609 1.00 . A A . 10 ALA HB1 1 1 2 517 1 1 10 ALA HB2 H -6.045 6.878 -0.376 1.00 . A A . 10 ALA HB2 1 1 2 518 1 1 10 ALA HB3 H -6.280 7.456 1.274 1.00 . A A . 10 ALA HB3 1 1 2 519 1 1 10 ALA N N -4.093 6.066 1.438 1.00 . A A . 10 ALA N 1 1 2 520 1 1 10 ALA O O -5.819 3.301 0.273 1.00 . A A . 10 ALA O 1 1 2 521 1 1 11 LYS C C -3.369 2.662 -1.655 1.00 . A A . 11 LYS C 1 1 2 522 1 1 11 LYS CA C -4.387 3.718 -2.052 1.00 . A A . 11 LYS CA 1 1 2 523 1 1 11 LYS CB C -3.935 4.412 -3.317 1.00 . A A . 11 LYS CB 1 1 2 524 1 1 11 LYS CD C -4.163 3.952 -5.730 1.00 . A A . 11 LYS CD 1 1 2 525 1 1 11 LYS CE C -3.893 2.961 -6.863 1.00 . A A . 11 LYS CE 1 1 2 526 1 1 11 LYS CG C -3.681 3.379 -4.417 1.00 . A A . 11 LYS CG 1 1 2 527 1 1 11 LYS H H -4.172 5.574 -1.073 1.00 . A A . 11 LYS H 1 1 2 528 1 1 11 LYS HA H -5.320 3.243 -2.250 1.00 . A A . 11 LYS HA 1 1 2 529 1 1 11 LYS HB2 H -4.699 5.108 -3.634 1.00 . A A . 11 LYS HB2 1 1 2 530 1 1 11 LYS HB3 H -3.039 4.942 -3.118 1.00 . A A . 11 LYS HB3 1 1 2 531 1 1 11 LYS HD2 H -5.221 4.149 -5.656 1.00 . A A . 11 LYS HD2 1 1 2 532 1 1 11 LYS HD3 H -3.639 4.867 -5.915 1.00 . A A . 11 LYS HD3 1 1 2 533 1 1 11 LYS HE2 H -2.879 2.595 -6.788 1.00 . A A . 11 LYS HE2 1 1 2 534 1 1 11 LYS HE3 H -4.581 2.132 -6.788 1.00 . A A . 11 LYS HE3 1 1 2 535 1 1 11 LYS HG2 H -2.625 3.162 -4.480 1.00 . A A . 11 LYS HG2 1 1 2 536 1 1 11 LYS HG3 H -4.223 2.478 -4.209 1.00 . A A . 11 LYS HG3 1 1 2 537 1 1 11 LYS HZ1 H -3.164 4.011 -8.508 1.00 . A A . 11 LYS HZ1 1 1 2 538 1 1 11 LYS HZ2 H -4.750 4.430 -8.065 1.00 . A A . 11 LYS HZ2 1 1 2 539 1 1 11 LYS HZ3 H -4.449 2.964 -8.870 1.00 . A A . 11 LYS HZ3 1 1 2 540 1 1 11 LYS N N -4.574 4.690 -0.988 1.00 . A A . 11 LYS N 1 1 2 541 1 1 11 LYS NZ N -4.078 3.643 -8.176 1.00 . A A . 11 LYS NZ 1 1 2 542 1 1 11 LYS O O -3.463 1.510 -2.080 1.00 . A A . 11 LYS O 1 1 2 543 1 1 12 ASP C C -2.077 0.820 0.087 1.00 . A A . 12 ASP C 1 1 2 544 1 1 12 ASP CA C -1.392 2.104 -0.364 1.00 . A A . 12 ASP CA 1 1 2 545 1 1 12 ASP CB C -0.594 2.702 0.796 1.00 . A A . 12 ASP CB 1 1 2 546 1 1 12 ASP CG C 0.536 1.760 1.192 1.00 . A A . 12 ASP CG 1 1 2 547 1 1 12 ASP H H -2.384 3.978 -0.508 1.00 . A A . 12 ASP H 1 1 2 548 1 1 12 ASP HA H -0.720 1.881 -1.179 1.00 . A A . 12 ASP HA 1 1 2 549 1 1 12 ASP HB2 H -0.180 3.653 0.494 1.00 . A A . 12 ASP HB2 1 1 2 550 1 1 12 ASP HB3 H -1.249 2.851 1.642 1.00 . A A . 12 ASP HB3 1 1 2 551 1 1 12 ASP N N -2.405 3.051 -0.824 1.00 . A A . 12 ASP N 1 1 2 552 1 1 12 ASP O O -1.433 -0.200 0.334 1.00 . A A . 12 ASP O 1 1 2 553 1 1 12 ASP OD1 O 0.350 1.006 2.133 1.00 . A A . 12 ASP OD1 1 1 2 554 1 1 12 ASP OD2 O 1.572 1.805 0.549 1.00 . A A . 12 ASP OD2 1 1 2 555 1 1 13 ILE C C -3.961 -1.426 -0.325 1.00 . A A . 13 ILE C 1 1 2 556 1 1 13 ILE CA C -4.221 -0.230 0.578 1.00 . A A . 13 ILE CA 1 1 2 557 1 1 13 ILE CB C -5.675 0.223 0.434 1.00 . A A . 13 ILE CB 1 1 2 558 1 1 13 ILE CD1 C -6.796 -0.383 2.573 1.00 . A A . 13 ILE CD1 1 1 2 559 1 1 13 ILE CG1 C -6.161 0.756 1.785 1.00 . A A . 13 ILE CG1 1 1 2 560 1 1 13 ILE CG2 C -6.567 -0.932 -0.052 1.00 . A A . 13 ILE CG2 1 1 2 561 1 1 13 ILE H H -3.846 1.739 -0.039 1.00 . A A . 13 ILE H 1 1 2 562 1 1 13 ILE HA H -4.022 -0.490 1.604 1.00 . A A . 13 ILE HA 1 1 2 563 1 1 13 ILE HB H -5.719 1.022 -0.294 1.00 . A A . 13 ILE HB 1 1 2 564 1 1 13 ILE HD11 H -7.778 -0.589 2.175 1.00 . A A . 13 ILE HD11 1 1 2 565 1 1 13 ILE HD12 H -6.874 -0.101 3.608 1.00 . A A . 13 ILE HD12 1 1 2 566 1 1 13 ILE HD13 H -6.179 -1.266 2.482 1.00 . A A . 13 ILE HD13 1 1 2 567 1 1 13 ILE HG12 H -5.320 1.156 2.339 1.00 . A A . 13 ILE HG12 1 1 2 568 1 1 13 ILE HG13 H -6.884 1.538 1.624 1.00 . A A . 13 ILE HG13 1 1 2 569 1 1 13 ILE HG21 H -6.318 -1.836 0.484 1.00 . A A . 13 ILE HG21 1 1 2 570 1 1 13 ILE HG22 H -6.410 -1.087 -1.110 1.00 . A A . 13 ILE HG22 1 1 2 571 1 1 13 ILE HG23 H -7.603 -0.684 0.121 1.00 . A A . 13 ILE HG23 1 1 2 572 1 1 13 ILE N N -3.400 0.894 0.176 1.00 . A A . 13 ILE N 1 1 2 573 1 1 13 ILE O O -3.615 -2.515 0.133 1.00 . A A . 13 ILE O 1 1 2 574 1 1 14 ALA C C -2.543 -2.860 -2.445 1.00 . A A . 14 ALA C 1 1 2 575 1 1 14 ALA CA C -3.926 -2.239 -2.607 1.00 . A A . 14 ALA CA 1 1 2 576 1 1 14 ALA CB C -4.064 -1.652 -4.013 1.00 . A A . 14 ALA CB 1 1 2 577 1 1 14 ALA H H -4.422 -0.304 -1.888 1.00 . A A . 14 ALA H 1 1 2 578 1 1 14 ALA HA H -4.674 -3.005 -2.475 1.00 . A A . 14 ALA HA 1 1 2 579 1 1 14 ALA HB1 H -4.047 -2.451 -4.739 1.00 . A A . 14 ALA HB1 1 1 2 580 1 1 14 ALA HB2 H -3.242 -0.975 -4.202 1.00 . A A . 14 ALA HB2 1 1 2 581 1 1 14 ALA HB3 H -4.998 -1.115 -4.090 1.00 . A A . 14 ALA HB3 1 1 2 582 1 1 14 ALA N N -4.135 -1.196 -1.609 1.00 . A A . 14 ALA N 1 1 2 583 1 1 14 ALA O O -2.387 -4.078 -2.516 1.00 . A A . 14 ALA O 1 1 2 584 1 1 15 GLY C C 0.005 -3.169 -0.706 1.00 . A A . 15 GLY C 1 1 2 585 1 1 15 GLY CA C -0.176 -2.485 -2.058 1.00 . A A . 15 GLY CA 1 1 2 586 1 1 15 GLY H H -1.731 -1.051 -2.182 1.00 . A A . 15 GLY H 1 1 2 587 1 1 15 GLY HA2 H 0.057 -3.187 -2.845 1.00 . A A . 15 GLY HA2 1 1 2 588 1 1 15 GLY HA3 H 0.499 -1.645 -2.121 1.00 . A A . 15 GLY HA3 1 1 2 589 1 1 15 GLY N N -1.544 -2.012 -2.228 1.00 . A A . 15 GLY N 1 1 2 590 1 1 15 GLY O O 0.817 -4.084 -0.568 1.00 . A A . 15 GLY O 1 1 2 591 1 1 16 HIS C C -1.257 -4.693 1.655 1.00 . A A . 16 HIS C 1 1 2 592 1 1 16 HIS CA C -0.658 -3.290 1.626 1.00 . A A . 16 HIS CA 1 1 2 593 1 1 16 HIS CB C -1.390 -2.395 2.629 1.00 . A A . 16 HIS CB 1 1 2 594 1 1 16 HIS CD2 C -2.497 -3.611 4.677 1.00 . A A . 16 HIS CD2 1 1 2 595 1 1 16 HIS CE1 C -0.712 -3.916 5.867 1.00 . A A . 16 HIS CE1 1 1 2 596 1 1 16 HIS CG C -1.450 -3.078 3.967 1.00 . A A . 16 HIS CG 1 1 2 597 1 1 16 HIS H H -1.378 -1.981 0.124 1.00 . A A . 16 HIS H 1 1 2 598 1 1 16 HIS HA H 0.383 -3.349 1.909 1.00 . A A . 16 HIS HA 1 1 2 599 1 1 16 HIS HB2 H -0.861 -1.458 2.727 1.00 . A A . 16 HIS HB2 1 1 2 600 1 1 16 HIS HB3 H -2.393 -2.207 2.276 1.00 . A A . 16 HIS HB3 1 1 2 601 1 1 16 HIS HD2 H -3.527 -3.619 4.353 1.00 . A A . 16 HIS HD2 1 1 2 602 1 1 16 HIS HE1 H -0.043 -4.208 6.662 1.00 . A A . 16 HIS HE1 1 1 2 603 1 1 16 HIS HE2 H -2.553 -4.581 6.577 1.00 . A A . 16 HIS HE2 1 1 2 604 1 1 16 HIS N N -0.751 -2.715 0.290 1.00 . A A . 16 HIS N 1 1 2 605 1 1 16 HIS ND1 N -0.321 -3.284 4.745 1.00 . A A . 16 HIS ND1 1 1 2 606 1 1 16 HIS NE2 N -2.029 -4.140 5.876 1.00 . A A . 16 HIS NE2 1 1 2 607 1 1 16 HIS O O -0.630 -5.634 2.142 1.00 . A A . 16 HIS O 1 1 2 608 1 1 17 LEU C C -2.453 -7.058 0.124 1.00 . A A . 17 LEU C 1 1 2 609 1 1 17 LEU CA C -3.138 -6.119 1.109 1.00 . A A . 17 LEU CA 1 1 2 610 1 1 17 LEU CB C -4.614 -5.924 0.738 1.00 . A A . 17 LEU CB 1 1 2 611 1 1 17 LEU CD1 C -4.992 -7.164 -1.432 1.00 . A A . 17 LEU CD1 1 1 2 612 1 1 17 LEU CD2 C -5.989 -4.892 -1.087 1.00 . A A . 17 LEU CD2 1 1 2 613 1 1 17 LEU CG C -4.777 -5.784 -0.786 1.00 . A A . 17 LEU CG 1 1 2 614 1 1 17 LEU H H -2.932 -4.053 0.762 1.00 . A A . 17 LEU H 1 1 2 615 1 1 17 LEU HA H -3.085 -6.553 2.095 1.00 . A A . 17 LEU HA 1 1 2 616 1 1 17 LEU HB2 H -5.180 -6.768 1.086 1.00 . A A . 17 LEU HB2 1 1 2 617 1 1 17 LEU HB3 H -4.982 -5.030 1.219 1.00 . A A . 17 LEU HB3 1 1 2 618 1 1 17 LEU HD11 H -4.472 -7.201 -2.378 1.00 . A A . 17 LEU HD11 1 1 2 619 1 1 17 LEU HD12 H -6.047 -7.327 -1.599 1.00 . A A . 17 LEU HD12 1 1 2 620 1 1 17 LEU HD13 H -4.610 -7.938 -0.783 1.00 . A A . 17 LEU HD13 1 1 2 621 1 1 17 LEU HD21 H -6.875 -5.334 -0.654 1.00 . A A . 17 LEU HD21 1 1 2 622 1 1 17 LEU HD22 H -6.115 -4.805 -2.155 1.00 . A A . 17 LEU HD22 1 1 2 623 1 1 17 LEU HD23 H -5.829 -3.913 -0.661 1.00 . A A . 17 LEU HD23 1 1 2 624 1 1 17 LEU HG H -3.890 -5.330 -1.202 1.00 . A A . 17 LEU HG 1 1 2 625 1 1 17 LEU N N -2.473 -4.830 1.133 1.00 . A A . 17 LEU N 1 1 2 626 1 1 17 LEU O O -2.440 -8.273 0.321 1.00 . A A . 17 LEU O 1 1 2 627 1 1 18 ALA C C 0.015 -7.989 -1.284 1.00 . A A . 18 ALA C 1 1 2 628 1 1 18 ALA CA C -1.181 -7.304 -1.922 1.00 . A A . 18 ALA CA 1 1 2 629 1 1 18 ALA CB C -0.717 -6.428 -3.088 1.00 . A A . 18 ALA CB 1 1 2 630 1 1 18 ALA H H -1.903 -5.520 -1.035 1.00 . A A . 18 ALA H 1 1 2 631 1 1 18 ALA HA H -1.854 -8.061 -2.296 1.00 . A A . 18 ALA HA 1 1 2 632 1 1 18 ALA HB1 H -1.574 -6.108 -3.662 1.00 . A A . 18 ALA HB1 1 1 2 633 1 1 18 ALA HB2 H -0.051 -6.995 -3.721 1.00 . A A . 18 ALA HB2 1 1 2 634 1 1 18 ALA HB3 H -0.198 -5.561 -2.703 1.00 . A A . 18 ALA HB3 1 1 2 635 1 1 18 ALA N N -1.873 -6.494 -0.929 1.00 . A A . 18 ALA N 1 1 2 636 1 1 18 ALA O O 0.100 -9.213 -1.275 1.00 . A A . 18 ALA O 1 1 2 637 1 1 19 SER C C 1.675 -8.830 0.906 1.00 . A A . 19 SER C 1 1 2 638 1 1 19 SER CA C 2.101 -7.759 -0.088 1.00 . A A . 19 SER CA 1 1 2 639 1 1 19 SER CB C 2.884 -6.656 0.629 1.00 . A A . 19 SER CB 1 1 2 640 1 1 19 SER H H 0.805 -6.226 -0.760 1.00 . A A . 19 SER H 1 1 2 641 1 1 19 SER HA H 2.732 -8.212 -0.839 1.00 . A A . 19 SER HA 1 1 2 642 1 1 19 SER HB2 H 3.939 -6.794 0.467 1.00 . A A . 19 SER HB2 1 1 2 643 1 1 19 SER HB3 H 2.586 -5.693 0.235 1.00 . A A . 19 SER HB3 1 1 2 644 1 1 19 SER HG H 3.395 -6.409 2.490 1.00 . A A . 19 SER HG 1 1 2 645 1 1 19 SER N N 0.928 -7.197 -0.737 1.00 . A A . 19 SER N 1 1 2 646 1 1 19 SER O O 2.337 -9.857 1.050 1.00 . A A . 19 SER O 1 1 2 647 1 1 19 SER OG O 2.613 -6.713 2.024 1.00 . A A . 19 SER OG 1 1 2 648 1 1 20 LYS C C -0.246 -10.872 1.838 1.00 . A A . 20 LYS C 1 1 2 649 1 1 20 LYS CA C 0.033 -9.547 2.537 1.00 . A A . 20 LYS CA 1 1 2 650 1 1 20 LYS CB C -1.257 -8.998 3.156 1.00 . A A . 20 LYS CB 1 1 2 651 1 1 20 LYS CD C -1.007 -10.032 5.429 1.00 . A A . 20 LYS CD 1 1 2 652 1 1 20 LYS CE C -1.263 -9.754 6.912 1.00 . A A . 20 LYS CE 1 1 2 653 1 1 20 LYS CG C -1.041 -8.715 4.647 1.00 . A A . 20 LYS CG 1 1 2 654 1 1 20 LYS H H 0.059 -7.760 1.409 1.00 . A A . 20 LYS H 1 1 2 655 1 1 20 LYS HA H 0.764 -9.701 3.314 1.00 . A A . 20 LYS HA 1 1 2 656 1 1 20 LYS HB2 H -1.523 -8.083 2.652 1.00 . A A . 20 LYS HB2 1 1 2 657 1 1 20 LYS HB3 H -2.056 -9.712 3.038 1.00 . A A . 20 LYS HB3 1 1 2 658 1 1 20 LYS HD2 H -1.770 -10.697 5.051 1.00 . A A . 20 LYS HD2 1 1 2 659 1 1 20 LYS HD3 H -0.039 -10.495 5.316 1.00 . A A . 20 LYS HD3 1 1 2 660 1 1 20 LYS HE2 H -0.663 -8.915 7.229 1.00 . A A . 20 LYS HE2 1 1 2 661 1 1 20 LYS HE3 H -2.308 -9.525 7.059 1.00 . A A . 20 LYS HE3 1 1 2 662 1 1 20 LYS HG2 H -0.104 -8.191 4.783 1.00 . A A . 20 LYS HG2 1 1 2 663 1 1 20 LYS HG3 H -1.845 -8.103 5.012 1.00 . A A . 20 LYS HG3 1 1 2 664 1 1 20 LYS HZ1 H -0.594 -10.661 8.661 1.00 . A A . 20 LYS HZ1 1 1 2 665 1 1 20 LYS HZ2 H -0.126 -11.467 7.241 1.00 . A A . 20 LYS HZ2 1 1 2 666 1 1 20 LYS HZ3 H -1.728 -11.580 7.798 1.00 . A A . 20 LYS HZ3 1 1 2 667 1 1 20 LYS N N 0.553 -8.591 1.574 1.00 . A A . 20 LYS N 1 1 2 668 1 1 20 LYS NZ N -0.900 -10.957 7.713 1.00 . A A . 20 LYS NZ 1 1 2 669 1 1 20 LYS O O 0.218 -11.929 2.268 1.00 . A A . 20 LYS O 1 1 2 670 1 1 21 VAL C C -0.159 -12.491 -0.806 1.00 . A A . 21 VAL C 1 1 2 671 1 1 21 VAL CA C -1.357 -11.986 -0.012 1.00 . A A . 21 VAL CA 1 1 2 672 1 1 21 VAL CB C -2.515 -11.684 -0.961 1.00 . A A . 21 VAL CB 1 1 2 673 1 1 21 VAL CG1 C -2.942 -12.978 -1.649 1.00 . A A . 21 VAL CG1 1 1 2 674 1 1 21 VAL CG2 C -3.696 -11.116 -0.168 1.00 . A A . 21 VAL CG2 1 1 2 675 1 1 21 VAL H H -1.350 -9.925 0.468 1.00 . A A . 21 VAL H 1 1 2 676 1 1 21 VAL HA H -1.664 -12.754 0.666 1.00 . A A . 21 VAL HA 1 1 2 677 1 1 21 VAL HB H -2.196 -10.967 -1.705 1.00 . A A . 21 VAL HB 1 1 2 678 1 1 21 VAL HG11 H -3.851 -12.806 -2.206 1.00 . A A . 21 VAL HG11 1 1 2 679 1 1 21 VAL HG12 H -3.116 -13.739 -0.901 1.00 . A A . 21 VAL HG12 1 1 2 680 1 1 21 VAL HG13 H -2.162 -13.303 -2.320 1.00 . A A . 21 VAL HG13 1 1 2 681 1 1 21 VAL HG21 H -4.204 -11.919 0.346 1.00 . A A . 21 VAL HG21 1 1 2 682 1 1 21 VAL HG22 H -4.384 -10.632 -0.845 1.00 . A A . 21 VAL HG22 1 1 2 683 1 1 21 VAL HG23 H -3.336 -10.398 0.553 1.00 . A A . 21 VAL HG23 1 1 2 684 1 1 21 VAL N N -1.012 -10.798 0.755 1.00 . A A . 21 VAL N 1 1 2 685 1 1 21 VAL O O 0.093 -13.694 -0.865 1.00 . A A . 21 VAL O 1 1 2 686 1 1 22 MET C C 2.746 -12.697 -1.330 1.00 . A A . 22 MET C 1 1 2 687 1 1 22 MET CA C 1.744 -11.944 -2.200 1.00 . A A . 22 MET CA 1 1 2 688 1 1 22 MET CB C 2.404 -10.695 -2.794 1.00 . A A . 22 MET CB 1 1 2 689 1 1 22 MET CE C 4.499 -10.862 -5.558 1.00 . A A . 22 MET CE 1 1 2 690 1 1 22 MET CG C 2.108 -10.611 -4.295 1.00 . A A . 22 MET CG 1 1 2 691 1 1 22 MET H H 0.326 -10.624 -1.330 1.00 . A A . 22 MET H 1 1 2 692 1 1 22 MET HA H 1.429 -12.587 -3.004 1.00 . A A . 22 MET HA 1 1 2 693 1 1 22 MET HB2 H 2.009 -9.825 -2.305 1.00 . A A . 22 MET HB2 1 1 2 694 1 1 22 MET HB3 H 3.472 -10.739 -2.643 1.00 . A A . 22 MET HB3 1 1 2 695 1 1 22 MET HE1 H 4.293 -10.269 -6.439 1.00 . A A . 22 MET HE1 1 1 2 696 1 1 22 MET HE2 H 5.350 -11.497 -5.748 1.00 . A A . 22 MET HE2 1 1 2 697 1 1 22 MET HE3 H 4.716 -10.212 -4.722 1.00 . A A . 22 MET HE3 1 1 2 698 1 1 22 MET HG2 H 1.051 -10.771 -4.464 1.00 . A A . 22 MET HG2 1 1 2 699 1 1 22 MET HG3 H 2.391 -9.633 -4.664 1.00 . A A . 22 MET HG3 1 1 2 700 1 1 22 MET N N 0.576 -11.569 -1.413 1.00 . A A . 22 MET N 1 1 2 701 1 1 22 MET O O 3.195 -13.788 -1.682 1.00 . A A . 22 MET O 1 1 2 702 1 1 22 MET SD S 3.056 -11.882 -5.169 1.00 . A A . 22 MET SD 1 1 2 703 1 1 23 ASN C C 3.556 -14.118 1.135 1.00 . A A . 23 ASN C 1 1 2 704 1 1 23 ASN CA C 4.034 -12.729 0.727 1.00 . A A . 23 ASN CA 1 1 2 705 1 1 23 ASN CB C 4.204 -11.865 1.969 1.00 . A A . 23 ASN CB 1 1 2 706 1 1 23 ASN CG C 5.405 -12.341 2.778 1.00 . A A . 23 ASN CG 1 1 2 707 1 1 23 ASN H H 2.695 -11.238 0.037 1.00 . A A . 23 ASN H 1 1 2 708 1 1 23 ASN HA H 4.987 -12.817 0.242 1.00 . A A . 23 ASN HA 1 1 2 709 1 1 23 ASN HB2 H 4.354 -10.836 1.675 1.00 . A A . 23 ASN HB2 1 1 2 710 1 1 23 ASN HB3 H 3.319 -11.940 2.569 1.00 . A A . 23 ASN HB3 1 1 2 711 1 1 23 ASN HD21 H 6.713 -11.969 1.332 1.00 . A A . 23 ASN HD21 1 1 2 712 1 1 23 ASN HD22 H 7.373 -12.606 2.760 1.00 . A A . 23 ASN HD22 1 1 2 713 1 1 23 ASN N N 3.088 -12.106 -0.190 1.00 . A A . 23 ASN N 1 1 2 714 1 1 23 ASN ND2 N 6.595 -12.303 2.245 1.00 . A A . 23 ASN ND2 1 1 2 715 1 1 23 ASN O O 4.360 -15.030 1.326 1.00 . A A . 23 ASN O 1 1 2 716 1 1 23 ASN OD1 O 5.255 -12.761 3.926 1.00 . A A . 23 ASN OD1 1 1 2 717 1 1 24 LYS C C 1.972 -16.613 0.592 1.00 . A A . 24 LYS C 1 1 2 718 1 1 24 LYS CA C 1.672 -15.558 1.650 1.00 . A A . 24 LYS CA 1 1 2 719 1 1 24 LYS CB C 0.157 -15.425 1.829 1.00 . A A . 24 LYS CB 1 1 2 720 1 1 24 LYS CD C -1.863 -16.424 2.914 1.00 . A A . 24 LYS CD 1 1 2 721 1 1 24 LYS CE C -2.674 -16.535 1.620 1.00 . A A . 24 LYS CE 1 1 2 722 1 1 24 LYS CG C -0.374 -16.626 2.614 1.00 . A A . 24 LYS CG 1 1 2 723 1 1 24 LYS H H 1.647 -13.514 1.100 1.00 . A A . 24 LYS H 1 1 2 724 1 1 24 LYS HA H 2.108 -15.865 2.586 1.00 . A A . 24 LYS HA 1 1 2 725 1 1 24 LYS HB2 H -0.062 -14.514 2.368 1.00 . A A . 24 LYS HB2 1 1 2 726 1 1 24 LYS HB3 H -0.316 -15.392 0.859 1.00 . A A . 24 LYS HB3 1 1 2 727 1 1 24 LYS HD2 H -2.193 -17.180 3.612 1.00 . A A . 24 LYS HD2 1 1 2 728 1 1 24 LYS HD3 H -2.012 -15.446 3.346 1.00 . A A . 24 LYS HD3 1 1 2 729 1 1 24 LYS HE2 H -2.613 -15.605 1.076 1.00 . A A . 24 LYS HE2 1 1 2 730 1 1 24 LYS HE3 H -2.279 -17.335 1.012 1.00 . A A . 24 LYS HE3 1 1 2 731 1 1 24 LYS HG2 H -0.240 -17.525 2.030 1.00 . A A . 24 LYS HG2 1 1 2 732 1 1 24 LYS HG3 H 0.167 -16.717 3.543 1.00 . A A . 24 LYS HG3 1 1 2 733 1 1 24 LYS HZ1 H -4.171 -17.766 2.383 1.00 . A A . 24 LYS HZ1 1 1 2 734 1 1 24 LYS HZ2 H -4.669 -16.792 1.083 1.00 . A A . 24 LYS HZ2 1 1 2 735 1 1 24 LYS HZ3 H -4.448 -16.110 2.623 1.00 . A A . 24 LYS HZ3 1 1 2 736 1 1 24 LYS N N 2.242 -14.273 1.265 1.00 . A A . 24 LYS N 1 1 2 737 1 1 24 LYS NZ N -4.098 -16.822 1.953 1.00 . A A . 24 LYS NZ 1 1 2 738 1 1 24 LYS O O 2.553 -17.657 0.887 1.00 . A A . 24 LYS O 1 1 2 739 1 1 25 LEU C C 3.292 -17.441 -1.989 1.00 . A A . 25 LEU C 1 1 2 740 1 1 25 LEU CA C 1.797 -17.255 -1.740 1.00 . A A . 25 LEU CA 1 1 2 741 1 1 25 LEU CB C 1.124 -16.711 -2.995 1.00 . A A . 25 LEU CB 1 1 2 742 1 1 25 LEU CD1 C 0.048 -17.297 -5.161 1.00 . A A . 25 LEU CD1 1 1 2 743 1 1 25 LEU CD2 C 2.046 -18.578 -4.375 1.00 . A A . 25 LEU CD2 1 1 2 744 1 1 25 LEU CG C 0.767 -17.860 -3.936 1.00 . A A . 25 LEU CG 1 1 2 745 1 1 25 LEU H H 1.113 -15.487 -0.824 1.00 . A A . 25 LEU H 1 1 2 746 1 1 25 LEU HA H 1.361 -18.202 -1.498 1.00 . A A . 25 LEU HA 1 1 2 747 1 1 25 LEU HB2 H 0.222 -16.180 -2.717 1.00 . A A . 25 LEU HB2 1 1 2 748 1 1 25 LEU HB3 H 1.800 -16.039 -3.493 1.00 . A A . 25 LEU HB3 1 1 2 749 1 1 25 LEU HD11 H -0.948 -16.988 -4.881 1.00 . A A . 25 LEU HD11 1 1 2 750 1 1 25 LEU HD12 H -0.012 -18.059 -5.924 1.00 . A A . 25 LEU HD12 1 1 2 751 1 1 25 LEU HD13 H 0.596 -16.448 -5.540 1.00 . A A . 25 LEU HD13 1 1 2 752 1 1 25 LEU HD21 H 2.820 -17.849 -4.567 1.00 . A A . 25 LEU HD21 1 1 2 753 1 1 25 LEU HD22 H 1.853 -19.143 -5.272 1.00 . A A . 25 LEU HD22 1 1 2 754 1 1 25 LEU HD23 H 2.368 -19.247 -3.590 1.00 . A A . 25 LEU HD23 1 1 2 755 1 1 25 LEU HG H 0.116 -18.556 -3.426 1.00 . A A . 25 LEU HG 1 1 2 756 1 1 25 LEU N N 1.571 -16.332 -0.644 1.00 . A A . 25 LEU N 1 1 2 757 1 1 25 LEU O O 3.832 -18.526 -1.766 1.00 . A A . 25 LEU O 1 1 2 758 1 1 26 NH2 HN1 H 3.564 -15.574 -2.618 1.00 . A A . 26 NH2 HN1 1 1 2 759 1 1 26 NH2 HN2 H 4.962 -16.553 -2.604 1.00 . A A . 26 NH2 HN2 1 1 2 760 1 1 26 NH2 N N 3.998 -16.441 -2.440 1.00 . A A . 26 NH2 N 1 1 3 761 1 1 1 GLY C C 3.676 16.365 0.729 1.00 . A A . 1 GLY C 1 1 3 762 1 1 1 GLY CA C 4.459 17.397 -0.073 1.00 . A A . 1 GLY CA 1 1 3 763 1 1 1 GLY H1 H 3.979 16.751 -1.994 1.00 . A A . 1 GLY H1 1 1 3 764 1 1 1 GLY H2 H 4.221 18.427 -1.867 1.00 . A A . 1 GLY H2 1 1 3 765 1 1 1 GLY H3 H 2.790 17.726 -1.276 1.00 . A A . 1 GLY H3 1 1 3 766 1 1 1 GLY HA2 H 5.475 17.053 -0.213 1.00 . A A . 1 GLY HA2 1 1 3 767 1 1 1 GLY HA3 H 4.466 18.334 0.463 1.00 . A A . 1 GLY HA3 1 1 3 768 1 1 1 GLY N N 3.813 17.590 -1.403 1.00 . A A . 1 GLY N 1 1 3 769 1 1 1 GLY O O 3.179 15.383 0.177 1.00 . A A . 1 GLY O 1 1 3 770 1 1 2 VAL C C 1.468 15.363 2.327 1.00 . A A . 2 VAL C 1 1 3 771 1 1 2 VAL CA C 2.845 15.673 2.904 1.00 . A A . 2 VAL CA 1 1 3 772 1 1 2 VAL CB C 2.692 16.284 4.297 1.00 . A A . 2 VAL CB 1 1 3 773 1 1 2 VAL CG1 C 1.933 17.608 4.194 1.00 . A A . 2 VAL CG1 1 1 3 774 1 1 2 VAL CG2 C 1.913 15.319 5.193 1.00 . A A . 2 VAL CG2 1 1 3 775 1 1 2 VAL H H 3.988 17.391 2.419 1.00 . A A . 2 VAL H 1 1 3 776 1 1 2 VAL HA H 3.406 14.753 2.986 1.00 . A A . 2 VAL HA 1 1 3 777 1 1 2 VAL HB H 3.670 16.463 4.721 1.00 . A A . 2 VAL HB 1 1 3 778 1 1 2 VAL HG11 H 0.905 17.413 3.924 1.00 . A A . 2 VAL HG11 1 1 3 779 1 1 2 VAL HG12 H 2.392 18.228 3.439 1.00 . A A . 2 VAL HG12 1 1 3 780 1 1 2 VAL HG13 H 1.965 18.116 5.146 1.00 . A A . 2 VAL HG13 1 1 3 781 1 1 2 VAL HG21 H 0.881 15.287 4.877 1.00 . A A . 2 VAL HG21 1 1 3 782 1 1 2 VAL HG22 H 1.964 15.658 6.218 1.00 . A A . 2 VAL HG22 1 1 3 783 1 1 2 VAL HG23 H 2.343 14.331 5.119 1.00 . A A . 2 VAL HG23 1 1 3 784 1 1 2 VAL N N 3.571 16.591 2.034 1.00 . A A . 2 VAL N 1 1 3 785 1 1 2 VAL O O 0.991 14.232 2.407 1.00 . A A . 2 VAL O 1 1 3 786 1 1 3 VAL C C -0.472 15.083 0.122 1.00 . A A . 3 VAL C 1 1 3 787 1 1 3 VAL CA C -0.489 16.202 1.159 1.00 . A A . 3 VAL CA 1 1 3 788 1 1 3 VAL CB C -0.944 17.504 0.498 1.00 . A A . 3 VAL CB 1 1 3 789 1 1 3 VAL CG1 C -2.362 17.332 -0.048 1.00 . A A . 3 VAL CG1 1 1 3 790 1 1 3 VAL CG2 C -0.932 18.632 1.533 1.00 . A A . 3 VAL CG2 1 1 3 791 1 1 3 VAL H H 1.264 17.257 1.711 1.00 . A A . 3 VAL H 1 1 3 792 1 1 3 VAL HA H -1.188 15.946 1.940 1.00 . A A . 3 VAL HA 1 1 3 793 1 1 3 VAL HB H -0.273 17.750 -0.313 1.00 . A A . 3 VAL HB 1 1 3 794 1 1 3 VAL HG11 H -2.353 16.610 -0.852 1.00 . A A . 3 VAL HG11 1 1 3 795 1 1 3 VAL HG12 H -2.722 18.279 -0.420 1.00 . A A . 3 VAL HG12 1 1 3 796 1 1 3 VAL HG13 H -3.013 16.984 0.741 1.00 . A A . 3 VAL HG13 1 1 3 797 1 1 3 VAL HG21 H 0.042 18.684 1.997 1.00 . A A . 3 VAL HG21 1 1 3 798 1 1 3 VAL HG22 H -1.679 18.436 2.288 1.00 . A A . 3 VAL HG22 1 1 3 799 1 1 3 VAL HG23 H -1.149 19.570 1.046 1.00 . A A . 3 VAL HG23 1 1 3 800 1 1 3 VAL N N 0.835 16.377 1.745 1.00 . A A . 3 VAL N 1 1 3 801 1 1 3 VAL O O -1.445 14.341 -0.021 1.00 . A A . 3 VAL O 1 1 3 802 1 1 4 ASP C C 0.924 12.559 -0.976 1.00 . A A . 4 ASP C 1 1 3 803 1 1 4 ASP CA C 0.772 13.934 -1.619 1.00 . A A . 4 ASP CA 1 1 3 804 1 1 4 ASP CB C 1.988 14.225 -2.500 1.00 . A A . 4 ASP CB 1 1 3 805 1 1 4 ASP CG C 2.150 13.123 -3.542 1.00 . A A . 4 ASP CG 1 1 3 806 1 1 4 ASP H H 1.382 15.586 -0.439 1.00 . A A . 4 ASP H 1 1 3 807 1 1 4 ASP HA H -0.114 13.936 -2.236 1.00 . A A . 4 ASP HA 1 1 3 808 1 1 4 ASP HB2 H 1.848 15.174 -3.001 1.00 . A A . 4 ASP HB2 1 1 3 809 1 1 4 ASP HB3 H 2.876 14.267 -1.883 1.00 . A A . 4 ASP HB3 1 1 3 810 1 1 4 ASP N N 0.640 14.967 -0.597 1.00 . A A . 4 ASP N 1 1 3 811 1 1 4 ASP O O 0.400 11.566 -1.479 1.00 . A A . 4 ASP O 1 1 3 812 1 1 4 ASP OD1 O 1.540 13.234 -4.592 1.00 . A A . 4 ASP OD1 1 1 3 813 1 1 4 ASP OD2 O 2.884 12.185 -3.274 1.00 . A A . 4 ASP OD2 1 1 3 814 1 1 5 ILE C C 0.591 10.816 1.563 1.00 . A A . 5 ILE C 1 1 3 815 1 1 5 ILE CA C 1.861 11.249 0.842 1.00 . A A . 5 ILE CA 1 1 3 816 1 1 5 ILE CB C 3.001 11.399 1.851 1.00 . A A . 5 ILE CB 1 1 3 817 1 1 5 ILE CD1 C 5.343 12.216 2.152 1.00 . A A . 5 ILE CD1 1 1 3 818 1 1 5 ILE CG1 C 4.261 11.876 1.126 1.00 . A A . 5 ILE CG1 1 1 3 819 1 1 5 ILE CG2 C 3.274 10.048 2.515 1.00 . A A . 5 ILE CG2 1 1 3 820 1 1 5 ILE H H 2.041 13.333 0.495 1.00 . A A . 5 ILE H 1 1 3 821 1 1 5 ILE HA H 2.127 10.492 0.126 1.00 . A A . 5 ILE HA 1 1 3 822 1 1 5 ILE HB H 2.721 12.120 2.606 1.00 . A A . 5 ILE HB 1 1 3 823 1 1 5 ILE HD11 H 5.022 13.057 2.748 1.00 . A A . 5 ILE HD11 1 1 3 824 1 1 5 ILE HD12 H 6.260 12.468 1.639 1.00 . A A . 5 ILE HD12 1 1 3 825 1 1 5 ILE HD13 H 5.513 11.364 2.793 1.00 . A A . 5 ILE HD13 1 1 3 826 1 1 5 ILE HG12 H 4.619 11.091 0.472 1.00 . A A . 5 ILE HG12 1 1 3 827 1 1 5 ILE HG13 H 4.030 12.757 0.543 1.00 . A A . 5 ILE HG13 1 1 3 828 1 1 5 ILE HG21 H 2.417 9.757 3.105 1.00 . A A . 5 ILE HG21 1 1 3 829 1 1 5 ILE HG22 H 4.140 10.131 3.155 1.00 . A A . 5 ILE HG22 1 1 3 830 1 1 5 ILE HG23 H 3.457 9.304 1.755 1.00 . A A . 5 ILE HG23 1 1 3 831 1 1 5 ILE N N 1.646 12.509 0.140 1.00 . A A . 5 ILE N 1 1 3 832 1 1 5 ILE O O 0.359 9.626 1.777 1.00 . A A . 5 ILE O 1 1 3 833 1 1 6 LEU C C -2.383 10.642 1.760 1.00 . A A . 6 LEU C 1 1 3 834 1 1 6 LEU CA C -1.475 11.508 2.631 1.00 . A A . 6 LEU CA 1 1 3 835 1 1 6 LEU CB C -2.185 12.825 2.978 1.00 . A A . 6 LEU CB 1 1 3 836 1 1 6 LEU CD1 C -2.150 14.689 4.652 1.00 . A A . 6 LEU CD1 1 1 3 837 1 1 6 LEU CD2 C -2.929 12.418 5.338 1.00 . A A . 6 LEU CD2 1 1 3 838 1 1 6 LEU CG C -1.943 13.185 4.452 1.00 . A A . 6 LEU CG 1 1 3 839 1 1 6 LEU H H 0.012 12.718 1.735 1.00 . A A . 6 LEU H 1 1 3 840 1 1 6 LEU HA H -1.254 10.973 3.543 1.00 . A A . 6 LEU HA 1 1 3 841 1 1 6 LEU HB2 H -1.794 13.615 2.349 1.00 . A A . 6 LEU HB2 1 1 3 842 1 1 6 LEU HB3 H -3.249 12.722 2.807 1.00 . A A . 6 LEU HB3 1 1 3 843 1 1 6 LEU HD11 H -1.348 15.228 4.171 1.00 . A A . 6 LEU HD11 1 1 3 844 1 1 6 LEU HD12 H -2.153 14.914 5.708 1.00 . A A . 6 LEU HD12 1 1 3 845 1 1 6 LEU HD13 H -3.094 14.982 4.217 1.00 . A A . 6 LEU HD13 1 1 3 846 1 1 6 LEU HD21 H -3.940 12.662 5.045 1.00 . A A . 6 LEU HD21 1 1 3 847 1 1 6 LEU HD22 H -2.777 12.697 6.370 1.00 . A A . 6 LEU HD22 1 1 3 848 1 1 6 LEU HD23 H -2.769 11.357 5.224 1.00 . A A . 6 LEU HD23 1 1 3 849 1 1 6 LEU HG H -0.930 12.924 4.727 1.00 . A A . 6 LEU HG 1 1 3 850 1 1 6 LEU N N -0.227 11.791 1.935 1.00 . A A . 6 LEU N 1 1 3 851 1 1 6 LEU O O -3.056 9.738 2.255 1.00 . A A . 6 LEU O 1 1 3 852 1 1 7 LYS C C -2.591 8.787 -0.739 1.00 . A A . 7 LYS C 1 1 3 853 1 1 7 LYS CA C -3.220 10.154 -0.467 1.00 . A A . 7 LYS CA 1 1 3 854 1 1 7 LYS CB C -3.437 10.915 -1.794 1.00 . A A . 7 LYS CB 1 1 3 855 1 1 7 LYS CD C -5.039 12.518 -0.725 1.00 . A A . 7 LYS CD 1 1 3 856 1 1 7 LYS CE C -6.193 13.456 -1.085 1.00 . A A . 7 LYS CE 1 1 3 857 1 1 7 LYS CG C -4.862 11.473 -1.834 1.00 . A A . 7 LYS CG 1 1 3 858 1 1 7 LYS H H -1.829 11.651 0.127 1.00 . A A . 7 LYS H 1 1 3 859 1 1 7 LYS HA H -4.183 9.995 -0.005 1.00 . A A . 7 LYS HA 1 1 3 860 1 1 7 LYS HB2 H -2.735 11.732 -1.883 1.00 . A A . 7 LYS HB2 1 1 3 861 1 1 7 LYS HB3 H -3.300 10.239 -2.622 1.00 . A A . 7 LYS HB3 1 1 3 862 1 1 7 LYS HD2 H -5.258 12.020 0.208 1.00 . A A . 7 LYS HD2 1 1 3 863 1 1 7 LYS HD3 H -4.130 13.093 -0.621 1.00 . A A . 7 LYS HD3 1 1 3 864 1 1 7 LYS HE2 H -6.437 14.071 -0.231 1.00 . A A . 7 LYS HE2 1 1 3 865 1 1 7 LYS HE3 H -5.900 14.088 -1.910 1.00 . A A . 7 LYS HE3 1 1 3 866 1 1 7 LYS HG2 H -5.037 11.930 -2.792 1.00 . A A . 7 LYS HG2 1 1 3 867 1 1 7 LYS HG3 H -5.569 10.671 -1.684 1.00 . A A . 7 LYS HG3 1 1 3 868 1 1 7 LYS HZ1 H -7.897 13.136 -2.237 1.00 . A A . 7 LYS HZ1 1 1 3 869 1 1 7 LYS HZ2 H -8.011 12.538 -0.651 1.00 . A A . 7 LYS HZ2 1 1 3 870 1 1 7 LYS HZ3 H -7.077 11.715 -1.808 1.00 . A A . 7 LYS HZ3 1 1 3 871 1 1 7 LYS N N -2.391 10.922 0.462 1.00 . A A . 7 LYS N 1 1 3 872 1 1 7 LYS NZ N -7.385 12.650 -1.475 1.00 . A A . 7 LYS NZ 1 1 3 873 1 1 7 LYS O O -3.297 7.816 -1.010 1.00 . A A . 7 LYS O 1 1 3 874 1 1 8 GLY C C -0.928 6.419 0.149 1.00 . A A . 8 GLY C 1 1 3 875 1 1 8 GLY CA C -0.565 7.457 -0.908 1.00 . A A . 8 GLY CA 1 1 3 876 1 1 8 GLY H H -0.744 9.514 -0.443 1.00 . A A . 8 GLY H 1 1 3 877 1 1 8 GLY HA2 H -0.839 7.083 -1.884 1.00 . A A . 8 GLY HA2 1 1 3 878 1 1 8 GLY HA3 H 0.500 7.631 -0.880 1.00 . A A . 8 GLY HA3 1 1 3 879 1 1 8 GLY N N -1.263 8.715 -0.666 1.00 . A A . 8 GLY N 1 1 3 880 1 1 8 GLY O O -1.338 5.307 -0.178 1.00 . A A . 8 GLY O 1 1 3 881 1 1 9 ALA C C -2.558 5.496 2.484 1.00 . A A . 9 ALA C 1 1 3 882 1 1 9 ALA CA C -1.085 5.882 2.512 1.00 . A A . 9 ALA CA 1 1 3 883 1 1 9 ALA CB C -0.752 6.541 3.851 1.00 . A A . 9 ALA CB 1 1 3 884 1 1 9 ALA H H -0.440 7.691 1.616 1.00 . A A . 9 ALA H 1 1 3 885 1 1 9 ALA HA H -0.493 4.989 2.405 1.00 . A A . 9 ALA HA 1 1 3 886 1 1 9 ALA HB1 H -1.137 5.933 4.657 1.00 . A A . 9 ALA HB1 1 1 3 887 1 1 9 ALA HB2 H -1.203 7.522 3.892 1.00 . A A . 9 ALA HB2 1 1 3 888 1 1 9 ALA HB3 H 0.320 6.632 3.951 1.00 . A A . 9 ALA HB3 1 1 3 889 1 1 9 ALA N N -0.772 6.792 1.415 1.00 . A A . 9 ALA N 1 1 3 890 1 1 9 ALA O O -2.912 4.351 2.770 1.00 . A A . 9 ALA O 1 1 3 891 1 1 10 ALA C C -5.112 5.032 1.107 1.00 . A A . 10 ALA C 1 1 3 892 1 1 10 ALA CA C -4.841 6.179 2.073 1.00 . A A . 10 ALA CA 1 1 3 893 1 1 10 ALA CB C -5.592 7.429 1.611 1.00 . A A . 10 ALA CB 1 1 3 894 1 1 10 ALA H H -3.078 7.342 1.912 1.00 . A A . 10 ALA H 1 1 3 895 1 1 10 ALA HA H -5.190 5.902 3.056 1.00 . A A . 10 ALA HA 1 1 3 896 1 1 10 ALA HB1 H -6.613 7.169 1.375 1.00 . A A . 10 ALA HB1 1 1 3 897 1 1 10 ALA HB2 H -5.112 7.835 0.734 1.00 . A A . 10 ALA HB2 1 1 3 898 1 1 10 ALA HB3 H -5.582 8.167 2.401 1.00 . A A . 10 ALA HB3 1 1 3 899 1 1 10 ALA N N -3.413 6.449 2.135 1.00 . A A . 10 ALA N 1 1 3 900 1 1 10 ALA O O -5.781 4.064 1.453 1.00 . A A . 10 ALA O 1 1 3 901 1 1 11 LYS C C -3.806 2.971 -0.918 1.00 . A A . 11 LYS C 1 1 3 902 1 1 11 LYS CA C -4.767 4.127 -1.119 1.00 . A A . 11 LYS CA 1 1 3 903 1 1 11 LYS CB C -4.558 4.718 -2.490 1.00 . A A . 11 LYS CB 1 1 3 904 1 1 11 LYS CD C -5.455 4.264 -4.742 1.00 . A A . 11 LYS CD 1 1 3 905 1 1 11 LYS CE C -5.635 3.227 -5.853 1.00 . A A . 11 LYS CE 1 1 3 906 1 1 11 LYS CG C -4.747 3.641 -3.562 1.00 . A A . 11 LYS CG 1 1 3 907 1 1 11 LYS H H -4.063 5.947 -0.322 1.00 . A A . 11 LYS H 1 1 3 908 1 1 11 LYS HA H -5.766 3.755 -1.058 1.00 . A A . 11 LYS HA 1 1 3 909 1 1 11 LYS HB2 H -5.263 5.522 -2.645 1.00 . A A . 11 LYS HB2 1 1 3 910 1 1 11 LYS HB3 H -3.569 5.099 -2.544 1.00 . A A . 11 LYS HB3 1 1 3 911 1 1 11 LYS HD2 H -6.418 4.626 -4.416 1.00 . A A . 11 LYS HD2 1 1 3 912 1 1 11 LYS HD3 H -4.864 5.081 -5.100 1.00 . A A . 11 LYS HD3 1 1 3 913 1 1 11 LYS HE2 H -4.667 2.884 -6.185 1.00 . A A . 11 LYS HE2 1 1 3 914 1 1 11 LYS HE3 H -6.203 2.390 -5.474 1.00 . A A . 11 LYS HE3 1 1 3 915 1 1 11 LYS HG2 H -3.785 3.261 -3.874 1.00 . A A . 11 LYS HG2 1 1 3 916 1 1 11 LYS HG3 H -5.344 2.837 -3.180 1.00 . A A . 11 LYS HG3 1 1 3 917 1 1 11 LYS HZ1 H -6.234 4.877 -6.974 1.00 . A A . 11 LYS HZ1 1 1 3 918 1 1 11 LYS HZ2 H -7.377 3.620 -6.925 1.00 . A A . 11 LYS HZ2 1 1 3 919 1 1 11 LYS HZ3 H -5.987 3.471 -7.891 1.00 . A A . 11 LYS HZ3 1 1 3 920 1 1 11 LYS N N -4.585 5.153 -0.105 1.00 . A A . 11 LYS N 1 1 3 921 1 1 11 LYS NZ N -6.363 3.846 -6.996 1.00 . A A . 11 LYS NZ 1 1 3 922 1 1 11 LYS O O -4.087 1.848 -1.340 1.00 . A A . 11 LYS O 1 1 3 923 1 1 12 ASP C C -2.434 0.934 0.455 1.00 . A A . 12 ASP C 1 1 3 924 1 1 12 ASP CA C -1.695 2.182 -0.004 1.00 . A A . 12 ASP CA 1 1 3 925 1 1 12 ASP CB C -0.706 2.623 1.074 1.00 . A A . 12 ASP CB 1 1 3 926 1 1 12 ASP CG C 0.266 1.490 1.383 1.00 . A A . 12 ASP CG 1 1 3 927 1 1 12 ASP H H -2.507 4.152 0.046 1.00 . A A . 12 ASP H 1 1 3 928 1 1 12 ASP HA H -1.157 1.963 -0.915 1.00 . A A . 12 ASP HA 1 1 3 929 1 1 12 ASP HB2 H -0.154 3.483 0.724 1.00 . A A . 12 ASP HB2 1 1 3 930 1 1 12 ASP HB3 H -1.247 2.883 1.971 1.00 . A A . 12 ASP HB3 1 1 3 931 1 1 12 ASP N N -2.676 3.239 -0.266 1.00 . A A . 12 ASP N 1 1 3 932 1 1 12 ASP O O -1.863 -0.148 0.592 1.00 . A A . 12 ASP O 1 1 3 933 1 1 12 ASP OD1 O 0.587 1.311 2.547 1.00 . A A . 12 ASP OD1 1 1 3 934 1 1 12 ASP OD2 O 0.676 0.817 0.452 1.00 . A A . 12 ASP OD2 1 1 3 935 1 1 13 ILE C C -4.518 -1.109 0.099 1.00 . A A . 13 ILE C 1 1 3 936 1 1 13 ILE CA C -4.624 0.057 1.071 1.00 . A A . 13 ILE CA 1 1 3 937 1 1 13 ILE CB C -6.049 0.616 1.024 1.00 . A A . 13 ILE CB 1 1 3 938 1 1 13 ILE CD1 C -7.577 2.299 2.044 1.00 . A A . 13 ILE CD1 1 1 3 939 1 1 13 ILE CG1 C -6.319 1.460 2.267 1.00 . A A . 13 ILE CG1 1 1 3 940 1 1 13 ILE CG2 C -7.068 -0.516 0.943 1.00 . A A . 13 ILE CG2 1 1 3 941 1 1 13 ILE H H -4.100 2.012 0.512 1.00 . A A . 13 ILE H 1 1 3 942 1 1 13 ILE HA H -4.390 -0.267 2.073 1.00 . A A . 13 ILE HA 1 1 3 943 1 1 13 ILE HB H -6.146 1.237 0.146 1.00 . A A . 13 ILE HB 1 1 3 944 1 1 13 ILE HD11 H -7.577 2.694 1.037 1.00 . A A . 13 ILE HD11 1 1 3 945 1 1 13 ILE HD12 H -7.596 3.114 2.749 1.00 . A A . 13 ILE HD12 1 1 3 946 1 1 13 ILE HD13 H -8.449 1.678 2.185 1.00 . A A . 13 ILE HD13 1 1 3 947 1 1 13 ILE HG12 H -6.466 0.809 3.112 1.00 . A A . 13 ILE HG12 1 1 3 948 1 1 13 ILE HG13 H -5.477 2.113 2.453 1.00 . A A . 13 ILE HG13 1 1 3 949 1 1 13 ILE HG21 H -7.098 -0.897 -0.067 1.00 . A A . 13 ILE HG21 1 1 3 950 1 1 13 ILE HG22 H -8.044 -0.138 1.214 1.00 . A A . 13 ILE HG22 1 1 3 951 1 1 13 ILE HG23 H -6.784 -1.305 1.620 1.00 . A A . 13 ILE HG23 1 1 3 952 1 1 13 ILE N N -3.730 1.119 0.660 1.00 . A A . 13 ILE N 1 1 3 953 1 1 13 ILE O O -4.276 -2.249 0.494 1.00 . A A . 13 ILE O 1 1 3 954 1 1 14 ALA C C -3.264 -2.516 -2.177 1.00 . A A . 14 ALA C 1 1 3 955 1 1 14 ALA CA C -4.620 -1.819 -2.219 1.00 . A A . 14 ALA CA 1 1 3 956 1 1 14 ALA CB C -4.825 -1.179 -3.594 1.00 . A A . 14 ALA CB 1 1 3 957 1 1 14 ALA H H -4.890 0.130 -1.423 1.00 . A A . 14 ALA H 1 1 3 958 1 1 14 ALA HA H -5.397 -2.551 -2.055 1.00 . A A . 14 ALA HA 1 1 3 959 1 1 14 ALA HB1 H -5.858 -0.884 -3.704 1.00 . A A . 14 ALA HB1 1 1 3 960 1 1 14 ALA HB2 H -4.571 -1.892 -4.364 1.00 . A A . 14 ALA HB2 1 1 3 961 1 1 14 ALA HB3 H -4.190 -0.310 -3.685 1.00 . A A . 14 ALA HB3 1 1 3 962 1 1 14 ALA N N -4.699 -0.802 -1.179 1.00 . A A . 14 ALA N 1 1 3 963 1 1 14 ALA O O -3.162 -3.713 -2.446 1.00 . A A . 14 ALA O 1 1 3 964 1 1 15 GLY C C -0.734 -3.216 -0.538 1.00 . A A . 15 GLY C 1 1 3 965 1 1 15 GLY CA C -0.880 -2.313 -1.757 1.00 . A A . 15 GLY CA 1 1 3 966 1 1 15 GLY H H -2.370 -0.811 -1.631 1.00 . A A . 15 GLY H 1 1 3 967 1 1 15 GLY HA2 H -0.681 -2.885 -2.652 1.00 . A A . 15 GLY HA2 1 1 3 968 1 1 15 GLY HA3 H -0.168 -1.505 -1.686 1.00 . A A . 15 GLY HA3 1 1 3 969 1 1 15 GLY N N -2.227 -1.759 -1.836 1.00 . A A . 15 GLY N 1 1 3 970 1 1 15 GLY O O -0.067 -4.248 -0.595 1.00 . A A . 15 GLY O 1 1 3 971 1 1 16 HIS C C -1.811 -5.021 1.540 1.00 . A A . 16 HIS C 1 1 3 972 1 1 16 HIS CA C -1.303 -3.604 1.789 1.00 . A A . 16 HIS CA 1 1 3 973 1 1 16 HIS CB C -2.145 -2.932 2.878 1.00 . A A . 16 HIS CB 1 1 3 974 1 1 16 HIS CD2 C -3.226 -4.711 4.478 1.00 . A A . 16 HIS CD2 1 1 3 975 1 1 16 HIS CE1 C -1.647 -4.806 5.960 1.00 . A A . 16 HIS CE1 1 1 3 976 1 1 16 HIS CG C -2.247 -3.839 4.073 1.00 . A A . 16 HIS CG 1 1 3 977 1 1 16 HIS H H -1.886 -1.991 0.548 1.00 . A A . 16 HIS H 1 1 3 978 1 1 16 HIS HA H -0.277 -3.653 2.122 1.00 . A A . 16 HIS HA 1 1 3 979 1 1 16 HIS HB2 H -1.676 -2.003 3.171 1.00 . A A . 16 HIS HB2 1 1 3 980 1 1 16 HIS HB3 H -3.134 -2.731 2.494 1.00 . A A . 16 HIS HB3 1 1 3 981 1 1 16 HIS HD2 H -4.151 -4.895 3.952 1.00 . A A . 16 HIS HD2 1 1 3 982 1 1 16 HIS HE1 H -1.068 -5.073 6.832 1.00 . A A . 16 HIS HE1 1 1 3 983 1 1 16 HIS HE2 H -3.348 -5.985 6.186 1.00 . A A . 16 HIS HE2 1 1 3 984 1 1 16 HIS N N -1.367 -2.821 0.563 1.00 . A A . 16 HIS N 1 1 3 985 1 1 16 HIS ND1 N -1.250 -3.916 5.032 1.00 . A A . 16 HIS ND1 1 1 3 986 1 1 16 HIS NE2 N -2.845 -5.321 5.670 1.00 . A A . 16 HIS NE2 1 1 3 987 1 1 16 HIS O O -1.259 -5.990 2.063 1.00 . A A . 16 HIS O 1 1 3 988 1 1 17 LEU C C -2.466 -7.242 -0.434 1.00 . A A . 17 LEU C 1 1 3 989 1 1 17 LEU CA C -3.435 -6.424 0.414 1.00 . A A . 17 LEU CA 1 1 3 990 1 1 17 LEU CB C -4.741 -6.203 -0.340 1.00 . A A . 17 LEU CB 1 1 3 991 1 1 17 LEU CD1 C -7.041 -7.052 -0.758 1.00 . A A . 17 LEU CD1 1 1 3 992 1 1 17 LEU CD2 C -5.183 -8.662 -0.300 1.00 . A A . 17 LEU CD2 1 1 3 993 1 1 17 LEU CG C -5.756 -7.282 0.033 1.00 . A A . 17 LEU CG 1 1 3 994 1 1 17 LEU H H -3.261 -4.333 0.341 1.00 . A A . 17 LEU H 1 1 3 995 1 1 17 LEU HA H -3.640 -6.957 1.323 1.00 . A A . 17 LEU HA 1 1 3 996 1 1 17 LEU HB2 H -5.141 -5.233 -0.084 1.00 . A A . 17 LEU HB2 1 1 3 997 1 1 17 LEU HB3 H -4.549 -6.242 -1.394 1.00 . A A . 17 LEU HB3 1 1 3 998 1 1 17 LEU HD11 H -7.808 -7.721 -0.402 1.00 . A A . 17 LEU HD11 1 1 3 999 1 1 17 LEU HD12 H -6.855 -7.239 -1.806 1.00 . A A . 17 LEU HD12 1 1 3 1000 1 1 17 LEU HD13 H -7.363 -6.029 -0.627 1.00 . A A . 17 LEU HD13 1 1 3 1001 1 1 17 LEU HD21 H -5.988 -9.376 -0.383 1.00 . A A . 17 LEU HD21 1 1 3 1002 1 1 17 LEU HD22 H -4.510 -8.969 0.486 1.00 . A A . 17 LEU HD22 1 1 3 1003 1 1 17 LEU HD23 H -4.646 -8.613 -1.237 1.00 . A A . 17 LEU HD23 1 1 3 1004 1 1 17 LEU HG H -5.970 -7.224 1.091 1.00 . A A . 17 LEU HG 1 1 3 1005 1 1 17 LEU N N -2.861 -5.134 0.734 1.00 . A A . 17 LEU N 1 1 3 1006 1 1 17 LEU O O -2.369 -8.460 -0.282 1.00 . A A . 17 LEU O 1 1 3 1007 1 1 18 ALA C C 0.284 -7.909 -1.317 1.00 . A A . 18 ALA C 1 1 3 1008 1 1 18 ALA CA C -0.780 -7.247 -2.173 1.00 . A A . 18 ALA CA 1 1 3 1009 1 1 18 ALA CB C -0.128 -6.252 -3.134 1.00 . A A . 18 ALA CB 1 1 3 1010 1 1 18 ALA H H -1.852 -5.595 -1.394 1.00 . A A . 18 ALA H 1 1 3 1011 1 1 18 ALA HA H -1.287 -8.009 -2.745 1.00 . A A . 18 ALA HA 1 1 3 1012 1 1 18 ALA HB1 H 0.556 -6.776 -3.786 1.00 . A A . 18 ALA HB1 1 1 3 1013 1 1 18 ALA HB2 H 0.413 -5.507 -2.569 1.00 . A A . 18 ALA HB2 1 1 3 1014 1 1 18 ALA HB3 H -0.891 -5.770 -3.727 1.00 . A A . 18 ALA HB3 1 1 3 1015 1 1 18 ALA N N -1.743 -6.566 -1.320 1.00 . A A . 18 ALA N 1 1 3 1016 1 1 18 ALA O O 0.463 -9.123 -1.370 1.00 . A A . 18 ALA O 1 1 3 1017 1 1 19 SER C C 1.446 -8.838 1.133 1.00 . A A . 19 SER C 1 1 3 1018 1 1 19 SER CA C 2.005 -7.653 0.358 1.00 . A A . 19 SER CA 1 1 3 1019 1 1 19 SER CB C 2.494 -6.574 1.327 1.00 . A A . 19 SER CB 1 1 3 1020 1 1 19 SER H H 0.782 -6.151 -0.499 1.00 . A A . 19 SER H 1 1 3 1021 1 1 19 SER HA H 2.832 -7.991 -0.246 1.00 . A A . 19 SER HA 1 1 3 1022 1 1 19 SER HB2 H 3.564 -6.629 1.423 1.00 . A A . 19 SER HB2 1 1 3 1023 1 1 19 SER HB3 H 2.219 -5.599 0.945 1.00 . A A . 19 SER HB3 1 1 3 1024 1 1 19 SER HG H 2.559 -7.174 3.178 1.00 . A A . 19 SER HG 1 1 3 1025 1 1 19 SER N N 0.975 -7.112 -0.514 1.00 . A A . 19 SER N 1 1 3 1026 1 1 19 SER O O 2.153 -9.807 1.407 1.00 . A A . 19 SER O 1 1 3 1027 1 1 19 SER OG O 1.900 -6.779 2.603 1.00 . A A . 19 SER OG 1 1 3 1028 1 1 20 LYS C C -0.537 -11.080 1.317 1.00 . A A . 20 LYS C 1 1 3 1029 1 1 20 LYS CA C -0.499 -9.828 2.187 1.00 . A A . 20 LYS CA 1 1 3 1030 1 1 20 LYS CB C -1.926 -9.395 2.553 1.00 . A A . 20 LYS CB 1 1 3 1031 1 1 20 LYS CD C -3.487 -8.847 4.426 1.00 . A A . 20 LYS CD 1 1 3 1032 1 1 20 LYS CE C -3.664 -8.896 5.945 1.00 . A A . 20 LYS CE 1 1 3 1033 1 1 20 LYS CG C -2.044 -9.206 4.068 1.00 . A A . 20 LYS CG 1 1 3 1034 1 1 20 LYS H H -0.353 -7.965 1.207 1.00 . A A . 20 LYS H 1 1 3 1035 1 1 20 LYS HA H 0.054 -10.039 3.088 1.00 . A A . 20 LYS HA 1 1 3 1036 1 1 20 LYS HB2 H -2.147 -8.464 2.057 1.00 . A A . 20 LYS HB2 1 1 3 1037 1 1 20 LYS HB3 H -2.632 -10.144 2.229 1.00 . A A . 20 LYS HB3 1 1 3 1038 1 1 20 LYS HD2 H -3.709 -7.851 4.070 1.00 . A A . 20 LYS HD2 1 1 3 1039 1 1 20 LYS HD3 H -4.160 -9.554 3.965 1.00 . A A . 20 LYS HD3 1 1 3 1040 1 1 20 LYS HE2 H -3.300 -9.841 6.319 1.00 . A A . 20 LYS HE2 1 1 3 1041 1 1 20 LYS HE3 H -3.107 -8.091 6.399 1.00 . A A . 20 LYS HE3 1 1 3 1042 1 1 20 LYS HG2 H -1.765 -10.123 4.568 1.00 . A A . 20 LYS HG2 1 1 3 1043 1 1 20 LYS HG3 H -1.388 -8.410 4.383 1.00 . A A . 20 LYS HG3 1 1 3 1044 1 1 20 LYS HZ1 H -5.427 -7.791 6.044 1.00 . A A . 20 LYS HZ1 1 1 3 1045 1 1 20 LYS HZ2 H -5.247 -8.921 7.300 1.00 . A A . 20 LYS HZ2 1 1 3 1046 1 1 20 LYS HZ3 H -5.663 -9.441 5.737 1.00 . A A . 20 LYS HZ3 1 1 3 1047 1 1 20 LYS N N 0.162 -8.757 1.464 1.00 . A A . 20 LYS N 1 1 3 1048 1 1 20 LYS NZ N -5.110 -8.752 6.282 1.00 . A A . 20 LYS NZ 1 1 3 1049 1 1 20 LYS O O -0.131 -12.162 1.743 1.00 . A A . 20 LYS O 1 1 3 1050 1 1 21 VAL C C 0.265 -12.416 -1.363 1.00 . A A . 21 VAL C 1 1 3 1051 1 1 21 VAL CA C -1.113 -12.029 -0.843 1.00 . A A . 21 VAL CA 1 1 3 1052 1 1 21 VAL CB C -2.018 -11.665 -2.018 1.00 . A A . 21 VAL CB 1 1 3 1053 1 1 21 VAL CG1 C -2.182 -12.889 -2.915 1.00 . A A . 21 VAL CG1 1 1 3 1054 1 1 21 VAL CG2 C -3.390 -11.231 -1.495 1.00 . A A . 21 VAL CG2 1 1 3 1055 1 1 21 VAL H H -1.330 -10.029 -0.187 1.00 . A A . 21 VAL H 1 1 3 1056 1 1 21 VAL HA H -1.536 -12.872 -0.336 1.00 . A A . 21 VAL HA 1 1 3 1057 1 1 21 VAL HB H -1.571 -10.858 -2.583 1.00 . A A . 21 VAL HB 1 1 3 1058 1 1 21 VAL HG11 H -1.250 -13.088 -3.423 1.00 . A A . 21 VAL HG11 1 1 3 1059 1 1 21 VAL HG12 H -2.957 -12.702 -3.641 1.00 . A A . 21 VAL HG12 1 1 3 1060 1 1 21 VAL HG13 H -2.451 -13.743 -2.310 1.00 . A A . 21 VAL HG13 1 1 3 1061 1 1 21 VAL HG21 H -3.924 -10.707 -2.274 1.00 . A A . 21 VAL HG21 1 1 3 1062 1 1 21 VAL HG22 H -3.264 -10.579 -0.645 1.00 . A A . 21 VAL HG22 1 1 3 1063 1 1 21 VAL HG23 H -3.955 -12.103 -1.198 1.00 . A A . 21 VAL HG23 1 1 3 1064 1 1 21 VAL N N -1.024 -10.916 0.093 1.00 . A A . 21 VAL N 1 1 3 1065 1 1 21 VAL O O 0.566 -13.598 -1.528 1.00 . A A . 21 VAL O 1 1 3 1066 1 1 22 MET C C 3.227 -12.525 -1.124 1.00 . A A . 22 MET C 1 1 3 1067 1 1 22 MET CA C 2.444 -11.675 -2.121 1.00 . A A . 22 MET CA 1 1 3 1068 1 1 22 MET CB C 3.177 -10.353 -2.372 1.00 . A A . 22 MET CB 1 1 3 1069 1 1 22 MET CE C 4.403 -10.554 -6.298 1.00 . A A . 22 MET CE 1 1 3 1070 1 1 22 MET CG C 3.270 -10.083 -3.877 1.00 . A A . 22 MET CG 1 1 3 1071 1 1 22 MET H H 0.805 -10.493 -1.468 1.00 . A A . 22 MET H 1 1 3 1072 1 1 22 MET HA H 2.367 -12.213 -3.051 1.00 . A A . 22 MET HA 1 1 3 1073 1 1 22 MET HB2 H 2.632 -9.556 -1.901 1.00 . A A . 22 MET HB2 1 1 3 1074 1 1 22 MET HB3 H 4.173 -10.401 -1.956 1.00 . A A . 22 MET HB3 1 1 3 1075 1 1 22 MET HE1 H 3.388 -10.570 -6.671 1.00 . A A . 22 MET HE1 1 1 3 1076 1 1 22 MET HE2 H 5.030 -11.144 -6.947 1.00 . A A . 22 MET HE2 1 1 3 1077 1 1 22 MET HE3 H 4.768 -9.536 -6.275 1.00 . A A . 22 MET HE3 1 1 3 1078 1 1 22 MET HG2 H 2.295 -10.215 -4.327 1.00 . A A . 22 MET HG2 1 1 3 1079 1 1 22 MET HG3 H 3.613 -9.070 -4.040 1.00 . A A . 22 MET HG3 1 1 3 1080 1 1 22 MET N N 1.100 -11.417 -1.619 1.00 . A A . 22 MET N 1 1 3 1081 1 1 22 MET O O 3.776 -13.567 -1.477 1.00 . A A . 22 MET O 1 1 3 1082 1 1 22 MET SD S 4.440 -11.243 -4.626 1.00 . A A . 22 MET SD 1 1 3 1083 1 1 23 ASN C C 3.398 -14.192 1.346 1.00 . A A . 23 ASN C 1 1 3 1084 1 1 23 ASN CA C 3.983 -12.795 1.166 1.00 . A A . 23 ASN CA 1 1 3 1085 1 1 23 ASN CB C 3.900 -12.030 2.483 1.00 . A A . 23 ASN CB 1 1 3 1086 1 1 23 ASN CG C 4.991 -12.508 3.437 1.00 . A A . 23 ASN CG 1 1 3 1087 1 1 23 ASN H H 2.810 -11.233 0.346 1.00 . A A . 23 ASN H 1 1 3 1088 1 1 23 ASN HA H 5.014 -12.883 0.887 1.00 . A A . 23 ASN HA 1 1 3 1089 1 1 23 ASN HB2 H 4.025 -10.975 2.295 1.00 . A A . 23 ASN HB2 1 1 3 1090 1 1 23 ASN HB3 H 2.940 -12.204 2.928 1.00 . A A . 23 ASN HB3 1 1 3 1091 1 1 23 ASN HD21 H 6.191 -10.970 3.069 1.00 . A A . 23 ASN HD21 1 1 3 1092 1 1 23 ASN HD22 H 6.784 -12.102 4.187 1.00 . A A . 23 ASN HD22 1 1 3 1093 1 1 23 ASN N N 3.268 -12.069 0.124 1.00 . A A . 23 ASN N 1 1 3 1094 1 1 23 ASN ND2 N 6.079 -11.801 3.577 1.00 . A A . 23 ASN ND2 1 1 3 1095 1 1 23 ASN O O 4.121 -15.146 1.634 1.00 . A A . 23 ASN O 1 1 3 1096 1 1 23 ASN OD1 O 4.847 -13.552 4.073 1.00 . A A . 23 ASN OD1 1 1 3 1097 1 1 24 LYS C C 1.974 -16.604 0.329 1.00 . A A . 24 LYS C 1 1 3 1098 1 1 24 LYS CA C 1.413 -15.591 1.322 1.00 . A A . 24 LYS CA 1 1 3 1099 1 1 24 LYS CB C -0.091 -15.425 1.090 1.00 . A A . 24 LYS CB 1 1 3 1100 1 1 24 LYS CD C -2.310 -16.566 1.219 1.00 . A A . 24 LYS CD 1 1 3 1101 1 1 24 LYS CE C -2.997 -17.932 1.165 1.00 . A A . 24 LYS CE 1 1 3 1102 1 1 24 LYS CG C -0.796 -16.761 1.331 1.00 . A A . 24 LYS CG 1 1 3 1103 1 1 24 LYS H H 1.557 -13.510 0.948 1.00 . A A . 24 LYS H 1 1 3 1104 1 1 24 LYS HA H 1.572 -15.956 2.325 1.00 . A A . 24 LYS HA 1 1 3 1105 1 1 24 LYS HB2 H -0.480 -14.682 1.771 1.00 . A A . 24 LYS HB2 1 1 3 1106 1 1 24 LYS HB3 H -0.265 -15.106 0.073 1.00 . A A . 24 LYS HB3 1 1 3 1107 1 1 24 LYS HD2 H -2.666 -16.017 2.079 1.00 . A A . 24 LYS HD2 1 1 3 1108 1 1 24 LYS HD3 H -2.536 -16.015 0.320 1.00 . A A . 24 LYS HD3 1 1 3 1109 1 1 24 LYS HE2 H -4.066 -17.794 1.094 1.00 . A A . 24 LYS HE2 1 1 3 1110 1 1 24 LYS HE3 H -2.645 -18.477 0.301 1.00 . A A . 24 LYS HE3 1 1 3 1111 1 1 24 LYS HG2 H -0.469 -17.479 0.592 1.00 . A A . 24 LYS HG2 1 1 3 1112 1 1 24 LYS HG3 H -0.553 -17.122 2.318 1.00 . A A . 24 LYS HG3 1 1 3 1113 1 1 24 LYS HZ1 H -1.662 -18.926 2.416 1.00 . A A . 24 LYS HZ1 1 1 3 1114 1 1 24 LYS HZ2 H -3.229 -19.581 2.415 1.00 . A A . 24 LYS HZ2 1 1 3 1115 1 1 24 LYS HZ3 H -2.914 -18.128 3.236 1.00 . A A . 24 LYS HZ3 1 1 3 1116 1 1 24 LYS N N 2.084 -14.304 1.175 1.00 . A A . 24 LYS N 1 1 3 1117 1 1 24 LYS NZ N -2.676 -18.699 2.401 1.00 . A A . 24 LYS NZ 1 1 3 1118 1 1 24 LYS O O 2.058 -17.796 0.625 1.00 . A A . 24 LYS O 1 1 3 1119 1 1 25 LEU C C 4.243 -17.572 -1.424 1.00 . A A . 25 LEU C 1 1 3 1120 1 1 25 LEU CA C 2.907 -16.987 -1.877 1.00 . A A . 25 LEU CA 1 1 3 1121 1 1 25 LEU CB C 3.094 -16.191 -3.168 1.00 . A A . 25 LEU CB 1 1 3 1122 1 1 25 LEU CD1 C 4.006 -18.280 -4.214 1.00 . A A . 25 LEU CD1 1 1 3 1123 1 1 25 LEU CD2 C 1.598 -17.671 -4.554 1.00 . A A . 25 LEU CD2 1 1 3 1124 1 1 25 LEU CG C 3.024 -17.119 -4.389 1.00 . A A . 25 LEU CG 1 1 3 1125 1 1 25 LEU H H 2.267 -15.165 -1.030 1.00 . A A . 25 LEU H 1 1 3 1126 1 1 25 LEU HA H 2.220 -17.788 -2.061 1.00 . A A . 25 LEU HA 1 1 3 1127 1 1 25 LEU HB2 H 2.318 -15.440 -3.241 1.00 . A A . 25 LEU HB2 1 1 3 1128 1 1 25 LEU HB3 H 4.056 -15.711 -3.142 1.00 . A A . 25 LEU HB3 1 1 3 1129 1 1 25 LEU HD11 H 4.140 -18.781 -5.160 1.00 . A A . 25 LEU HD11 1 1 3 1130 1 1 25 LEU HD12 H 3.613 -18.979 -3.491 1.00 . A A . 25 LEU HD12 1 1 3 1131 1 1 25 LEU HD13 H 4.956 -17.899 -3.871 1.00 . A A . 25 LEU HD13 1 1 3 1132 1 1 25 LEU HD21 H 1.383 -17.799 -5.604 1.00 . A A . 25 LEU HD21 1 1 3 1133 1 1 25 LEU HD22 H 0.888 -16.980 -4.125 1.00 . A A . 25 LEU HD22 1 1 3 1134 1 1 25 LEU HD23 H 1.516 -18.625 -4.054 1.00 . A A . 25 LEU HD23 1 1 3 1135 1 1 25 LEU HG H 3.294 -16.560 -5.274 1.00 . A A . 25 LEU HG 1 1 3 1136 1 1 25 LEU N N 2.356 -16.121 -0.848 1.00 . A A . 25 LEU N 1 1 3 1137 1 1 25 LEU O O 4.341 -18.769 -1.154 1.00 . A A . 25 LEU O 1 1 3 1138 1 1 26 NH2 HN1 H 5.203 -15.835 -1.543 1.00 . A A . 26 NH2 HN1 1 1 3 1139 1 1 26 NH2 HN2 H 6.149 -17.161 -1.036 1.00 . A A . 26 NH2 HN2 1 1 3 1140 1 1 26 NH2 N N 5.284 -16.792 -1.327 1.00 . A A . 26 NH2 N 1 1 4 1141 1 1 1 GLY C C 3.614 16.450 1.062 1.00 . A A . 1 GLY C 1 1 4 1142 1 1 1 GLY CA C 4.369 17.656 0.515 1.00 . A A . 1 GLY CA 1 1 4 1143 1 1 1 GLY H1 H 6.343 18.177 0.104 1.00 . A A . 1 GLY H1 1 1 4 1144 1 1 1 GLY H2 H 6.030 16.509 0.001 1.00 . A A . 1 GLY H2 1 1 4 1145 1 1 1 GLY H3 H 6.150 17.262 1.520 1.00 . A A . 1 GLY H3 1 1 4 1146 1 1 1 GLY HA2 H 4.157 18.522 1.126 1.00 . A A . 1 GLY HA2 1 1 4 1147 1 1 1 GLY HA3 H 4.052 17.844 -0.499 1.00 . A A . 1 GLY HA3 1 1 4 1148 1 1 1 GLY N N 5.834 17.380 0.537 1.00 . A A . 1 GLY N 1 1 4 1149 1 1 1 GLY O O 2.955 15.726 0.316 1.00 . A A . 1 GLY O 1 1 4 1150 1 1 2 VAL C C 1.578 15.052 2.572 1.00 . A A . 2 VAL C 1 1 4 1151 1 1 2 VAL CA C 3.039 15.115 3.008 1.00 . A A . 2 VAL CA 1 1 4 1152 1 1 2 VAL CB C 3.115 15.253 4.529 1.00 . A A . 2 VAL CB 1 1 4 1153 1 1 2 VAL CG1 C 4.562 15.069 4.987 1.00 . A A . 2 VAL CG1 1 1 4 1154 1 1 2 VAL CG2 C 2.625 16.645 4.937 1.00 . A A . 2 VAL CG2 1 1 4 1155 1 1 2 VAL H H 4.256 16.847 2.917 1.00 . A A . 2 VAL H 1 1 4 1156 1 1 2 VAL HA H 3.530 14.199 2.717 1.00 . A A . 2 VAL HA 1 1 4 1157 1 1 2 VAL HB H 2.491 14.500 4.991 1.00 . A A . 2 VAL HB 1 1 4 1158 1 1 2 VAL HG11 H 4.917 14.098 4.673 1.00 . A A . 2 VAL HG11 1 1 4 1159 1 1 2 VAL HG12 H 4.611 15.138 6.063 1.00 . A A . 2 VAL HG12 1 1 4 1160 1 1 2 VAL HG13 H 5.180 15.837 4.548 1.00 . A A . 2 VAL HG13 1 1 4 1161 1 1 2 VAL HG21 H 2.675 16.743 6.012 1.00 . A A . 2 VAL HG21 1 1 4 1162 1 1 2 VAL HG22 H 1.605 16.778 4.610 1.00 . A A . 2 VAL HG22 1 1 4 1163 1 1 2 VAL HG23 H 3.251 17.395 4.478 1.00 . A A . 2 VAL HG23 1 1 4 1164 1 1 2 VAL N N 3.716 16.238 2.370 1.00 . A A . 2 VAL N 1 1 4 1165 1 1 2 VAL O O 0.987 13.975 2.504 1.00 . A A . 2 VAL O 1 1 4 1166 1 1 3 VAL C C -0.618 15.388 0.634 1.00 . A A . 3 VAL C 1 1 4 1167 1 1 3 VAL CA C -0.390 16.277 1.851 1.00 . A A . 3 VAL CA 1 1 4 1168 1 1 3 VAL CB C -0.767 17.720 1.509 1.00 . A A . 3 VAL CB 1 1 4 1169 1 1 3 VAL CG1 C -2.238 17.779 1.093 1.00 . A A . 3 VAL CG1 1 1 4 1170 1 1 3 VAL CG2 C -0.550 18.608 2.736 1.00 . A A . 3 VAL CG2 1 1 4 1171 1 1 3 VAL H H 1.522 17.041 2.351 1.00 . A A . 3 VAL H 1 1 4 1172 1 1 3 VAL HA H -1.021 15.935 2.658 1.00 . A A . 3 VAL HA 1 1 4 1173 1 1 3 VAL HB H -0.149 18.069 0.695 1.00 . A A . 3 VAL HB 1 1 4 1174 1 1 3 VAL HG11 H -2.352 17.340 0.112 1.00 . A A . 3 VAL HG11 1 1 4 1175 1 1 3 VAL HG12 H -2.563 18.808 1.067 1.00 . A A . 3 VAL HG12 1 1 4 1176 1 1 3 VAL HG13 H -2.835 17.230 1.805 1.00 . A A . 3 VAL HG13 1 1 4 1177 1 1 3 VAL HG21 H 0.508 18.685 2.943 1.00 . A A . 3 VAL HG21 1 1 4 1178 1 1 3 VAL HG22 H -1.051 18.173 3.588 1.00 . A A . 3 VAL HG22 1 1 4 1179 1 1 3 VAL HG23 H -0.952 19.591 2.544 1.00 . A A . 3 VAL HG23 1 1 4 1180 1 1 3 VAL N N 1.002 16.213 2.279 1.00 . A A . 3 VAL N 1 1 4 1181 1 1 3 VAL O O -1.652 14.730 0.518 1.00 . A A . 3 VAL O 1 1 4 1182 1 1 4 ASP C C 0.417 13.081 -1.144 1.00 . A A . 4 ASP C 1 1 4 1183 1 1 4 ASP CA C 0.250 14.560 -1.479 1.00 . A A . 4 ASP CA 1 1 4 1184 1 1 4 ASP CB C 1.320 14.981 -2.487 1.00 . A A . 4 ASP CB 1 1 4 1185 1 1 4 ASP CG C 1.073 14.295 -3.826 1.00 . A A . 4 ASP CG 1 1 4 1186 1 1 4 ASP H H 1.156 15.917 -0.126 1.00 . A A . 4 ASP H 1 1 4 1187 1 1 4 ASP HA H -0.723 14.712 -1.919 1.00 . A A . 4 ASP HA 1 1 4 1188 1 1 4 ASP HB2 H 1.283 16.055 -2.622 1.00 . A A . 4 ASP HB2 1 1 4 1189 1 1 4 ASP HB3 H 2.296 14.697 -2.114 1.00 . A A . 4 ASP HB3 1 1 4 1190 1 1 4 ASP N N 0.355 15.373 -0.273 1.00 . A A . 4 ASP N 1 1 4 1191 1 1 4 ASP O O -0.301 12.230 -1.670 1.00 . A A . 4 ASP O 1 1 4 1192 1 1 4 ASP OD1 O 0.315 14.835 -4.615 1.00 . A A . 4 ASP OD1 1 1 4 1193 1 1 4 ASP OD2 O 1.645 13.241 -4.044 1.00 . A A . 4 ASP OD2 1 1 4 1194 1 1 5 ILE C C 0.458 10.860 0.954 1.00 . A A . 5 ILE C 1 1 4 1195 1 1 5 ILE CA C 1.621 11.402 0.132 1.00 . A A . 5 ILE CA 1 1 4 1196 1 1 5 ILE CB C 2.911 11.319 0.948 1.00 . A A . 5 ILE CB 1 1 4 1197 1 1 5 ILE CD1 C 5.309 12.018 1.046 1.00 . A A . 5 ILE CD1 1 1 4 1198 1 1 5 ILE CG1 C 4.039 12.027 0.194 1.00 . A A . 5 ILE CG1 1 1 4 1199 1 1 5 ILE CG2 C 3.286 9.852 1.164 1.00 . A A . 5 ILE CG2 1 1 4 1200 1 1 5 ILE H H 1.910 13.501 0.121 1.00 . A A . 5 ILE H 1 1 4 1201 1 1 5 ILE HA H 1.730 10.800 -0.754 1.00 . A A . 5 ILE HA 1 1 4 1202 1 1 5 ILE HB H 2.762 11.797 1.907 1.00 . A A . 5 ILE HB 1 1 4 1203 1 1 5 ILE HD11 H 5.720 11.020 1.068 1.00 . A A . 5 ILE HD11 1 1 4 1204 1 1 5 ILE HD12 H 5.070 12.331 2.051 1.00 . A A . 5 ILE HD12 1 1 4 1205 1 1 5 ILE HD13 H 6.033 12.696 0.620 1.00 . A A . 5 ILE HD13 1 1 4 1206 1 1 5 ILE HG12 H 4.227 11.511 -0.740 1.00 . A A . 5 ILE HG12 1 1 4 1207 1 1 5 ILE HG13 H 3.750 13.050 -0.009 1.00 . A A . 5 ILE HG13 1 1 4 1208 1 1 5 ILE HG21 H 2.466 9.335 1.638 1.00 . A A . 5 ILE HG21 1 1 4 1209 1 1 5 ILE HG22 H 4.162 9.793 1.794 1.00 . A A . 5 ILE HG22 1 1 4 1210 1 1 5 ILE HG23 H 3.498 9.391 0.210 1.00 . A A . 5 ILE HG23 1 1 4 1211 1 1 5 ILE N N 1.369 12.782 -0.266 1.00 . A A . 5 ILE N 1 1 4 1212 1 1 5 ILE O O 0.199 9.657 0.966 1.00 . A A . 5 ILE O 1 1 4 1213 1 1 6 LEU C C -2.441 10.692 1.609 1.00 . A A . 6 LEU C 1 1 4 1214 1 1 6 LEU CA C -1.371 11.367 2.465 1.00 . A A . 6 LEU CA 1 1 4 1215 1 1 6 LEU CB C -1.959 12.606 3.160 1.00 . A A . 6 LEU CB 1 1 4 1216 1 1 6 LEU CD1 C -1.624 14.089 5.149 1.00 . A A . 6 LEU CD1 1 1 4 1217 1 1 6 LEU CD2 C -2.379 11.728 5.471 1.00 . A A . 6 LEU CD2 1 1 4 1218 1 1 6 LEU CG C -1.499 12.656 4.624 1.00 . A A . 6 LEU CG 1 1 4 1219 1 1 6 LEU H H 0.020 12.701 1.588 1.00 . A A . 6 LEU H 1 1 4 1220 1 1 6 LEU HA H -1.033 10.667 3.214 1.00 . A A . 6 LEU HA 1 1 4 1221 1 1 6 LEU HB2 H -1.616 13.495 2.646 1.00 . A A . 6 LEU HB2 1 1 4 1222 1 1 6 LEU HB3 H -3.039 12.563 3.125 1.00 . A A . 6 LEU HB3 1 1 4 1223 1 1 6 LEU HD11 H -2.617 14.462 4.947 1.00 . A A . 6 LEU HD11 1 1 4 1224 1 1 6 LEU HD12 H -0.895 14.716 4.657 1.00 . A A . 6 LEU HD12 1 1 4 1225 1 1 6 LEU HD13 H -1.446 14.098 6.214 1.00 . A A . 6 LEU HD13 1 1 4 1226 1 1 6 LEU HD21 H -1.887 11.529 6.412 1.00 . A A . 6 LEU HD21 1 1 4 1227 1 1 6 LEU HD22 H -2.537 10.799 4.944 1.00 . A A . 6 LEU HD22 1 1 4 1228 1 1 6 LEU HD23 H -3.330 12.203 5.656 1.00 . A A . 6 LEU HD23 1 1 4 1229 1 1 6 LEU HG H -0.469 12.340 4.690 1.00 . A A . 6 LEU HG 1 1 4 1230 1 1 6 LEU N N -0.235 11.758 1.639 1.00 . A A . 6 LEU N 1 1 4 1231 1 1 6 LEU O O -2.977 9.647 1.979 1.00 . A A . 6 LEU O 1 1 4 1232 1 1 7 LYS C C -3.266 9.409 -1.020 1.00 . A A . 7 LYS C 1 1 4 1233 1 1 7 LYS CA C -3.757 10.732 -0.432 1.00 . A A . 7 LYS CA 1 1 4 1234 1 1 7 LYS CB C -4.124 11.715 -1.566 1.00 . A A . 7 LYS CB 1 1 4 1235 1 1 7 LYS CD C -5.516 13.146 -0.051 1.00 . A A . 7 LYS CD 1 1 4 1236 1 1 7 LYS CE C -6.703 14.112 -0.078 1.00 . A A . 7 LYS CE 1 1 4 1237 1 1 7 LYS CG C -5.525 12.283 -1.318 1.00 . A A . 7 LYS CG 1 1 4 1238 1 1 7 LYS H H -2.285 12.123 0.224 1.00 . A A . 7 LYS H 1 1 4 1239 1 1 7 LYS HA H -4.646 10.531 0.147 1.00 . A A . 7 LYS HA 1 1 4 1240 1 1 7 LYS HB2 H -3.414 12.528 -1.610 1.00 . A A . 7 LYS HB2 1 1 4 1241 1 1 7 LYS HB3 H -4.119 11.192 -2.510 1.00 . A A . 7 LYS HB3 1 1 4 1242 1 1 7 LYS HD2 H -5.593 12.508 0.819 1.00 . A A . 7 LYS HD2 1 1 4 1243 1 1 7 LYS HD3 H -4.597 13.710 -0.002 1.00 . A A . 7 LYS HD3 1 1 4 1244 1 1 7 LYS HE2 H -7.589 13.585 -0.400 1.00 . A A . 7 LYS HE2 1 1 4 1245 1 1 7 LYS HE3 H -6.863 14.514 0.911 1.00 . A A . 7 LYS HE3 1 1 4 1246 1 1 7 LYS HG2 H -5.818 12.884 -2.161 1.00 . A A . 7 LYS HG2 1 1 4 1247 1 1 7 LYS HG3 H -6.227 11.472 -1.195 1.00 . A A . 7 LYS HG3 1 1 4 1248 1 1 7 LYS HZ1 H -5.884 14.858 -1.842 1.00 . A A . 7 LYS HZ1 1 1 4 1249 1 1 7 LYS HZ2 H -5.852 15.954 -0.544 1.00 . A A . 7 LYS HZ2 1 1 4 1250 1 1 7 LYS HZ3 H -7.310 15.639 -1.357 1.00 . A A . 7 LYS HZ3 1 1 4 1251 1 1 7 LYS N N -2.747 11.295 0.465 1.00 . A A . 7 LYS N 1 1 4 1252 1 1 7 LYS NZ N -6.415 15.225 -1.027 1.00 . A A . 7 LYS NZ 1 1 4 1253 1 1 7 LYS O O -4.065 8.522 -1.320 1.00 . A A . 7 LYS O 1 1 4 1254 1 1 8 GLY C C -1.409 6.934 -0.698 1.00 . A A . 8 GLY C 1 1 4 1255 1 1 8 GLY CA C -1.378 8.056 -1.730 1.00 . A A . 8 GLY CA 1 1 4 1256 1 1 8 GLY H H -1.355 10.013 -0.921 1.00 . A A . 8 GLY H 1 1 4 1257 1 1 8 GLY HA2 H -1.946 7.757 -2.599 1.00 . A A . 8 GLY HA2 1 1 4 1258 1 1 8 GLY HA3 H -0.355 8.241 -2.020 1.00 . A A . 8 GLY HA3 1 1 4 1259 1 1 8 GLY N N -1.951 9.279 -1.181 1.00 . A A . 8 GLY N 1 1 4 1260 1 1 8 GLY O O -1.804 5.809 -1.001 1.00 . A A . 8 GLY O 1 1 4 1261 1 1 9 ALA C C -2.381 5.751 1.871 1.00 . A A . 9 ALA C 1 1 4 1262 1 1 9 ALA CA C -0.975 6.265 1.597 1.00 . A A . 9 ALA CA 1 1 4 1263 1 1 9 ALA CB C -0.395 6.885 2.869 1.00 . A A . 9 ALA CB 1 1 4 1264 1 1 9 ALA H H -0.687 8.165 0.705 1.00 . A A . 9 ALA H 1 1 4 1265 1 1 9 ALA HA H -0.355 5.435 1.300 1.00 . A A . 9 ALA HA 1 1 4 1266 1 1 9 ALA HB1 H -0.482 6.181 3.684 1.00 . A A . 9 ALA HB1 1 1 4 1267 1 1 9 ALA HB2 H -0.941 7.785 3.112 1.00 . A A . 9 ALA HB2 1 1 4 1268 1 1 9 ALA HB3 H 0.646 7.126 2.711 1.00 . A A . 9 ALA HB3 1 1 4 1269 1 1 9 ALA N N -0.990 7.251 0.523 1.00 . A A . 9 ALA N 1 1 4 1270 1 1 9 ALA O O -2.565 4.606 2.282 1.00 . A A . 9 ALA O 1 1 4 1271 1 1 10 ALA C C -5.087 4.966 1.059 1.00 . A A . 10 ALA C 1 1 4 1272 1 1 10 ALA CA C -4.756 6.214 1.868 1.00 . A A . 10 ALA CA 1 1 4 1273 1 1 10 ALA CB C -5.695 7.351 1.465 1.00 . A A . 10 ALA CB 1 1 4 1274 1 1 10 ALA H H -3.172 7.503 1.312 1.00 . A A . 10 ALA H 1 1 4 1275 1 1 10 ALA HA H -4.895 6.000 2.918 1.00 . A A . 10 ALA HA 1 1 4 1276 1 1 10 ALA HB1 H -6.707 7.103 1.750 1.00 . A A . 10 ALA HB1 1 1 4 1277 1 1 10 ALA HB2 H -5.648 7.495 0.395 1.00 . A A . 10 ALA HB2 1 1 4 1278 1 1 10 ALA HB3 H -5.393 8.261 1.963 1.00 . A A . 10 ALA HB3 1 1 4 1279 1 1 10 ALA N N -3.373 6.603 1.642 1.00 . A A . 10 ALA N 1 1 4 1280 1 1 10 ALA O O -5.596 3.987 1.594 1.00 . A A . 10 ALA O 1 1 4 1281 1 1 11 LYS C C -3.986 2.824 -1.007 1.00 . A A . 11 LYS C 1 1 4 1282 1 1 11 LYS CA C -5.061 3.888 -1.117 1.00 . A A . 11 LYS CA 1 1 4 1283 1 1 11 LYS CB C -5.147 4.366 -2.544 1.00 . A A . 11 LYS CB 1 1 4 1284 1 1 11 LYS CD C -6.343 3.620 -4.567 1.00 . A A . 11 LYS CD 1 1 4 1285 1 1 11 LYS CE C -6.587 2.473 -5.549 1.00 . A A . 11 LYS CE 1 1 4 1286 1 1 11 LYS CG C -5.391 3.180 -3.480 1.00 . A A . 11 LYS CG 1 1 4 1287 1 1 11 LYS H H -4.394 5.822 -0.604 1.00 . A A . 11 LYS H 1 1 4 1288 1 1 11 LYS HA H -5.998 3.455 -0.848 1.00 . A A . 11 LYS HA 1 1 4 1289 1 1 11 LYS HB2 H -5.952 5.081 -2.635 1.00 . A A . 11 LYS HB2 1 1 4 1290 1 1 11 LYS HB3 H -4.229 4.832 -2.799 1.00 . A A . 11 LYS HB3 1 1 4 1291 1 1 11 LYS HD2 H -7.274 3.919 -4.111 1.00 . A A . 11 LYS HD2 1 1 4 1292 1 1 11 LYS HD3 H -5.909 4.454 -5.081 1.00 . A A . 11 LYS HD3 1 1 4 1293 1 1 11 LYS HE2 H -7.225 1.734 -5.088 1.00 . A A . 11 LYS HE2 1 1 4 1294 1 1 11 LYS HE3 H -7.065 2.858 -6.437 1.00 . A A . 11 LYS HE3 1 1 4 1295 1 1 11 LYS HG2 H -4.456 2.862 -3.920 1.00 . A A . 11 LYS HG2 1 1 4 1296 1 1 11 LYS HG3 H -5.829 2.365 -2.938 1.00 . A A . 11 LYS HG3 1 1 4 1297 1 1 11 LYS HZ1 H -4.513 2.518 -5.733 1.00 . A A . 11 LYS HZ1 1 1 4 1298 1 1 11 LYS HZ2 H -5.295 1.596 -6.928 1.00 . A A . 11 LYS HZ2 1 1 4 1299 1 1 11 LYS HZ3 H -5.140 0.989 -5.349 1.00 . A A . 11 LYS HZ3 1 1 4 1300 1 1 11 LYS N N -4.795 5.014 -0.235 1.00 . A A . 11 LYS N 1 1 4 1301 1 1 11 LYS NZ N -5.286 1.847 -5.917 1.00 . A A . 11 LYS NZ 1 1 4 1302 1 1 11 LYS O O -4.246 1.651 -1.276 1.00 . A A . 11 LYS O 1 1 4 1303 1 1 12 ASP C C -2.228 1.018 0.241 1.00 . A A . 12 ASP C 1 1 4 1304 1 1 12 ASP CA C -1.688 2.263 -0.451 1.00 . A A . 12 ASP CA 1 1 4 1305 1 1 12 ASP CB C -0.553 2.866 0.378 1.00 . A A . 12 ASP CB 1 1 4 1306 1 1 12 ASP CG C 0.519 1.813 0.635 1.00 . A A . 12 ASP CG 1 1 4 1307 1 1 12 ASP H H -2.632 4.174 -0.406 1.00 . A A . 12 ASP H 1 1 4 1308 1 1 12 ASP HA H -1.313 1.992 -1.427 1.00 . A A . 12 ASP HA 1 1 4 1309 1 1 12 ASP HB2 H -0.118 3.695 -0.162 1.00 . A A . 12 ASP HB2 1 1 4 1310 1 1 12 ASP HB3 H -0.944 3.215 1.320 1.00 . A A . 12 ASP HB3 1 1 4 1311 1 1 12 ASP N N -2.781 3.226 -0.605 1.00 . A A . 12 ASP N 1 1 4 1312 1 1 12 ASP O O -1.553 -0.006 0.357 1.00 . A A . 12 ASP O 1 1 4 1313 1 1 12 ASP OD1 O 1.069 1.811 1.725 1.00 . A A . 12 ASP OD1 1 1 4 1314 1 1 12 ASP OD2 O 0.775 1.025 -0.260 1.00 . A A . 12 ASP OD2 1 1 4 1315 1 1 13 ILE C C -4.179 -1.184 0.453 1.00 . A A . 13 ILE C 1 1 4 1316 1 1 13 ILE CA C -4.193 0.062 1.328 1.00 . A A . 13 ILE CA 1 1 4 1317 1 1 13 ILE CB C -5.640 0.524 1.509 1.00 . A A . 13 ILE CB 1 1 4 1318 1 1 13 ILE CD1 C -7.090 2.186 2.670 1.00 . A A . 13 ILE CD1 1 1 4 1319 1 1 13 ILE CG1 C -5.743 1.461 2.708 1.00 . A A . 13 ILE CG1 1 1 4 1320 1 1 13 ILE CG2 C -6.566 -0.672 1.715 1.00 . A A . 13 ILE CG2 1 1 4 1321 1 1 13 ILE H H -3.941 1.983 0.520 1.00 . A A . 13 ILE H 1 1 4 1322 1 1 13 ILE HA H -3.753 -0.150 2.290 1.00 . A A . 13 ILE HA 1 1 4 1323 1 1 13 ILE HB H -5.948 1.052 0.618 1.00 . A A . 13 ILE HB 1 1 4 1324 1 1 13 ILE HD11 H -7.038 3.071 3.286 1.00 . A A . 13 ILE HD11 1 1 4 1325 1 1 13 ILE HD12 H -7.861 1.529 3.045 1.00 . A A . 13 ILE HD12 1 1 4 1326 1 1 13 ILE HD13 H -7.322 2.468 1.652 1.00 . A A . 13 ILE HD13 1 1 4 1327 1 1 13 ILE HG12 H -5.673 0.885 3.615 1.00 . A A . 13 ILE HG12 1 1 4 1328 1 1 13 ILE HG13 H -4.941 2.184 2.675 1.00 . A A . 13 ILE HG13 1 1 4 1329 1 1 13 ILE HG21 H -7.501 -0.334 2.137 1.00 . A A . 13 ILE HG21 1 1 4 1330 1 1 13 ILE HG22 H -6.099 -1.376 2.385 1.00 . A A . 13 ILE HG22 1 1 4 1331 1 1 13 ILE HG23 H -6.752 -1.147 0.762 1.00 . A A . 13 ILE HG23 1 1 4 1332 1 1 13 ILE N N -3.477 1.135 0.668 1.00 . A A . 13 ILE N 1 1 4 1333 1 1 13 ILE O O -3.780 -2.265 0.887 1.00 . A A . 13 ILE O 1 1 4 1334 1 1 14 ALA C C -3.282 -2.751 -1.876 1.00 . A A . 14 ALA C 1 1 4 1335 1 1 14 ALA CA C -4.662 -2.116 -1.734 1.00 . A A . 14 ALA CA 1 1 4 1336 1 1 14 ALA CB C -5.138 -1.617 -3.098 1.00 . A A . 14 ALA CB 1 1 4 1337 1 1 14 ALA H H -4.927 -0.120 -1.063 1.00 . A A . 14 ALA H 1 1 4 1338 1 1 14 ALA HA H -5.354 -2.862 -1.375 1.00 . A A . 14 ALA HA 1 1 4 1339 1 1 14 ALA HB1 H -4.377 -0.986 -3.536 1.00 . A A . 14 ALA HB1 1 1 4 1340 1 1 14 ALA HB2 H -6.048 -1.049 -2.976 1.00 . A A . 14 ALA HB2 1 1 4 1341 1 1 14 ALA HB3 H -5.324 -2.460 -3.747 1.00 . A A . 14 ALA HB3 1 1 4 1342 1 1 14 ALA N N -4.620 -1.012 -0.785 1.00 . A A . 14 ALA N 1 1 4 1343 1 1 14 ALA O O -3.160 -3.958 -2.084 1.00 . A A . 14 ALA O 1 1 4 1344 1 1 15 GLY C C -0.474 -3.223 -0.651 1.00 . A A . 15 GLY C 1 1 4 1345 1 1 15 GLY CA C -0.876 -2.415 -1.879 1.00 . A A . 15 GLY CA 1 1 4 1346 1 1 15 GLY H H -2.404 -0.975 -1.596 1.00 . A A . 15 GLY H 1 1 4 1347 1 1 15 GLY HA2 H -0.797 -3.039 -2.758 1.00 . A A . 15 GLY HA2 1 1 4 1348 1 1 15 GLY HA3 H -0.207 -1.573 -1.981 1.00 . A A . 15 GLY HA3 1 1 4 1349 1 1 15 GLY N N -2.245 -1.927 -1.762 1.00 . A A . 15 GLY N 1 1 4 1350 1 1 15 GLY O O 0.330 -4.151 -0.743 1.00 . A A . 15 GLY O 1 1 4 1351 1 1 16 HIS C C -1.239 -5.001 1.693 1.00 . A A . 16 HIS C 1 1 4 1352 1 1 16 HIS CA C -0.723 -3.565 1.740 1.00 . A A . 16 HIS CA 1 1 4 1353 1 1 16 HIS CB C -1.350 -2.827 2.926 1.00 . A A . 16 HIS CB 1 1 4 1354 1 1 16 HIS CD2 C -2.088 -4.384 4.908 1.00 . A A . 16 HIS CD2 1 1 4 1355 1 1 16 HIS CE1 C -0.167 -4.579 5.891 1.00 . A A . 16 HIS CE1 1 1 4 1356 1 1 16 HIS CG C -1.191 -3.650 4.174 1.00 . A A . 16 HIS CG 1 1 4 1357 1 1 16 HIS H H -1.668 -2.117 0.515 1.00 . A A . 16 HIS H 1 1 4 1358 1 1 16 HIS HA H 0.349 -3.583 1.869 1.00 . A A . 16 HIS HA 1 1 4 1359 1 1 16 HIS HB2 H -0.858 -1.875 3.058 1.00 . A A . 16 HIS HB2 1 1 4 1360 1 1 16 HIS HB3 H -2.400 -2.666 2.734 1.00 . A A . 16 HIS HB3 1 1 4 1361 1 1 16 HIS HD2 H -3.139 -4.492 4.679 1.00 . A A . 16 HIS HD2 1 1 4 1362 1 1 16 HIS HE1 H 0.611 -4.862 6.585 1.00 . A A . 16 HIS HE1 1 1 4 1363 1 1 16 HIS HE2 H -1.834 -5.547 6.680 1.00 . A A . 16 HIS HE2 1 1 4 1364 1 1 16 HIS N N -1.035 -2.865 0.499 1.00 . A A . 16 HIS N 1 1 4 1365 1 1 16 HIS ND1 N 0.029 -3.788 4.820 1.00 . A A . 16 HIS ND1 1 1 4 1366 1 1 16 HIS NE2 N -1.440 -4.970 5.991 1.00 . A A . 16 HIS NE2 1 1 4 1367 1 1 16 HIS O O -0.503 -5.942 1.988 1.00 . A A . 16 HIS O 1 1 4 1368 1 1 17 LEU C C -2.385 -7.334 0.199 1.00 . A A . 17 LEU C 1 1 4 1369 1 1 17 LEU CA C -3.102 -6.486 1.245 1.00 . A A . 17 LEU CA 1 1 4 1370 1 1 17 LEU CB C -4.600 -6.358 0.920 1.00 . A A . 17 LEU CB 1 1 4 1371 1 1 17 LEU CD1 C -4.829 -7.924 -1.051 1.00 . A A . 17 LEU CD1 1 1 4 1372 1 1 17 LEU CD2 C -6.210 -5.835 -0.925 1.00 . A A . 17 LEU CD2 1 1 4 1373 1 1 17 LEU CG C -4.847 -6.453 -0.596 1.00 . A A . 17 LEU CG 1 1 4 1374 1 1 17 LEU H H -3.049 -4.380 1.101 1.00 . A A . 17 LEU H 1 1 4 1375 1 1 17 LEU HA H -2.997 -6.967 2.206 1.00 . A A . 17 LEU HA 1 1 4 1376 1 1 17 LEU HB2 H -5.142 -7.143 1.423 1.00 . A A . 17 LEU HB2 1 1 4 1377 1 1 17 LEU HB3 H -4.955 -5.402 1.278 1.00 . A A . 17 LEU HB3 1 1 4 1378 1 1 17 LEU HD11 H -4.600 -8.568 -0.214 1.00 . A A . 17 LEU HD11 1 1 4 1379 1 1 17 LEU HD12 H -4.076 -8.053 -1.814 1.00 . A A . 17 LEU HD12 1 1 4 1380 1 1 17 LEU HD13 H -5.796 -8.192 -1.456 1.00 . A A . 17 LEU HD13 1 1 4 1381 1 1 17 LEU HD21 H -6.346 -5.813 -1.997 1.00 . A A . 17 LEU HD21 1 1 4 1382 1 1 17 LEU HD22 H -6.255 -4.828 -0.537 1.00 . A A . 17 LEU HD22 1 1 4 1383 1 1 17 LEU HD23 H -6.993 -6.428 -0.475 1.00 . A A . 17 LEU HD23 1 1 4 1384 1 1 17 LEU HG H -4.073 -5.909 -1.118 1.00 . A A . 17 LEU HG 1 1 4 1385 1 1 17 LEU N N -2.505 -5.162 1.323 1.00 . A A . 17 LEU N 1 1 4 1386 1 1 17 LEU O O -2.307 -8.556 0.326 1.00 . A A . 17 LEU O 1 1 4 1387 1 1 18 ALA C C 0.101 -8.057 -1.307 1.00 . A A . 18 ALA C 1 1 4 1388 1 1 18 ALA CA C -1.140 -7.396 -1.880 1.00 . A A . 18 ALA CA 1 1 4 1389 1 1 18 ALA CB C -0.744 -6.432 -3.000 1.00 . A A . 18 ALA CB 1 1 4 1390 1 1 18 ALA H H -1.937 -5.707 -0.880 1.00 . A A . 18 ALA H 1 1 4 1391 1 1 18 ALA HA H -1.783 -8.164 -2.287 1.00 . A A . 18 ALA HA 1 1 4 1392 1 1 18 ALA HB1 H -0.434 -6.995 -3.867 1.00 . A A . 18 ALA HB1 1 1 4 1393 1 1 18 ALA HB2 H 0.072 -5.809 -2.665 1.00 . A A . 18 ALA HB2 1 1 4 1394 1 1 18 ALA HB3 H -1.589 -5.812 -3.256 1.00 . A A . 18 ALA HB3 1 1 4 1395 1 1 18 ALA N N -1.853 -6.681 -0.830 1.00 . A A . 18 ALA N 1 1 4 1396 1 1 18 ALA O O 0.246 -9.275 -1.373 1.00 . A A . 18 ALA O 1 1 4 1397 1 1 19 SER C C 1.842 -8.942 0.802 1.00 . A A . 19 SER C 1 1 4 1398 1 1 19 SER CA C 2.199 -7.800 -0.138 1.00 . A A . 19 SER CA 1 1 4 1399 1 1 19 SER CB C 2.949 -6.704 0.624 1.00 . A A . 19 SER CB 1 1 4 1400 1 1 19 SER H H 0.817 -6.292 -0.690 1.00 . A A . 19 SER H 1 1 4 1401 1 1 19 SER HA H 2.830 -8.182 -0.926 1.00 . A A . 19 SER HA 1 1 4 1402 1 1 19 SER HB2 H 4.005 -6.780 0.425 1.00 . A A . 19 SER HB2 1 1 4 1403 1 1 19 SER HB3 H 2.594 -5.735 0.299 1.00 . A A . 19 SER HB3 1 1 4 1404 1 1 19 SER HG H 3.499 -7.282 2.399 1.00 . A A . 19 SER HG 1 1 4 1405 1 1 19 SER N N 0.986 -7.256 -0.729 1.00 . A A . 19 SER N 1 1 4 1406 1 1 19 SER O O 2.581 -9.919 0.921 1.00 . A A . 19 SER O 1 1 4 1407 1 1 19 SER OG O 2.724 -6.860 2.020 1.00 . A A . 19 SER OG 1 1 4 1408 1 1 20 LYS C C -0.079 -11.118 1.586 1.00 . A A . 20 LYS C 1 1 4 1409 1 1 20 LYS CA C 0.226 -9.844 2.365 1.00 . A A . 20 LYS CA 1 1 4 1410 1 1 20 LYS CB C -1.035 -9.351 3.090 1.00 . A A . 20 LYS CB 1 1 4 1411 1 1 20 LYS CD C -1.980 -8.580 5.274 1.00 . A A . 20 LYS CD 1 1 4 1412 1 1 20 LYS CE C -1.726 -8.531 6.782 1.00 . A A . 20 LYS CE 1 1 4 1413 1 1 20 LYS CG C -0.712 -9.052 4.558 1.00 . A A . 20 LYS CG 1 1 4 1414 1 1 20 LYS H H 0.142 -8.019 1.308 1.00 . A A . 20 LYS H 1 1 4 1415 1 1 20 LYS HA H 0.998 -10.047 3.089 1.00 . A A . 20 LYS HA 1 1 4 1416 1 1 20 LYS HB2 H -1.387 -8.452 2.611 1.00 . A A . 20 LYS HB2 1 1 4 1417 1 1 20 LYS HB3 H -1.806 -10.105 3.041 1.00 . A A . 20 LYS HB3 1 1 4 1418 1 1 20 LYS HD2 H -2.246 -7.594 4.920 1.00 . A A . 20 LYS HD2 1 1 4 1419 1 1 20 LYS HD3 H -2.786 -9.267 5.069 1.00 . A A . 20 LYS HD3 1 1 4 1420 1 1 20 LYS HE2 H -1.355 -9.487 7.115 1.00 . A A . 20 LYS HE2 1 1 4 1421 1 1 20 LYS HE3 H -0.996 -7.765 6.999 1.00 . A A . 20 LYS HE3 1 1 4 1422 1 1 20 LYS HG2 H -0.342 -9.947 5.035 1.00 . A A . 20 LYS HG2 1 1 4 1423 1 1 20 LYS HG3 H 0.038 -8.278 4.610 1.00 . A A . 20 LYS HG3 1 1 4 1424 1 1 20 LYS HZ1 H -2.790 -7.892 8.454 1.00 . A A . 20 LYS HZ1 1 1 4 1425 1 1 20 LYS HZ2 H -3.590 -9.075 7.534 1.00 . A A . 20 LYS HZ2 1 1 4 1426 1 1 20 LYS HZ3 H -3.509 -7.472 6.976 1.00 . A A . 20 LYS HZ3 1 1 4 1427 1 1 20 LYS N N 0.692 -8.815 1.454 1.00 . A A . 20 LYS N 1 1 4 1428 1 1 20 LYS NZ N -3.001 -8.218 7.489 1.00 . A A . 20 LYS NZ 1 1 4 1429 1 1 20 LYS O O 0.390 -12.201 1.934 1.00 . A A . 20 LYS O 1 1 4 1430 1 1 21 VAL C C -0.044 -12.567 -1.151 1.00 . A A . 21 VAL C 1 1 4 1431 1 1 21 VAL CA C -1.228 -12.110 -0.310 1.00 . A A . 21 VAL CA 1 1 4 1432 1 1 21 VAL CB C -2.395 -11.746 -1.224 1.00 . A A . 21 VAL CB 1 1 4 1433 1 1 21 VAL CG1 C -2.786 -12.978 -2.037 1.00 . A A . 21 VAL CG1 1 1 4 1434 1 1 21 VAL CG2 C -3.590 -11.296 -0.378 1.00 . A A . 21 VAL CG2 1 1 4 1435 1 1 21 VAL H H -1.205 -10.084 0.297 1.00 . A A . 21 VAL H 1 1 4 1436 1 1 21 VAL HA H -1.531 -12.919 0.322 1.00 . A A . 21 VAL HA 1 1 4 1437 1 1 21 VAL HB H -2.099 -10.950 -1.892 1.00 . A A . 21 VAL HB 1 1 4 1438 1 1 21 VAL HG11 H -2.903 -13.823 -1.372 1.00 . A A . 21 VAL HG11 1 1 4 1439 1 1 21 VAL HG12 H -2.011 -13.192 -2.758 1.00 . A A . 21 VAL HG12 1 1 4 1440 1 1 21 VAL HG13 H -3.716 -12.791 -2.549 1.00 . A A . 21 VAL HG13 1 1 4 1441 1 1 21 VAL HG21 H -3.246 -10.660 0.424 1.00 . A A . 21 VAL HG21 1 1 4 1442 1 1 21 VAL HG22 H -4.084 -12.162 0.039 1.00 . A A . 21 VAL HG22 1 1 4 1443 1 1 21 VAL HG23 H -4.285 -10.751 -0.999 1.00 . A A . 21 VAL HG23 1 1 4 1444 1 1 21 VAL N N -0.866 -10.973 0.524 1.00 . A A . 21 VAL N 1 1 4 1445 1 1 21 VAL O O 0.166 -13.765 -1.343 1.00 . A A . 21 VAL O 1 1 4 1446 1 1 22 MET C C 2.877 -12.785 -1.669 1.00 . A A . 22 MET C 1 1 4 1447 1 1 22 MET CA C 1.889 -11.941 -2.470 1.00 . A A . 22 MET CA 1 1 4 1448 1 1 22 MET CB C 2.575 -10.658 -2.956 1.00 . A A . 22 MET CB 1 1 4 1449 1 1 22 MET CE C 3.511 -10.626 -6.872 1.00 . A A . 22 MET CE 1 1 4 1450 1 1 22 MET CG C 2.297 -10.448 -4.448 1.00 . A A . 22 MET CG 1 1 4 1451 1 1 22 MET H H 0.512 -10.672 -1.464 1.00 . A A . 22 MET H 1 1 4 1452 1 1 22 MET HA H 1.561 -12.505 -3.324 1.00 . A A . 22 MET HA 1 1 4 1453 1 1 22 MET HB2 H 2.189 -9.823 -2.402 1.00 . A A . 22 MET HB2 1 1 4 1454 1 1 22 MET HB3 H 3.641 -10.730 -2.799 1.00 . A A . 22 MET HB3 1 1 4 1455 1 1 22 MET HE1 H 2.653 -9.986 -7.023 1.00 . A A . 22 MET HE1 1 1 4 1456 1 1 22 MET HE2 H 3.646 -11.253 -7.738 1.00 . A A . 22 MET HE2 1 1 4 1457 1 1 22 MET HE3 H 4.396 -10.022 -6.724 1.00 . A A . 22 MET HE3 1 1 4 1458 1 1 22 MET HG2 H 1.240 -10.580 -4.639 1.00 . A A . 22 MET HG2 1 1 4 1459 1 1 22 MET HG3 H 2.598 -9.449 -4.733 1.00 . A A . 22 MET HG3 1 1 4 1460 1 1 22 MET N N 0.728 -11.611 -1.650 1.00 . A A . 22 MET N 1 1 4 1461 1 1 22 MET O O 3.292 -13.857 -2.106 1.00 . A A . 22 MET O 1 1 4 1462 1 1 22 MET SD S 3.238 -11.659 -5.410 1.00 . A A . 22 MET SD 1 1 4 1463 1 1 23 ASN C C 3.586 -14.316 0.854 1.00 . A A . 23 ASN C 1 1 4 1464 1 1 23 ASN CA C 4.187 -13.000 0.364 1.00 . A A . 23 ASN CA 1 1 4 1465 1 1 23 ASN CB C 4.563 -12.130 1.559 1.00 . A A . 23 ASN CB 1 1 4 1466 1 1 23 ASN CG C 5.904 -12.576 2.135 1.00 . A A . 23 ASN CG 1 1 4 1467 1 1 23 ASN H H 2.886 -11.429 -0.199 1.00 . A A . 23 ASN H 1 1 4 1468 1 1 23 ASN HA H 5.076 -13.213 -0.197 1.00 . A A . 23 ASN HA 1 1 4 1469 1 1 23 ASN HB2 H 4.631 -11.099 1.246 1.00 . A A . 23 ASN HB2 1 1 4 1470 1 1 23 ASN HB3 H 3.805 -12.225 2.313 1.00 . A A . 23 ASN HB3 1 1 4 1471 1 1 23 ASN HD21 H 5.101 -13.926 3.349 1.00 . A A . 23 ASN HD21 1 1 4 1472 1 1 23 ASN HD22 H 6.793 -13.805 3.415 1.00 . A A . 23 ASN HD22 1 1 4 1473 1 1 23 ASN N N 3.249 -12.289 -0.493 1.00 . A A . 23 ASN N 1 1 4 1474 1 1 23 ASN ND2 N 5.936 -13.513 3.042 1.00 . A A . 23 ASN ND2 1 1 4 1475 1 1 23 ASN O O 4.294 -15.310 1.013 1.00 . A A . 23 ASN O 1 1 4 1476 1 1 23 ASN OD1 O 6.951 -12.056 1.747 1.00 . A A . 23 ASN OD1 1 1 4 1477 1 1 24 LYS C C 1.957 -16.712 0.694 1.00 . A A . 24 LYS C 1 1 4 1478 1 1 24 LYS CA C 1.597 -15.514 1.565 1.00 . A A . 24 LYS CA 1 1 4 1479 1 1 24 LYS CB C 0.081 -15.299 1.541 1.00 . A A . 24 LYS CB 1 1 4 1480 1 1 24 LYS CD C -2.115 -16.274 2.225 1.00 . A A . 24 LYS CD 1 1 4 1481 1 1 24 LYS CE C -2.863 -17.590 2.452 1.00 . A A . 24 LYS CE 1 1 4 1482 1 1 24 LYS CG C -0.622 -16.557 2.055 1.00 . A A . 24 LYS CG 1 1 4 1483 1 1 24 LYS H H 1.764 -13.492 0.949 1.00 . A A . 24 LYS H 1 1 4 1484 1 1 24 LYS HA H 1.904 -15.714 2.580 1.00 . A A . 24 LYS HA 1 1 4 1485 1 1 24 LYS HB2 H -0.174 -14.461 2.173 1.00 . A A . 24 LYS HB2 1 1 4 1486 1 1 24 LYS HB3 H -0.239 -15.099 0.530 1.00 . A A . 24 LYS HB3 1 1 4 1487 1 1 24 LYS HD2 H -2.265 -15.624 3.074 1.00 . A A . 24 LYS HD2 1 1 4 1488 1 1 24 LYS HD3 H -2.495 -15.796 1.335 1.00 . A A . 24 LYS HD3 1 1 4 1489 1 1 24 LYS HE2 H -3.926 -17.400 2.479 1.00 . A A . 24 LYS HE2 1 1 4 1490 1 1 24 LYS HE3 H -2.640 -18.274 1.647 1.00 . A A . 24 LYS HE3 1 1 4 1491 1 1 24 LYS HG2 H -0.485 -17.362 1.347 1.00 . A A . 24 LYS HG2 1 1 4 1492 1 1 24 LYS HG3 H -0.201 -16.841 3.008 1.00 . A A . 24 LYS HG3 1 1 4 1493 1 1 24 LYS HZ1 H -3.009 -19.029 3.950 1.00 . A A . 24 LYS HZ1 1 1 4 1494 1 1 24 LYS HZ2 H -2.553 -17.491 4.508 1.00 . A A . 24 LYS HZ2 1 1 4 1495 1 1 24 LYS HZ3 H -1.431 -18.466 3.684 1.00 . A A . 24 LYS HZ3 1 1 4 1496 1 1 24 LYS N N 2.279 -14.313 1.092 1.00 . A A . 24 LYS N 1 1 4 1497 1 1 24 LYS NZ N -2.432 -18.189 3.746 1.00 . A A . 24 LYS NZ 1 1 4 1498 1 1 24 LYS O O 2.069 -17.836 1.184 1.00 . A A . 24 LYS O 1 1 4 1499 1 1 25 LEU C C 3.884 -18.058 -1.233 1.00 . A A . 25 LEU C 1 1 4 1500 1 1 25 LEU CA C 2.485 -17.527 -1.529 1.00 . A A . 25 LEU CA 1 1 4 1501 1 1 25 LEU CB C 2.417 -16.997 -2.960 1.00 . A A . 25 LEU CB 1 1 4 1502 1 1 25 LEU CD1 C 3.119 -19.274 -3.738 1.00 . A A . 25 LEU CD1 1 1 4 1503 1 1 25 LEU CD2 C 0.688 -18.664 -3.721 1.00 . A A . 25 LEU CD2 1 1 4 1504 1 1 25 LEU CG C 2.115 -18.137 -3.943 1.00 . A A . 25 LEU CG 1 1 4 1505 1 1 25 LEU H H 2.035 -15.552 -0.934 1.00 . A A . 25 LEU H 1 1 4 1506 1 1 25 LEU HA H 1.779 -18.323 -1.421 1.00 . A A . 25 LEU HA 1 1 4 1507 1 1 25 LEU HB2 H 1.638 -16.247 -3.028 1.00 . A A . 25 LEU HB2 1 1 4 1508 1 1 25 LEU HB3 H 3.363 -16.552 -3.210 1.00 . A A . 25 LEU HB3 1 1 4 1509 1 1 25 LEU HD11 H 3.073 -19.950 -4.579 1.00 . A A . 25 LEU HD11 1 1 4 1510 1 1 25 LEU HD12 H 2.878 -19.811 -2.833 1.00 . A A . 25 LEU HD12 1 1 4 1511 1 1 25 LEU HD13 H 4.116 -18.865 -3.660 1.00 . A A . 25 LEU HD13 1 1 4 1512 1 1 25 LEU HD21 H 0.712 -19.508 -3.046 1.00 . A A . 25 LEU HD21 1 1 4 1513 1 1 25 LEU HD22 H 0.272 -18.976 -4.667 1.00 . A A . 25 LEU HD22 1 1 4 1514 1 1 25 LEU HD23 H 0.072 -17.884 -3.299 1.00 . A A . 25 LEU HD23 1 1 4 1515 1 1 25 LEU HG H 2.206 -17.765 -4.954 1.00 . A A . 25 LEU HG 1 1 4 1516 1 1 25 LEU N N 2.138 -16.464 -0.599 1.00 . A A . 25 LEU N 1 1 4 1517 1 1 25 LEU O O 4.040 -19.189 -0.773 1.00 . A A . 25 LEU O 1 1 4 1518 1 1 26 NH2 HN1 H 4.795 -16.399 -1.841 1.00 . A A . 26 NH2 HN1 1 1 4 1519 1 1 26 NH2 HN2 H 5.828 -17.638 -1.285 1.00 . A A . 26 NH2 HN2 1 1 4 1520 1 1 26 NH2 N N 4.921 -17.303 -1.473 1.00 . A A . 26 NH2 N 1 1 5 1521 1 1 1 GLY C C 1.482 18.376 0.809 1.00 . A A . 1 GLY C 1 1 5 1522 1 1 1 GLY CA C 1.393 19.802 0.279 1.00 . A A . 1 GLY CA 1 1 5 1523 1 1 1 GLY H1 H 3.328 19.931 -0.483 1.00 . A A . 1 GLY H1 1 1 5 1524 1 1 1 GLY H2 H 2.195 20.899 -1.299 1.00 . A A . 1 GLY H2 1 1 5 1525 1 1 1 GLY H3 H 2.213 19.218 -1.545 1.00 . A A . 1 GLY H3 1 1 5 1526 1 1 1 GLY HA2 H 1.636 20.498 1.069 1.00 . A A . 1 GLY HA2 1 1 5 1527 1 1 1 GLY HA3 H 0.390 19.990 -0.073 1.00 . A A . 1 GLY HA3 1 1 5 1528 1 1 1 GLY N N 2.355 19.976 -0.847 1.00 . A A . 1 GLY N 1 1 5 1529 1 1 1 GLY O O 1.384 17.413 0.049 1.00 . A A . 1 GLY O 1 1 5 1530 1 1 2 VAL C C 0.551 16.081 2.393 1.00 . A A . 2 VAL C 1 1 5 1531 1 1 2 VAL CA C 1.768 16.933 2.740 1.00 . A A . 2 VAL CA 1 1 5 1532 1 1 2 VAL CB C 1.876 17.079 4.259 1.00 . A A . 2 VAL CB 1 1 5 1533 1 1 2 VAL CG1 C 0.605 17.737 4.801 1.00 . A A . 2 VAL CG1 1 1 5 1534 1 1 2 VAL CG2 C 2.043 15.697 4.893 1.00 . A A . 2 VAL CG2 1 1 5 1535 1 1 2 VAL H H 1.739 19.050 2.676 1.00 . A A . 2 VAL H 1 1 5 1536 1 1 2 VAL HA H 2.656 16.439 2.375 1.00 . A A . 2 VAL HA 1 1 5 1537 1 1 2 VAL HB H 2.730 17.694 4.501 1.00 . A A . 2 VAL HB 1 1 5 1538 1 1 2 VAL HG11 H -0.210 17.029 4.763 1.00 . A A . 2 VAL HG11 1 1 5 1539 1 1 2 VAL HG12 H 0.362 18.600 4.199 1.00 . A A . 2 VAL HG12 1 1 5 1540 1 1 2 VAL HG13 H 0.767 18.044 5.823 1.00 . A A . 2 VAL HG13 1 1 5 1541 1 1 2 VAL HG21 H 2.799 15.143 4.355 1.00 . A A . 2 VAL HG21 1 1 5 1542 1 1 2 VAL HG22 H 1.105 15.164 4.848 1.00 . A A . 2 VAL HG22 1 1 5 1543 1 1 2 VAL HG23 H 2.344 15.808 5.925 1.00 . A A . 2 VAL HG23 1 1 5 1544 1 1 2 VAL N N 1.667 18.248 2.119 1.00 . A A . 2 VAL N 1 1 5 1545 1 1 2 VAL O O 0.641 14.857 2.307 1.00 . A A . 2 VAL O 1 1 5 1546 1 1 3 VAL C C -1.588 15.092 0.677 1.00 . A A . 3 VAL C 1 1 5 1547 1 1 3 VAL CA C -1.818 16.032 1.857 1.00 . A A . 3 VAL CA 1 1 5 1548 1 1 3 VAL CB C -2.918 17.036 1.506 1.00 . A A . 3 VAL CB 1 1 5 1549 1 1 3 VAL CG1 C -4.175 16.283 1.066 1.00 . A A . 3 VAL CG1 1 1 5 1550 1 1 3 VAL CG2 C -3.239 17.888 2.736 1.00 . A A . 3 VAL CG2 1 1 5 1551 1 1 3 VAL H H -0.600 17.715 2.277 1.00 . A A . 3 VAL H 1 1 5 1552 1 1 3 VAL HA H -2.135 15.452 2.711 1.00 . A A . 3 VAL HA 1 1 5 1553 1 1 3 VAL HB H -2.580 17.673 0.702 1.00 . A A . 3 VAL HB 1 1 5 1554 1 1 3 VAL HG11 H -4.367 15.471 1.752 1.00 . A A . 3 VAL HG11 1 1 5 1555 1 1 3 VAL HG12 H -4.028 15.888 0.072 1.00 . A A . 3 VAL HG12 1 1 5 1556 1 1 3 VAL HG13 H -5.017 16.959 1.063 1.00 . A A . 3 VAL HG13 1 1 5 1557 1 1 3 VAL HG21 H -2.401 18.533 2.956 1.00 . A A . 3 VAL HG21 1 1 5 1558 1 1 3 VAL HG22 H -3.428 17.243 3.582 1.00 . A A . 3 VAL HG22 1 1 5 1559 1 1 3 VAL HG23 H -4.114 18.489 2.539 1.00 . A A . 3 VAL HG23 1 1 5 1560 1 1 3 VAL N N -0.587 16.739 2.196 1.00 . A A . 3 VAL N 1 1 5 1561 1 1 3 VAL O O -2.286 14.091 0.524 1.00 . A A . 3 VAL O 1 1 5 1562 1 1 4 ASP C C 0.373 13.297 -0.886 1.00 . A A . 4 ASP C 1 1 5 1563 1 1 4 ASP CA C -0.291 14.601 -1.316 1.00 . A A . 4 ASP CA 1 1 5 1564 1 1 4 ASP CB C 0.641 15.364 -2.260 1.00 . A A . 4 ASP CB 1 1 5 1565 1 1 4 ASP CG C 0.772 14.613 -3.581 1.00 . A A . 4 ASP CG 1 1 5 1566 1 1 4 ASP H H -0.080 16.233 0.020 1.00 . A A . 4 ASP H 1 1 5 1567 1 1 4 ASP HA H -1.206 14.372 -1.840 1.00 . A A . 4 ASP HA 1 1 5 1568 1 1 4 ASP HB2 H 0.234 16.350 -2.446 1.00 . A A . 4 ASP HB2 1 1 5 1569 1 1 4 ASP HB3 H 1.618 15.455 -1.802 1.00 . A A . 4 ASP HB3 1 1 5 1570 1 1 4 ASP N N -0.604 15.423 -0.153 1.00 . A A . 4 ASP N 1 1 5 1571 1 1 4 ASP O O 0.032 12.223 -1.381 1.00 . A A . 4 ASP O 1 1 5 1572 1 1 4 ASP OD1 O 1.567 13.690 -3.638 1.00 . A A . 4 ASP OD1 1 1 5 1573 1 1 4 ASP OD2 O 0.075 14.972 -4.515 1.00 . A A . 4 ASP OD2 1 1 5 1574 1 1 5 ILE C C 1.063 11.292 1.260 1.00 . A A . 5 ILE C 1 1 5 1575 1 1 5 ILE CA C 2.025 12.221 0.530 1.00 . A A . 5 ILE CA 1 1 5 1576 1 1 5 ILE CB C 3.153 12.639 1.475 1.00 . A A . 5 ILE CB 1 1 5 1577 1 1 5 ILE CD1 C 5.089 14.190 1.777 1.00 . A A . 5 ILE CD1 1 1 5 1578 1 1 5 ILE CG1 C 3.983 13.745 0.818 1.00 . A A . 5 ILE CG1 1 1 5 1579 1 1 5 ILE CG2 C 4.050 11.435 1.767 1.00 . A A . 5 ILE CG2 1 1 5 1580 1 1 5 ILE H H 1.551 14.282 0.399 1.00 . A A . 5 ILE H 1 1 5 1581 1 1 5 ILE HA H 2.449 11.693 -0.307 1.00 . A A . 5 ILE HA 1 1 5 1582 1 1 5 ILE HB H 2.731 13.004 2.400 1.00 . A A . 5 ILE HB 1 1 5 1583 1 1 5 ILE HD11 H 5.793 13.383 1.914 1.00 . A A . 5 ILE HD11 1 1 5 1584 1 1 5 ILE HD12 H 4.655 14.455 2.729 1.00 . A A . 5 ILE HD12 1 1 5 1585 1 1 5 ILE HD13 H 5.601 15.046 1.363 1.00 . A A . 5 ILE HD13 1 1 5 1586 1 1 5 ILE HG12 H 4.426 13.367 -0.095 1.00 . A A . 5 ILE HG12 1 1 5 1587 1 1 5 ILE HG13 H 3.344 14.588 0.591 1.00 . A A . 5 ILE HG13 1 1 5 1588 1 1 5 ILE HG21 H 3.442 10.603 2.090 1.00 . A A . 5 ILE HG21 1 1 5 1589 1 1 5 ILE HG22 H 4.755 11.690 2.543 1.00 . A A . 5 ILE HG22 1 1 5 1590 1 1 5 ILE HG23 H 4.586 11.160 0.870 1.00 . A A . 5 ILE HG23 1 1 5 1591 1 1 5 ILE N N 1.322 13.400 0.039 1.00 . A A . 5 ILE N 1 1 5 1592 1 1 5 ILE O O 1.268 10.081 1.310 1.00 . A A . 5 ILE O 1 1 5 1593 1 1 6 LEU C C -1.837 10.293 1.579 1.00 . A A . 6 LEU C 1 1 5 1594 1 1 6 LEU CA C -0.982 11.103 2.551 1.00 . A A . 6 LEU CA 1 1 5 1595 1 1 6 LEU CB C -1.872 12.051 3.364 1.00 . A A . 6 LEU CB 1 1 5 1596 1 1 6 LEU CD1 C -1.745 13.601 5.328 1.00 . A A . 6 LEU CD1 1 1 5 1597 1 1 6 LEU CD2 C -1.744 11.131 5.693 1.00 . A A . 6 LEU CD2 1 1 5 1598 1 1 6 LEU CG C -1.278 12.257 4.765 1.00 . A A . 6 LEU CG 1 1 5 1599 1 1 6 LEU H H -0.094 12.843 1.748 1.00 . A A . 6 LEU H 1 1 5 1600 1 1 6 LEU HA H -0.479 10.425 3.224 1.00 . A A . 6 LEU HA 1 1 5 1601 1 1 6 LEU HB2 H -1.932 13.006 2.855 1.00 . A A . 6 LEU HB2 1 1 5 1602 1 1 6 LEU HB3 H -2.863 11.629 3.452 1.00 . A A . 6 LEU HB3 1 1 5 1603 1 1 6 LEU HD11 H -1.381 13.713 6.339 1.00 . A A . 6 LEU HD11 1 1 5 1604 1 1 6 LEU HD12 H -2.825 13.636 5.328 1.00 . A A . 6 LEU HD12 1 1 5 1605 1 1 6 LEU HD13 H -1.358 14.402 4.716 1.00 . A A . 6 LEU HD13 1 1 5 1606 1 1 6 LEU HD21 H -2.773 11.300 5.977 1.00 . A A . 6 LEU HD21 1 1 5 1607 1 1 6 LEU HD22 H -1.126 11.114 6.578 1.00 . A A . 6 LEU HD22 1 1 5 1608 1 1 6 LEU HD23 H -1.665 10.184 5.181 1.00 . A A . 6 LEU HD23 1 1 5 1609 1 1 6 LEU HG H -0.198 12.251 4.704 1.00 . A A . 6 LEU HG 1 1 5 1610 1 1 6 LEU N N 0.015 11.875 1.824 1.00 . A A . 6 LEU N 1 1 5 1611 1 1 6 LEU O O -1.985 9.080 1.729 1.00 . A A . 6 LEU O 1 1 5 1612 1 1 7 LYS C C -2.537 9.057 -0.942 1.00 . A A . 7 LYS C 1 1 5 1613 1 1 7 LYS CA C -3.239 10.305 -0.403 1.00 . A A . 7 LYS CA 1 1 5 1614 1 1 7 LYS CB C -3.599 11.254 -1.568 1.00 . A A . 7 LYS CB 1 1 5 1615 1 1 7 LYS CD C -5.332 12.499 -0.250 1.00 . A A . 7 LYS CD 1 1 5 1616 1 1 7 LYS CE C -6.652 13.259 -0.411 1.00 . A A . 7 LYS CE 1 1 5 1617 1 1 7 LYS CG C -5.083 11.629 -1.488 1.00 . A A . 7 LYS CG 1 1 5 1618 1 1 7 LYS H H -2.245 11.937 0.522 1.00 . A A . 7 LYS H 1 1 5 1619 1 1 7 LYS HA H -4.152 9.996 0.082 1.00 . A A . 7 LYS HA 1 1 5 1620 1 1 7 LYS HB2 H -3.003 12.153 -1.522 1.00 . A A . 7 LYS HB2 1 1 5 1621 1 1 7 LYS HB3 H -3.411 10.757 -2.503 1.00 . A A . 7 LYS HB3 1 1 5 1622 1 1 7 LYS HD2 H -5.384 11.871 0.627 1.00 . A A . 7 LYS HD2 1 1 5 1623 1 1 7 LYS HD3 H -4.524 13.207 -0.137 1.00 . A A . 7 LYS HD3 1 1 5 1624 1 1 7 LYS HE2 H -7.381 12.622 -0.889 1.00 . A A . 7 LYS HE2 1 1 5 1625 1 1 7 LYS HE3 H -7.017 13.555 0.562 1.00 . A A . 7 LYS HE3 1 1 5 1626 1 1 7 LYS HG2 H -5.358 12.175 -2.373 1.00 . A A . 7 LYS HG2 1 1 5 1627 1 1 7 LYS HG3 H -5.680 10.732 -1.421 1.00 . A A . 7 LYS HG3 1 1 5 1628 1 1 7 LYS HZ1 H -5.406 14.632 -1.358 1.00 . A A . 7 LYS HZ1 1 1 5 1629 1 1 7 LYS HZ2 H -6.860 15.297 -0.783 1.00 . A A . 7 LYS HZ2 1 1 5 1630 1 1 7 LYS HZ3 H -6.857 14.334 -2.182 1.00 . A A . 7 LYS HZ3 1 1 5 1631 1 1 7 LYS N N -2.398 10.975 0.586 1.00 . A A . 7 LYS N 1 1 5 1632 1 1 7 LYS NZ N -6.427 14.472 -1.247 1.00 . A A . 7 LYS NZ 1 1 5 1633 1 1 7 LYS O O -3.190 8.085 -1.319 1.00 . A A . 7 LYS O 1 1 5 1634 1 1 8 GLY C C -0.430 6.817 -0.451 1.00 . A A . 8 GLY C 1 1 5 1635 1 1 8 GLY CA C -0.440 7.951 -1.469 1.00 . A A . 8 GLY CA 1 1 5 1636 1 1 8 GLY H H -0.732 9.886 -0.660 1.00 . A A . 8 GLY H 1 1 5 1637 1 1 8 GLY HA2 H -0.883 7.597 -2.390 1.00 . A A . 8 GLY HA2 1 1 5 1638 1 1 8 GLY HA3 H 0.576 8.262 -1.661 1.00 . A A . 8 GLY HA3 1 1 5 1639 1 1 8 GLY N N -1.206 9.089 -0.976 1.00 . A A . 8 GLY N 1 1 5 1640 1 1 8 GLY O O -0.844 5.697 -0.748 1.00 . A A . 8 GLY O 1 1 5 1641 1 1 9 ALA C C -1.278 5.551 2.097 1.00 . A A . 9 ALA C 1 1 5 1642 1 1 9 ALA CA C 0.108 6.113 1.811 1.00 . A A . 9 ALA CA 1 1 5 1643 1 1 9 ALA CB C 0.687 6.731 3.085 1.00 . A A . 9 ALA CB 1 1 5 1644 1 1 9 ALA H H 0.365 8.026 0.933 1.00 . A A . 9 ALA H 1 1 5 1645 1 1 9 ALA HA H 0.749 5.307 1.493 1.00 . A A . 9 ALA HA 1 1 5 1646 1 1 9 ALA HB1 H 0.495 6.078 3.923 1.00 . A A . 9 ALA HB1 1 1 5 1647 1 1 9 ALA HB2 H 0.222 7.690 3.264 1.00 . A A . 9 ALA HB2 1 1 5 1648 1 1 9 ALA HB3 H 1.752 6.864 2.970 1.00 . A A . 9 ALA HB3 1 1 5 1649 1 1 9 ALA N N 0.048 7.115 0.754 1.00 . A A . 9 ALA N 1 1 5 1650 1 1 9 ALA O O -1.417 4.391 2.485 1.00 . A A . 9 ALA O 1 1 5 1651 1 1 10 ALA C C -3.991 4.728 1.265 1.00 . A A . 10 ALA C 1 1 5 1652 1 1 10 ALA CA C -3.666 5.934 2.139 1.00 . A A . 10 ALA CA 1 1 5 1653 1 1 10 ALA CB C -4.644 7.070 1.832 1.00 . A A . 10 ALA CB 1 1 5 1654 1 1 10 ALA H H -2.133 7.286 1.586 1.00 . A A . 10 ALA H 1 1 5 1655 1 1 10 ALA HA H -3.769 5.655 3.176 1.00 . A A . 10 ALA HA 1 1 5 1656 1 1 10 ALA HB1 H -5.648 6.676 1.775 1.00 . A A . 10 ALA HB1 1 1 5 1657 1 1 10 ALA HB2 H -4.381 7.525 0.888 1.00 . A A . 10 ALA HB2 1 1 5 1658 1 1 10 ALA HB3 H -4.591 7.812 2.615 1.00 . A A . 10 ALA HB3 1 1 5 1659 1 1 10 ALA N N -2.300 6.373 1.899 1.00 . A A . 10 ALA N 1 1 5 1660 1 1 10 ALA O O -4.450 3.703 1.757 1.00 . A A . 10 ALA O 1 1 5 1661 1 1 11 LYS C C -2.901 2.756 -0.969 1.00 . A A . 11 LYS C 1 1 5 1662 1 1 11 LYS CA C -4.016 3.784 -0.973 1.00 . A A . 11 LYS CA 1 1 5 1663 1 1 11 LYS CB C -4.180 4.341 -2.363 1.00 . A A . 11 LYS CB 1 1 5 1664 1 1 11 LYS CD C -5.429 3.668 -4.377 1.00 . A A . 11 LYS CD 1 1 5 1665 1 1 11 LYS CE C -5.654 2.577 -5.426 1.00 . A A . 11 LYS CE 1 1 5 1666 1 1 11 LYS CG C -4.415 3.204 -3.360 1.00 . A A . 11 LYS CG 1 1 5 1667 1 1 11 LYS H H -3.388 5.703 -0.367 1.00 . A A . 11 LYS H 1 1 5 1668 1 1 11 LYS HA H -4.925 3.300 -0.691 1.00 . A A . 11 LYS HA 1 1 5 1669 1 1 11 LYS HB2 H -5.016 5.026 -2.380 1.00 . A A . 11 LYS HB2 1 1 5 1670 1 1 11 LYS HB3 H -3.292 4.860 -2.625 1.00 . A A . 11 LYS HB3 1 1 5 1671 1 1 11 LYS HD2 H -6.354 3.888 -3.869 1.00 . A A . 11 LYS HD2 1 1 5 1672 1 1 11 LYS HD3 H -5.057 4.554 -4.850 1.00 . A A . 11 LYS HD3 1 1 5 1673 1 1 11 LYS HE2 H -6.213 2.985 -6.254 1.00 . A A . 11 LYS HE2 1 1 5 1674 1 1 11 LYS HE3 H -4.699 2.214 -5.779 1.00 . A A . 11 LYS HE3 1 1 5 1675 1 1 11 LYS HG2 H -3.489 2.952 -3.856 1.00 . A A . 11 LYS HG2 1 1 5 1676 1 1 11 LYS HG3 H -4.798 2.341 -2.851 1.00 . A A . 11 LYS HG3 1 1 5 1677 1 1 11 LYS HZ1 H -5.755 0.754 -4.423 1.00 . A A . 11 LYS HZ1 1 1 5 1678 1 1 11 LYS HZ2 H -7.008 0.999 -5.545 1.00 . A A . 11 LYS HZ2 1 1 5 1679 1 1 11 LYS HZ3 H -7.026 1.817 -4.055 1.00 . A A . 11 LYS HZ3 1 1 5 1680 1 1 11 LYS N N -3.750 4.863 -0.033 1.00 . A A . 11 LYS N 1 1 5 1681 1 1 11 LYS NZ N -6.419 1.452 -4.816 1.00 . A A . 11 LYS NZ 1 1 5 1682 1 1 11 LYS O O -3.130 1.591 -1.294 1.00 . A A . 11 LYS O 1 1 5 1683 1 1 12 ASP C C -1.022 0.951 0.100 1.00 . A A . 12 ASP C 1 1 5 1684 1 1 12 ASP CA C -0.561 2.256 -0.540 1.00 . A A . 12 ASP CA 1 1 5 1685 1 1 12 ASP CB C 0.583 2.859 0.276 1.00 . A A . 12 ASP CB 1 1 5 1686 1 1 12 ASP CG C 1.742 1.872 0.355 1.00 . A A . 12 ASP CG 1 1 5 1687 1 1 12 ASP H H -1.573 4.121 -0.347 1.00 . A A . 12 ASP H 1 1 5 1688 1 1 12 ASP HA H -0.216 2.056 -1.544 1.00 . A A . 12 ASP HA 1 1 5 1689 1 1 12 ASP HB2 H 0.918 3.769 -0.197 1.00 . A A . 12 ASP HB2 1 1 5 1690 1 1 12 ASP HB3 H 0.233 3.078 1.274 1.00 . A A . 12 ASP HB3 1 1 5 1691 1 1 12 ASP N N -1.695 3.181 -0.595 1.00 . A A . 12 ASP N 1 1 5 1692 1 1 12 ASP O O -0.302 -0.046 0.133 1.00 . A A . 12 ASP O 1 1 5 1693 1 1 12 ASP OD1 O 2.297 1.556 -0.685 1.00 . A A . 12 ASP OD1 1 1 5 1694 1 1 12 ASP OD2 O 2.060 1.448 1.454 1.00 . A A . 12 ASP OD2 1 1 5 1695 1 1 13 ILE C C -2.873 -1.340 0.267 1.00 . A A . 13 ILE C 1 1 5 1696 1 1 13 ILE CA C -2.901 -0.144 1.209 1.00 . A A . 13 ILE CA 1 1 5 1697 1 1 13 ILE CB C -4.357 0.248 1.469 1.00 . A A . 13 ILE CB 1 1 5 1698 1 1 13 ILE CD1 C -5.822 1.778 2.780 1.00 . A A . 13 ILE CD1 1 1 5 1699 1 1 13 ILE CG1 C -4.448 1.111 2.724 1.00 . A A . 13 ILE CG1 1 1 5 1700 1 1 13 ILE CG2 C -5.227 -0.994 1.640 1.00 . A A . 13 ILE CG2 1 1 5 1701 1 1 13 ILE H H -2.759 1.827 0.501 1.00 . A A . 13 ILE H 1 1 5 1702 1 1 13 ILE HA H -2.415 -0.388 2.141 1.00 . A A . 13 ILE HA 1 1 5 1703 1 1 13 ILE HB H -4.719 0.814 0.623 1.00 . A A . 13 ILE HB 1 1 5 1704 1 1 13 ILE HD11 H -5.782 2.630 3.442 1.00 . A A . 13 ILE HD11 1 1 5 1705 1 1 13 ILE HD12 H -6.549 1.071 3.146 1.00 . A A . 13 ILE HD12 1 1 5 1706 1 1 13 ILE HD13 H -6.108 2.106 1.791 1.00 . A A . 13 ILE HD13 1 1 5 1707 1 1 13 ILE HG12 H -4.316 0.489 3.593 1.00 . A A . 13 ILE HG12 1 1 5 1708 1 1 13 ILE HG13 H -3.677 1.870 2.701 1.00 . A A . 13 ILE HG13 1 1 5 1709 1 1 13 ILE HG21 H -4.709 -1.714 2.251 1.00 . A A . 13 ILE HG21 1 1 5 1710 1 1 13 ILE HG22 H -5.433 -1.420 0.669 1.00 . A A . 13 ILE HG22 1 1 5 1711 1 1 13 ILE HG23 H -6.156 -0.716 2.115 1.00 . A A . 13 ILE HG23 1 1 5 1712 1 1 13 ILE N N -2.255 0.993 0.583 1.00 . A A . 13 ILE N 1 1 5 1713 1 1 13 ILE O O -2.417 -2.425 0.627 1.00 . A A . 13 ILE O 1 1 5 1714 1 1 14 ALA C C -2.047 -2.860 -2.057 1.00 . A A . 14 ALA C 1 1 5 1715 1 1 14 ALA CA C -3.407 -2.177 -1.947 1.00 . A A . 14 ALA CA 1 1 5 1716 1 1 14 ALA CB C -3.799 -1.591 -3.305 1.00 . A A . 14 ALA CB 1 1 5 1717 1 1 14 ALA H H -3.720 -0.230 -1.159 1.00 . A A . 14 ALA H 1 1 5 1718 1 1 14 ALA HA H -4.145 -2.910 -1.659 1.00 . A A . 14 ALA HA 1 1 5 1719 1 1 14 ALA HB1 H -4.595 -0.874 -3.171 1.00 . A A . 14 ALA HB1 1 1 5 1720 1 1 14 ALA HB2 H -4.136 -2.384 -3.957 1.00 . A A . 14 ALA HB2 1 1 5 1721 1 1 14 ALA HB3 H -2.944 -1.101 -3.748 1.00 . A A . 14 ALA HB3 1 1 5 1722 1 1 14 ALA N N -3.370 -1.122 -0.942 1.00 . A A . 14 ALA N 1 1 5 1723 1 1 14 ALA O O -1.963 -4.059 -2.318 1.00 . A A . 14 ALA O 1 1 5 1724 1 1 15 GLY C C 0.673 -3.509 -0.730 1.00 . A A . 15 GLY C 1 1 5 1725 1 1 15 GLY CA C 0.367 -2.627 -1.935 1.00 . A A . 15 GLY CA 1 1 5 1726 1 1 15 GLY H H -1.114 -1.136 -1.652 1.00 . A A . 15 GLY H 1 1 5 1727 1 1 15 GLY HA2 H 0.462 -3.213 -2.838 1.00 . A A . 15 GLY HA2 1 1 5 1728 1 1 15 GLY HA3 H 1.074 -1.812 -1.965 1.00 . A A . 15 GLY HA3 1 1 5 1729 1 1 15 GLY N N -0.985 -2.087 -1.857 1.00 . A A . 15 GLY N 1 1 5 1730 1 1 15 GLY O O 1.152 -4.633 -0.877 1.00 . A A . 15 GLY O 1 1 5 1731 1 1 16 HIS C C -0.168 -5.029 1.700 1.00 . A A . 16 HIS C 1 1 5 1732 1 1 16 HIS CA C 0.646 -3.739 1.688 1.00 . A A . 16 HIS CA 1 1 5 1733 1 1 16 HIS CB C 0.274 -2.886 2.903 1.00 . A A . 16 HIS CB 1 1 5 1734 1 1 16 HIS CD2 C -0.481 -4.501 4.833 1.00 . A A . 16 HIS CD2 1 1 5 1735 1 1 16 HIS CE1 C 1.383 -4.571 5.935 1.00 . A A . 16 HIS CE1 1 1 5 1736 1 1 16 HIS CG C 0.410 -3.705 4.157 1.00 . A A . 16 HIS CG 1 1 5 1737 1 1 16 HIS H H 0.014 -2.089 0.519 1.00 . A A . 16 HIS H 1 1 5 1738 1 1 16 HIS HA H 1.695 -3.984 1.741 1.00 . A A . 16 HIS HA 1 1 5 1739 1 1 16 HIS HB2 H 0.935 -2.032 2.958 1.00 . A A . 16 HIS HB2 1 1 5 1740 1 1 16 HIS HB3 H -0.745 -2.545 2.806 1.00 . A A . 16 HIS HB3 1 1 5 1741 1 1 16 HIS HD2 H -1.504 -4.678 4.536 1.00 . A A . 16 HIS HD2 1 1 5 1742 1 1 16 HIS HE1 H 2.132 -4.804 6.677 1.00 . A A . 16 HIS HE1 1 1 5 1743 1 1 16 HIS HE2 H -0.261 -5.650 6.617 1.00 . A A . 16 HIS HE2 1 1 5 1744 1 1 16 HIS N N 0.395 -2.990 0.463 1.00 . A A . 16 HIS N 1 1 5 1745 1 1 16 HIS ND1 N 1.592 -3.764 4.879 1.00 . A A . 16 HIS ND1 1 1 5 1746 1 1 16 HIS NE2 N 0.135 -5.047 5.955 1.00 . A A . 16 HIS NE2 1 1 5 1747 1 1 16 HIS O O 0.366 -6.109 1.958 1.00 . A A . 16 HIS O 1 1 5 1748 1 1 17 LEU C C -1.897 -7.067 0.341 1.00 . A A . 17 LEU C 1 1 5 1749 1 1 17 LEU CA C -2.341 -6.066 1.402 1.00 . A A . 17 LEU CA 1 1 5 1750 1 1 17 LEU CB C -3.760 -5.607 1.117 1.00 . A A . 17 LEU CB 1 1 5 1751 1 1 17 LEU CD1 C -4.804 -7.040 2.900 1.00 . A A . 17 LEU CD1 1 1 5 1752 1 1 17 LEU CD2 C -6.128 -6.306 0.907 1.00 . A A . 17 LEU CD2 1 1 5 1753 1 1 17 LEU CG C -4.749 -6.740 1.395 1.00 . A A . 17 LEU CG 1 1 5 1754 1 1 17 LEU H H -1.836 -4.026 1.224 1.00 . A A . 17 LEU H 1 1 5 1755 1 1 17 LEU HA H -2.319 -6.541 2.361 1.00 . A A . 17 LEU HA 1 1 5 1756 1 1 17 LEU HB2 H -3.997 -4.759 1.742 1.00 . A A . 17 LEU HB2 1 1 5 1757 1 1 17 LEU HB3 H -3.831 -5.321 0.087 1.00 . A A . 17 LEU HB3 1 1 5 1758 1 1 17 LEU HD11 H -5.783 -7.421 3.157 1.00 . A A . 17 LEU HD11 1 1 5 1759 1 1 17 LEU HD12 H -4.614 -6.137 3.461 1.00 . A A . 17 LEU HD12 1 1 5 1760 1 1 17 LEU HD13 H -4.058 -7.780 3.148 1.00 . A A . 17 LEU HD13 1 1 5 1761 1 1 17 LEU HD21 H -6.826 -7.119 1.030 1.00 . A A . 17 LEU HD21 1 1 5 1762 1 1 17 LEU HD22 H -6.069 -6.034 -0.136 1.00 . A A . 17 LEU HD22 1 1 5 1763 1 1 17 LEU HD23 H -6.460 -5.455 1.483 1.00 . A A . 17 LEU HD23 1 1 5 1764 1 1 17 LEU HG H -4.439 -7.627 0.862 1.00 . A A . 17 LEU HG 1 1 5 1765 1 1 17 LEU N N -1.462 -4.910 1.421 1.00 . A A . 17 LEU N 1 1 5 1766 1 1 17 LEU O O -1.985 -8.277 0.542 1.00 . A A . 17 LEU O 1 1 5 1767 1 1 18 ALA C C 0.182 -8.304 -1.365 1.00 . A A . 18 ALA C 1 1 5 1768 1 1 18 ALA CA C -0.952 -7.428 -1.860 1.00 . A A . 18 ALA CA 1 1 5 1769 1 1 18 ALA CB C -0.483 -6.595 -3.053 1.00 . A A . 18 ALA CB 1 1 5 1770 1 1 18 ALA H H -1.353 -5.587 -0.894 1.00 . A A . 18 ALA H 1 1 5 1771 1 1 18 ALA HA H -1.767 -8.065 -2.173 1.00 . A A . 18 ALA HA 1 1 5 1772 1 1 18 ALA HB1 H -0.004 -7.239 -3.775 1.00 . A A . 18 ALA HB1 1 1 5 1773 1 1 18 ALA HB2 H 0.219 -5.846 -2.716 1.00 . A A . 18 ALA HB2 1 1 5 1774 1 1 18 ALA HB3 H -1.333 -6.110 -3.510 1.00 . A A . 18 ALA HB3 1 1 5 1775 1 1 18 ALA N N -1.411 -6.558 -0.786 1.00 . A A . 18 ALA N 1 1 5 1776 1 1 18 ALA O O 0.089 -9.527 -1.396 1.00 . A A . 18 ALA O 1 1 5 1777 1 1 19 SER C C 1.912 -9.434 0.652 1.00 . A A . 19 SER C 1 1 5 1778 1 1 19 SER CA C 2.387 -8.426 -0.385 1.00 . A A . 19 SER CA 1 1 5 1779 1 1 19 SER CB C 3.411 -7.473 0.236 1.00 . A A . 19 SER CB 1 1 5 1780 1 1 19 SER H H 1.269 -6.694 -0.881 1.00 . A A . 19 SER H 1 1 5 1781 1 1 19 SER HA H 2.847 -8.959 -1.203 1.00 . A A . 19 SER HA 1 1 5 1782 1 1 19 SER HB2 H 4.404 -7.762 -0.061 1.00 . A A . 19 SER HB2 1 1 5 1783 1 1 19 SER HB3 H 3.216 -6.465 -0.106 1.00 . A A . 19 SER HB3 1 1 5 1784 1 1 19 SER HG H 2.383 -7.601 1.885 1.00 . A A . 19 SER HG 1 1 5 1785 1 1 19 SER N N 1.250 -7.675 -0.894 1.00 . A A . 19 SER N 1 1 5 1786 1 1 19 SER O O 2.435 -10.545 0.742 1.00 . A A . 19 SER O 1 1 5 1787 1 1 19 SER OG O 3.312 -7.531 1.655 1.00 . A A . 19 SER OG 1 1 5 1788 1 1 20 LYS C C -0.333 -11.107 1.775 1.00 . A A . 20 LYS C 1 1 5 1789 1 1 20 LYS CA C 0.350 -9.918 2.441 1.00 . A A . 20 LYS CA 1 1 5 1790 1 1 20 LYS CB C -0.656 -9.141 3.295 1.00 . A A . 20 LYS CB 1 1 5 1791 1 1 20 LYS CD C 1.080 -7.787 4.485 1.00 . A A . 20 LYS CD 1 1 5 1792 1 1 20 LYS CE C 1.889 -7.688 5.780 1.00 . A A . 20 LYS CE 1 1 5 1793 1 1 20 LYS CG C -0.038 -8.817 4.659 1.00 . A A . 20 LYS CG 1 1 5 1794 1 1 20 LYS H H 0.521 -8.151 1.301 1.00 . A A . 20 LYS H 1 1 5 1795 1 1 20 LYS HA H 1.148 -10.274 3.069 1.00 . A A . 20 LYS HA 1 1 5 1796 1 1 20 LYS HB2 H -0.910 -8.222 2.790 1.00 . A A . 20 LYS HB2 1 1 5 1797 1 1 20 LYS HB3 H -1.550 -9.728 3.438 1.00 . A A . 20 LYS HB3 1 1 5 1798 1 1 20 LYS HD2 H 1.728 -8.091 3.677 1.00 . A A . 20 LYS HD2 1 1 5 1799 1 1 20 LYS HD3 H 0.649 -6.823 4.258 1.00 . A A . 20 LYS HD3 1 1 5 1800 1 1 20 LYS HE2 H 2.624 -6.902 5.686 1.00 . A A . 20 LYS HE2 1 1 5 1801 1 1 20 LYS HE3 H 1.226 -7.465 6.603 1.00 . A A . 20 LYS HE3 1 1 5 1802 1 1 20 LYS HG2 H -0.798 -8.418 5.307 1.00 . A A . 20 LYS HG2 1 1 5 1803 1 1 20 LYS HG3 H 0.368 -9.717 5.096 1.00 . A A . 20 LYS HG3 1 1 5 1804 1 1 20 LYS HZ1 H 1.934 -9.628 6.538 1.00 . A A . 20 LYS HZ1 1 1 5 1805 1 1 20 LYS HZ2 H 3.427 -8.819 6.615 1.00 . A A . 20 LYS HZ2 1 1 5 1806 1 1 20 LYS HZ3 H 2.855 -9.414 5.130 1.00 . A A . 20 LYS HZ3 1 1 5 1807 1 1 20 LYS N N 0.904 -9.042 1.425 1.00 . A A . 20 LYS N 1 1 5 1808 1 1 20 LYS NZ N 2.578 -8.985 6.035 1.00 . A A . 20 LYS NZ 1 1 5 1809 1 1 20 LYS O O -0.114 -12.259 2.152 1.00 . A A . 20 LYS O 1 1 5 1810 1 1 21 VAL C C -0.922 -12.631 -0.854 1.00 . A A . 21 VAL C 1 1 5 1811 1 1 21 VAL CA C -1.870 -11.856 0.050 1.00 . A A . 21 VAL CA 1 1 5 1812 1 1 21 VAL CB C -2.993 -11.248 -0.786 1.00 . A A . 21 VAL CB 1 1 5 1813 1 1 21 VAL CG1 C -3.744 -12.373 -1.494 1.00 . A A . 21 VAL CG1 1 1 5 1814 1 1 21 VAL CG2 C -3.961 -10.483 0.126 1.00 . A A . 21 VAL CG2 1 1 5 1815 1 1 21 VAL H H -1.289 -9.878 0.520 1.00 . A A . 21 VAL H 1 1 5 1816 1 1 21 VAL HA H -2.302 -12.536 0.755 1.00 . A A . 21 VAL HA 1 1 5 1817 1 1 21 VAL HB H -2.574 -10.575 -1.521 1.00 . A A . 21 VAL HB 1 1 5 1818 1 1 21 VAL HG11 H -3.116 -12.797 -2.262 1.00 . A A . 21 VAL HG11 1 1 5 1819 1 1 21 VAL HG12 H -4.646 -11.981 -1.937 1.00 . A A . 21 VAL HG12 1 1 5 1820 1 1 21 VAL HG13 H -3.999 -13.139 -0.775 1.00 . A A . 21 VAL HG13 1 1 5 1821 1 1 21 VAL HG21 H -4.460 -9.712 -0.445 1.00 . A A . 21 VAL HG21 1 1 5 1822 1 1 21 VAL HG22 H -3.414 -10.029 0.938 1.00 . A A . 21 VAL HG22 1 1 5 1823 1 1 21 VAL HG23 H -4.697 -11.164 0.527 1.00 . A A . 21 VAL HG23 1 1 5 1824 1 1 21 VAL N N -1.159 -10.814 0.775 1.00 . A A . 21 VAL N 1 1 5 1825 1 1 21 VAL O O -1.026 -13.851 -0.980 1.00 . A A . 21 VAL O 1 1 5 1826 1 1 22 MET C C 1.788 -13.592 -1.608 1.00 . A A . 22 MET C 1 1 5 1827 1 1 22 MET CA C 0.965 -12.559 -2.375 1.00 . A A . 22 MET CA 1 1 5 1828 1 1 22 MET CB C 1.894 -11.510 -2.996 1.00 . A A . 22 MET CB 1 1 5 1829 1 1 22 MET CE C 2.649 -10.765 -6.888 1.00 . A A . 22 MET CE 1 1 5 1830 1 1 22 MET CG C 1.535 -11.301 -4.471 1.00 . A A . 22 MET CG 1 1 5 1831 1 1 22 MET H H 0.040 -10.947 -1.345 1.00 . A A . 22 MET H 1 1 5 1832 1 1 22 MET HA H 0.427 -13.058 -3.161 1.00 . A A . 22 MET HA 1 1 5 1833 1 1 22 MET HB2 H 1.778 -10.581 -2.467 1.00 . A A . 22 MET HB2 1 1 5 1834 1 1 22 MET HB3 H 2.921 -11.839 -2.922 1.00 . A A . 22 MET HB3 1 1 5 1835 1 1 22 MET HE1 H 1.627 -10.833 -7.232 1.00 . A A . 22 MET HE1 1 1 5 1836 1 1 22 MET HE2 H 3.094 -11.747 -6.897 1.00 . A A . 22 MET HE2 1 1 5 1837 1 1 22 MET HE3 H 3.212 -10.112 -7.540 1.00 . A A . 22 MET HE3 1 1 5 1838 1 1 22 MET HG2 H 1.617 -12.243 -4.998 1.00 . A A . 22 MET HG2 1 1 5 1839 1 1 22 MET HG3 H 0.522 -10.928 -4.546 1.00 . A A . 22 MET HG3 1 1 5 1840 1 1 22 MET N N 0.004 -11.918 -1.483 1.00 . A A . 22 MET N 1 1 5 1841 1 1 22 MET O O 1.877 -14.752 -2.009 1.00 . A A . 22 MET O 1 1 5 1842 1 1 22 MET SD S 2.676 -10.102 -5.205 1.00 . A A . 22 MET SD 1 1 5 1843 1 1 23 ASN C C 2.371 -15.228 0.813 1.00 . A A . 23 ASN C 1 1 5 1844 1 1 23 ASN CA C 3.200 -14.049 0.312 1.00 . A A . 23 ASN CA 1 1 5 1845 1 1 23 ASN CB C 3.778 -13.285 1.500 1.00 . A A . 23 ASN CB 1 1 5 1846 1 1 23 ASN CG C 5.006 -14.010 2.045 1.00 . A A . 23 ASN CG 1 1 5 1847 1 1 23 ASN H H 2.279 -12.220 -0.236 1.00 . A A . 23 ASN H 1 1 5 1848 1 1 23 ASN HA H 4.012 -14.422 -0.280 1.00 . A A . 23 ASN HA 1 1 5 1849 1 1 23 ASN HB2 H 4.056 -12.289 1.186 1.00 . A A . 23 ASN HB2 1 1 5 1850 1 1 23 ASN HB3 H 3.034 -13.223 2.269 1.00 . A A . 23 ASN HB3 1 1 5 1851 1 1 23 ASN HD21 H 4.126 -15.788 2.074 1.00 . A A . 23 ASN HD21 1 1 5 1852 1 1 23 ASN HD22 H 5.736 -15.767 2.610 1.00 . A A . 23 ASN HD22 1 1 5 1853 1 1 23 ASN N N 2.387 -13.157 -0.504 1.00 . A A . 23 ASN N 1 1 5 1854 1 1 23 ASN ND2 N 4.952 -15.295 2.260 1.00 . A A . 23 ASN ND2 1 1 5 1855 1 1 23 ASN O O 2.894 -16.324 1.018 1.00 . A A . 23 ASN O 1 1 5 1856 1 1 23 ASN OD1 O 6.042 -13.386 2.278 1.00 . A A . 23 ASN OD1 1 1 5 1857 1 1 24 LYS C C 0.143 -17.202 0.492 1.00 . A A . 24 LYS C 1 1 5 1858 1 1 24 LYS CA C 0.184 -16.044 1.484 1.00 . A A . 24 LYS CA 1 1 5 1859 1 1 24 LYS CB C -1.225 -15.482 1.675 1.00 . A A . 24 LYS CB 1 1 5 1860 1 1 24 LYS CD C -3.518 -16.006 2.520 1.00 . A A . 24 LYS CD 1 1 5 1861 1 1 24 LYS CE C -4.375 -17.060 3.226 1.00 . A A . 24 LYS CE 1 1 5 1862 1 1 24 LYS CG C -2.056 -16.458 2.512 1.00 . A A . 24 LYS CG 1 1 5 1863 1 1 24 LYS H H 0.717 -14.103 0.827 1.00 . A A . 24 LYS H 1 1 5 1864 1 1 24 LYS HA H 0.548 -16.407 2.433 1.00 . A A . 24 LYS HA 1 1 5 1865 1 1 24 LYS HB2 H -1.167 -14.531 2.183 1.00 . A A . 24 LYS HB2 1 1 5 1866 1 1 24 LYS HB3 H -1.694 -15.349 0.712 1.00 . A A . 24 LYS HB3 1 1 5 1867 1 1 24 LYS HD2 H -3.600 -15.064 3.043 1.00 . A A . 24 LYS HD2 1 1 5 1868 1 1 24 LYS HD3 H -3.864 -15.886 1.505 1.00 . A A . 24 LYS HD3 1 1 5 1869 1 1 24 LYS HE2 H -4.243 -18.015 2.740 1.00 . A A . 24 LYS HE2 1 1 5 1870 1 1 24 LYS HE3 H -4.071 -17.136 4.259 1.00 . A A . 24 LYS HE3 1 1 5 1871 1 1 24 LYS HG2 H -1.987 -17.448 2.084 1.00 . A A . 24 LYS HG2 1 1 5 1872 1 1 24 LYS HG3 H -1.682 -16.475 3.523 1.00 . A A . 24 LYS HG3 1 1 5 1873 1 1 24 LYS HZ1 H -6.316 -17.300 2.512 1.00 . A A . 24 LYS HZ1 1 1 5 1874 1 1 24 LYS HZ2 H -5.881 -15.684 2.805 1.00 . A A . 24 LYS HZ2 1 1 5 1875 1 1 24 LYS HZ3 H -6.232 -16.720 4.104 1.00 . A A . 24 LYS HZ3 1 1 5 1876 1 1 24 LYS N N 1.077 -14.995 1.006 1.00 . A A . 24 LYS N 1 1 5 1877 1 1 24 LYS NZ N -5.809 -16.661 3.157 1.00 . A A . 24 LYS NZ 1 1 5 1878 1 1 24 LYS O O 0.373 -18.355 0.857 1.00 . A A . 24 LYS O 1 1 5 1879 1 1 25 LEU C C 1.163 -18.485 -2.073 1.00 . A A . 25 LEU C 1 1 5 1880 1 1 25 LEU CA C -0.221 -17.903 -1.802 1.00 . A A . 25 LEU CA 1 1 5 1881 1 1 25 LEU CB C -0.791 -17.290 -3.081 1.00 . A A . 25 LEU CB 1 1 5 1882 1 1 25 LEU CD1 C -0.530 -19.538 -4.162 1.00 . A A . 25 LEU CD1 1 1 5 1883 1 1 25 LEU CD2 C -2.752 -18.867 -3.215 1.00 . A A . 25 LEU CD2 1 1 5 1884 1 1 25 LEU CG C -1.486 -18.366 -3.930 1.00 . A A . 25 LEU CG 1 1 5 1885 1 1 25 LEU H H -0.325 -15.955 -1.000 1.00 . A A . 25 LEU H 1 1 5 1886 1 1 25 LEU HA H -0.872 -18.686 -1.474 1.00 . A A . 25 LEU HA 1 1 5 1887 1 1 25 LEU HB2 H -1.506 -16.519 -2.822 1.00 . A A . 25 LEU HB2 1 1 5 1888 1 1 25 LEU HB3 H 0.014 -16.858 -3.647 1.00 . A A . 25 LEU HB3 1 1 5 1889 1 1 25 LEU HD11 H -0.915 -20.163 -4.953 1.00 . A A . 25 LEU HD11 1 1 5 1890 1 1 25 LEU HD12 H -0.443 -20.118 -3.256 1.00 . A A . 25 LEU HD12 1 1 5 1891 1 1 25 LEU HD13 H 0.441 -19.160 -4.444 1.00 . A A . 25 LEU HD13 1 1 5 1892 1 1 25 LEU HD21 H -2.518 -19.745 -2.630 1.00 . A A . 25 LEU HD21 1 1 5 1893 1 1 25 LEU HD22 H -3.501 -19.120 -3.952 1.00 . A A . 25 LEU HD22 1 1 5 1894 1 1 25 LEU HD23 H -3.137 -18.094 -2.568 1.00 . A A . 25 LEU HD23 1 1 5 1895 1 1 25 LEU HG H -1.760 -17.939 -4.884 1.00 . A A . 25 LEU HG 1 1 5 1896 1 1 25 LEU N N -0.151 -16.886 -0.765 1.00 . A A . 25 LEU N 1 1 5 1897 1 1 25 LEU O O 1.423 -19.649 -1.766 1.00 . A A . 25 LEU O 1 1 5 1898 1 1 26 NH2 HN1 H 1.865 -16.809 -2.878 1.00 . A A . 26 NH2 HN1 1 1 5 1899 1 1 26 NH2 HN2 H 2.970 -18.107 -2.813 1.00 . A A . 26 NH2 HN2 1 1 5 1900 1 1 26 NH2 N N 2.075 -17.739 -2.634 1.00 . A A . 26 NH2 N 1 1 6 1901 1 1 1 GLY C C 3.318 17.675 -0.212 1.00 . A A . 1 GLY C 1 1 6 1902 1 1 1 GLY CA C 3.267 19.033 -0.904 1.00 . A A . 1 GLY CA 1 1 6 1903 1 1 1 GLY H1 H 2.119 19.850 -2.437 1.00 . A A . 1 GLY H1 1 1 6 1904 1 1 1 GLY H2 H 1.232 19.455 -1.043 1.00 . A A . 1 GLY H2 1 1 6 1905 1 1 1 GLY H3 H 1.760 18.229 -2.094 1.00 . A A . 1 GLY H3 1 1 6 1906 1 1 1 GLY HA2 H 4.108 19.129 -1.575 1.00 . A A . 1 GLY HA2 1 1 6 1907 1 1 1 GLY HA3 H 3.309 19.813 -0.160 1.00 . A A . 1 GLY HA3 1 1 6 1908 1 1 1 GLY N N 1.998 19.151 -1.678 1.00 . A A . 1 GLY N 1 1 6 1909 1 1 1 GLY O O 2.995 16.650 -0.813 1.00 . A A . 1 GLY O 1 1 6 1910 1 1 2 VAL C C 2.421 15.882 2.101 1.00 . A A . 2 VAL C 1 1 6 1911 1 1 2 VAL CA C 3.814 16.436 1.816 1.00 . A A . 2 VAL CA 1 1 6 1912 1 1 2 VAL CB C 4.546 16.684 3.135 1.00 . A A . 2 VAL CB 1 1 6 1913 1 1 2 VAL CG1 C 5.963 17.182 2.846 1.00 . A A . 2 VAL CG1 1 1 6 1914 1 1 2 VAL CG2 C 3.791 17.740 3.945 1.00 . A A . 2 VAL CG2 1 1 6 1915 1 1 2 VAL H H 3.969 18.522 1.480 1.00 . A A . 2 VAL H 1 1 6 1916 1 1 2 VAL HA H 4.368 15.709 1.241 1.00 . A A . 2 VAL HA 1 1 6 1917 1 1 2 VAL HB H 4.597 15.763 3.698 1.00 . A A . 2 VAL HB 1 1 6 1918 1 1 2 VAL HG11 H 6.416 16.561 2.087 1.00 . A A . 2 VAL HG11 1 1 6 1919 1 1 2 VAL HG12 H 6.553 17.133 3.750 1.00 . A A . 2 VAL HG12 1 1 6 1920 1 1 2 VAL HG13 H 5.922 18.204 2.498 1.00 . A A . 2 VAL HG13 1 1 6 1921 1 1 2 VAL HG21 H 4.416 18.087 4.755 1.00 . A A . 2 VAL HG21 1 1 6 1922 1 1 2 VAL HG22 H 2.887 17.307 4.348 1.00 . A A . 2 VAL HG22 1 1 6 1923 1 1 2 VAL HG23 H 3.537 18.572 3.305 1.00 . A A . 2 VAL HG23 1 1 6 1924 1 1 2 VAL N N 3.725 17.675 1.053 1.00 . A A . 2 VAL N 1 1 6 1925 1 1 2 VAL O O 2.215 14.668 2.109 1.00 . A A . 2 VAL O 1 1 6 1926 1 1 3 VAL C C -0.408 15.413 1.547 1.00 . A A . 3 VAL C 1 1 6 1927 1 1 3 VAL CA C 0.100 16.370 2.621 1.00 . A A . 3 VAL CA 1 1 6 1928 1 1 3 VAL CB C -0.811 17.597 2.687 1.00 . A A . 3 VAL CB 1 1 6 1929 1 1 3 VAL CG1 C -0.885 18.252 1.307 1.00 . A A . 3 VAL CG1 1 1 6 1930 1 1 3 VAL CG2 C -2.213 17.167 3.122 1.00 . A A . 3 VAL CG2 1 1 6 1931 1 1 3 VAL H H 1.693 17.734 2.317 1.00 . A A . 3 VAL H 1 1 6 1932 1 1 3 VAL HA H 0.077 15.868 3.577 1.00 . A A . 3 VAL HA 1 1 6 1933 1 1 3 VAL HB H -0.410 18.305 3.399 1.00 . A A . 3 VAL HB 1 1 6 1934 1 1 3 VAL HG11 H -1.470 17.631 0.645 1.00 . A A . 3 VAL HG11 1 1 6 1935 1 1 3 VAL HG12 H 0.112 18.366 0.908 1.00 . A A . 3 VAL HG12 1 1 6 1936 1 1 3 VAL HG13 H -1.350 19.223 1.394 1.00 . A A . 3 VAL HG13 1 1 6 1937 1 1 3 VAL HG21 H -2.145 16.585 4.030 1.00 . A A . 3 VAL HG21 1 1 6 1938 1 1 3 VAL HG22 H -2.664 16.569 2.344 1.00 . A A . 3 VAL HG22 1 1 6 1939 1 1 3 VAL HG23 H -2.819 18.043 3.300 1.00 . A A . 3 VAL HG23 1 1 6 1940 1 1 3 VAL N N 1.470 16.780 2.336 1.00 . A A . 3 VAL N 1 1 6 1941 1 1 3 VAL O O -1.272 14.575 1.807 1.00 . A A . 3 VAL O 1 1 6 1942 1 1 4 ASP C C 0.201 13.252 -0.531 1.00 . A A . 4 ASP C 1 1 6 1943 1 1 4 ASP CA C -0.274 14.683 -0.764 1.00 . A A . 4 ASP CA 1 1 6 1944 1 1 4 ASP CB C 0.310 15.207 -2.078 1.00 . A A . 4 ASP CB 1 1 6 1945 1 1 4 ASP CG C -0.087 14.288 -3.228 1.00 . A A . 4 ASP CG 1 1 6 1946 1 1 4 ASP H H 0.819 16.228 0.191 1.00 . A A . 4 ASP H 1 1 6 1947 1 1 4 ASP HA H -1.351 14.688 -0.834 1.00 . A A . 4 ASP HA 1 1 6 1948 1 1 4 ASP HB2 H -0.072 16.204 -2.266 1.00 . A A . 4 ASP HB2 1 1 6 1949 1 1 4 ASP HB3 H 1.389 15.241 -2.003 1.00 . A A . 4 ASP HB3 1 1 6 1950 1 1 4 ASP N N 0.133 15.543 0.340 1.00 . A A . 4 ASP N 1 1 6 1951 1 1 4 ASP O O -0.552 12.298 -0.727 1.00 . A A . 4 ASP O 1 1 6 1952 1 1 4 ASP OD1 O -1.222 14.377 -3.666 1.00 . A A . 4 ASP OD1 1 1 6 1953 1 1 4 ASP OD2 O 0.749 13.507 -3.651 1.00 . A A . 4 ASP OD2 1 1 6 1954 1 1 5 ILE C C 1.206 11.065 1.215 1.00 . A A . 5 ILE C 1 1 6 1955 1 1 5 ILE CA C 2.018 11.792 0.150 1.00 . A A . 5 ILE CA 1 1 6 1956 1 1 5 ILE CB C 3.470 11.925 0.612 1.00 . A A . 5 ILE CB 1 1 6 1957 1 1 5 ILE CD1 C 5.690 12.909 0.019 1.00 . A A . 5 ILE CD1 1 1 6 1958 1 1 5 ILE CG1 C 4.311 12.522 -0.519 1.00 . A A . 5 ILE CG1 1 1 6 1959 1 1 5 ILE CG2 C 4.019 10.545 0.979 1.00 . A A . 5 ILE CG2 1 1 6 1960 1 1 5 ILE H H 2.007 13.908 0.032 1.00 . A A . 5 ILE H 1 1 6 1961 1 1 5 ILE HA H 1.992 11.218 -0.760 1.00 . A A . 5 ILE HA 1 1 6 1962 1 1 5 ILE HB H 3.515 12.571 1.477 1.00 . A A . 5 ILE HB 1 1 6 1963 1 1 5 ILE HD11 H 6.349 13.130 -0.806 1.00 . A A . 5 ILE HD11 1 1 6 1964 1 1 5 ILE HD12 H 6.094 12.089 0.595 1.00 . A A . 5 ILE HD12 1 1 6 1965 1 1 5 ILE HD13 H 5.598 13.780 0.650 1.00 . A A . 5 ILE HD13 1 1 6 1966 1 1 5 ILE HG12 H 4.424 11.790 -1.309 1.00 . A A . 5 ILE HG12 1 1 6 1967 1 1 5 ILE HG13 H 3.818 13.404 -0.908 1.00 . A A . 5 ILE HG13 1 1 6 1968 1 1 5 ILE HG21 H 3.770 9.840 0.199 1.00 . A A . 5 ILE HG21 1 1 6 1969 1 1 5 ILE HG22 H 3.581 10.219 1.911 1.00 . A A . 5 ILE HG22 1 1 6 1970 1 1 5 ILE HG23 H 5.091 10.600 1.086 1.00 . A A . 5 ILE HG23 1 1 6 1971 1 1 5 ILE N N 1.454 13.112 -0.108 1.00 . A A . 5 ILE N 1 1 6 1972 1 1 5 ILE O O 1.153 9.835 1.240 1.00 . A A . 5 ILE O 1 1 6 1973 1 1 6 LEU C C -1.507 10.647 2.583 1.00 . A A . 6 LEU C 1 1 6 1974 1 1 6 LEU CA C -0.234 11.264 3.157 1.00 . A A . 6 LEU CA 1 1 6 1975 1 1 6 LEU CB C -0.596 12.360 4.170 1.00 . A A . 6 LEU CB 1 1 6 1976 1 1 6 LEU CD1 C 0.441 13.741 5.983 1.00 . A A . 6 LEU CD1 1 1 6 1977 1 1 6 LEU CD2 C 0.009 11.312 6.367 1.00 . A A . 6 LEU CD2 1 1 6 1978 1 1 6 LEU CG C 0.415 12.360 5.325 1.00 . A A . 6 LEU CG 1 1 6 1979 1 1 6 LEU H H 0.656 12.807 2.016 1.00 . A A . 6 LEU H 1 1 6 1980 1 1 6 LEU HA H 0.334 10.494 3.654 1.00 . A A . 6 LEU HA 1 1 6 1981 1 1 6 LEU HB2 H -0.575 13.323 3.675 1.00 . A A . 6 LEU HB2 1 1 6 1982 1 1 6 LEU HB3 H -1.588 12.177 4.562 1.00 . A A . 6 LEU HB3 1 1 6 1983 1 1 6 LEU HD11 H 0.978 14.432 5.350 1.00 . A A . 6 LEU HD11 1 1 6 1984 1 1 6 LEU HD12 H 0.935 13.676 6.941 1.00 . A A . 6 LEU HD12 1 1 6 1985 1 1 6 LEU HD13 H -0.570 14.093 6.123 1.00 . A A . 6 LEU HD13 1 1 6 1986 1 1 6 LEU HD21 H 0.844 11.112 7.021 1.00 . A A . 6 LEU HD21 1 1 6 1987 1 1 6 LEU HD22 H -0.282 10.399 5.867 1.00 . A A . 6 LEU HD22 1 1 6 1988 1 1 6 LEU HD23 H -0.822 11.684 6.947 1.00 . A A . 6 LEU HD23 1 1 6 1989 1 1 6 LEU HG H 1.400 12.128 4.944 1.00 . A A . 6 LEU HG 1 1 6 1990 1 1 6 LEU N N 0.575 11.836 2.090 1.00 . A A . 6 LEU N 1 1 6 1991 1 1 6 LEU O O -2.094 9.743 3.178 1.00 . A A . 6 LEU O 1 1 6 1992 1 1 7 LYS C C -2.848 9.261 0.130 1.00 . A A . 7 LYS C 1 1 6 1993 1 1 7 LYS CA C -3.131 10.619 0.775 1.00 . A A . 7 LYS CA 1 1 6 1994 1 1 7 LYS CB C -3.681 11.605 -0.280 1.00 . A A . 7 LYS CB 1 1 6 1995 1 1 7 LYS CD C -4.563 13.147 1.489 1.00 . A A . 7 LYS CD 1 1 6 1996 1 1 7 LYS CE C -5.607 14.251 1.680 1.00 . A A . 7 LYS CE 1 1 6 1997 1 1 7 LYS CG C -4.935 12.291 0.271 1.00 . A A . 7 LYS CG 1 1 6 1998 1 1 7 LYS H H -1.412 11.854 0.993 1.00 . A A . 7 LYS H 1 1 6 1999 1 1 7 LYS HA H -3.885 10.478 1.534 1.00 . A A . 7 LYS HA 1 1 6 2000 1 1 7 LYS HB2 H -2.943 12.356 -0.518 1.00 . A A . 7 LYS HB2 1 1 6 2001 1 1 7 LYS HB3 H -3.940 11.066 -1.176 1.00 . A A . 7 LYS HB3 1 1 6 2002 1 1 7 LYS HD2 H -4.534 12.524 2.371 1.00 . A A . 7 LYS HD2 1 1 6 2003 1 1 7 LYS HD3 H -3.594 13.596 1.333 1.00 . A A . 7 LYS HD3 1 1 6 2004 1 1 7 LYS HE2 H -5.593 14.585 2.707 1.00 . A A . 7 LYS HE2 1 1 6 2005 1 1 7 LYS HE3 H -5.378 15.080 1.028 1.00 . A A . 7 LYS HE3 1 1 6 2006 1 1 7 LYS HG2 H -5.360 12.917 -0.494 1.00 . A A . 7 LYS HG2 1 1 6 2007 1 1 7 LYS HG3 H -5.657 11.544 0.565 1.00 . A A . 7 LYS HG3 1 1 6 2008 1 1 7 LYS HZ1 H -7.295 13.117 2.129 1.00 . A A . 7 LYS HZ1 1 1 6 2009 1 1 7 LYS HZ2 H -6.905 13.155 0.475 1.00 . A A . 7 LYS HZ2 1 1 6 2010 1 1 7 LYS HZ3 H -7.620 14.508 1.213 1.00 . A A . 7 LYS HZ3 1 1 6 2011 1 1 7 LYS N N -1.925 11.138 1.419 1.00 . A A . 7 LYS N 1 1 6 2012 1 1 7 LYS NZ N -6.959 13.718 1.349 1.00 . A A . 7 LYS NZ 1 1 6 2013 1 1 7 LYS O O -3.742 8.420 0.024 1.00 . A A . 7 LYS O 1 1 6 2014 1 1 8 GLY C C -1.469 6.618 0.019 1.00 . A A . 8 GLY C 1 1 6 2015 1 1 8 GLY CA C -1.232 7.788 -0.929 1.00 . A A . 8 GLY CA 1 1 6 2016 1 1 8 GLY H H -0.929 9.748 -0.190 1.00 . A A . 8 GLY H 1 1 6 2017 1 1 8 GLY HA2 H -1.824 7.648 -1.822 1.00 . A A . 8 GLY HA2 1 1 6 2018 1 1 8 GLY HA3 H -0.187 7.820 -1.195 1.00 . A A . 8 GLY HA3 1 1 6 2019 1 1 8 GLY N N -1.606 9.050 -0.299 1.00 . A A . 8 GLY N 1 1 6 2020 1 1 8 GLY O O -1.896 5.542 -0.401 1.00 . A A . 8 GLY O 1 1 6 2021 1 1 9 ALA C C -2.792 5.233 2.232 1.00 . A A . 9 ALA C 1 1 6 2022 1 1 9 ALA CA C -1.376 5.789 2.300 1.00 . A A . 9 ALA CA 1 1 6 2023 1 1 9 ALA CB C -1.111 6.346 3.700 1.00 . A A . 9 ALA CB 1 1 6 2024 1 1 9 ALA H H -0.852 7.712 1.579 1.00 . A A . 9 ALA H 1 1 6 2025 1 1 9 ALA HA H -0.681 4.989 2.105 1.00 . A A . 9 ALA HA 1 1 6 2026 1 1 9 ALA HB1 H -1.005 5.529 4.398 1.00 . A A . 9 ALA HB1 1 1 6 2027 1 1 9 ALA HB2 H -1.938 6.972 4.001 1.00 . A A . 9 ALA HB2 1 1 6 2028 1 1 9 ALA HB3 H -0.203 6.929 3.688 1.00 . A A . 9 ALA HB3 1 1 6 2029 1 1 9 ALA N N -1.189 6.835 1.302 1.00 . A A . 9 ALA N 1 1 6 2030 1 1 9 ALA O O -3.017 4.050 2.487 1.00 . A A . 9 ALA O 1 1 6 2031 1 1 10 ALA C C -5.251 4.521 0.775 1.00 . A A . 10 ALA C 1 1 6 2032 1 1 10 ALA CA C -5.129 5.661 1.778 1.00 . A A . 10 ALA CA 1 1 6 2033 1 1 10 ALA CB C -6.009 6.832 1.334 1.00 . A A . 10 ALA CB 1 1 6 2034 1 1 10 ALA H H -3.508 7.020 1.683 1.00 . A A . 10 ALA H 1 1 6 2035 1 1 10 ALA HA H -5.465 5.318 2.745 1.00 . A A . 10 ALA HA 1 1 6 2036 1 1 10 ALA HB1 H -5.846 7.674 1.992 1.00 . A A . 10 ALA HB1 1 1 6 2037 1 1 10 ALA HB2 H -7.048 6.538 1.376 1.00 . A A . 10 ALA HB2 1 1 6 2038 1 1 10 ALA HB3 H -5.754 7.111 0.322 1.00 . A A . 10 ALA HB3 1 1 6 2039 1 1 10 ALA N N -3.743 6.089 1.880 1.00 . A A . 10 ALA N 1 1 6 2040 1 1 10 ALA O O -5.814 3.475 1.079 1.00 . A A . 10 ALA O 1 1 6 2041 1 1 11 LYS C C -3.685 2.674 -1.273 1.00 . A A . 11 LYS C 1 1 6 2042 1 1 11 LYS CA C -4.763 3.725 -1.466 1.00 . A A . 11 LYS CA 1 1 6 2043 1 1 11 LYS CB C -4.591 4.375 -2.815 1.00 . A A . 11 LYS CB 1 1 6 2044 1 1 11 LYS CD C -5.353 3.873 -5.105 1.00 . A A . 11 LYS CD 1 1 6 2045 1 1 11 LYS CE C -5.357 2.856 -6.248 1.00 . A A . 11 LYS CE 1 1 6 2046 1 1 11 LYS CG C -4.607 3.314 -3.916 1.00 . A A . 11 LYS CG 1 1 6 2047 1 1 11 LYS H H -4.283 5.588 -0.605 1.00 . A A . 11 LYS H 1 1 6 2048 1 1 11 LYS HA H -5.716 3.244 -1.439 1.00 . A A . 11 LYS HA 1 1 6 2049 1 1 11 LYS HB2 H -5.390 5.086 -2.974 1.00 . A A . 11 LYS HB2 1 1 6 2050 1 1 11 LYS HB3 H -3.658 4.883 -2.827 1.00 . A A . 11 LYS HB3 1 1 6 2051 1 1 11 LYS HD2 H -6.365 4.095 -4.805 1.00 . A A . 11 LYS HD2 1 1 6 2052 1 1 11 LYS HD3 H -4.865 4.773 -5.420 1.00 . A A . 11 LYS HD3 1 1 6 2053 1 1 11 LYS HE2 H -4.347 2.519 -6.433 1.00 . A A . 11 LYS HE2 1 1 6 2054 1 1 11 LYS HE3 H -5.974 2.013 -5.977 1.00 . A A . 11 LYS HE3 1 1 6 2055 1 1 11 LYS HG2 H -3.595 3.068 -4.204 1.00 . A A . 11 LYS HG2 1 1 6 2056 1 1 11 LYS HG3 H -5.109 2.430 -3.572 1.00 . A A . 11 LYS HG3 1 1 6 2057 1 1 11 LYS HZ1 H -6.889 3.770 -7.321 1.00 . A A . 11 LYS HZ1 1 1 6 2058 1 1 11 LYS HZ2 H -5.848 2.822 -8.271 1.00 . A A . 11 LYS HZ2 1 1 6 2059 1 1 11 LYS HZ3 H -5.341 4.342 -7.707 1.00 . A A . 11 LYS HZ3 1 1 6 2060 1 1 11 LYS N N -4.716 4.734 -0.421 1.00 . A A . 11 LYS N 1 1 6 2061 1 1 11 LYS NZ N -5.899 3.496 -7.480 1.00 . A A . 11 LYS NZ 1 1 6 2062 1 1 11 LYS O O -3.838 1.539 -1.724 1.00 . A A . 11 LYS O 1 1 6 2063 1 1 12 ASP C C -2.123 0.764 0.079 1.00 . A A . 12 ASP C 1 1 6 2064 1 1 12 ASP CA C -1.515 2.096 -0.341 1.00 . A A . 12 ASP CA 1 1 6 2065 1 1 12 ASP CB C -0.594 2.616 0.763 1.00 . A A . 12 ASP CB 1 1 6 2066 1 1 12 ASP CG C 0.481 1.581 1.075 1.00 . A A . 12 ASP CG 1 1 6 2067 1 1 12 ASP H H -2.534 3.966 -0.261 1.00 . A A . 12 ASP H 1 1 6 2068 1 1 12 ASP HA H -0.944 1.957 -1.247 1.00 . A A . 12 ASP HA 1 1 6 2069 1 1 12 ASP HB2 H -0.126 3.532 0.436 1.00 . A A . 12 ASP HB2 1 1 6 2070 1 1 12 ASP HB3 H -1.176 2.806 1.653 1.00 . A A . 12 ASP HB3 1 1 6 2071 1 1 12 ASP N N -2.600 3.047 -0.596 1.00 . A A . 12 ASP N 1 1 6 2072 1 1 12 ASP O O -1.438 -0.252 0.207 1.00 . A A . 12 ASP O 1 1 6 2073 1 1 12 ASP OD1 O 1.038 1.643 2.159 1.00 . A A . 12 ASP OD1 1 1 6 2074 1 1 12 ASP OD2 O 0.732 0.742 0.225 1.00 . A A . 12 ASP OD2 1 1 6 2075 1 1 13 ILE C C -3.971 -1.490 -0.357 1.00 . A A . 13 ILE C 1 1 6 2076 1 1 13 ILE CA C -4.216 -0.361 0.635 1.00 . A A . 13 ILE CA 1 1 6 2077 1 1 13 ILE CB C -5.692 0.043 0.571 1.00 . A A . 13 ILE CB 1 1 6 2078 1 1 13 ILE CD1 C -7.415 1.522 1.595 1.00 . A A . 13 ILE CD1 1 1 6 2079 1 1 13 ILE CG1 C -6.073 0.824 1.824 1.00 . A A . 13 ILE CG1 1 1 6 2080 1 1 13 ILE CG2 C -6.582 -1.189 0.445 1.00 . A A . 13 ILE CG2 1 1 6 2081 1 1 13 ILE H H -3.898 1.651 0.122 1.00 . A A . 13 ILE H 1 1 6 2082 1 1 13 ILE HA H -3.967 -0.677 1.635 1.00 . A A . 13 ILE HA 1 1 6 2083 1 1 13 ILE HB H -5.840 0.670 -0.297 1.00 . A A . 13 ILE HB 1 1 6 2084 1 1 13 ILE HD11 H -7.446 1.931 0.595 1.00 . A A . 13 ILE HD11 1 1 6 2085 1 1 13 ILE HD12 H -7.533 2.318 2.313 1.00 . A A . 13 ILE HD12 1 1 6 2086 1 1 13 ILE HD13 H -8.215 0.807 1.714 1.00 . A A . 13 ILE HD13 1 1 6 2087 1 1 13 ILE HG12 H -6.161 0.143 2.653 1.00 . A A . 13 ILE HG12 1 1 6 2088 1 1 13 ILE HG13 H -5.314 1.562 2.039 1.00 . A A . 13 ILE HG13 1 1 6 2089 1 1 13 ILE HG21 H -6.228 -1.956 1.114 1.00 . A A . 13 ILE HG21 1 1 6 2090 1 1 13 ILE HG22 H -6.550 -1.550 -0.573 1.00 . A A . 13 ILE HG22 1 1 6 2091 1 1 13 ILE HG23 H -7.598 -0.924 0.700 1.00 . A A . 13 ILE HG23 1 1 6 2092 1 1 13 ILE N N -3.434 0.801 0.260 1.00 . A A . 13 ILE N 1 1 6 2093 1 1 13 ILE O O -3.618 -2.607 0.023 1.00 . A A . 13 ILE O 1 1 6 2094 1 1 14 ALA C C -2.594 -2.820 -2.553 1.00 . A A . 14 ALA C 1 1 6 2095 1 1 14 ALA CA C -3.963 -2.161 -2.690 1.00 . A A . 14 ALA CA 1 1 6 2096 1 1 14 ALA CB C -4.073 -1.486 -4.057 1.00 . A A . 14 ALA CB 1 1 6 2097 1 1 14 ALA H H -4.449 -0.267 -1.862 1.00 . A A . 14 ALA H 1 1 6 2098 1 1 14 ALA HA H -4.727 -2.920 -2.613 1.00 . A A . 14 ALA HA 1 1 6 2099 1 1 14 ALA HB1 H -3.742 -2.170 -4.825 1.00 . A A . 14 ALA HB1 1 1 6 2100 1 1 14 ALA HB2 H -3.453 -0.602 -4.073 1.00 . A A . 14 ALA HB2 1 1 6 2101 1 1 14 ALA HB3 H -5.101 -1.208 -4.241 1.00 . A A . 14 ALA HB3 1 1 6 2102 1 1 14 ALA N N -4.163 -1.179 -1.631 1.00 . A A . 14 ALA N 1 1 6 2103 1 1 14 ALA O O -2.452 -4.025 -2.760 1.00 . A A . 14 ALA O 1 1 6 2104 1 1 15 GLY C C -0.127 -3.379 -0.773 1.00 . A A . 15 GLY C 1 1 6 2105 1 1 15 GLY CA C -0.239 -2.536 -2.039 1.00 . A A . 15 GLY CA 1 1 6 2106 1 1 15 GLY H H -1.767 -1.069 -2.049 1.00 . A A . 15 GLY H 1 1 6 2107 1 1 15 GLY HA2 H 0.015 -3.144 -2.895 1.00 . A A . 15 GLY HA2 1 1 6 2108 1 1 15 GLY HA3 H 0.451 -1.709 -1.973 1.00 . A A . 15 GLY HA3 1 1 6 2109 1 1 15 GLY N N -1.593 -2.021 -2.202 1.00 . A A . 15 GLY N 1 1 6 2110 1 1 15 GLY O O 0.507 -4.435 -0.773 1.00 . A A . 15 GLY O 1 1 6 2111 1 1 16 HIS C C -1.374 -4.994 1.424 1.00 . A A . 16 HIS C 1 1 6 2112 1 1 16 HIS CA C -0.715 -3.627 1.570 1.00 . A A . 16 HIS CA 1 1 6 2113 1 1 16 HIS CB C -1.439 -2.816 2.648 1.00 . A A . 16 HIS CB 1 1 6 2114 1 1 16 HIS CD2 C -2.487 -4.474 4.396 1.00 . A A . 16 HIS CD2 1 1 6 2115 1 1 16 HIS CE1 C -0.897 -4.427 5.869 1.00 . A A . 16 HIS CE1 1 1 6 2116 1 1 16 HIS CG C -1.524 -3.623 3.915 1.00 . A A . 16 HIS CG 1 1 6 2117 1 1 16 HIS H H -1.240 -2.061 0.243 1.00 . A A . 16 HIS H 1 1 6 2118 1 1 16 HIS HA H 0.314 -3.763 1.868 1.00 . A A . 16 HIS HA 1 1 6 2119 1 1 16 HIS HB2 H -0.894 -1.903 2.838 1.00 . A A . 16 HIS HB2 1 1 6 2120 1 1 16 HIS HB3 H -2.435 -2.576 2.308 1.00 . A A . 16 HIS HB3 1 1 6 2121 1 1 16 HIS HD2 H -3.412 -4.714 3.895 1.00 . A A . 16 HIS HD2 1 1 6 2122 1 1 16 HIS HE1 H -0.309 -4.613 6.754 1.00 . A A . 16 HIS HE1 1 1 6 2123 1 1 16 HIS HE2 H -2.579 -5.608 6.202 1.00 . A A . 16 HIS HE2 1 1 6 2124 1 1 16 HIS N N -0.749 -2.907 0.302 1.00 . A A . 16 HIS N 1 1 6 2125 1 1 16 HIS ND1 N -0.519 -3.609 4.869 1.00 . A A . 16 HIS ND1 1 1 6 2126 1 1 16 HIS NE2 N -2.089 -4.981 5.631 1.00 . A A . 16 HIS NE2 1 1 6 2127 1 1 16 HIS O O -0.911 -5.981 1.994 1.00 . A A . 16 HIS O 1 1 6 2128 1 1 17 LEU C C -2.319 -7.244 -0.398 1.00 . A A . 17 LEU C 1 1 6 2129 1 1 17 LEU CA C -3.169 -6.287 0.432 1.00 . A A . 17 LEU CA 1 1 6 2130 1 1 17 LEU CB C -4.487 -5.991 -0.286 1.00 . A A . 17 LEU CB 1 1 6 2131 1 1 17 LEU CD1 C -5.053 -8.423 -0.056 1.00 . A A . 17 LEU CD1 1 1 6 2132 1 1 17 LEU CD2 C -5.957 -6.776 1.604 1.00 . A A . 17 LEU CD2 1 1 6 2133 1 1 17 LEU CG C -5.571 -6.997 0.132 1.00 . A A . 17 LEU CG 1 1 6 2134 1 1 17 LEU H H -2.778 -4.229 0.220 1.00 . A A . 17 LEU H 1 1 6 2135 1 1 17 LEU HA H -3.381 -6.741 1.378 1.00 . A A . 17 LEU HA 1 1 6 2136 1 1 17 LEU HB2 H -4.812 -4.991 -0.037 1.00 . A A . 17 LEU HB2 1 1 6 2137 1 1 17 LEU HB3 H -4.330 -6.058 -1.343 1.00 . A A . 17 LEU HB3 1 1 6 2138 1 1 17 LEU HD11 H -5.887 -9.106 -0.093 1.00 . A A . 17 LEU HD11 1 1 6 2139 1 1 17 LEU HD12 H -4.411 -8.687 0.772 1.00 . A A . 17 LEU HD12 1 1 6 2140 1 1 17 LEU HD13 H -4.494 -8.487 -0.979 1.00 . A A . 17 LEU HD13 1 1 6 2141 1 1 17 LEU HD21 H -7.004 -7.009 1.737 1.00 . A A . 17 LEU HD21 1 1 6 2142 1 1 17 LEU HD22 H -5.783 -5.746 1.877 1.00 . A A . 17 LEU HD22 1 1 6 2143 1 1 17 LEU HD23 H -5.364 -7.421 2.237 1.00 . A A . 17 LEU HD23 1 1 6 2144 1 1 17 LEU HG H -6.443 -6.853 -0.491 1.00 . A A . 17 LEU HG 1 1 6 2145 1 1 17 LEU N N -2.456 -5.044 0.653 1.00 . A A . 17 LEU N 1 1 6 2146 1 1 17 LEU O O -2.299 -8.448 -0.148 1.00 . A A . 17 LEU O 1 1 6 2147 1 1 18 ALA C C 0.297 -8.212 -1.371 1.00 . A A . 18 ALA C 1 1 6 2148 1 1 18 ALA CA C -0.751 -7.520 -2.223 1.00 . A A . 18 ALA CA 1 1 6 2149 1 1 18 ALA CB C -0.068 -6.653 -3.284 1.00 . A A . 18 ALA CB 1 1 6 2150 1 1 18 ALA H H -1.648 -5.732 -1.528 1.00 . A A . 18 ALA H 1 1 6 2151 1 1 18 ALA HA H -1.351 -8.272 -2.714 1.00 . A A . 18 ALA HA 1 1 6 2152 1 1 18 ALA HB1 H 0.381 -5.792 -2.810 1.00 . A A . 18 ALA HB1 1 1 6 2153 1 1 18 ALA HB2 H -0.801 -6.325 -4.006 1.00 . A A . 18 ALA HB2 1 1 6 2154 1 1 18 ALA HB3 H 0.696 -7.230 -3.781 1.00 . A A . 18 ALA HB3 1 1 6 2155 1 1 18 ALA N N -1.606 -6.699 -1.378 1.00 . A A . 18 ALA N 1 1 6 2156 1 1 18 ALA O O 0.373 -9.437 -1.347 1.00 . A A . 18 ALA O 1 1 6 2157 1 1 19 SER C C 1.505 -9.069 1.084 1.00 . A A . 19 SER C 1 1 6 2158 1 1 19 SER CA C 2.119 -7.991 0.200 1.00 . A A . 19 SER CA 1 1 6 2159 1 1 19 SER CB C 2.747 -6.895 1.064 1.00 . A A . 19 SER CB 1 1 6 2160 1 1 19 SER H H 0.979 -6.451 -0.706 1.00 . A A . 19 SER H 1 1 6 2161 1 1 19 SER HA H 2.882 -8.441 -0.417 1.00 . A A . 19 SER HA 1 1 6 2162 1 1 19 SER HB2 H 3.813 -7.031 1.106 1.00 . A A . 19 SER HB2 1 1 6 2163 1 1 19 SER HB3 H 2.528 -5.928 0.629 1.00 . A A . 19 SER HB3 1 1 6 2164 1 1 19 SER HG H 1.295 -7.234 2.314 1.00 . A A . 19 SER HG 1 1 6 2165 1 1 19 SER N N 1.092 -7.424 -0.660 1.00 . A A . 19 SER N 1 1 6 2166 1 1 19 SER O O 2.138 -10.082 1.379 1.00 . A A . 19 SER O 1 1 6 2167 1 1 19 SER OG O 2.215 -6.967 2.380 1.00 . A A . 19 SER OG 1 1 6 2168 1 1 20 LYS C C -0.630 -11.108 1.550 1.00 . A A . 20 LYS C 1 1 6 2169 1 1 20 LYS CA C -0.444 -9.804 2.318 1.00 . A A . 20 LYS CA 1 1 6 2170 1 1 20 LYS CB C -1.808 -9.228 2.715 1.00 . A A . 20 LYS CB 1 1 6 2171 1 1 20 LYS CD C -1.961 -10.265 4.995 1.00 . A A . 20 LYS CD 1 1 6 2172 1 1 20 LYS CE C -2.444 -9.979 6.418 1.00 . A A . 20 LYS CE 1 1 6 2173 1 1 20 LYS CG C -1.835 -8.948 4.222 1.00 . A A . 20 LYS CG 1 1 6 2174 1 1 20 LYS H H -0.198 -8.026 1.210 1.00 . A A . 20 LYS H 1 1 6 2175 1 1 20 LYS HA H 0.134 -9.994 3.206 1.00 . A A . 20 LYS HA 1 1 6 2176 1 1 20 LYS HB2 H -1.970 -8.308 2.176 1.00 . A A . 20 LYS HB2 1 1 6 2177 1 1 20 LYS HB3 H -2.591 -9.926 2.465 1.00 . A A . 20 LYS HB3 1 1 6 2178 1 1 20 LYS HD2 H -2.670 -10.910 4.497 1.00 . A A . 20 LYS HD2 1 1 6 2179 1 1 20 LYS HD3 H -0.999 -10.752 5.037 1.00 . A A . 20 LYS HD3 1 1 6 2180 1 1 20 LYS HE2 H -1.851 -9.186 6.847 1.00 . A A . 20 LYS HE2 1 1 6 2181 1 1 20 LYS HE3 H -3.482 -9.679 6.393 1.00 . A A . 20 LYS HE3 1 1 6 2182 1 1 20 LYS HG2 H -0.924 -8.446 4.511 1.00 . A A . 20 LYS HG2 1 1 6 2183 1 1 20 LYS HG3 H -2.676 -8.319 4.450 1.00 . A A . 20 LYS HG3 1 1 6 2184 1 1 20 LYS HZ1 H -3.086 -11.861 7.037 1.00 . A A . 20 LYS HZ1 1 1 6 2185 1 1 20 LYS HZ2 H -2.325 -10.953 8.255 1.00 . A A . 20 LYS HZ2 1 1 6 2186 1 1 20 LYS HZ3 H -1.400 -11.675 7.026 1.00 . A A . 20 LYS HZ3 1 1 6 2187 1 1 20 LYS N N 0.260 -8.846 1.487 1.00 . A A . 20 LYS N 1 1 6 2188 1 1 20 LYS NZ N -2.304 -11.210 7.247 1.00 . A A . 20 LYS NZ 1 1 6 2189 1 1 20 LYS O O -0.288 -12.186 2.035 1.00 . A A . 20 LYS O 1 1 6 2190 1 1 21 VAL C C -0.094 -12.697 -1.055 1.00 . A A . 21 VAL C 1 1 6 2191 1 1 21 VAL CA C -1.404 -12.158 -0.498 1.00 . A A . 21 VAL CA 1 1 6 2192 1 1 21 VAL CB C -2.343 -11.805 -1.650 1.00 . A A . 21 VAL CB 1 1 6 2193 1 1 21 VAL CG1 C -2.672 -13.077 -2.429 1.00 . A A . 21 VAL CG1 1 1 6 2194 1 1 21 VAL CG2 C -3.637 -11.202 -1.094 1.00 . A A . 21 VAL CG2 1 1 6 2195 1 1 21 VAL H H -1.426 -10.105 0.015 1.00 . A A . 21 VAL H 1 1 6 2196 1 1 21 VAL HA H -1.863 -12.923 0.094 1.00 . A A . 21 VAL HA 1 1 6 2197 1 1 21 VAL HB H -1.861 -11.094 -2.305 1.00 . A A . 21 VAL HB 1 1 6 2198 1 1 21 VAL HG11 H -3.047 -13.827 -1.747 1.00 . A A . 21 VAL HG11 1 1 6 2199 1 1 21 VAL HG12 H -1.778 -13.443 -2.910 1.00 . A A . 21 VAL HG12 1 1 6 2200 1 1 21 VAL HG13 H -3.422 -12.859 -3.173 1.00 . A A . 21 VAL HG13 1 1 6 2201 1 1 21 VAL HG21 H -3.400 -10.493 -0.316 1.00 . A A . 21 VAL HG21 1 1 6 2202 1 1 21 VAL HG22 H -4.255 -11.988 -0.686 1.00 . A A . 21 VAL HG22 1 1 6 2203 1 1 21 VAL HG23 H -4.170 -10.700 -1.887 1.00 . A A . 21 VAL HG23 1 1 6 2204 1 1 21 VAL N N -1.174 -10.992 0.343 1.00 . A A . 21 VAL N 1 1 6 2205 1 1 21 VAL O O 0.105 -13.909 -1.135 1.00 . A A . 21 VAL O 1 1 6 2206 1 1 22 MET C C 2.838 -13.060 -0.973 1.00 . A A . 22 MET C 1 1 6 2207 1 1 22 MET CA C 2.087 -12.206 -1.988 1.00 . A A . 22 MET CA 1 1 6 2208 1 1 22 MET CB C 2.922 -10.975 -2.356 1.00 . A A . 22 MET CB 1 1 6 2209 1 1 22 MET CE C 5.549 -11.450 -4.475 1.00 . A A . 22 MET CE 1 1 6 2210 1 1 22 MET CG C 2.976 -10.816 -3.879 1.00 . A A . 22 MET CG 1 1 6 2211 1 1 22 MET H H 0.588 -10.840 -1.353 1.00 . A A . 22 MET H 1 1 6 2212 1 1 22 MET HA H 1.915 -12.789 -2.875 1.00 . A A . 22 MET HA 1 1 6 2213 1 1 22 MET HB2 H 2.469 -10.103 -1.923 1.00 . A A . 22 MET HB2 1 1 6 2214 1 1 22 MET HB3 H 3.926 -11.085 -1.974 1.00 . A A . 22 MET HB3 1 1 6 2215 1 1 22 MET HE1 H 5.762 -10.901 -5.381 1.00 . A A . 22 MET HE1 1 1 6 2216 1 1 22 MET HE2 H 6.287 -12.224 -4.343 1.00 . A A . 22 MET HE2 1 1 6 2217 1 1 22 MET HE3 H 5.578 -10.780 -3.625 1.00 . A A . 22 MET HE3 1 1 6 2218 1 1 22 MET HG2 H 1.969 -10.814 -4.276 1.00 . A A . 22 MET HG2 1 1 6 2219 1 1 22 MET HG3 H 3.467 -9.883 -4.126 1.00 . A A . 22 MET HG3 1 1 6 2220 1 1 22 MET N N 0.799 -11.794 -1.440 1.00 . A A . 22 MET N 1 1 6 2221 1 1 22 MET O O 3.284 -14.164 -1.282 1.00 . A A . 22 MET O 1 1 6 2222 1 1 22 MET SD S 3.904 -12.194 -4.595 1.00 . A A . 22 MET SD 1 1 6 2223 1 1 23 ASN C C 3.033 -14.633 1.514 1.00 . A A . 23 ASN C 1 1 6 2224 1 1 23 ASN CA C 3.664 -13.261 1.300 1.00 . A A . 23 ASN CA 1 1 6 2225 1 1 23 ASN CB C 3.610 -12.462 2.597 1.00 . A A . 23 ASN CB 1 1 6 2226 1 1 23 ASN CG C 4.193 -13.282 3.744 1.00 . A A . 23 ASN CG 1 1 6 2227 1 1 23 ASN H H 2.591 -11.654 0.430 1.00 . A A . 23 ASN H 1 1 6 2228 1 1 23 ASN HA H 4.691 -13.387 1.021 1.00 . A A . 23 ASN HA 1 1 6 2229 1 1 23 ASN HB2 H 4.178 -11.551 2.481 1.00 . A A . 23 ASN HB2 1 1 6 2230 1 1 23 ASN HB3 H 2.589 -12.222 2.814 1.00 . A A . 23 ASN HB3 1 1 6 2231 1 1 23 ASN HD21 H 2.423 -13.685 4.549 1.00 . A A . 23 ASN HD21 1 1 6 2232 1 1 23 ASN HD22 H 3.759 -14.341 5.366 1.00 . A A . 23 ASN HD22 1 1 6 2233 1 1 23 ASN N N 2.970 -12.539 0.242 1.00 . A A . 23 ASN N 1 1 6 2234 1 1 23 ASN ND2 N 3.392 -13.813 4.626 1.00 . A A . 23 ASN ND2 1 1 6 2235 1 1 23 ASN O O 3.735 -15.623 1.724 1.00 . A A . 23 ASN O 1 1 6 2236 1 1 23 ASN OD1 O 5.410 -13.441 3.839 1.00 . A A . 23 ASN OD1 1 1 6 2237 1 1 24 LYS C C 1.409 -16.956 0.587 1.00 . A A . 24 LYS C 1 1 6 2238 1 1 24 LYS CA C 0.991 -15.940 1.647 1.00 . A A . 24 LYS CA 1 1 6 2239 1 1 24 LYS CB C -0.517 -15.699 1.563 1.00 . A A . 24 LYS CB 1 1 6 2240 1 1 24 LYS CD C -2.750 -16.785 1.852 1.00 . A A . 24 LYS CD 1 1 6 2241 1 1 24 LYS CE C -3.539 -18.054 1.520 1.00 . A A . 24 LYS CE 1 1 6 2242 1 1 24 LYS CG C -1.257 -17.037 1.628 1.00 . A A . 24 LYS CG 1 1 6 2243 1 1 24 LYS H H 1.198 -13.864 1.288 1.00 . A A . 24 LYS H 1 1 6 2244 1 1 24 LYS HA H 1.227 -16.335 2.624 1.00 . A A . 24 LYS HA 1 1 6 2245 1 1 24 LYS HB2 H -0.828 -15.075 2.388 1.00 . A A . 24 LYS HB2 1 1 6 2246 1 1 24 LYS HB3 H -0.752 -15.206 0.631 1.00 . A A . 24 LYS HB3 1 1 6 2247 1 1 24 LYS HD2 H -2.918 -16.516 2.886 1.00 . A A . 24 LYS HD2 1 1 6 2248 1 1 24 LYS HD3 H -3.080 -15.980 1.212 1.00 . A A . 24 LYS HD3 1 1 6 2249 1 1 24 LYS HE2 H -4.485 -18.037 2.040 1.00 . A A . 24 LYS HE2 1 1 6 2250 1 1 24 LYS HE3 H -3.713 -18.101 0.455 1.00 . A A . 24 LYS HE3 1 1 6 2251 1 1 24 LYS HG2 H -1.117 -17.572 0.700 1.00 . A A . 24 LYS HG2 1 1 6 2252 1 1 24 LYS HG3 H -0.867 -17.625 2.446 1.00 . A A . 24 LYS HG3 1 1 6 2253 1 1 24 LYS HZ1 H -3.093 -20.087 1.429 1.00 . A A . 24 LYS HZ1 1 1 6 2254 1 1 24 LYS HZ2 H -2.887 -19.400 2.970 1.00 . A A . 24 LYS HZ2 1 1 6 2255 1 1 24 LYS HZ3 H -1.750 -19.098 1.744 1.00 . A A . 24 LYS HZ3 1 1 6 2256 1 1 24 LYS N N 1.706 -14.684 1.459 1.00 . A A . 24 LYS N 1 1 6 2257 1 1 24 LYS NZ N -2.758 -19.250 1.948 1.00 . A A . 24 LYS NZ 1 1 6 2258 1 1 24 LYS O O 1.591 -18.137 0.883 1.00 . A A . 24 LYS O 1 1 6 2259 1 1 25 LEU C C 3.375 -17.867 -1.535 1.00 . A A . 25 LEU C 1 1 6 2260 1 1 25 LEU CA C 1.951 -17.357 -1.743 1.00 . A A . 25 LEU CA 1 1 6 2261 1 1 25 LEU CB C 1.858 -16.588 -3.062 1.00 . A A . 25 LEU CB 1 1 6 2262 1 1 25 LEU CD1 C 2.669 -18.660 -4.219 1.00 . A A . 25 LEU CD1 1 1 6 2263 1 1 25 LEU CD2 C 0.212 -18.178 -4.117 1.00 . A A . 25 LEU CD2 1 1 6 2264 1 1 25 LEU CG C 1.612 -17.554 -4.231 1.00 . A A . 25 LEU CG 1 1 6 2265 1 1 25 LEU H H 1.399 -15.539 -0.824 1.00 . A A . 25 LEU H 1 1 6 2266 1 1 25 LEU HA H 1.283 -18.190 -1.781 1.00 . A A . 25 LEU HA 1 1 6 2267 1 1 25 LEU HB2 H 1.044 -15.877 -3.005 1.00 . A A . 25 LEU HB2 1 1 6 2268 1 1 25 LEU HB3 H 2.782 -16.063 -3.223 1.00 . A A . 25 LEU HB3 1 1 6 2269 1 1 25 LEU HD11 H 2.453 -19.357 -3.422 1.00 . A A . 25 LEU HD11 1 1 6 2270 1 1 25 LEU HD12 H 3.645 -18.224 -4.062 1.00 . A A . 25 LEU HD12 1 1 6 2271 1 1 25 LEU HD13 H 2.655 -19.181 -5.165 1.00 . A A . 25 LEU HD13 1 1 6 2272 1 1 25 LEU HD21 H -0.445 -17.508 -3.580 1.00 . A A . 25 LEU HD21 1 1 6 2273 1 1 25 LEU HD22 H 0.273 -19.119 -3.590 1.00 . A A . 25 LEU HD22 1 1 6 2274 1 1 25 LEU HD23 H -0.184 -18.349 -5.107 1.00 . A A . 25 LEU HD23 1 1 6 2275 1 1 25 LEU HG H 1.685 -17.007 -5.161 1.00 . A A . 25 LEU HG 1 1 6 2276 1 1 25 LEU N N 1.558 -16.487 -0.647 1.00 . A A . 25 LEU N 1 1 6 2277 1 1 25 LEU O O 3.582 -19.058 -1.298 1.00 . A A . 25 LEU O 1 1 6 2278 1 1 26 NH2 HN1 H 4.205 -16.081 -1.799 1.00 . A A . 26 NH2 HN1 1 1 6 2279 1 1 26 NH2 HN2 H 5.294 -17.354 -1.476 1.00 . A A . 26 NH2 HN2 1 1 6 2280 1 1 26 NH2 N N 4.374 -17.032 -1.609 1.00 . A A . 26 NH2 N 1 1 7 2281 1 1 1 GLY C C 1.746 18.831 0.422 1.00 . A A . 1 GLY C 1 1 7 2282 1 1 1 GLY CA C 1.402 20.187 -0.184 1.00 . A A . 1 GLY CA 1 1 7 2283 1 1 1 GLY H1 H 2.465 20.642 -1.917 1.00 . A A . 1 GLY H1 1 1 7 2284 1 1 1 GLY H2 H 3.444 20.205 -0.598 1.00 . A A . 1 GLY H2 1 1 7 2285 1 1 1 GLY H3 H 2.713 21.738 -0.645 1.00 . A A . 1 GLY H3 1 1 7 2286 1 1 1 GLY HA2 H 1.104 20.869 0.599 1.00 . A A . 1 GLY HA2 1 1 7 2287 1 1 1 GLY HA3 H 0.592 20.068 -0.887 1.00 . A A . 1 GLY HA3 1 1 7 2288 1 1 1 GLY N N 2.596 20.734 -0.889 1.00 . A A . 1 GLY N 1 1 7 2289 1 1 1 GLY O O 1.903 17.842 -0.294 1.00 . A A . 1 GLY O 1 1 7 2290 1 1 2 VAL C C 0.988 16.606 2.433 1.00 . A A . 2 VAL C 1 1 7 2291 1 1 2 VAL CA C 2.186 17.551 2.438 1.00 . A A . 2 VAL CA 1 1 7 2292 1 1 2 VAL CB C 2.596 17.850 3.880 1.00 . A A . 2 VAL CB 1 1 7 2293 1 1 2 VAL CG1 C 3.860 18.711 3.883 1.00 . A A . 2 VAL CG1 1 1 7 2294 1 1 2 VAL CG2 C 1.467 18.604 4.585 1.00 . A A . 2 VAL CG2 1 1 7 2295 1 1 2 VAL H H 1.724 19.613 2.264 1.00 . A A . 2 VAL H 1 1 7 2296 1 1 2 VAL HA H 3.012 17.074 1.933 1.00 . A A . 2 VAL HA 1 1 7 2297 1 1 2 VAL HB H 2.791 16.922 4.399 1.00 . A A . 2 VAL HB 1 1 7 2298 1 1 2 VAL HG11 H 4.685 18.139 3.484 1.00 . A A . 2 VAL HG11 1 1 7 2299 1 1 2 VAL HG12 H 4.089 19.012 4.896 1.00 . A A . 2 VAL HG12 1 1 7 2300 1 1 2 VAL HG13 H 3.701 19.588 3.274 1.00 . A A . 2 VAL HG13 1 1 7 2301 1 1 2 VAL HG21 H 1.170 19.452 3.985 1.00 . A A . 2 VAL HG21 1 1 7 2302 1 1 2 VAL HG22 H 1.810 18.949 5.550 1.00 . A A . 2 VAL HG22 1 1 7 2303 1 1 2 VAL HG23 H 0.621 17.945 4.718 1.00 . A A . 2 VAL HG23 1 1 7 2304 1 1 2 VAL N N 1.860 18.792 1.746 1.00 . A A . 2 VAL N 1 1 7 2305 1 1 2 VAL O O 1.149 15.386 2.393 1.00 . A A . 2 VAL O 1 1 7 2306 1 1 3 VAL C C -1.449 15.434 1.273 1.00 . A A . 3 VAL C 1 1 7 2307 1 1 3 VAL CA C -1.429 16.376 2.474 1.00 . A A . 3 VAL CA 1 1 7 2308 1 1 3 VAL CB C -2.654 17.288 2.428 1.00 . A A . 3 VAL CB 1 1 7 2309 1 1 3 VAL CG1 C -2.697 18.021 1.086 1.00 . A A . 3 VAL CG1 1 1 7 2310 1 1 3 VAL CG2 C -3.923 16.447 2.589 1.00 . A A . 3 VAL CG2 1 1 7 2311 1 1 3 VAL H H -0.277 18.155 2.505 1.00 . A A . 3 VAL H 1 1 7 2312 1 1 3 VAL HA H -1.463 15.790 3.378 1.00 . A A . 3 VAL HA 1 1 7 2313 1 1 3 VAL HB H -2.595 18.010 3.230 1.00 . A A . 3 VAL HB 1 1 7 2314 1 1 3 VAL HG11 H -3.414 18.828 1.139 1.00 . A A . 3 VAL HG11 1 1 7 2315 1 1 3 VAL HG12 H -2.989 17.331 0.309 1.00 . A A . 3 VAL HG12 1 1 7 2316 1 1 3 VAL HG13 H -1.720 18.422 0.864 1.00 . A A . 3 VAL HG13 1 1 7 2317 1 1 3 VAL HG21 H -4.779 17.099 2.677 1.00 . A A . 3 VAL HG21 1 1 7 2318 1 1 3 VAL HG22 H -3.841 15.839 3.478 1.00 . A A . 3 VAL HG22 1 1 7 2319 1 1 3 VAL HG23 H -4.044 15.809 1.727 1.00 . A A . 3 VAL HG23 1 1 7 2320 1 1 3 VAL N N -0.210 17.177 2.474 1.00 . A A . 3 VAL N 1 1 7 2321 1 1 3 VAL O O -2.100 14.390 1.302 1.00 . A A . 3 VAL O 1 1 7 2322 1 1 4 ASP C C 0.089 13.699 -0.716 1.00 . A A . 4 ASP C 1 1 7 2323 1 1 4 ASP CA C -0.674 14.992 -0.985 1.00 . A A . 4 ASP CA 1 1 7 2324 1 1 4 ASP CB C 0.010 15.766 -2.112 1.00 . A A . 4 ASP CB 1 1 7 2325 1 1 4 ASP CG C 0.001 14.938 -3.393 1.00 . A A . 4 ASP CG 1 1 7 2326 1 1 4 ASP H H -0.232 16.654 0.253 1.00 . A A . 4 ASP H 1 1 7 2327 1 1 4 ASP HA H -1.680 14.747 -1.290 1.00 . A A . 4 ASP HA 1 1 7 2328 1 1 4 ASP HB2 H -0.519 16.695 -2.281 1.00 . A A . 4 ASP HB2 1 1 7 2329 1 1 4 ASP HB3 H 1.034 15.978 -1.832 1.00 . A A . 4 ASP HB3 1 1 7 2330 1 1 4 ASP N N -0.731 15.811 0.220 1.00 . A A . 4 ASP N 1 1 7 2331 1 1 4 ASP O O -0.378 12.609 -1.050 1.00 . A A . 4 ASP O 1 1 7 2332 1 1 4 ASP OD1 O 0.786 15.241 -4.276 1.00 . A A . 4 ASP OD1 1 1 7 2333 1 1 4 ASP OD2 O -0.791 14.014 -3.473 1.00 . A A . 4 ASP OD2 1 1 7 2334 1 1 5 ILE C C 1.274 11.632 0.979 1.00 . A A . 5 ILE C 1 1 7 2335 1 1 5 ILE CA C 2.085 12.661 0.199 1.00 . A A . 5 ILE CA 1 1 7 2336 1 1 5 ILE CB C 3.307 13.080 1.017 1.00 . A A . 5 ILE CB 1 1 7 2337 1 1 5 ILE CD1 C 5.240 14.662 1.078 1.00 . A A . 5 ILE CD1 1 1 7 2338 1 1 5 ILE CG1 C 4.177 14.023 0.183 1.00 . A A . 5 ILE CG1 1 1 7 2339 1 1 5 ILE CG2 C 4.120 11.840 1.394 1.00 . A A . 5 ILE CG2 1 1 7 2340 1 1 5 ILE H H 1.588 14.719 0.133 1.00 . A A . 5 ILE H 1 1 7 2341 1 1 5 ILE HA H 2.417 12.214 -0.722 1.00 . A A . 5 ILE HA 1 1 7 2342 1 1 5 ILE HB H 2.983 13.585 1.915 1.00 . A A . 5 ILE HB 1 1 7 2343 1 1 5 ILE HD11 H 4.765 15.111 1.938 1.00 . A A . 5 ILE HD11 1 1 7 2344 1 1 5 ILE HD12 H 5.771 15.420 0.522 1.00 . A A . 5 ILE HD12 1 1 7 2345 1 1 5 ILE HD13 H 5.936 13.904 1.406 1.00 . A A . 5 ILE HD13 1 1 7 2346 1 1 5 ILE HG12 H 4.660 13.463 -0.609 1.00 . A A . 5 ILE HG12 1 1 7 2347 1 1 5 ILE HG13 H 3.557 14.800 -0.247 1.00 . A A . 5 ILE HG13 1 1 7 2348 1 1 5 ILE HG21 H 3.604 11.293 2.169 1.00 . A A . 5 ILE HG21 1 1 7 2349 1 1 5 ILE HG22 H 5.092 12.142 1.753 1.00 . A A . 5 ILE HG22 1 1 7 2350 1 1 5 ILE HG23 H 4.237 11.209 0.526 1.00 . A A . 5 ILE HG23 1 1 7 2351 1 1 5 ILE N N 1.266 13.826 -0.110 1.00 . A A . 5 ILE N 1 1 7 2352 1 1 5 ILE O O 1.542 10.432 0.911 1.00 . A A . 5 ILE O 1 1 7 2353 1 1 6 LEU C C -1.526 10.470 1.598 1.00 . A A . 6 LEU C 1 1 7 2354 1 1 6 LEU CA C -0.567 11.235 2.507 1.00 . A A . 6 LEU CA 1 1 7 2355 1 1 6 LEU CB C -1.361 12.065 3.525 1.00 . A A . 6 LEU CB 1 1 7 2356 1 1 6 LEU CD1 C -1.045 13.338 5.659 1.00 . A A . 6 LEU CD1 1 1 7 2357 1 1 6 LEU CD2 C -0.969 10.842 5.680 1.00 . A A . 6 LEU CD2 1 1 7 2358 1 1 6 LEU CG C -0.621 12.097 4.871 1.00 . A A . 6 LEU CG 1 1 7 2359 1 1 6 LEU H H 0.119 13.078 1.727 1.00 . A A . 6 LEU H 1 1 7 2360 1 1 6 LEU HA H 0.055 10.528 3.034 1.00 . A A . 6 LEU HA 1 1 7 2361 1 1 6 LEU HB2 H -1.469 13.076 3.152 1.00 . A A . 6 LEU HB2 1 1 7 2362 1 1 6 LEU HB3 H -2.340 11.627 3.665 1.00 . A A . 6 LEU HB3 1 1 7 2363 1 1 6 LEU HD11 H -0.621 14.218 5.201 1.00 . A A . 6 LEU HD11 1 1 7 2364 1 1 6 LEU HD12 H -0.692 13.256 6.677 1.00 . A A . 6 LEU HD12 1 1 7 2365 1 1 6 LEU HD13 H -2.122 13.415 5.659 1.00 . A A . 6 LEU HD13 1 1 7 2366 1 1 6 LEU HD21 H -2.010 10.876 5.965 1.00 . A A . 6 LEU HD21 1 1 7 2367 1 1 6 LEU HD22 H -0.354 10.806 6.568 1.00 . A A . 6 LEU HD22 1 1 7 2368 1 1 6 LEU HD23 H -0.788 9.963 5.080 1.00 . A A . 6 LEU HD23 1 1 7 2369 1 1 6 LEU HG H 0.445 12.131 4.696 1.00 . A A . 6 LEU HG 1 1 7 2370 1 1 6 LEU N N 0.283 12.113 1.716 1.00 . A A . 6 LEU N 1 1 7 2371 1 1 6 LEU O O -1.768 9.279 1.795 1.00 . A A . 6 LEU O 1 1 7 2372 1 1 7 LYS C C -2.426 9.219 -0.848 1.00 . A A . 7 LYS C 1 1 7 2373 1 1 7 LYS CA C -3.004 10.535 -0.328 1.00 . A A . 7 LYS CA 1 1 7 2374 1 1 7 LYS CB C -3.332 11.467 -1.516 1.00 . A A . 7 LYS CB 1 1 7 2375 1 1 7 LYS CD C -4.999 12.841 -0.243 1.00 . A A . 7 LYS CD 1 1 7 2376 1 1 7 LYS CE C -6.292 13.638 -0.429 1.00 . A A . 7 LYS CE 1 1 7 2377 1 1 7 LYS CG C -4.797 11.904 -1.439 1.00 . A A . 7 LYS CG 1 1 7 2378 1 1 7 LYS H H -1.839 12.109 0.501 1.00 . A A . 7 LYS H 1 1 7 2379 1 1 7 LYS HA H -3.919 10.318 0.202 1.00 . A A . 7 LYS HA 1 1 7 2380 1 1 7 LYS HB2 H -2.699 12.342 -1.496 1.00 . A A . 7 LYS HB2 1 1 7 2381 1 1 7 LYS HB3 H -3.169 10.940 -2.441 1.00 . A A . 7 LYS HB3 1 1 7 2382 1 1 7 LYS HD2 H -5.063 12.258 0.664 1.00 . A A . 7 LYS HD2 1 1 7 2383 1 1 7 LYS HD3 H -4.165 13.524 -0.175 1.00 . A A . 7 LYS HD3 1 1 7 2384 1 1 7 LYS HE2 H -6.183 14.309 -1.269 1.00 . A A . 7 LYS HE2 1 1 7 2385 1 1 7 LYS HE3 H -7.110 12.959 -0.614 1.00 . A A . 7 LYS HE3 1 1 7 2386 1 1 7 LYS HG2 H -5.063 12.418 -2.348 1.00 . A A . 7 LYS HG2 1 1 7 2387 1 1 7 LYS HG3 H -5.428 11.035 -1.324 1.00 . A A . 7 LYS HG3 1 1 7 2388 1 1 7 LYS HZ1 H -6.915 13.793 1.552 1.00 . A A . 7 LYS HZ1 1 1 7 2389 1 1 7 LYS HZ2 H -7.294 15.147 0.599 1.00 . A A . 7 LYS HZ2 1 1 7 2390 1 1 7 LYS HZ3 H -5.697 14.893 1.122 1.00 . A A . 7 LYS HZ3 1 1 7 2391 1 1 7 LYS N N -2.070 11.164 0.604 1.00 . A A . 7 LYS N 1 1 7 2392 1 1 7 LYS NZ N -6.570 14.427 0.804 1.00 . A A . 7 LYS NZ 1 1 7 2393 1 1 7 LYS O O -3.168 8.288 -1.163 1.00 . A A . 7 LYS O 1 1 7 2394 1 1 8 GLY C C -0.564 6.809 -0.396 1.00 . A A . 8 GLY C 1 1 7 2395 1 1 8 GLY CA C -0.443 7.936 -1.415 1.00 . A A . 8 GLY CA 1 1 7 2396 1 1 8 GLY H H -0.555 9.914 -0.668 1.00 . A A . 8 GLY H 1 1 7 2397 1 1 8 GLY HA2 H -0.904 7.627 -2.344 1.00 . A A . 8 GLY HA2 1 1 7 2398 1 1 8 GLY HA3 H 0.601 8.144 -1.589 1.00 . A A . 8 GLY HA3 1 1 7 2399 1 1 8 GLY N N -1.100 9.145 -0.934 1.00 . A A . 8 GLY N 1 1 7 2400 1 1 8 GLY O O -0.845 5.665 -0.751 1.00 . A A . 8 GLY O 1 1 7 2401 1 1 9 ALA C C -1.786 5.435 1.892 1.00 . A A . 9 ALA C 1 1 7 2402 1 1 9 ALA CA C -0.438 6.147 1.938 1.00 . A A . 9 ALA CA 1 1 7 2403 1 1 9 ALA CB C -0.260 6.820 3.299 1.00 . A A . 9 ALA CB 1 1 7 2404 1 1 9 ALA H H -0.130 8.068 1.098 1.00 . A A . 9 ALA H 1 1 7 2405 1 1 9 ALA HA H 0.346 5.418 1.803 1.00 . A A . 9 ALA HA 1 1 7 2406 1 1 9 ALA HB1 H -1.158 7.364 3.552 1.00 . A A . 9 ALA HB1 1 1 7 2407 1 1 9 ALA HB2 H 0.574 7.504 3.256 1.00 . A A . 9 ALA HB2 1 1 7 2408 1 1 9 ALA HB3 H -0.072 6.068 4.051 1.00 . A A . 9 ALA HB3 1 1 7 2409 1 1 9 ALA N N -0.351 7.141 0.873 1.00 . A A . 9 ALA N 1 1 7 2410 1 1 9 ALA O O -1.869 4.229 2.123 1.00 . A A . 9 ALA O 1 1 7 2411 1 1 10 ALA C C -4.197 4.447 0.534 1.00 . A A . 10 ALA C 1 1 7 2412 1 1 10 ALA CA C -4.176 5.613 1.515 1.00 . A A . 10 ALA CA 1 1 7 2413 1 1 10 ALA CB C -5.178 6.679 1.066 1.00 . A A . 10 ALA CB 1 1 7 2414 1 1 10 ALA H H -2.714 7.143 1.413 1.00 . A A . 10 ALA H 1 1 7 2415 1 1 10 ALA HA H -4.461 5.256 2.492 1.00 . A A . 10 ALA HA 1 1 7 2416 1 1 10 ALA HB1 H -4.969 6.962 0.045 1.00 . A A . 10 ALA HB1 1 1 7 2417 1 1 10 ALA HB2 H -5.092 7.546 1.704 1.00 . A A . 10 ALA HB2 1 1 7 2418 1 1 10 ALA HB3 H -6.180 6.282 1.132 1.00 . A A . 10 ALA HB3 1 1 7 2419 1 1 10 ALA N N -2.838 6.187 1.590 1.00 . A A . 10 ALA N 1 1 7 2420 1 1 10 ALA O O -4.723 3.376 0.839 1.00 . A A . 10 ALA O 1 1 7 2421 1 1 11 LYS C C -2.521 2.585 -1.335 1.00 . A A . 11 LYS C 1 1 7 2422 1 1 11 LYS CA C -3.578 3.627 -1.662 1.00 . A A . 11 LYS CA 1 1 7 2423 1 1 11 LYS CB C -3.288 4.240 -3.014 1.00 . A A . 11 LYS CB 1 1 7 2424 1 1 11 LYS CD C -3.807 3.629 -5.348 1.00 . A A . 11 LYS CD 1 1 7 2425 1 1 11 LYS CE C -3.668 2.570 -6.442 1.00 . A A . 11 LYS CE 1 1 7 2426 1 1 11 LYS CG C -3.165 3.139 -4.070 1.00 . A A . 11 LYS CG 1 1 7 2427 1 1 11 LYS H H -3.222 5.532 -0.830 1.00 . A A . 11 LYS H 1 1 7 2428 1 1 11 LYS HA H -4.529 3.152 -1.711 1.00 . A A . 11 LYS HA 1 1 7 2429 1 1 11 LYS HB2 H -4.089 4.915 -3.278 1.00 . A A . 11 LYS HB2 1 1 7 2430 1 1 11 LYS HB3 H -2.377 4.781 -2.961 1.00 . A A . 11 LYS HB3 1 1 7 2431 1 1 11 LYS HD2 H -4.849 3.829 -5.157 1.00 . A A . 11 LYS HD2 1 1 7 2432 1 1 11 LYS HD3 H -3.317 4.532 -5.651 1.00 . A A . 11 LYS HD3 1 1 7 2433 1 1 11 LYS HE2 H -2.658 2.192 -6.452 1.00 . A A . 11 LYS HE2 1 1 7 2434 1 1 11 LYS HE3 H -4.355 1.759 -6.247 1.00 . A A . 11 LYS HE3 1 1 7 2435 1 1 11 LYS HG2 H -2.123 2.917 -4.249 1.00 . A A . 11 LYS HG2 1 1 7 2436 1 1 11 LYS HG3 H -3.673 2.254 -3.740 1.00 . A A . 11 LYS HG3 1 1 7 2437 1 1 11 LYS HZ1 H -4.649 3.967 -7.636 1.00 . A A . 11 LYS HZ1 1 1 7 2438 1 1 11 LYS HZ2 H -4.412 2.461 -8.385 1.00 . A A . 11 LYS HZ2 1 1 7 2439 1 1 11 LYS HZ3 H -3.110 3.536 -8.201 1.00 . A A . 11 LYS HZ3 1 1 7 2440 1 1 11 LYS N N -3.622 4.662 -0.644 1.00 . A A . 11 LYS N 1 1 7 2441 1 1 11 LYS NZ N -3.983 3.179 -7.766 1.00 . A A . 11 LYS NZ 1 1 7 2442 1 1 11 LYS O O -2.675 1.411 -1.671 1.00 . A A . 11 LYS O 1 1 7 2443 1 1 12 ASP C C -1.022 0.836 0.331 1.00 . A A . 12 ASP C 1 1 7 2444 1 1 12 ASP CA C -0.395 2.083 -0.282 1.00 . A A . 12 ASP CA 1 1 7 2445 1 1 12 ASP CB C 0.548 2.741 0.730 1.00 . A A . 12 ASP CB 1 1 7 2446 1 1 12 ASP CG C 1.744 1.835 0.994 1.00 . A A . 12 ASP CG 1 1 7 2447 1 1 12 ASP H H -1.387 3.956 -0.413 1.00 . A A . 12 ASP H 1 1 7 2448 1 1 12 ASP HA H 0.167 1.803 -1.161 1.00 . A A . 12 ASP HA 1 1 7 2449 1 1 12 ASP HB2 H 0.892 3.685 0.335 1.00 . A A . 12 ASP HB2 1 1 7 2450 1 1 12 ASP HB3 H 0.017 2.912 1.655 1.00 . A A . 12 ASP HB3 1 1 7 2451 1 1 12 ASP N N -1.454 3.012 -0.664 1.00 . A A . 12 ASP N 1 1 7 2452 1 1 12 ASP O O -0.359 -0.178 0.546 1.00 . A A . 12 ASP O 1 1 7 2453 1 1 12 ASP OD1 O 1.627 0.963 1.839 1.00 . A A . 12 ASP OD1 1 1 7 2454 1 1 12 ASP OD2 O 2.762 2.026 0.350 1.00 . A A . 12 ASP OD2 1 1 7 2455 1 1 13 ILE C C -2.970 -1.397 0.304 1.00 . A A . 13 ILE C 1 1 7 2456 1 1 13 ILE CA C -3.089 -0.150 1.164 1.00 . A A . 13 ILE CA 1 1 7 2457 1 1 13 ILE CB C -4.545 0.321 1.194 1.00 . A A . 13 ILE CB 1 1 7 2458 1 1 13 ILE CD1 C -5.356 -0.135 3.502 1.00 . A A . 13 ILE CD1 1 1 7 2459 1 1 13 ILE CG1 C -4.834 0.944 2.562 1.00 . A A . 13 ILE CG1 1 1 7 2460 1 1 13 ILE CG2 C -5.507 -0.845 0.909 1.00 . A A . 13 ILE CG2 1 1 7 2461 1 1 13 ILE H H -2.784 1.776 0.390 1.00 . A A . 13 ILE H 1 1 7 2462 1 1 13 ILE HA H -2.756 -0.356 2.167 1.00 . A A . 13 ILE HA 1 1 7 2463 1 1 13 ILE HB H -4.682 1.074 0.430 1.00 . A A . 13 ILE HB 1 1 7 2464 1 1 13 ILE HD11 H -4.766 -1.032 3.376 1.00 . A A . 13 ILE HD11 1 1 7 2465 1 1 13 ILE HD12 H -6.389 -0.345 3.265 1.00 . A A . 13 ILE HD12 1 1 7 2466 1 1 13 ILE HD13 H -5.278 0.209 4.519 1.00 . A A . 13 ILE HD13 1 1 7 2467 1 1 13 ILE HG12 H -3.921 1.367 2.967 1.00 . A A . 13 ILE HG12 1 1 7 2468 1 1 13 ILE HG13 H -5.569 1.724 2.455 1.00 . A A . 13 ILE HG13 1 1 7 2469 1 1 13 ILE HG21 H -6.506 -0.569 1.212 1.00 . A A . 13 ILE HG21 1 1 7 2470 1 1 13 ILE HG22 H -5.194 -1.720 1.457 1.00 . A A . 13 ILE HG22 1 1 7 2471 1 1 13 ILE HG23 H -5.504 -1.064 -0.150 1.00 . A A . 13 ILE HG23 1 1 7 2472 1 1 13 ILE N N -2.320 0.937 0.593 1.00 . A A . 13 ILE N 1 1 7 2473 1 1 13 ILE O O -2.574 -2.465 0.772 1.00 . A A . 13 ILE O 1 1 7 2474 1 1 14 ALA C C -1.912 -3.044 -1.824 1.00 . A A . 14 ALA C 1 1 7 2475 1 1 14 ALA CA C -3.259 -2.335 -1.910 1.00 . A A . 14 ALA CA 1 1 7 2476 1 1 14 ALA CB C -3.468 -1.805 -3.331 1.00 . A A . 14 ALA CB 1 1 7 2477 1 1 14 ALA H H -3.631 -0.355 -1.243 1.00 . A A . 14 ALA H 1 1 7 2478 1 1 14 ALA HA H -4.042 -3.041 -1.683 1.00 . A A . 14 ALA HA 1 1 7 2479 1 1 14 ALA HB1 H -3.658 -2.633 -3.999 1.00 . A A . 14 ALA HB1 1 1 7 2480 1 1 14 ALA HB2 H -2.582 -1.278 -3.653 1.00 . A A . 14 ALA HB2 1 1 7 2481 1 1 14 ALA HB3 H -4.313 -1.132 -3.342 1.00 . A A . 14 ALA HB3 1 1 7 2482 1 1 14 ALA N N -3.317 -1.236 -0.955 1.00 . A A . 14 ALA N 1 1 7 2483 1 1 14 ALA O O -1.821 -4.254 -2.025 1.00 . A A . 14 ALA O 1 1 7 2484 1 1 15 GLY C C 0.602 -3.685 -0.143 1.00 . A A . 15 GLY C 1 1 7 2485 1 1 15 GLY CA C 0.472 -2.845 -1.408 1.00 . A A . 15 GLY CA 1 1 7 2486 1 1 15 GLY H H -1.000 -1.320 -1.371 1.00 . A A . 15 GLY H 1 1 7 2487 1 1 15 GLY HA2 H 0.669 -3.466 -2.270 1.00 . A A . 15 GLY HA2 1 1 7 2488 1 1 15 GLY HA3 H 1.194 -2.043 -1.375 1.00 . A A . 15 GLY HA3 1 1 7 2489 1 1 15 GLY N N -0.867 -2.280 -1.521 1.00 . A A . 15 GLY N 1 1 7 2490 1 1 15 GLY O O 1.246 -4.733 -0.146 1.00 . A A . 15 GLY O 1 1 7 2491 1 1 16 HIS C C -0.695 -5.268 2.094 1.00 . A A . 16 HIS C 1 1 7 2492 1 1 16 HIS CA C 0.038 -3.935 2.206 1.00 . A A . 16 HIS CA 1 1 7 2493 1 1 16 HIS CB C -0.597 -3.087 3.310 1.00 . A A . 16 HIS CB 1 1 7 2494 1 1 16 HIS CD2 C -1.732 -4.574 5.155 1.00 . A A . 16 HIS CD2 1 1 7 2495 1 1 16 HIS CE1 C -0.015 -4.837 6.450 1.00 . A A . 16 HIS CE1 1 1 7 2496 1 1 16 HIS CG C -0.690 -3.894 4.576 1.00 . A A . 16 HIS CG 1 1 7 2497 1 1 16 HIS H H -0.514 -2.376 0.881 1.00 . A A . 16 HIS H 1 1 7 2498 1 1 16 HIS HA H 1.070 -4.122 2.460 1.00 . A A . 16 HIS HA 1 1 7 2499 1 1 16 HIS HB2 H 0.009 -2.211 3.486 1.00 . A A . 16 HIS HB2 1 1 7 2500 1 1 16 HIS HB3 H -1.588 -2.784 3.006 1.00 . A A . 16 HIS HB3 1 1 7 2501 1 1 16 HIS HD2 H -2.733 -4.637 4.754 1.00 . A A . 16 HIS HD2 1 1 7 2502 1 1 16 HIS HE1 H 0.622 -5.143 7.268 1.00 . A A . 16 HIS HE1 1 1 7 2503 1 1 16 HIS HE2 H -1.834 -5.714 6.956 1.00 . A A . 16 HIS HE2 1 1 7 2504 1 1 16 HIS N N -0.015 -3.217 0.937 1.00 . A A . 16 HIS N 1 1 7 2505 1 1 16 HIS ND1 N 0.395 -4.075 5.419 1.00 . A A . 16 HIS ND1 1 1 7 2506 1 1 16 HIS NE2 N -1.303 -5.170 6.338 1.00 . A A . 16 HIS NE2 1 1 7 2507 1 1 16 HIS O O -0.164 -6.313 2.468 1.00 . A A . 16 HIS O 1 1 7 2508 1 1 17 LEU C C -2.111 -7.342 0.363 1.00 . A A . 17 LEU C 1 1 7 2509 1 1 17 LEU CA C -2.717 -6.425 1.420 1.00 . A A . 17 LEU CA 1 1 7 2510 1 1 17 LEU CB C -4.135 -6.033 1.018 1.00 . A A . 17 LEU CB 1 1 7 2511 1 1 17 LEU CD1 C -5.220 -7.090 3.030 1.00 . A A . 17 LEU CD1 1 1 7 2512 1 1 17 LEU CD2 C -6.507 -6.750 0.908 1.00 . A A . 17 LEU CD2 1 1 7 2513 1 1 17 LEU CG C -5.137 -7.086 1.495 1.00 . A A . 17 LEU CG 1 1 7 2514 1 1 17 LEU H H -2.295 -4.365 1.297 1.00 . A A . 17 LEU H 1 1 7 2515 1 1 17 LEU HA H -2.753 -6.947 2.355 1.00 . A A . 17 LEU HA 1 1 7 2516 1 1 17 LEU HB2 H -4.380 -5.078 1.459 1.00 . A A . 17 LEU HB2 1 1 7 2517 1 1 17 LEU HB3 H -4.185 -5.954 -0.050 1.00 . A A . 17 LEU HB3 1 1 7 2518 1 1 17 LEU HD11 H -4.933 -6.122 3.414 1.00 . A A . 17 LEU HD11 1 1 7 2519 1 1 17 LEU HD12 H -4.555 -7.844 3.423 1.00 . A A . 17 LEU HD12 1 1 7 2520 1 1 17 LEU HD13 H -6.232 -7.312 3.337 1.00 . A A . 17 LEU HD13 1 1 7 2521 1 1 17 LEU HD21 H -6.467 -6.836 -0.167 1.00 . A A . 17 LEU HD21 1 1 7 2522 1 1 17 LEU HD22 H -6.773 -5.739 1.179 1.00 . A A . 17 LEU HD22 1 1 7 2523 1 1 17 LEU HD23 H -7.243 -7.435 1.298 1.00 . A A . 17 LEU HD23 1 1 7 2524 1 1 17 LEU HG H -4.826 -8.062 1.149 1.00 . A A . 17 LEU HG 1 1 7 2525 1 1 17 LEU N N -1.919 -5.223 1.577 1.00 . A A . 17 LEU N 1 1 7 2526 1 1 17 LEU O O -2.125 -8.562 0.506 1.00 . A A . 17 LEU O 1 1 7 2527 1 1 18 ALA C C 0.169 -8.369 -1.201 1.00 . A A . 18 ALA C 1 1 7 2528 1 1 18 ALA CA C -0.961 -7.528 -1.761 1.00 . A A . 18 ALA CA 1 1 7 2529 1 1 18 ALA CB C -0.427 -6.604 -2.857 1.00 . A A . 18 ALA CB 1 1 7 2530 1 1 18 ALA H H -1.580 -5.769 -0.759 1.00 . A A . 18 ALA H 1 1 7 2531 1 1 18 ALA HA H -1.702 -8.188 -2.187 1.00 . A A . 18 ALA HA 1 1 7 2532 1 1 18 ALA HB1 H 0.140 -5.802 -2.407 1.00 . A A . 18 ALA HB1 1 1 7 2533 1 1 18 ALA HB2 H -1.255 -6.190 -3.414 1.00 . A A . 18 ALA HB2 1 1 7 2534 1 1 18 ALA HB3 H 0.210 -7.166 -3.523 1.00 . A A . 18 ALA HB3 1 1 7 2535 1 1 18 ALA N N -1.572 -6.746 -0.697 1.00 . A A . 18 ALA N 1 1 7 2536 1 1 18 ALA O O 0.156 -9.590 -1.318 1.00 . A A . 18 ALA O 1 1 7 2537 1 1 19 SER C C 1.746 -9.518 0.938 1.00 . A A . 19 SER C 1 1 7 2538 1 1 19 SER CA C 2.261 -8.431 0.004 1.00 . A A . 19 SER CA 1 1 7 2539 1 1 19 SER CB C 3.162 -7.460 0.773 1.00 . A A . 19 SER CB 1 1 7 2540 1 1 19 SER H H 1.093 -6.737 -0.505 1.00 . A A . 19 SER H 1 1 7 2541 1 1 19 SER HA H 2.831 -8.894 -0.788 1.00 . A A . 19 SER HA 1 1 7 2542 1 1 19 SER HB2 H 4.195 -7.681 0.565 1.00 . A A . 19 SER HB2 1 1 7 2543 1 1 19 SER HB3 H 2.944 -6.447 0.461 1.00 . A A . 19 SER HB3 1 1 7 2544 1 1 19 SER HG H 3.776 -7.708 2.603 1.00 . A A . 19 SER HG 1 1 7 2545 1 1 19 SER N N 1.139 -7.714 -0.580 1.00 . A A . 19 SER N 1 1 7 2546 1 1 19 SER O O 2.284 -10.624 0.980 1.00 . A A . 19 SER O 1 1 7 2547 1 1 19 SER OG O 2.926 -7.599 2.168 1.00 . A A . 19 SER OG 1 1 7 2548 1 1 20 LYS C C -0.497 -11.320 1.814 1.00 . A A . 20 LYS C 1 1 7 2549 1 1 20 LYS CA C 0.094 -10.149 2.594 1.00 . A A . 20 LYS CA 1 1 7 2550 1 1 20 LYS CB C -1.002 -9.451 3.413 1.00 . A A . 20 LYS CB 1 1 7 2551 1 1 20 LYS CD C -1.545 -8.363 5.607 1.00 . A A . 20 LYS CD 1 1 7 2552 1 1 20 LYS CE C -2.521 -9.353 6.247 1.00 . A A . 20 LYS CE 1 1 7 2553 1 1 20 LYS CG C -0.476 -9.126 4.815 1.00 . A A . 20 LYS CG 1 1 7 2554 1 1 20 LYS H H 0.299 -8.302 1.592 1.00 . A A . 20 LYS H 1 1 7 2555 1 1 20 LYS HA H 0.856 -10.517 3.261 1.00 . A A . 20 LYS HA 1 1 7 2556 1 1 20 LYS HB2 H -1.283 -8.536 2.916 1.00 . A A . 20 LYS HB2 1 1 7 2557 1 1 20 LYS HB3 H -1.865 -10.092 3.493 1.00 . A A . 20 LYS HB3 1 1 7 2558 1 1 20 LYS HD2 H -1.067 -7.778 6.381 1.00 . A A . 20 LYS HD2 1 1 7 2559 1 1 20 LYS HD3 H -2.086 -7.705 4.943 1.00 . A A . 20 LYS HD3 1 1 7 2560 1 1 20 LYS HE2 H -3.052 -9.888 5.474 1.00 . A A . 20 LYS HE2 1 1 7 2561 1 1 20 LYS HE3 H -1.974 -10.055 6.860 1.00 . A A . 20 LYS HE3 1 1 7 2562 1 1 20 LYS HG2 H -0.230 -10.045 5.328 1.00 . A A . 20 LYS HG2 1 1 7 2563 1 1 20 LYS HG3 H 0.411 -8.516 4.732 1.00 . A A . 20 LYS HG3 1 1 7 2564 1 1 20 LYS HZ1 H -4.327 -8.355 6.526 1.00 . A A . 20 LYS HZ1 1 1 7 2565 1 1 20 LYS HZ2 H -3.046 -7.745 7.462 1.00 . A A . 20 LYS HZ2 1 1 7 2566 1 1 20 LYS HZ3 H -3.793 -9.211 7.890 1.00 . A A . 20 LYS HZ3 1 1 7 2567 1 1 20 LYS N N 0.690 -9.196 1.675 1.00 . A A . 20 LYS N 1 1 7 2568 1 1 20 LYS NZ N -3.496 -8.610 7.095 1.00 . A A . 20 LYS NZ 1 1 7 2569 1 1 20 LYS O O -0.280 -12.482 2.156 1.00 . A A . 20 LYS O 1 1 7 2570 1 1 21 VAL C C -0.820 -12.730 -0.928 1.00 . A A . 21 VAL C 1 1 7 2571 1 1 21 VAL CA C -1.861 -12.024 -0.069 1.00 . A A . 21 VAL CA 1 1 7 2572 1 1 21 VAL CB C -2.930 -11.404 -0.965 1.00 . A A . 21 VAL CB 1 1 7 2573 1 1 21 VAL CG1 C -3.565 -12.508 -1.807 1.00 . A A . 21 VAL CG1 1 1 7 2574 1 1 21 VAL CG2 C -4.009 -10.738 -0.099 1.00 . A A . 21 VAL CG2 1 1 7 2575 1 1 21 VAL H H -1.379 -10.056 0.539 1.00 . A A . 21 VAL H 1 1 7 2576 1 1 21 VAL HA H -2.329 -12.748 0.566 1.00 . A A . 21 VAL HA 1 1 7 2577 1 1 21 VAL HB H -2.477 -10.669 -1.614 1.00 . A A . 21 VAL HB 1 1 7 2578 1 1 21 VAL HG11 H -2.859 -12.844 -2.551 1.00 . A A . 21 VAL HG11 1 1 7 2579 1 1 21 VAL HG12 H -4.449 -12.127 -2.292 1.00 . A A . 21 VAL HG12 1 1 7 2580 1 1 21 VAL HG13 H -3.834 -13.337 -1.167 1.00 . A A . 21 VAL HG13 1 1 7 2581 1 1 21 VAL HG21 H -4.751 -11.472 0.181 1.00 . A A . 21 VAL HG21 1 1 7 2582 1 1 21 VAL HG22 H -4.480 -9.945 -0.659 1.00 . A A . 21 VAL HG22 1 1 7 2583 1 1 21 VAL HG23 H -3.556 -10.328 0.792 1.00 . A A . 21 VAL HG23 1 1 7 2584 1 1 21 VAL N N -1.244 -10.999 0.761 1.00 . A A . 21 VAL N 1 1 7 2585 1 1 21 VAL O O -0.890 -13.942 -1.132 1.00 . A A . 21 VAL O 1 1 7 2586 1 1 22 MET C C 1.924 -13.646 -1.510 1.00 . A A . 22 MET C 1 1 7 2587 1 1 22 MET CA C 1.193 -12.541 -2.264 1.00 . A A . 22 MET CA 1 1 7 2588 1 1 22 MET CB C 2.186 -11.451 -2.681 1.00 . A A . 22 MET CB 1 1 7 2589 1 1 22 MET CE C 0.398 -10.232 -6.188 1.00 . A A . 22 MET CE 1 1 7 2590 1 1 22 MET CG C 1.980 -11.092 -4.156 1.00 . A A . 22 MET CG 1 1 7 2591 1 1 22 MET H H 0.149 -11.007 -1.229 1.00 . A A . 22 MET H 1 1 7 2592 1 1 22 MET HA H 0.743 -12.960 -3.147 1.00 . A A . 22 MET HA 1 1 7 2593 1 1 22 MET HB2 H 2.021 -10.579 -2.076 1.00 . A A . 22 MET HB2 1 1 7 2594 1 1 22 MET HB3 H 3.196 -11.801 -2.537 1.00 . A A . 22 MET HB3 1 1 7 2595 1 1 22 MET HE1 H -0.337 -9.499 -6.492 1.00 . A A . 22 MET HE1 1 1 7 2596 1 1 22 MET HE2 H 0.205 -11.163 -6.697 1.00 . A A . 22 MET HE2 1 1 7 2597 1 1 22 MET HE3 H 1.389 -9.884 -6.443 1.00 . A A . 22 MET HE3 1 1 7 2598 1 1 22 MET HG2 H 2.684 -10.320 -4.440 1.00 . A A . 22 MET HG2 1 1 7 2599 1 1 22 MET HG3 H 2.139 -11.971 -4.766 1.00 . A A . 22 MET HG3 1 1 7 2600 1 1 22 MET N N 0.144 -11.968 -1.427 1.00 . A A . 22 MET N 1 1 7 2601 1 1 22 MET O O 2.079 -14.759 -2.012 1.00 . A A . 22 MET O 1 1 7 2602 1 1 22 MET SD S 0.292 -10.486 -4.399 1.00 . A A . 22 MET SD 1 1 7 2603 1 1 23 ASN C C 2.248 -15.564 0.704 1.00 . A A . 23 ASN C 1 1 7 2604 1 1 23 ASN CA C 3.082 -14.301 0.521 1.00 . A A . 23 ASN CA 1 1 7 2605 1 1 23 ASN CB C 3.405 -13.696 1.882 1.00 . A A . 23 ASN CB 1 1 7 2606 1 1 23 ASN CG C 3.998 -14.757 2.803 1.00 . A A . 23 ASN CG 1 1 7 2607 1 1 23 ASN H H 2.214 -12.424 0.047 1.00 . A A . 23 ASN H 1 1 7 2608 1 1 23 ASN HA H 4.004 -14.557 0.036 1.00 . A A . 23 ASN HA 1 1 7 2609 1 1 23 ASN HB2 H 4.115 -12.890 1.759 1.00 . A A . 23 ASN HB2 1 1 7 2610 1 1 23 ASN HB3 H 2.503 -13.313 2.314 1.00 . A A . 23 ASN HB3 1 1 7 2611 1 1 23 ASN HD21 H 2.472 -14.718 4.073 1.00 . A A . 23 ASN HD21 1 1 7 2612 1 1 23 ASN HD22 H 3.715 -15.805 4.466 1.00 . A A . 23 ASN HD22 1 1 7 2613 1 1 23 ASN N N 2.370 -13.328 -0.300 1.00 . A A . 23 ASN N 1 1 7 2614 1 1 23 ASN ND2 N 3.341 -15.123 3.869 1.00 . A A . 23 ASN ND2 1 1 7 2615 1 1 23 ASN O O 2.774 -16.676 0.682 1.00 . A A . 23 ASN O 1 1 7 2616 1 1 23 ASN OD1 O 5.089 -15.265 2.545 1.00 . A A . 23 ASN OD1 1 1 7 2617 1 1 24 LYS C C 0.109 -17.455 -0.129 1.00 . A A . 24 LYS C 1 1 7 2618 1 1 24 LYS CA C 0.043 -16.513 1.070 1.00 . A A . 24 LYS CA 1 1 7 2619 1 1 24 LYS CB C -1.391 -16.011 1.248 1.00 . A A . 24 LYS CB 1 1 7 2620 1 1 24 LYS CD C -3.675 -16.614 2.062 1.00 . A A . 24 LYS CD 1 1 7 2621 1 1 24 LYS CE C -4.504 -17.701 2.748 1.00 . A A . 24 LYS CE 1 1 7 2622 1 1 24 LYS CG C -2.271 -17.147 1.774 1.00 . A A . 24 LYS CG 1 1 7 2623 1 1 24 LYS H H 0.582 -14.472 0.892 1.00 . A A . 24 LYS H 1 1 7 2624 1 1 24 LYS HA H 0.336 -17.053 1.958 1.00 . A A . 24 LYS HA 1 1 7 2625 1 1 24 LYS HB2 H -1.401 -15.192 1.952 1.00 . A A . 24 LYS HB2 1 1 7 2626 1 1 24 LYS HB3 H -1.776 -15.674 0.297 1.00 . A A . 24 LYS HB3 1 1 7 2627 1 1 24 LYS HD2 H -3.606 -15.751 2.709 1.00 . A A . 24 LYS HD2 1 1 7 2628 1 1 24 LYS HD3 H -4.151 -16.333 1.134 1.00 . A A . 24 LYS HD3 1 1 7 2629 1 1 24 LYS HE2 H -4.733 -18.481 2.037 1.00 . A A . 24 LYS HE2 1 1 7 2630 1 1 24 LYS HE3 H -3.943 -18.117 3.571 1.00 . A A . 24 LYS HE3 1 1 7 2631 1 1 24 LYS HG2 H -2.327 -17.932 1.033 1.00 . A A . 24 LYS HG2 1 1 7 2632 1 1 24 LYS HG3 H -1.843 -17.541 2.684 1.00 . A A . 24 LYS HG3 1 1 7 2633 1 1 24 LYS HZ1 H -6.108 -16.381 2.598 1.00 . A A . 24 LYS HZ1 1 1 7 2634 1 1 24 LYS HZ2 H -5.602 -16.679 4.192 1.00 . A A . 24 LYS HZ2 1 1 7 2635 1 1 24 LYS HZ3 H -6.493 -17.853 3.347 1.00 . A A . 24 LYS HZ3 1 1 7 2636 1 1 24 LYS N N 0.944 -15.382 0.884 1.00 . A A . 24 LYS N 1 1 7 2637 1 1 24 LYS NZ N -5.773 -17.109 3.260 1.00 . A A . 24 LYS NZ 1 1 7 2638 1 1 24 LYS O O -0.020 -18.671 0.017 1.00 . A A . 24 LYS O 1 1 7 2639 1 1 25 LEU C C 1.620 -18.585 -2.492 1.00 . A A . 25 LEU C 1 1 7 2640 1 1 25 LEU CA C 0.394 -17.677 -2.528 1.00 . A A . 25 LEU CA 1 1 7 2641 1 1 25 LEU CB C 0.467 -16.746 -3.738 1.00 . A A . 25 LEU CB 1 1 7 2642 1 1 25 LEU CD1 C 0.599 -18.790 -5.185 1.00 . A A . 25 LEU CD1 1 1 7 2643 1 1 25 LEU CD2 C -1.610 -17.658 -4.836 1.00 . A A . 25 LEU CD2 1 1 7 2644 1 1 25 LEU CG C -0.095 -17.441 -4.987 1.00 . A A . 25 LEU CG 1 1 7 2645 1 1 25 LEU H H 0.407 -15.914 -1.369 1.00 . A A . 25 LEU H 1 1 7 2646 1 1 25 LEU HA H -0.486 -18.281 -2.608 1.00 . A A . 25 LEU HA 1 1 7 2647 1 1 25 LEU HB2 H -0.108 -15.850 -3.535 1.00 . A A . 25 LEU HB2 1 1 7 2648 1 1 25 LEU HB3 H 1.494 -16.481 -3.911 1.00 . A A . 25 LEU HB3 1 1 7 2649 1 1 25 LEU HD11 H 0.227 -19.497 -4.458 1.00 . A A . 25 LEU HD11 1 1 7 2650 1 1 25 LEU HD12 H 1.664 -18.669 -5.059 1.00 . A A . 25 LEU HD12 1 1 7 2651 1 1 25 LEU HD13 H 0.394 -19.157 -6.179 1.00 . A A . 25 LEU HD13 1 1 7 2652 1 1 25 LEU HD21 H -2.081 -17.578 -5.805 1.00 . A A . 25 LEU HD21 1 1 7 2653 1 1 25 LEU HD22 H -2.023 -16.909 -4.176 1.00 . A A . 25 LEU HD22 1 1 7 2654 1 1 25 LEU HD23 H -1.799 -18.639 -4.426 1.00 . A A . 25 LEU HD23 1 1 7 2655 1 1 25 LEU HG H 0.091 -16.818 -5.851 1.00 . A A . 25 LEU HG 1 1 7 2656 1 1 25 LEU N N 0.312 -16.884 -1.312 1.00 . A A . 25 LEU N 1 1 7 2657 1 1 25 LEU O O 1.494 -19.801 -2.342 1.00 . A A . 25 LEU O 1 1 7 2658 1 1 26 NH2 HN1 H 2.908 -17.092 -2.746 1.00 . A A . 26 NH2 HN1 1 1 7 2659 1 1 26 NH2 HN2 H 3.604 -18.643 -2.604 1.00 . A A . 26 NH2 HN2 1 1 7 2660 1 1 26 NH2 N N 2.809 -18.064 -2.625 1.00 . A A . 26 NH2 N 1 1 8 2661 1 1 1 GLY C C 3.698 16.818 0.845 1.00 . A A . 1 GLY C 1 1 8 2662 1 1 1 GLY CA C 4.178 18.110 0.195 1.00 . A A . 1 GLY CA 1 1 8 2663 1 1 1 GLY H1 H 6.027 17.205 -0.120 1.00 . A A . 1 GLY H1 1 1 8 2664 1 1 1 GLY H2 H 5.866 18.726 -0.859 1.00 . A A . 1 GLY H2 1 1 8 2665 1 1 1 GLY H3 H 5.091 17.369 -1.524 1.00 . A A . 1 GLY H3 1 1 8 2666 1 1 1 GLY HA2 H 4.432 18.830 0.961 1.00 . A A . 1 GLY HA2 1 1 8 2667 1 1 1 GLY HA3 H 3.392 18.509 -0.429 1.00 . A A . 1 GLY HA3 1 1 8 2668 1 1 1 GLY N N 5.381 17.831 -0.639 1.00 . A A . 1 GLY N 1 1 8 2669 1 1 1 GLY O O 3.496 15.809 0.170 1.00 . A A . 1 GLY O 1 1 8 2670 1 1 2 VAL C C 1.619 15.347 2.524 1.00 . A A . 2 VAL C 1 1 8 2671 1 1 2 VAL CA C 3.060 15.681 2.894 1.00 . A A . 2 VAL CA 1 1 8 2672 1 1 2 VAL CB C 3.157 15.934 4.399 1.00 . A A . 2 VAL CB 1 1 8 2673 1 1 2 VAL CG1 C 4.628 15.998 4.814 1.00 . A A . 2 VAL CG1 1 1 8 2674 1 1 2 VAL CG2 C 2.474 17.261 4.738 1.00 . A A . 2 VAL CG2 1 1 8 2675 1 1 2 VAL H H 3.694 17.689 2.648 1.00 . A A . 2 VAL H 1 1 8 2676 1 1 2 VAL HA H 3.690 14.842 2.640 1.00 . A A . 2 VAL HA 1 1 8 2677 1 1 2 VAL HB H 2.668 15.130 4.931 1.00 . A A . 2 VAL HB 1 1 8 2678 1 1 2 VAL HG11 H 4.696 16.162 5.879 1.00 . A A . 2 VAL HG11 1 1 8 2679 1 1 2 VAL HG12 H 5.113 16.811 4.294 1.00 . A A . 2 VAL HG12 1 1 8 2680 1 1 2 VAL HG13 H 5.114 15.067 4.561 1.00 . A A . 2 VAL HG13 1 1 8 2681 1 1 2 VAL HG21 H 3.057 18.077 4.337 1.00 . A A . 2 VAL HG21 1 1 8 2682 1 1 2 VAL HG22 H 2.401 17.365 5.811 1.00 . A A . 2 VAL HG22 1 1 8 2683 1 1 2 VAL HG23 H 1.485 17.277 4.306 1.00 . A A . 2 VAL HG23 1 1 8 2684 1 1 2 VAL N N 3.517 16.857 2.162 1.00 . A A . 2 VAL N 1 1 8 2685 1 1 2 VAL O O 1.209 14.187 2.571 1.00 . A A . 2 VAL O 1 1 8 2686 1 1 3 VAL C C -0.651 15.196 0.615 1.00 . A A . 3 VAL C 1 1 8 2687 1 1 3 VAL CA C -0.541 16.174 1.781 1.00 . A A . 3 VAL CA 1 1 8 2688 1 1 3 VAL CB C -1.169 17.512 1.389 1.00 . A A . 3 VAL CB 1 1 8 2689 1 1 3 VAL CG1 C -0.413 18.102 0.197 1.00 . A A . 3 VAL CG1 1 1 8 2690 1 1 3 VAL CG2 C -2.634 17.292 1.003 1.00 . A A . 3 VAL CG2 1 1 8 2691 1 1 3 VAL H H 1.235 17.274 2.139 1.00 . A A . 3 VAL H 1 1 8 2692 1 1 3 VAL HA H -1.078 15.771 2.627 1.00 . A A . 3 VAL HA 1 1 8 2693 1 1 3 VAL HB H -1.113 18.194 2.225 1.00 . A A . 3 VAL HB 1 1 8 2694 1 1 3 VAL HG11 H 0.649 18.056 0.388 1.00 . A A . 3 VAL HG11 1 1 8 2695 1 1 3 VAL HG12 H -0.710 19.130 0.056 1.00 . A A . 3 VAL HG12 1 1 8 2696 1 1 3 VAL HG13 H -0.644 17.536 -0.692 1.00 . A A . 3 VAL HG13 1 1 8 2697 1 1 3 VAL HG21 H -3.116 16.680 1.751 1.00 . A A . 3 VAL HG21 1 1 8 2698 1 1 3 VAL HG22 H -2.683 16.794 0.045 1.00 . A A . 3 VAL HG22 1 1 8 2699 1 1 3 VAL HG23 H -3.136 18.246 0.940 1.00 . A A . 3 VAL HG23 1 1 8 2700 1 1 3 VAL N N 0.854 16.370 2.157 1.00 . A A . 3 VAL N 1 1 8 2701 1 1 3 VAL O O -1.555 14.362 0.574 1.00 . A A . 3 VAL O 1 1 8 2702 1 1 4 ASP C C 0.710 13.018 -1.106 1.00 . A A . 4 ASP C 1 1 8 2703 1 1 4 ASP CA C 0.271 14.426 -1.496 1.00 . A A . 4 ASP CA 1 1 8 2704 1 1 4 ASP CB C 1.211 14.977 -2.570 1.00 . A A . 4 ASP CB 1 1 8 2705 1 1 4 ASP CG C 0.957 14.270 -3.898 1.00 . A A . 4 ASP CG 1 1 8 2706 1 1 4 ASP H H 0.973 15.989 -0.247 1.00 . A A . 4 ASP H 1 1 8 2707 1 1 4 ASP HA H -0.729 14.383 -1.898 1.00 . A A . 4 ASP HA 1 1 8 2708 1 1 4 ASP HB2 H 1.035 16.038 -2.689 1.00 . A A . 4 ASP HB2 1 1 8 2709 1 1 4 ASP HB3 H 2.237 14.811 -2.267 1.00 . A A . 4 ASP HB3 1 1 8 2710 1 1 4 ASP N N 0.276 15.306 -0.332 1.00 . A A . 4 ASP N 1 1 8 2711 1 1 4 ASP O O 0.266 12.034 -1.697 1.00 . A A . 4 ASP O 1 1 8 2712 1 1 4 ASP OD1 O 0.874 13.052 -3.891 1.00 . A A . 4 ASP OD1 1 1 8 2713 1 1 4 ASP OD2 O 0.849 14.956 -4.900 1.00 . A A . 4 ASP OD2 1 1 8 2714 1 1 5 ILE C C 1.070 10.975 1.277 1.00 . A A . 5 ILE C 1 1 8 2715 1 1 5 ILE CA C 2.080 11.636 0.348 1.00 . A A . 5 ILE CA 1 1 8 2716 1 1 5 ILE CB C 3.411 11.814 1.080 1.00 . A A . 5 ILE CB 1 1 8 2717 1 1 5 ILE CD1 C 5.667 12.875 0.911 1.00 . A A . 5 ILE CD1 1 1 8 2718 1 1 5 ILE CG1 C 4.443 12.411 0.119 1.00 . A A . 5 ILE CG1 1 1 8 2719 1 1 5 ILE CG2 C 3.905 10.454 1.578 1.00 . A A . 5 ILE CG2 1 1 8 2720 1 1 5 ILE H H 1.907 13.749 0.322 1.00 . A A . 5 ILE H 1 1 8 2721 1 1 5 ILE HA H 2.234 11.000 -0.506 1.00 . A A . 5 ILE HA 1 1 8 2722 1 1 5 ILE HB H 3.273 12.477 1.921 1.00 . A A . 5 ILE HB 1 1 8 2723 1 1 5 ILE HD11 H 6.472 13.100 0.229 1.00 . A A . 5 ILE HD11 1 1 8 2724 1 1 5 ILE HD12 H 5.977 12.092 1.588 1.00 . A A . 5 ILE HD12 1 1 8 2725 1 1 5 ILE HD13 H 5.415 13.761 1.476 1.00 . A A . 5 ILE HD13 1 1 8 2726 1 1 5 ILE HG12 H 4.742 11.659 -0.600 1.00 . A A . 5 ILE HG12 1 1 8 2727 1 1 5 ILE HG13 H 4.008 13.257 -0.396 1.00 . A A . 5 ILE HG13 1 1 8 2728 1 1 5 ILE HG21 H 4.924 10.547 1.926 1.00 . A A . 5 ILE HG21 1 1 8 2729 1 1 5 ILE HG22 H 3.866 9.739 0.770 1.00 . A A . 5 ILE HG22 1 1 8 2730 1 1 5 ILE HG23 H 3.276 10.117 2.388 1.00 . A A . 5 ILE HG23 1 1 8 2731 1 1 5 ILE N N 1.586 12.930 -0.111 1.00 . A A . 5 ILE N 1 1 8 2732 1 1 5 ILE O O 1.009 9.749 1.377 1.00 . A A . 5 ILE O 1 1 8 2733 1 1 6 LEU C C -1.901 10.691 2.112 1.00 . A A . 6 LEU C 1 1 8 2734 1 1 6 LEU CA C -0.724 11.291 2.879 1.00 . A A . 6 LEU CA 1 1 8 2735 1 1 6 LEU CB C -1.215 12.432 3.779 1.00 . A A . 6 LEU CB 1 1 8 2736 1 1 6 LEU CD1 C -0.413 13.899 5.646 1.00 . A A . 6 LEU CD1 1 1 8 2737 1 1 6 LEU CD2 C -0.952 11.504 6.095 1.00 . A A . 6 LEU CD2 1 1 8 2738 1 1 6 LEU CG C -0.378 12.483 5.066 1.00 . A A . 6 LEU CG 1 1 8 2739 1 1 6 LEU H H 0.378 12.761 1.835 1.00 . A A . 6 LEU H 1 1 8 2740 1 1 6 LEU HA H -0.281 10.522 3.494 1.00 . A A . 6 LEU HA 1 1 8 2741 1 1 6 LEU HB2 H -1.113 13.371 3.247 1.00 . A A . 6 LEU HB2 1 1 8 2742 1 1 6 LEU HB3 H -2.254 12.273 4.032 1.00 . A A . 6 LEU HB3 1 1 8 2743 1 1 6 LEU HD11 H 0.175 13.932 6.551 1.00 . A A . 6 LEU HD11 1 1 8 2744 1 1 6 LEU HD12 H -1.434 14.172 5.869 1.00 . A A . 6 LEU HD12 1 1 8 2745 1 1 6 LEU HD13 H -0.005 14.593 4.926 1.00 . A A . 6 LEU HD13 1 1 8 2746 1 1 6 LEU HD21 H -0.385 11.571 7.011 1.00 . A A . 6 LEU HD21 1 1 8 2747 1 1 6 LEU HD22 H -0.893 10.497 5.709 1.00 . A A . 6 LEU HD22 1 1 8 2748 1 1 6 LEU HD23 H -1.985 11.752 6.292 1.00 . A A . 6 LEU HD23 1 1 8 2749 1 1 6 LEU HG H 0.645 12.214 4.842 1.00 . A A . 6 LEU HG 1 1 8 2750 1 1 6 LEU N N 0.282 11.796 1.956 1.00 . A A . 6 LEU N 1 1 8 2751 1 1 6 LEU O O -2.593 9.804 2.613 1.00 . A A . 6 LEU O 1 1 8 2752 1 1 7 LYS C C -2.870 9.305 -0.513 1.00 . A A . 7 LYS C 1 1 8 2753 1 1 7 LYS CA C -3.221 10.675 0.071 1.00 . A A . 7 LYS CA 1 1 8 2754 1 1 7 LYS CB C -3.579 11.660 -1.064 1.00 . A A . 7 LYS CB 1 1 8 2755 1 1 7 LYS CD C -4.774 13.185 0.527 1.00 . A A . 7 LYS CD 1 1 8 2756 1 1 7 LYS CE C -5.781 14.338 0.495 1.00 . A A . 7 LYS CE 1 1 8 2757 1 1 7 LYS CG C -4.914 12.342 -0.747 1.00 . A A . 7 LYS CG 1 1 8 2758 1 1 7 LYS H H -1.532 11.881 0.551 1.00 . A A . 7 LYS H 1 1 8 2759 1 1 7 LYS HA H -4.088 10.557 0.704 1.00 . A A . 7 LYS HA 1 1 8 2760 1 1 7 LYS HB2 H -2.813 12.413 -1.168 1.00 . A A . 7 LYS HB2 1 1 8 2761 1 1 7 LYS HB3 H -3.673 11.120 -1.995 1.00 . A A . 7 LYS HB3 1 1 8 2762 1 1 7 LYS HD2 H -4.965 12.567 1.392 1.00 . A A . 7 LYS HD2 1 1 8 2763 1 1 7 LYS HD3 H -3.773 13.588 0.589 1.00 . A A . 7 LYS HD3 1 1 8 2764 1 1 7 LYS HE2 H -5.919 14.724 1.495 1.00 . A A . 7 LYS HE2 1 1 8 2765 1 1 7 LYS HE3 H -5.409 15.124 -0.145 1.00 . A A . 7 LYS HE3 1 1 8 2766 1 1 7 LYS HG2 H -5.192 12.975 -1.571 1.00 . A A . 7 LYS HG2 1 1 8 2767 1 1 7 LYS HG3 H -5.676 11.592 -0.599 1.00 . A A . 7 LYS HG3 1 1 8 2768 1 1 7 LYS HZ1 H -6.939 12.951 -0.540 1.00 . A A . 7 LYS HZ1 1 1 8 2769 1 1 7 LYS HZ2 H -7.487 14.553 -0.678 1.00 . A A . 7 LYS HZ2 1 1 8 2770 1 1 7 LYS HZ3 H -7.741 13.687 0.761 1.00 . A A . 7 LYS HZ3 1 1 8 2771 1 1 7 LYS N N -2.120 11.179 0.895 1.00 . A A . 7 LYS N 1 1 8 2772 1 1 7 LYS NZ N -7.085 13.846 -0.030 1.00 . A A . 7 LYS NZ 1 1 8 2773 1 1 7 LYS O O -3.755 8.481 -0.749 1.00 . A A . 7 LYS O 1 1 8 2774 1 1 8 GLY C C -1.375 6.654 -0.314 1.00 . A A . 8 GLY C 1 1 8 2775 1 1 8 GLY CA C -1.142 7.792 -1.302 1.00 . A A . 8 GLY CA 1 1 8 2776 1 1 8 GLY H H -0.916 9.754 -0.539 1.00 . A A . 8 GLY H 1 1 8 2777 1 1 8 GLY HA2 H -1.693 7.593 -2.210 1.00 . A A . 8 GLY HA2 1 1 8 2778 1 1 8 GLY HA3 H -0.089 7.849 -1.531 1.00 . A A . 8 GLY HA3 1 1 8 2779 1 1 8 GLY N N -1.582 9.066 -0.745 1.00 . A A . 8 GLY N 1 1 8 2780 1 1 8 GLY O O -1.789 5.561 -0.697 1.00 . A A . 8 GLY O 1 1 8 2781 1 1 9 ALA C C -2.736 5.435 2.032 1.00 . A A . 9 ALA C 1 1 8 2782 1 1 9 ALA CA C -1.290 5.910 1.997 1.00 . A A . 9 ALA CA 1 1 8 2783 1 1 9 ALA CB C -0.904 6.484 3.361 1.00 . A A . 9 ALA CB 1 1 8 2784 1 1 9 ALA H H -0.778 7.809 1.208 1.00 . A A . 9 ALA H 1 1 8 2785 1 1 9 ALA HA H -0.654 5.067 1.780 1.00 . A A . 9 ALA HA 1 1 8 2786 1 1 9 ALA HB1 H 0.086 6.909 3.305 1.00 . A A . 9 ALA HB1 1 1 8 2787 1 1 9 ALA HB2 H -0.916 5.695 4.099 1.00 . A A . 9 ALA HB2 1 1 8 2788 1 1 9 ALA HB3 H -1.611 7.250 3.642 1.00 . A A . 9 ALA HB3 1 1 8 2789 1 1 9 ALA N N -1.106 6.920 0.961 1.00 . A A . 9 ALA N 1 1 8 2790 1 1 9 ALA O O -3.011 4.284 2.373 1.00 . A A . 9 ALA O 1 1 8 2791 1 1 10 ALA C C -5.308 4.775 0.755 1.00 . A A . 10 ALA C 1 1 8 2792 1 1 10 ALA CA C -5.069 5.967 1.672 1.00 . A A . 10 ALA CA 1 1 8 2793 1 1 10 ALA CB C -5.907 7.157 1.198 1.00 . A A . 10 ALA CB 1 1 8 2794 1 1 10 ALA H H -3.384 7.224 1.410 1.00 . A A . 10 ALA H 1 1 8 2795 1 1 10 ALA HA H -5.369 5.705 2.675 1.00 . A A . 10 ALA HA 1 1 8 2796 1 1 10 ALA HB1 H -5.663 7.383 0.171 1.00 . A A . 10 ALA HB1 1 1 8 2797 1 1 10 ALA HB2 H -5.693 8.016 1.817 1.00 . A A . 10 ALA HB2 1 1 8 2798 1 1 10 ALA HB3 H -6.956 6.910 1.273 1.00 . A A . 10 ALA HB3 1 1 8 2799 1 1 10 ALA N N -3.657 6.321 1.676 1.00 . A A . 10 ALA N 1 1 8 2800 1 1 10 ALA O O -5.910 3.784 1.156 1.00 . A A . 10 ALA O 1 1 8 2801 1 1 11 LYS C C -3.967 2.715 -1.253 1.00 . A A . 11 LYS C 1 1 8 2802 1 1 11 LYS CA C -4.996 3.811 -1.452 1.00 . A A . 11 LYS CA 1 1 8 2803 1 1 11 LYS CB C -4.874 4.365 -2.849 1.00 . A A . 11 LYS CB 1 1 8 2804 1 1 11 LYS CD C -5.807 3.770 -5.051 1.00 . A A . 11 LYS CD 1 1 8 2805 1 1 11 LYS CE C -5.937 2.690 -6.125 1.00 . A A . 11 LYS CE 1 1 8 2806 1 1 11 LYS CG C -5.021 3.240 -3.875 1.00 . A A . 11 LYS CG 1 1 8 2807 1 1 11 LYS H H -4.366 5.695 -0.744 1.00 . A A . 11 LYS H 1 1 8 2808 1 1 11 LYS HA H -5.969 3.388 -1.338 1.00 . A A . 11 LYS HA 1 1 8 2809 1 1 11 LYS HB2 H -5.640 5.112 -3.006 1.00 . A A . 11 LYS HB2 1 1 8 2810 1 1 11 LYS HB3 H -3.918 4.813 -2.951 1.00 . A A . 11 LYS HB3 1 1 8 2811 1 1 11 LYS HD2 H -6.784 4.069 -4.707 1.00 . A A . 11 LYS HD2 1 1 8 2812 1 1 11 LYS HD3 H -5.291 4.620 -5.450 1.00 . A A . 11 LYS HD3 1 1 8 2813 1 1 11 LYS HE2 H -6.624 1.929 -5.789 1.00 . A A . 11 LYS HE2 1 1 8 2814 1 1 11 LYS HE3 H -6.309 3.134 -7.035 1.00 . A A . 11 LYS HE3 1 1 8 2815 1 1 11 LYS HG2 H -4.045 2.915 -4.205 1.00 . A A . 11 LYS HG2 1 1 8 2816 1 1 11 LYS HG3 H -5.550 2.413 -3.445 1.00 . A A . 11 LYS HG3 1 1 8 2817 1 1 11 LYS HZ1 H -3.859 2.696 -5.999 1.00 . A A . 11 LYS HZ1 1 1 8 2818 1 1 11 LYS HZ2 H -4.466 1.962 -7.405 1.00 . A A . 11 LYS HZ2 1 1 8 2819 1 1 11 LYS HZ3 H -4.552 1.150 -5.914 1.00 . A A . 11 LYS HZ3 1 1 8 2820 1 1 11 LYS N N -4.833 4.882 -0.480 1.00 . A A . 11 LYS N 1 1 8 2821 1 1 11 LYS NZ N -4.603 2.078 -6.380 1.00 . A A . 11 LYS NZ 1 1 8 2822 1 1 11 LYS O O -4.208 1.564 -1.616 1.00 . A A . 11 LYS O 1 1 8 2823 1 1 12 ASP C C -2.426 0.807 0.132 1.00 . A A . 12 ASP C 1 1 8 2824 1 1 12 ASP CA C -1.777 2.072 -0.416 1.00 . A A . 12 ASP CA 1 1 8 2825 1 1 12 ASP CB C -0.759 2.609 0.590 1.00 . A A . 12 ASP CB 1 1 8 2826 1 1 12 ASP CG C 0.291 1.544 0.888 1.00 . A A . 12 ASP CG 1 1 8 2827 1 1 12 ASP H H -2.685 3.999 -0.401 1.00 . A A . 12 ASP H 1 1 8 2828 1 1 12 ASP HA H -1.274 1.841 -1.343 1.00 . A A . 12 ASP HA 1 1 8 2829 1 1 12 ASP HB2 H -0.276 3.482 0.178 1.00 . A A . 12 ASP HB2 1 1 8 2830 1 1 12 ASP HB3 H -1.266 2.875 1.505 1.00 . A A . 12 ASP HB3 1 1 8 2831 1 1 12 ASP N N -2.822 3.067 -0.669 1.00 . A A . 12 ASP N 1 1 8 2832 1 1 12 ASP O O -1.787 -0.233 0.294 1.00 . A A . 12 ASP O 1 1 8 2833 1 1 12 ASP OD1 O 0.128 0.837 1.870 1.00 . A A . 12 ASP OD1 1 1 8 2834 1 1 12 ASP OD2 O 1.242 1.449 0.130 1.00 . A A . 12 ASP OD2 1 1 8 2835 1 1 13 ILE C C -4.413 -1.367 -0.036 1.00 . A A . 13 ILE C 1 1 8 2836 1 1 13 ILE CA C -4.536 -0.160 0.884 1.00 . A A . 13 ILE CA 1 1 8 2837 1 1 13 ILE CB C -5.989 0.323 0.877 1.00 . A A . 13 ILE CB 1 1 8 2838 1 1 13 ILE CD1 C -7.568 1.958 1.897 1.00 . A A . 13 ILE CD1 1 1 8 2839 1 1 13 ILE CG1 C -6.253 1.202 2.095 1.00 . A A . 13 ILE CG1 1 1 8 2840 1 1 13 ILE CG2 C -6.950 -0.863 0.884 1.00 . A A . 13 ILE CG2 1 1 8 2841 1 1 13 ILE H H -4.148 1.791 0.213 1.00 . A A . 13 ILE H 1 1 8 2842 1 1 13 ILE HA H -4.243 -0.421 1.888 1.00 . A A . 13 ILE HA 1 1 8 2843 1 1 13 ILE HB H -6.156 0.900 -0.021 1.00 . A A . 13 ILE HB 1 1 8 2844 1 1 13 ILE HD11 H -8.395 1.299 2.114 1.00 . A A . 13 ILE HD11 1 1 8 2845 1 1 13 ILE HD12 H -7.641 2.300 0.874 1.00 . A A . 13 ILE HD12 1 1 8 2846 1 1 13 ILE HD13 H -7.598 2.806 2.563 1.00 . A A . 13 ILE HD13 1 1 8 2847 1 1 13 ILE HG12 H -6.325 0.582 2.972 1.00 . A A . 13 ILE HG12 1 1 8 2848 1 1 13 ILE HG13 H -5.444 1.909 2.216 1.00 . A A . 13 ILE HG13 1 1 8 2849 1 1 13 ILE HG21 H -6.594 -1.609 1.576 1.00 . A A . 13 ILE HG21 1 1 8 2850 1 1 13 ILE HG22 H -7.002 -1.284 -0.109 1.00 . A A . 13 ILE HG22 1 1 8 2851 1 1 13 ILE HG23 H -7.931 -0.527 1.184 1.00 . A A . 13 ILE HG23 1 1 8 2852 1 1 13 ILE N N -3.721 0.929 0.384 1.00 . A A . 13 ILE N 1 1 8 2853 1 1 13 ILE O O -4.095 -2.473 0.401 1.00 . A A . 13 ILE O 1 1 8 2854 1 1 14 ALA C C -3.220 -2.863 -2.272 1.00 . A A . 14 ALA C 1 1 8 2855 1 1 14 ALA CA C -4.591 -2.196 -2.310 1.00 . A A . 14 ALA CA 1 1 8 2856 1 1 14 ALA CB C -4.846 -1.625 -3.705 1.00 . A A . 14 ALA CB 1 1 8 2857 1 1 14 ALA H H -4.924 -0.225 -1.593 1.00 . A A . 14 ALA H 1 1 8 2858 1 1 14 ALA HA H -5.347 -2.935 -2.093 1.00 . A A . 14 ALA HA 1 1 8 2859 1 1 14 ALA HB1 H -4.023 -0.984 -3.987 1.00 . A A . 14 ALA HB1 1 1 8 2860 1 1 14 ALA HB2 H -5.762 -1.054 -3.700 1.00 . A A . 14 ALA HB2 1 1 8 2861 1 1 14 ALA HB3 H -4.931 -2.435 -4.416 1.00 . A A . 14 ALA HB3 1 1 8 2862 1 1 14 ALA N N -4.671 -1.133 -1.314 1.00 . A A . 14 ALA N 1 1 8 2863 1 1 14 ALA O O -3.111 -4.085 -2.367 1.00 . A A . 14 ALA O 1 1 8 2864 1 1 15 GLY C C -0.545 -3.277 -0.760 1.00 . A A . 15 GLY C 1 1 8 2865 1 1 15 GLY CA C -0.817 -2.574 -2.087 1.00 . A A . 15 GLY CA 1 1 8 2866 1 1 15 GLY H H -2.325 -1.086 -2.065 1.00 . A A . 15 GLY H 1 1 8 2867 1 1 15 GLY HA2 H -0.678 -3.276 -2.896 1.00 . A A . 15 GLY HA2 1 1 8 2868 1 1 15 GLY HA3 H -0.120 -1.758 -2.201 1.00 . A A . 15 GLY HA3 1 1 8 2869 1 1 15 GLY N N -2.177 -2.052 -2.135 1.00 . A A . 15 GLY N 1 1 8 2870 1 1 15 GLY O O 0.243 -4.221 -0.698 1.00 . A A . 15 GLY O 1 1 8 2871 1 1 16 HIS C C -1.495 -4.843 1.647 1.00 . A A . 16 HIS C 1 1 8 2872 1 1 16 HIS CA C -1.010 -3.396 1.622 1.00 . A A . 16 HIS CA 1 1 8 2873 1 1 16 HIS CB C -1.775 -2.580 2.666 1.00 . A A . 16 HIS CB 1 1 8 2874 1 1 16 HIS CD2 C -2.401 -4.259 4.590 1.00 . A A . 16 HIS CD2 1 1 8 2875 1 1 16 HIS CE1 C -0.885 -3.673 6.024 1.00 . A A . 16 HIS CE1 1 1 8 2876 1 1 16 HIS CG C -1.671 -3.251 4.008 1.00 . A A . 16 HIS CG 1 1 8 2877 1 1 16 HIS H H -1.808 -2.050 0.192 1.00 . A A . 16 HIS H 1 1 8 2878 1 1 16 HIS HA H 0.040 -3.376 1.869 1.00 . A A . 16 HIS HA 1 1 8 2879 1 1 16 HIS HB2 H -1.353 -1.587 2.727 1.00 . A A . 16 HIS HB2 1 1 8 2880 1 1 16 HIS HB3 H -2.814 -2.512 2.379 1.00 . A A . 16 HIS HB3 1 1 8 2881 1 1 16 HIS HD2 H -3.235 -4.768 4.130 1.00 . A A . 16 HIS HD2 1 1 8 2882 1 1 16 HIS HE1 H -0.277 -3.618 6.915 1.00 . A A . 16 HIS HE1 1 1 8 2883 1 1 16 HIS HE2 H -2.228 -5.191 6.502 1.00 . A A . 16 HIS HE2 1 1 8 2884 1 1 16 HIS N N -1.196 -2.808 0.299 1.00 . A A . 16 HIS N 1 1 8 2885 1 1 16 HIS ND1 N -0.710 -2.894 4.942 1.00 . A A . 16 HIS ND1 1 1 8 2886 1 1 16 HIS NE2 N -1.902 -4.524 5.862 1.00 . A A . 16 HIS NE2 1 1 8 2887 1 1 16 HIS O O -0.781 -5.738 2.098 1.00 . A A . 16 HIS O 1 1 8 2888 1 1 17 LEU C C -2.519 -7.296 0.166 1.00 . A A . 17 LEU C 1 1 8 2889 1 1 17 LEU CA C -3.280 -6.404 1.144 1.00 . A A . 17 LEU CA 1 1 8 2890 1 1 17 LEU CB C -4.768 -6.324 0.769 1.00 . A A . 17 LEU CB 1 1 8 2891 1 1 17 LEU CD1 C -4.959 -7.832 -1.252 1.00 . A A . 17 LEU CD1 1 1 8 2892 1 1 17 LEU CD2 C -6.275 -5.699 -1.130 1.00 . A A . 17 LEU CD2 1 1 8 2893 1 1 17 LEU CG C -4.949 -6.373 -0.759 1.00 . A A . 17 LEU CG 1 1 8 2894 1 1 17 LEU H H -3.244 -4.322 0.823 1.00 . A A . 17 LEU H 1 1 8 2895 1 1 17 LEU HA H -3.195 -6.830 2.132 1.00 . A A . 17 LEU HA 1 1 8 2896 1 1 17 LEU HB2 H -5.293 -7.146 1.222 1.00 . A A . 17 LEU HB2 1 1 8 2897 1 1 17 LEU HB3 H -5.174 -5.396 1.144 1.00 . A A . 17 LEU HB3 1 1 8 2898 1 1 17 LEU HD11 H -5.951 -8.096 -1.587 1.00 . A A . 17 LEU HD11 1 1 8 2899 1 1 17 LEU HD12 H -4.665 -8.495 -0.452 1.00 . A A . 17 LEU HD12 1 1 8 2900 1 1 17 LEU HD13 H -4.265 -7.934 -2.073 1.00 . A A . 17 LEU HD13 1 1 8 2901 1 1 17 LEU HD21 H -7.089 -6.216 -0.645 1.00 . A A . 17 LEU HD21 1 1 8 2902 1 1 17 LEU HD22 H -6.410 -5.738 -2.201 1.00 . A A . 17 LEU HD22 1 1 8 2903 1 1 17 LEU HD23 H -6.258 -4.668 -0.807 1.00 . A A . 17 LEU HD23 1 1 8 2904 1 1 17 LEU HG H -4.135 -5.843 -1.231 1.00 . A A . 17 LEU HG 1 1 8 2905 1 1 17 LEU N N -2.714 -5.067 1.166 1.00 . A A . 17 LEU N 1 1 8 2906 1 1 17 LEU O O -2.425 -8.506 0.365 1.00 . A A . 17 LEU O 1 1 8 2907 1 1 18 ALA C C 0.018 -8.057 -1.227 1.00 . A A . 18 ALA C 1 1 8 2908 1 1 18 ALA CA C -1.219 -7.454 -1.871 1.00 . A A . 18 ALA CA 1 1 8 2909 1 1 18 ALA CB C -0.808 -6.551 -3.034 1.00 . A A . 18 ALA CB 1 1 8 2910 1 1 18 ALA H H -2.070 -5.724 -0.992 1.00 . A A . 18 ALA H 1 1 8 2911 1 1 18 ALA HA H -1.836 -8.255 -2.248 1.00 . A A . 18 ALA HA 1 1 8 2912 1 1 18 ALA HB1 H -1.685 -6.266 -3.597 1.00 . A A . 18 ALA HB1 1 1 8 2913 1 1 18 ALA HB2 H -0.124 -7.082 -3.680 1.00 . A A . 18 ALA HB2 1 1 8 2914 1 1 18 ALA HB3 H -0.324 -5.665 -2.649 1.00 . A A . 18 ALA HB3 1 1 8 2915 1 1 18 ALA N N -1.971 -6.693 -0.884 1.00 . A A . 18 ALA N 1 1 8 2916 1 1 18 ALA O O 0.187 -9.273 -1.219 1.00 . A A . 18 ALA O 1 1 8 2917 1 1 19 SER C C 1.721 -8.779 0.978 1.00 . A A . 19 SER C 1 1 8 2918 1 1 19 SER CA C 2.078 -7.689 -0.021 1.00 . A A . 19 SER CA 1 1 8 2919 1 1 19 SER CB C 2.790 -6.536 0.690 1.00 . A A . 19 SER CB 1 1 8 2920 1 1 19 SER H H 0.684 -6.245 -0.697 1.00 . A A . 19 SER H 1 1 8 2921 1 1 19 SER HA H 2.736 -8.106 -0.769 1.00 . A A . 19 SER HA 1 1 8 2922 1 1 19 SER HB2 H 3.852 -6.605 0.524 1.00 . A A . 19 SER HB2 1 1 8 2923 1 1 19 SER HB3 H 2.428 -5.595 0.296 1.00 . A A . 19 SER HB3 1 1 8 2924 1 1 19 SER HG H 1.630 -6.919 2.204 1.00 . A A . 19 SER HG 1 1 8 2925 1 1 19 SER N N 0.873 -7.207 -0.674 1.00 . A A . 19 SER N 1 1 8 2926 1 1 19 SER O O 2.462 -9.746 1.153 1.00 . A A . 19 SER O 1 1 8 2927 1 1 19 SER OG O 2.530 -6.608 2.087 1.00 . A A . 19 SER OG 1 1 8 2928 1 1 20 LYS C C -0.147 -10.932 1.885 1.00 . A A . 20 LYS C 1 1 8 2929 1 1 20 LYS CA C 0.107 -9.602 2.587 1.00 . A A . 20 LYS CA 1 1 8 2930 1 1 20 LYS CB C -1.184 -9.100 3.248 1.00 . A A . 20 LYS CB 1 1 8 2931 1 1 20 LYS CD C -2.197 -8.201 5.352 1.00 . A A . 20 LYS CD 1 1 8 2932 1 1 20 LYS CE C -1.973 -7.997 6.851 1.00 . A A . 20 LYS CE 1 1 8 2933 1 1 20 LYS CG C -0.913 -8.734 4.711 1.00 . A A . 20 LYS CG 1 1 8 2934 1 1 20 LYS H H 0.015 -7.837 1.431 1.00 . A A . 20 LYS H 1 1 8 2935 1 1 20 LYS HA H 0.866 -9.737 3.340 1.00 . A A . 20 LYS HA 1 1 8 2936 1 1 20 LYS HB2 H -1.533 -8.226 2.721 1.00 . A A . 20 LYS HB2 1 1 8 2937 1 1 20 LYS HB3 H -1.943 -9.867 3.207 1.00 . A A . 20 LYS HB3 1 1 8 2938 1 1 20 LYS HD2 H -2.461 -7.257 4.894 1.00 . A A . 20 LYS HD2 1 1 8 2939 1 1 20 LYS HD3 H -2.996 -8.910 5.201 1.00 . A A . 20 LYS HD3 1 1 8 2940 1 1 20 LYS HE2 H -1.559 -8.898 7.279 1.00 . A A . 20 LYS HE2 1 1 8 2941 1 1 20 LYS HE3 H -1.287 -7.177 7.005 1.00 . A A . 20 LYS HE3 1 1 8 2942 1 1 20 LYS HG2 H -0.582 -9.613 5.246 1.00 . A A . 20 LYS HG2 1 1 8 2943 1 1 20 LYS HG3 H -0.148 -7.974 4.757 1.00 . A A . 20 LYS HG3 1 1 8 2944 1 1 20 LYS HZ1 H -3.157 -7.723 8.542 1.00 . A A . 20 LYS HZ1 1 1 8 2945 1 1 20 LYS HZ2 H -3.986 -8.384 7.215 1.00 . A A . 20 LYS HZ2 1 1 8 2946 1 1 20 LYS HZ3 H -3.584 -6.734 7.232 1.00 . A A . 20 LYS HZ3 1 1 8 2947 1 1 20 LYS N N 0.569 -8.621 1.620 1.00 . A A . 20 LYS N 1 1 8 2948 1 1 20 LYS NZ N -3.273 -7.686 7.510 1.00 . A A . 20 LYS NZ 1 1 8 2949 1 1 20 LYS O O 0.350 -11.976 2.307 1.00 . A A . 20 LYS O 1 1 8 2950 1 1 21 VAL C C -0.041 -12.553 -0.760 1.00 . A A . 21 VAL C 1 1 8 2951 1 1 21 VAL CA C -1.243 -12.077 0.046 1.00 . A A . 21 VAL CA 1 1 8 2952 1 1 21 VAL CB C -2.416 -11.810 -0.894 1.00 . A A . 21 VAL CB 1 1 8 2953 1 1 21 VAL CG1 C -2.779 -13.108 -1.612 1.00 . A A . 21 VAL CG1 1 1 8 2954 1 1 21 VAL CG2 C -3.623 -11.322 -0.085 1.00 . A A . 21 VAL CG2 1 1 8 2955 1 1 21 VAL H H -1.290 -10.017 0.524 1.00 . A A . 21 VAL H 1 1 8 2956 1 1 21 VAL HA H -1.524 -12.854 0.727 1.00 . A A . 21 VAL HA 1 1 8 2957 1 1 21 VAL HB H -2.136 -11.060 -1.620 1.00 . A A . 21 VAL HB 1 1 8 2958 1 1 21 VAL HG11 H -3.714 -12.982 -2.133 1.00 . A A . 21 VAL HG11 1 1 8 2959 1 1 21 VAL HG12 H -2.873 -13.904 -0.887 1.00 . A A . 21 VAL HG12 1 1 8 2960 1 1 21 VAL HG13 H -2.001 -13.357 -2.318 1.00 . A A . 21 VAL HG13 1 1 8 2961 1 1 21 VAL HG21 H -4.324 -10.834 -0.745 1.00 . A A . 21 VAL HG21 1 1 8 2962 1 1 21 VAL HG22 H -3.295 -10.624 0.669 1.00 . A A . 21 VAL HG22 1 1 8 2963 1 1 21 VAL HG23 H -4.103 -12.165 0.390 1.00 . A A . 21 VAL HG23 1 1 8 2964 1 1 21 VAL N N -0.924 -10.879 0.808 1.00 . A A . 21 VAL N 1 1 8 2965 1 1 21 VAL O O 0.204 -13.755 -0.870 1.00 . A A . 21 VAL O 1 1 8 2966 1 1 22 MET C C 2.861 -12.770 -1.266 1.00 . A A . 22 MET C 1 1 8 2967 1 1 22 MET CA C 1.878 -11.965 -2.112 1.00 . A A . 22 MET CA 1 1 8 2968 1 1 22 MET CB C 2.558 -10.698 -2.641 1.00 . A A . 22 MET CB 1 1 8 2969 1 1 22 MET CE C 0.473 -10.685 -6.169 1.00 . A A . 22 MET CE 1 1 8 2970 1 1 22 MET CG C 2.264 -10.530 -4.134 1.00 . A A . 22 MET CG 1 1 8 2971 1 1 22 MET H H 0.466 -10.668 -1.200 1.00 . A A . 22 MET H 1 1 8 2972 1 1 22 MET HA H 1.565 -12.567 -2.947 1.00 . A A . 22 MET HA 1 1 8 2973 1 1 22 MET HB2 H 2.179 -9.849 -2.106 1.00 . A A . 22 MET HB2 1 1 8 2974 1 1 22 MET HB3 H 3.625 -10.767 -2.492 1.00 . A A . 22 MET HB3 1 1 8 2975 1 1 22 MET HE1 H 1.329 -10.197 -6.615 1.00 . A A . 22 MET HE1 1 1 8 2976 1 1 22 MET HE2 H -0.431 -10.285 -6.599 1.00 . A A . 22 MET HE2 1 1 8 2977 1 1 22 MET HE3 H 0.520 -11.749 -6.358 1.00 . A A . 22 MET HE3 1 1 8 2978 1 1 22 MET HG2 H 2.750 -9.634 -4.498 1.00 . A A . 22 MET HG2 1 1 8 2979 1 1 22 MET HG3 H 2.638 -11.392 -4.674 1.00 . A A . 22 MET HG3 1 1 8 2980 1 1 22 MET N N 0.706 -11.612 -1.320 1.00 . A A . 22 MET N 1 1 8 2981 1 1 22 MET O O 3.311 -13.842 -1.670 1.00 . A A . 22 MET O 1 1 8 2982 1 1 22 MET SD S 0.477 -10.392 -4.383 1.00 . A A . 22 MET SD 1 1 8 2983 1 1 23 ASN C C 3.661 -14.354 1.067 1.00 . A A . 23 ASN C 1 1 8 2984 1 1 23 ASN CA C 4.111 -12.919 0.808 1.00 . A A . 23 ASN CA 1 1 8 2985 1 1 23 ASN CB C 4.202 -12.163 2.129 1.00 . A A . 23 ASN CB 1 1 8 2986 1 1 23 ASN CG C 5.473 -12.557 2.875 1.00 . A A . 23 ASN CG 1 1 8 2987 1 1 23 ASN H H 2.793 -11.386 0.177 1.00 . A A . 23 ASN H 1 1 8 2988 1 1 23 ASN HA H 5.085 -12.937 0.357 1.00 . A A . 23 ASN HA 1 1 8 2989 1 1 23 ASN HB2 H 4.214 -11.100 1.934 1.00 . A A . 23 ASN HB2 1 1 8 2990 1 1 23 ASN HB3 H 3.348 -12.406 2.728 1.00 . A A . 23 ASN HB3 1 1 8 2991 1 1 23 ASN HD21 H 5.823 -10.722 3.547 1.00 . A A . 23 ASN HD21 1 1 8 2992 1 1 23 ASN HD22 H 6.956 -11.895 4.016 1.00 . A A . 23 ASN HD22 1 1 8 2993 1 1 23 ASN N N 3.185 -12.243 -0.091 1.00 . A A . 23 ASN N 1 1 8 2994 1 1 23 ASN ND2 N 6.139 -11.649 3.534 1.00 . A A . 23 ASN ND2 1 1 8 2995 1 1 23 ASN O O 4.480 -15.268 1.140 1.00 . A A . 23 ASN O 1 1 8 2996 1 1 23 ASN OD1 O 5.867 -13.722 2.857 1.00 . A A . 23 ASN OD1 1 1 8 2997 1 1 24 LYS C C 2.181 -16.825 0.323 1.00 . A A . 24 LYS C 1 1 8 2998 1 1 24 LYS CA C 1.806 -15.872 1.453 1.00 . A A . 24 LYS CA 1 1 8 2999 1 1 24 LYS CB C 0.281 -15.799 1.577 1.00 . A A . 24 LYS CB 1 1 8 3000 1 1 24 LYS CD C -1.334 -17.648 1.039 1.00 . A A . 24 LYS CD 1 1 8 3001 1 1 24 LYS CE C -1.952 -18.952 1.549 1.00 . A A . 24 LYS CE 1 1 8 3002 1 1 24 LYS CG C -0.272 -17.162 2.031 1.00 . A A . 24 LYS CG 1 1 8 3003 1 1 24 LYS H H 1.743 -13.777 1.136 1.00 . A A . 24 LYS H 1 1 8 3004 1 1 24 LYS HA H 2.213 -16.249 2.379 1.00 . A A . 24 LYS HA 1 1 8 3005 1 1 24 LYS HB2 H 0.018 -15.042 2.302 1.00 . A A . 24 LYS HB2 1 1 8 3006 1 1 24 LYS HB3 H -0.142 -15.539 0.617 1.00 . A A . 24 LYS HB3 1 1 8 3007 1 1 24 LYS HD2 H -2.106 -16.897 0.942 1.00 . A A . 24 LYS HD2 1 1 8 3008 1 1 24 LYS HD3 H -0.878 -17.821 0.077 1.00 . A A . 24 LYS HD3 1 1 8 3009 1 1 24 LYS HE2 H -2.437 -19.464 0.730 1.00 . A A . 24 LYS HE2 1 1 8 3010 1 1 24 LYS HE3 H -1.178 -19.584 1.958 1.00 . A A . 24 LYS HE3 1 1 8 3011 1 1 24 LYS HG2 H 0.532 -17.884 2.075 1.00 . A A . 24 LYS HG2 1 1 8 3012 1 1 24 LYS HG3 H -0.717 -17.062 3.009 1.00 . A A . 24 LYS HG3 1 1 8 3013 1 1 24 LYS HZ1 H -3.241 -17.650 2.537 1.00 . A A . 24 LYS HZ1 1 1 8 3014 1 1 24 LYS HZ2 H -2.537 -18.824 3.542 1.00 . A A . 24 LYS HZ2 1 1 8 3015 1 1 24 LYS HZ3 H -3.790 -19.254 2.479 1.00 . A A . 24 LYS HZ3 1 1 8 3016 1 1 24 LYS N N 2.351 -14.543 1.203 1.00 . A A . 24 LYS N 1 1 8 3017 1 1 24 LYS NZ N -2.957 -18.647 2.607 1.00 . A A . 24 LYS NZ 1 1 8 3018 1 1 24 LYS O O 2.514 -17.985 0.560 1.00 . A A . 24 LYS O 1 1 8 3019 1 1 25 LEU C C 3.943 -17.497 -2.055 1.00 . A A . 25 LEU C 1 1 8 3020 1 1 25 LEU CA C 2.460 -17.134 -2.067 1.00 . A A . 25 LEU CA 1 1 8 3021 1 1 25 LEU CB C 2.120 -16.364 -3.343 1.00 . A A . 25 LEU CB 1 1 8 3022 1 1 25 LEU CD1 C 2.971 -18.329 -4.647 1.00 . A A . 25 LEU CD1 1 1 8 3023 1 1 25 LEU CD2 C 0.513 -18.097 -4.215 1.00 . A A . 25 LEU CD2 1 1 8 3024 1 1 25 LEU CG C 1.819 -17.334 -4.494 1.00 . A A . 25 LEU CG 1 1 8 3025 1 1 25 LEU H H 1.855 -15.395 -1.038 1.00 . A A . 25 LEU H 1 1 8 3026 1 1 25 LEU HA H 1.880 -18.033 -2.040 1.00 . A A . 25 LEU HA 1 1 8 3027 1 1 25 LEU HB2 H 1.254 -15.738 -3.163 1.00 . A A . 25 LEU HB2 1 1 8 3028 1 1 25 LEU HB3 H 2.959 -15.747 -3.609 1.00 . A A . 25 LEU HB3 1 1 8 3029 1 1 25 LEU HD11 H 3.912 -17.800 -4.606 1.00 . A A . 25 LEU HD11 1 1 8 3030 1 1 25 LEU HD12 H 2.884 -18.836 -5.595 1.00 . A A . 25 LEU HD12 1 1 8 3031 1 1 25 LEU HD13 H 2.931 -19.054 -3.847 1.00 . A A . 25 LEU HD13 1 1 8 3032 1 1 25 LEU HD21 H 0.006 -18.291 -5.148 1.00 . A A . 25 LEU HD21 1 1 8 3033 1 1 25 LEU HD22 H -0.127 -17.505 -3.577 1.00 . A A . 25 LEU HD22 1 1 8 3034 1 1 25 LEU HD23 H 0.735 -19.035 -3.727 1.00 . A A . 25 LEU HD23 1 1 8 3035 1 1 25 LEU HG H 1.714 -16.772 -5.411 1.00 . A A . 25 LEU HG 1 1 8 3036 1 1 25 LEU N N 2.126 -16.325 -0.908 1.00 . A A . 25 LEU N 1 1 8 3037 1 1 25 LEU O O 4.300 -18.659 -1.859 1.00 . A A . 25 LEU O 1 1 8 3038 1 1 26 NH2 HN1 H 4.545 -15.637 -2.413 1.00 . A A . 26 NH2 HN1 1 1 8 3039 1 1 26 NH2 HN2 H 5.791 -16.792 -2.250 1.00 . A A . 26 NH2 HN2 1 1 8 3040 1 1 26 NH2 N N 4.833 -16.565 -2.257 1.00 . A A . 26 NH2 N 1 1 9 3041 1 1 1 GLY C C 3.947 16.365 0.508 1.00 . A A . 1 GLY C 1 1 9 3042 1 1 1 GLY CA C 4.546 17.519 -0.289 1.00 . A A . 1 GLY CA 1 1 9 3043 1 1 1 GLY H1 H 3.022 18.766 0.391 1.00 . A A . 1 GLY H1 1 1 9 3044 1 1 1 GLY H2 H 4.284 19.582 -0.401 1.00 . A A . 1 GLY H2 1 1 9 3045 1 1 1 GLY H3 H 4.506 18.997 1.178 1.00 . A A . 1 GLY H3 1 1 9 3046 1 1 1 GLY HA2 H 4.253 17.434 -1.325 1.00 . A A . 1 GLY HA2 1 1 9 3047 1 1 1 GLY HA3 H 5.622 17.483 -0.214 1.00 . A A . 1 GLY HA3 1 1 9 3048 1 1 1 GLY N N 4.053 18.813 0.261 1.00 . A A . 1 GLY N 1 1 9 3049 1 1 1 GLY O O 3.118 15.611 -0.003 1.00 . A A . 1 GLY O 1 1 9 3050 1 1 2 VAL C C 2.349 15.071 2.521 1.00 . A A . 2 VAL C 1 1 9 3051 1 1 2 VAL CA C 3.869 15.167 2.619 1.00 . A A . 2 VAL CA 1 1 9 3052 1 1 2 VAL CB C 4.273 15.431 4.070 1.00 . A A . 2 VAL CB 1 1 9 3053 1 1 2 VAL CG1 C 5.781 15.228 4.225 1.00 . A A . 2 VAL CG1 1 1 9 3054 1 1 2 VAL CG2 C 3.912 16.871 4.444 1.00 . A A . 2 VAL CG2 1 1 9 3055 1 1 2 VAL H H 5.032 16.865 2.114 1.00 . A A . 2 VAL H 1 1 9 3056 1 1 2 VAL HA H 4.300 14.230 2.302 1.00 . A A . 2 VAL HA 1 1 9 3057 1 1 2 VAL HB H 3.749 14.745 4.720 1.00 . A A . 2 VAL HB 1 1 9 3058 1 1 2 VAL HG11 H 6.298 15.739 3.426 1.00 . A A . 2 VAL HG11 1 1 9 3059 1 1 2 VAL HG12 H 6.009 14.173 4.184 1.00 . A A . 2 VAL HG12 1 1 9 3060 1 1 2 VAL HG13 H 6.101 15.629 5.175 1.00 . A A . 2 VAL HG13 1 1 9 3061 1 1 2 VAL HG21 H 4.568 17.552 3.924 1.00 . A A . 2 VAL HG21 1 1 9 3062 1 1 2 VAL HG22 H 4.024 17.004 5.509 1.00 . A A . 2 VAL HG22 1 1 9 3063 1 1 2 VAL HG23 H 2.889 17.069 4.162 1.00 . A A . 2 VAL HG23 1 1 9 3064 1 1 2 VAL N N 4.371 16.234 1.761 1.00 . A A . 2 VAL N 1 1 9 3065 1 1 2 VAL O O 1.773 13.998 2.696 1.00 . A A . 2 VAL O 1 1 9 3066 1 1 3 VAL C C -0.216 15.272 1.037 1.00 . A A . 3 VAL C 1 1 9 3067 1 1 3 VAL CA C 0.256 16.233 2.123 1.00 . A A . 3 VAL CA 1 1 9 3068 1 1 3 VAL CB C -0.209 17.652 1.790 1.00 . A A . 3 VAL CB 1 1 9 3069 1 1 3 VAL CG1 C 0.245 18.021 0.377 1.00 . A A . 3 VAL CG1 1 1 9 3070 1 1 3 VAL CG2 C -1.736 17.719 1.868 1.00 . A A . 3 VAL CG2 1 1 9 3071 1 1 3 VAL H H 2.220 17.026 2.113 1.00 . A A . 3 VAL H 1 1 9 3072 1 1 3 VAL HA H -0.180 15.937 3.066 1.00 . A A . 3 VAL HA 1 1 9 3073 1 1 3 VAL HB H 0.220 18.346 2.499 1.00 . A A . 3 VAL HB 1 1 9 3074 1 1 3 VAL HG11 H -0.366 17.499 -0.345 1.00 . A A . 3 VAL HG11 1 1 9 3075 1 1 3 VAL HG12 H 1.279 17.738 0.246 1.00 . A A . 3 VAL HG12 1 1 9 3076 1 1 3 VAL HG13 H 0.143 19.086 0.232 1.00 . A A . 3 VAL HG13 1 1 9 3077 1 1 3 VAL HG21 H -2.066 18.717 1.619 1.00 . A A . 3 VAL HG21 1 1 9 3078 1 1 3 VAL HG22 H -2.057 17.475 2.871 1.00 . A A . 3 VAL HG22 1 1 9 3079 1 1 3 VAL HG23 H -2.164 17.013 1.172 1.00 . A A . 3 VAL HG23 1 1 9 3080 1 1 3 VAL N N 1.708 16.200 2.242 1.00 . A A . 3 VAL N 1 1 9 3081 1 1 3 VAL O O -1.243 14.610 1.182 1.00 . A A . 3 VAL O 1 1 9 3082 1 1 4 ASP C C 0.474 12.865 -0.794 1.00 . A A . 4 ASP C 1 1 9 3083 1 1 4 ASP CA C 0.192 14.319 -1.160 1.00 . A A . 4 ASP CA 1 1 9 3084 1 1 4 ASP CB C 0.995 14.700 -2.405 1.00 . A A . 4 ASP CB 1 1 9 3085 1 1 4 ASP CG C 0.388 14.039 -3.638 1.00 . A A . 4 ASP CG 1 1 9 3086 1 1 4 ASP H H 1.350 15.754 -0.114 1.00 . A A . 4 ASP H 1 1 9 3087 1 1 4 ASP HA H -0.859 14.428 -1.376 1.00 . A A . 4 ASP HA 1 1 9 3088 1 1 4 ASP HB2 H 0.975 15.775 -2.528 1.00 . A A . 4 ASP HB2 1 1 9 3089 1 1 4 ASP HB3 H 2.018 14.366 -2.288 1.00 . A A . 4 ASP HB3 1 1 9 3090 1 1 4 ASP N N 0.542 15.202 -0.053 1.00 . A A . 4 ASP N 1 1 9 3091 1 1 4 ASP O O -0.406 12.009 -0.892 1.00 . A A . 4 ASP O 1 1 9 3092 1 1 4 ASP OD1 O -0.633 13.386 -3.495 1.00 . A A . 4 ASP OD1 1 1 9 3093 1 1 4 ASP OD2 O 0.953 14.196 -4.708 1.00 . A A . 4 ASP OD2 1 1 9 3094 1 1 5 ILE C C 1.054 10.626 0.936 1.00 . A A . 5 ILE C 1 1 9 3095 1 1 5 ILE CA C 2.090 11.237 0.001 1.00 . A A . 5 ILE CA 1 1 9 3096 1 1 5 ILE CB C 3.457 11.253 0.688 1.00 . A A . 5 ILE CB 1 1 9 3097 1 1 5 ILE CD1 C 5.832 11.990 0.435 1.00 . A A . 5 ILE CD1 1 1 9 3098 1 1 5 ILE CG1 C 4.521 11.720 -0.307 1.00 . A A . 5 ILE CG1 1 1 9 3099 1 1 5 ILE CG2 C 3.800 9.844 1.177 1.00 . A A . 5 ILE CG2 1 1 9 3100 1 1 5 ILE H H 2.365 13.314 -0.319 1.00 . A A . 5 ILE H 1 1 9 3101 1 1 5 ILE HA H 2.155 10.634 -0.888 1.00 . A A . 5 ILE HA 1 1 9 3102 1 1 5 ILE HB H 3.428 11.929 1.531 1.00 . A A . 5 ILE HB 1 1 9 3103 1 1 5 ILE HD11 H 5.734 12.892 1.021 1.00 . A A . 5 ILE HD11 1 1 9 3104 1 1 5 ILE HD12 H 6.632 12.111 -0.280 1.00 . A A . 5 ILE HD12 1 1 9 3105 1 1 5 ILE HD13 H 6.054 11.159 1.087 1.00 . A A . 5 ILE HD13 1 1 9 3106 1 1 5 ILE HG12 H 4.681 10.949 -1.051 1.00 . A A . 5 ILE HG12 1 1 9 3107 1 1 5 ILE HG13 H 4.189 12.628 -0.791 1.00 . A A . 5 ILE HG13 1 1 9 3108 1 1 5 ILE HG21 H 4.846 9.798 1.440 1.00 . A A . 5 ILE HG21 1 1 9 3109 1 1 5 ILE HG22 H 3.594 9.131 0.393 1.00 . A A . 5 ILE HG22 1 1 9 3110 1 1 5 ILE HG23 H 3.200 9.608 2.044 1.00 . A A . 5 ILE HG23 1 1 9 3111 1 1 5 ILE N N 1.705 12.592 -0.376 1.00 . A A . 5 ILE N 1 1 9 3112 1 1 5 ILE O O 0.880 9.408 0.980 1.00 . A A . 5 ILE O 1 1 9 3113 1 1 6 LEU C C -1.881 10.533 1.862 1.00 . A A . 6 LEU C 1 1 9 3114 1 1 6 LEU CA C -0.649 11.028 2.616 1.00 . A A . 6 LEU CA 1 1 9 3115 1 1 6 LEU CB C -1.036 12.181 3.550 1.00 . A A . 6 LEU CB 1 1 9 3116 1 1 6 LEU CD1 C -0.078 13.560 5.410 1.00 . A A . 6 LEU CD1 1 1 9 3117 1 1 6 LEU CD2 C -0.755 11.193 5.838 1.00 . A A . 6 LEU CD2 1 1 9 3118 1 1 6 LEU CG C -0.154 12.155 4.806 1.00 . A A . 6 LEU CG 1 1 9 3119 1 1 6 LEU H H 0.553 12.439 1.602 1.00 . A A . 6 LEU H 1 1 9 3120 1 1 6 LEU HA H -0.248 10.216 3.204 1.00 . A A . 6 LEU HA 1 1 9 3121 1 1 6 LEU HB2 H -0.896 13.120 3.031 1.00 . A A . 6 LEU HB2 1 1 9 3122 1 1 6 LEU HB3 H -2.073 12.080 3.837 1.00 . A A . 6 LEU HB3 1 1 9 3123 1 1 6 LEU HD11 H 0.538 13.539 6.297 1.00 . A A . 6 LEU HD11 1 1 9 3124 1 1 6 LEU HD12 H -1.072 13.894 5.670 1.00 . A A . 6 LEU HD12 1 1 9 3125 1 1 6 LEU HD13 H 0.352 14.239 4.688 1.00 . A A . 6 LEU HD13 1 1 9 3126 1 1 6 LEU HD21 H -0.001 10.932 6.567 1.00 . A A . 6 LEU HD21 1 1 9 3127 1 1 6 LEU HD22 H -1.100 10.299 5.342 1.00 . A A . 6 LEU HD22 1 1 9 3128 1 1 6 LEU HD23 H -1.585 11.672 6.337 1.00 . A A . 6 LEU HD23 1 1 9 3129 1 1 6 LEU HG H 0.841 11.826 4.541 1.00 . A A . 6 LEU HG 1 1 9 3130 1 1 6 LEU N N 0.370 11.483 1.681 1.00 . A A . 6 LEU N 1 1 9 3131 1 1 6 LEU O O -2.351 9.416 2.085 1.00 . A A . 6 LEU O 1 1 9 3132 1 1 7 LYS C C -3.407 9.617 -0.422 1.00 . A A . 7 LYS C 1 1 9 3133 1 1 7 LYS CA C -3.584 11.004 0.195 1.00 . A A . 7 LYS CA 1 1 9 3134 1 1 7 LYS CB C -3.870 12.038 -0.918 1.00 . A A . 7 LYS CB 1 1 9 3135 1 1 7 LYS CD C -4.960 13.696 0.617 1.00 . A A . 7 LYS CD 1 1 9 3136 1 1 7 LYS CE C -6.056 14.763 0.653 1.00 . A A . 7 LYS CE 1 1 9 3137 1 1 7 LYS CG C -5.169 12.789 -0.601 1.00 . A A . 7 LYS CG 1 1 9 3138 1 1 7 LYS H H -1.984 12.246 0.843 1.00 . A A . 7 LYS H 1 1 9 3139 1 1 7 LYS HA H -4.432 10.972 0.862 1.00 . A A . 7 LYS HA 1 1 9 3140 1 1 7 LYS HB2 H -3.060 12.746 -0.994 1.00 . A A . 7 LYS HB2 1 1 9 3141 1 1 7 LYS HB3 H -3.981 11.528 -1.860 1.00 . A A . 7 LYS HB3 1 1 9 3142 1 1 7 LYS HD2 H -5.005 13.103 1.519 1.00 . A A . 7 LYS HD2 1 1 9 3143 1 1 7 LYS HD3 H -3.996 14.177 0.550 1.00 . A A . 7 LYS HD3 1 1 9 3144 1 1 7 LYS HE2 H -6.131 15.168 1.652 1.00 . A A . 7 LYS HE2 1 1 9 3145 1 1 7 LYS HE3 H -5.810 15.556 -0.038 1.00 . A A . 7 LYS HE3 1 1 9 3146 1 1 7 LYS HG2 H -5.448 13.387 -1.451 1.00 . A A . 7 LYS HG2 1 1 9 3147 1 1 7 LYS HG3 H -5.955 12.080 -0.389 1.00 . A A . 7 LYS HG3 1 1 9 3148 1 1 7 LYS HZ1 H -7.295 13.118 0.347 1.00 . A A . 7 LYS HZ1 1 1 9 3149 1 1 7 LYS HZ2 H -7.584 14.410 -0.717 1.00 . A A . 7 LYS HZ2 1 1 9 3150 1 1 7 LYS HZ3 H -8.108 14.502 0.896 1.00 . A A . 7 LYS HZ3 1 1 9 3151 1 1 7 LYS N N -2.401 11.372 0.973 1.00 . A A . 7 LYS N 1 1 9 3152 1 1 7 LYS NZ N -7.359 14.153 0.265 1.00 . A A . 7 LYS NZ 1 1 9 3153 1 1 7 LYS O O -4.381 8.892 -0.625 1.00 . A A . 7 LYS O 1 1 9 3154 1 1 8 GLY C C -2.041 6.833 -0.287 1.00 . A A . 8 GLY C 1 1 9 3155 1 1 8 GLY CA C -1.880 7.950 -1.313 1.00 . A A . 8 GLY CA 1 1 9 3156 1 1 8 GLY H H -1.422 9.867 -0.536 1.00 . A A . 8 GLY H 1 1 9 3157 1 1 8 GLY HA2 H -2.561 7.781 -2.134 1.00 . A A . 8 GLY HA2 1 1 9 3158 1 1 8 GLY HA3 H -0.866 7.943 -1.686 1.00 . A A . 8 GLY HA3 1 1 9 3159 1 1 8 GLY N N -2.162 9.252 -0.719 1.00 . A A . 8 GLY N 1 1 9 3160 1 1 8 GLY O O -2.571 5.766 -0.596 1.00 . A A . 8 GLY O 1 1 9 3161 1 1 9 ALA C C -3.089 5.524 2.073 1.00 . A A . 9 ALA C 1 1 9 3162 1 1 9 ALA CA C -1.677 6.088 1.995 1.00 . A A . 9 ALA CA 1 1 9 3163 1 1 9 ALA CB C -1.299 6.718 3.338 1.00 . A A . 9 ALA CB 1 1 9 3164 1 1 9 ALA H H -1.165 7.952 1.123 1.00 . A A . 9 ALA H 1 1 9 3165 1 1 9 ALA HA H -0.994 5.282 1.783 1.00 . A A . 9 ALA HA 1 1 9 3166 1 1 9 ALA HB1 H -0.405 7.312 3.217 1.00 . A A . 9 ALA HB1 1 1 9 3167 1 1 9 ALA HB2 H -1.117 5.937 4.062 1.00 . A A . 9 ALA HB2 1 1 9 3168 1 1 9 ALA HB3 H -2.106 7.347 3.681 1.00 . A A . 9 ALA HB3 1 1 9 3169 1 1 9 ALA N N -1.579 7.084 0.933 1.00 . A A . 9 ALA N 1 1 9 3170 1 1 9 ALA O O -3.281 4.363 2.435 1.00 . A A . 9 ALA O 1 1 9 3171 1 1 10 ALA C C -5.643 4.697 0.851 1.00 . A A . 10 ALA C 1 1 9 3172 1 1 10 ALA CA C -5.457 5.902 1.765 1.00 . A A . 10 ALA CA 1 1 9 3173 1 1 10 ALA CB C -6.383 7.035 1.317 1.00 . A A . 10 ALA CB 1 1 9 3174 1 1 10 ALA H H -3.863 7.260 1.446 1.00 . A A . 10 ALA H 1 1 9 3175 1 1 10 ALA HA H -5.711 5.621 2.775 1.00 . A A . 10 ALA HA 1 1 9 3176 1 1 10 ALA HB1 H -6.282 7.871 1.993 1.00 . A A . 10 ALA HB1 1 1 9 3177 1 1 10 ALA HB2 H -7.406 6.687 1.324 1.00 . A A . 10 ALA HB2 1 1 9 3178 1 1 10 ALA HB3 H -6.115 7.346 0.319 1.00 . A A . 10 ALA HB3 1 1 9 3179 1 1 10 ALA N N -4.071 6.346 1.730 1.00 . A A . 10 ALA N 1 1 9 3180 1 1 10 ALA O O -6.168 3.669 1.267 1.00 . A A . 10 ALA O 1 1 9 3181 1 1 11 LYS C C -4.223 2.731 -1.193 1.00 . A A . 11 LYS C 1 1 9 3182 1 1 11 LYS CA C -5.325 3.759 -1.366 1.00 . A A . 11 LYS CA 1 1 9 3183 1 1 11 LYS CB C -5.268 4.323 -2.763 1.00 . A A . 11 LYS CB 1 1 9 3184 1 1 11 LYS CD C -6.236 3.691 -4.940 1.00 . A A . 11 LYS CD 1 1 9 3185 1 1 11 LYS CE C -6.353 2.607 -6.012 1.00 . A A . 11 LYS CE 1 1 9 3186 1 1 11 LYS CG C -5.388 3.196 -3.792 1.00 . A A . 11 LYS CG 1 1 9 3187 1 1 11 LYS H H -4.802 5.676 -0.669 1.00 . A A . 11 LYS H 1 1 9 3188 1 1 11 LYS HA H -6.267 3.274 -1.232 1.00 . A A . 11 LYS HA 1 1 9 3189 1 1 11 LYS HB2 H -6.074 5.032 -2.895 1.00 . A A . 11 LYS HB2 1 1 9 3190 1 1 11 LYS HB3 H -4.338 4.817 -2.888 1.00 . A A . 11 LYS HB3 1 1 9 3191 1 1 11 LYS HD2 H -7.214 3.945 -4.564 1.00 . A A . 11 LYS HD2 1 1 9 3192 1 1 11 LYS HD3 H -5.771 4.563 -5.354 1.00 . A A . 11 LYS HD3 1 1 9 3193 1 1 11 LYS HE2 H -5.389 2.449 -6.473 1.00 . A A . 11 LYS HE2 1 1 9 3194 1 1 11 LYS HE3 H -6.689 1.685 -5.558 1.00 . A A . 11 LYS HE3 1 1 9 3195 1 1 11 LYS HG2 H -4.407 2.925 -4.154 1.00 . A A . 11 LYS HG2 1 1 9 3196 1 1 11 LYS HG3 H -5.860 2.339 -3.352 1.00 . A A . 11 LYS HG3 1 1 9 3197 1 1 11 LYS HZ1 H -7.815 3.902 -6.732 1.00 . A A . 11 LYS HZ1 1 1 9 3198 1 1 11 LYS HZ2 H -8.037 2.282 -7.193 1.00 . A A . 11 LYS HZ2 1 1 9 3199 1 1 11 LYS HZ3 H -6.837 3.225 -7.941 1.00 . A A . 11 LYS HZ3 1 1 9 3200 1 1 11 LYS N N -5.209 4.835 -0.395 1.00 . A A . 11 LYS N 1 1 9 3201 1 1 11 LYS NZ N -7.335 3.036 -7.047 1.00 . A A . 11 LYS NZ 1 1 9 3202 1 1 11 LYS O O -4.393 1.569 -1.565 1.00 . A A . 11 LYS O 1 1 9 3203 1 1 12 ASP C C -2.538 0.917 0.146 1.00 . A A . 12 ASP C 1 1 9 3204 1 1 12 ASP CA C -1.982 2.228 -0.394 1.00 . A A . 12 ASP CA 1 1 9 3205 1 1 12 ASP CB C -0.991 2.822 0.608 1.00 . A A . 12 ASP CB 1 1 9 3206 1 1 12 ASP CG C 0.106 1.809 0.918 1.00 . A A . 12 ASP CG 1 1 9 3207 1 1 12 ASP H H -3.018 4.090 -0.348 1.00 . A A . 12 ASP H 1 1 9 3208 1 1 12 ASP HA H -1.476 2.042 -1.329 1.00 . A A . 12 ASP HA 1 1 9 3209 1 1 12 ASP HB2 H -0.547 3.712 0.187 1.00 . A A . 12 ASP HB2 1 1 9 3210 1 1 12 ASP HB3 H -1.512 3.074 1.519 1.00 . A A . 12 ASP HB3 1 1 9 3211 1 1 12 ASP N N -3.095 3.153 -0.622 1.00 . A A . 12 ASP N 1 1 9 3212 1 1 12 ASP O O -1.832 -0.083 0.278 1.00 . A A . 12 ASP O 1 1 9 3213 1 1 12 ASP OD1 O 0.356 0.960 0.078 1.00 . A A . 12 ASP OD1 1 1 9 3214 1 1 12 ASP OD2 O 0.679 1.896 1.992 1.00 . A A . 12 ASP OD2 1 1 9 3215 1 1 13 ILE C C -4.387 -1.372 -0.019 1.00 . A A . 13 ILE C 1 1 9 3216 1 1 13 ILE CA C -4.570 -0.190 0.924 1.00 . A A . 13 ILE CA 1 1 9 3217 1 1 13 ILE CB C -6.050 0.199 0.949 1.00 . A A . 13 ILE CB 1 1 9 3218 1 1 13 ILE CD1 C -7.704 1.730 2.012 1.00 . A A . 13 ILE CD1 1 1 9 3219 1 1 13 ILE CG1 C -6.345 1.048 2.182 1.00 . A A . 13 ILE CG1 1 1 9 3220 1 1 13 ILE CG2 C -6.933 -1.045 0.960 1.00 . A A . 13 ILE CG2 1 1 9 3221 1 1 13 ILE H H -4.315 1.792 0.276 1.00 . A A . 13 ILE H 1 1 9 3222 1 1 13 ILE HA H -4.241 -0.447 1.918 1.00 . A A . 13 ILE HA 1 1 9 3223 1 1 13 ILE HB H -6.270 0.775 0.062 1.00 . A A . 13 ILE HB 1 1 9 3224 1 1 13 ILE HD11 H -8.488 1.020 2.225 1.00 . A A . 13 ILE HD11 1 1 9 3225 1 1 13 ILE HD12 H -7.808 2.085 0.998 1.00 . A A . 13 ILE HD12 1 1 9 3226 1 1 13 ILE HD13 H -7.776 2.562 2.694 1.00 . A A . 13 ILE HD13 1 1 9 3227 1 1 13 ILE HG12 H -6.369 0.414 3.052 1.00 . A A . 13 ILE HG12 1 1 9 3228 1 1 13 ILE HG13 H -5.575 1.798 2.301 1.00 . A A . 13 ILE HG13 1 1 9 3229 1 1 13 ILE HG21 H -6.516 -1.775 1.635 1.00 . A A . 13 ILE HG21 1 1 9 3230 1 1 13 ILE HG22 H -6.982 -1.456 -0.037 1.00 . A A . 13 ILE HG22 1 1 9 3231 1 1 13 ILE HG23 H -7.927 -0.774 1.286 1.00 . A A . 13 ILE HG23 1 1 9 3232 1 1 13 ILE N N -3.832 0.954 0.426 1.00 . A A . 13 ILE N 1 1 9 3233 1 1 13 ILE O O -3.994 -2.462 0.393 1.00 . A A . 13 ILE O 1 1 9 3234 1 1 14 ALA C C -3.145 -2.769 -2.281 1.00 . A A . 14 ALA C 1 1 9 3235 1 1 14 ALA CA C -4.549 -2.174 -2.304 1.00 . A A . 14 ALA CA 1 1 9 3236 1 1 14 ALA CB C -4.838 -1.593 -3.689 1.00 . A A . 14 ALA CB 1 1 9 3237 1 1 14 ALA H H -4.991 -0.239 -1.549 1.00 . A A . 14 ALA H 1 1 9 3238 1 1 14 ALA HA H -5.265 -2.956 -2.098 1.00 . A A . 14 ALA HA 1 1 9 3239 1 1 14 ALA HB1 H -3.998 -0.994 -4.010 1.00 . A A . 14 ALA HB1 1 1 9 3240 1 1 14 ALA HB2 H -5.723 -0.976 -3.643 1.00 . A A . 14 ALA HB2 1 1 9 3241 1 1 14 ALA HB3 H -4.996 -2.397 -4.392 1.00 . A A . 14 ALA HB3 1 1 9 3242 1 1 14 ALA N N -4.679 -1.134 -1.290 1.00 . A A . 14 ALA N 1 1 9 3243 1 1 14 ALA O O -2.966 -3.971 -2.482 1.00 . A A . 14 ALA O 1 1 9 3244 1 1 15 GLY C C -0.486 -3.174 -0.727 1.00 . A A . 15 GLY C 1 1 9 3245 1 1 15 GLY CA C -0.766 -2.371 -1.994 1.00 . A A . 15 GLY CA 1 1 9 3246 1 1 15 GLY H H -2.356 -0.973 -1.889 1.00 . A A . 15 GLY H 1 1 9 3247 1 1 15 GLY HA2 H -0.567 -2.989 -2.858 1.00 . A A . 15 GLY HA2 1 1 9 3248 1 1 15 GLY HA3 H -0.114 -1.511 -2.016 1.00 . A A . 15 GLY HA3 1 1 9 3249 1 1 15 GLY N N -2.152 -1.920 -2.039 1.00 . A A . 15 GLY N 1 1 9 3250 1 1 15 GLY O O 0.356 -4.072 -0.724 1.00 . A A . 15 GLY O 1 1 9 3251 1 1 16 HIS C C -1.434 -4.992 1.525 1.00 . A A . 16 HIS C 1 1 9 3252 1 1 16 HIS CA C -0.998 -3.533 1.621 1.00 . A A . 16 HIS CA 1 1 9 3253 1 1 16 HIS CB C -1.799 -2.830 2.720 1.00 . A A . 16 HIS CB 1 1 9 3254 1 1 16 HIS CD2 C -2.566 -4.555 4.547 1.00 . A A . 16 HIS CD2 1 1 9 3255 1 1 16 HIS CE1 C -0.882 -4.358 5.896 1.00 . A A . 16 HIS CE1 1 1 9 3256 1 1 16 HIS CG C -1.718 -3.629 3.993 1.00 . A A . 16 HIS CG 1 1 9 3257 1 1 16 HIS H H -1.843 -2.112 0.293 1.00 . A A . 16 HIS H 1 1 9 3258 1 1 16 HIS HA H 0.049 -3.499 1.881 1.00 . A A . 16 HIS HA 1 1 9 3259 1 1 16 HIS HB2 H -1.391 -1.844 2.888 1.00 . A A . 16 HIS HB2 1 1 9 3260 1 1 16 HIS HB3 H -2.831 -2.745 2.415 1.00 . A A . 16 HIS HB3 1 1 9 3261 1 1 16 HIS HD2 H -3.501 -4.880 4.116 1.00 . A A . 16 HIS HD2 1 1 9 3262 1 1 16 HIS HE1 H -0.215 -4.485 6.735 1.00 . A A . 16 HIS HE1 1 1 9 3263 1 1 16 HIS HE2 H -2.425 -5.677 6.357 1.00 . A A . 16 HIS HE2 1 1 9 3264 1 1 16 HIS N N -1.189 -2.840 0.351 1.00 . A A . 16 HIS N 1 1 9 3265 1 1 16 HIS ND1 N -0.651 -3.519 4.869 1.00 . A A . 16 HIS ND1 1 1 9 3266 1 1 16 HIS NE2 N -2.035 -5.014 5.749 1.00 . A A . 16 HIS NE2 1 1 9 3267 1 1 16 HIS O O -0.692 -5.896 1.910 1.00 . A A . 16 HIS O 1 1 9 3268 1 1 17 LEU C C -2.308 -7.382 -0.093 1.00 . A A . 17 LEU C 1 1 9 3269 1 1 17 LEU CA C -3.156 -6.572 0.883 1.00 . A A . 17 LEU CA 1 1 9 3270 1 1 17 LEU CB C -4.620 -6.519 0.422 1.00 . A A . 17 LEU CB 1 1 9 3271 1 1 17 LEU CD1 C -4.600 -7.875 -1.713 1.00 . A A . 17 LEU CD1 1 1 9 3272 1 1 17 LEU CD2 C -6.041 -5.830 -1.524 1.00 . A A . 17 LEU CD2 1 1 9 3273 1 1 17 LEU CG C -4.704 -6.461 -1.114 1.00 . A A . 17 LEU CG 1 1 9 3274 1 1 17 LEU H H -3.195 -4.469 0.728 1.00 . A A . 17 LEU H 1 1 9 3275 1 1 17 LEU HA H -3.117 -7.052 1.850 1.00 . A A . 17 LEU HA 1 1 9 3276 1 1 17 LEU HB2 H -5.138 -7.391 0.779 1.00 . A A . 17 LEU HB2 1 1 9 3277 1 1 17 LEU HB3 H -5.087 -5.637 0.836 1.00 . A A . 17 LEU HB3 1 1 9 3278 1 1 17 LEU HD11 H -4.386 -8.591 -0.934 1.00 . A A . 17 LEU HD11 1 1 9 3279 1 1 17 LEU HD12 H -3.805 -7.896 -2.443 1.00 . A A . 17 LEU HD12 1 1 9 3280 1 1 17 LEU HD13 H -5.531 -8.137 -2.193 1.00 . A A . 17 LEU HD13 1 1 9 3281 1 1 17 LEU HD21 H -6.853 -6.458 -1.190 1.00 . A A . 17 LEU HD21 1 1 9 3282 1 1 17 LEU HD22 H -6.079 -5.735 -2.599 1.00 . A A . 17 LEU HD22 1 1 9 3283 1 1 17 LEU HD23 H -6.133 -4.853 -1.073 1.00 . A A . 17 LEU HD23 1 1 9 3284 1 1 17 LEU HG H -3.894 -5.855 -1.492 1.00 . A A . 17 LEU HG 1 1 9 3285 1 1 17 LEU N N -2.640 -5.220 1.015 1.00 . A A . 17 LEU N 1 1 9 3286 1 1 17 LEU O O -2.180 -8.597 0.046 1.00 . A A . 17 LEU O 1 1 9 3287 1 1 18 ALA C C 0.324 -7.996 -1.363 1.00 . A A . 18 ALA C 1 1 9 3288 1 1 18 ALA CA C -0.884 -7.386 -2.051 1.00 . A A . 18 ALA CA 1 1 9 3289 1 1 18 ALA CB C -0.425 -6.406 -3.131 1.00 . A A . 18 ALA CB 1 1 9 3290 1 1 18 ALA H H -1.847 -5.735 -1.137 1.00 . A A . 18 ALA H 1 1 9 3291 1 1 18 ALA HA H -1.452 -8.180 -2.514 1.00 . A A . 18 ALA HA 1 1 9 3292 1 1 18 ALA HB1 H 0.363 -6.856 -3.716 1.00 . A A . 18 ALA HB1 1 1 9 3293 1 1 18 ALA HB2 H -0.057 -5.504 -2.665 1.00 . A A . 18 ALA HB2 1 1 9 3294 1 1 18 ALA HB3 H -1.258 -6.164 -3.775 1.00 . A A . 18 ALA HB3 1 1 9 3295 1 1 18 ALA N N -1.721 -6.705 -1.074 1.00 . A A . 18 ALA N 1 1 9 3296 1 1 18 ALA O O 0.530 -9.204 -1.416 1.00 . A A . 18 ALA O 1 1 9 3297 1 1 19 SER C C 1.896 -8.798 0.917 1.00 . A A . 19 SER C 1 1 9 3298 1 1 19 SER CA C 2.288 -7.647 0.001 1.00 . A A . 19 SER CA 1 1 9 3299 1 1 19 SER CB C 2.921 -6.516 0.817 1.00 . A A . 19 SER CB 1 1 9 3300 1 1 19 SER H H 0.898 -6.202 -0.682 1.00 . A A . 19 SER H 1 1 9 3301 1 1 19 SER HA H 3.003 -8.007 -0.723 1.00 . A A . 19 SER HA 1 1 9 3302 1 1 19 SER HB2 H 3.992 -6.547 0.711 1.00 . A A . 19 SER HB2 1 1 9 3303 1 1 19 SER HB3 H 2.555 -5.565 0.453 1.00 . A A . 19 SER HB3 1 1 9 3304 1 1 19 SER HG H 3.359 -6.996 2.651 1.00 . A A . 19 SER HG 1 1 9 3305 1 1 19 SER N N 1.113 -7.157 -0.703 1.00 . A A . 19 SER N 1 1 9 3306 1 1 19 SER O O 2.626 -9.779 1.048 1.00 . A A . 19 SER O 1 1 9 3307 1 1 19 SER OG O 2.582 -6.674 2.188 1.00 . A A . 19 SER OG 1 1 9 3308 1 1 20 LYS C C 0.028 -11.005 1.644 1.00 . A A . 20 LYS C 1 1 9 3309 1 1 20 LYS CA C 0.235 -9.711 2.426 1.00 . A A . 20 LYS CA 1 1 9 3310 1 1 20 LYS CB C -1.088 -9.254 3.058 1.00 . A A . 20 LYS CB 1 1 9 3311 1 1 20 LYS CD C -2.167 -8.355 5.136 1.00 . A A . 20 LYS CD 1 1 9 3312 1 1 20 LYS CE C -2.962 -9.539 5.693 1.00 . A A . 20 LYS CE 1 1 9 3313 1 1 20 LYS CG C -0.855 -8.856 4.519 1.00 . A A . 20 LYS CG 1 1 9 3314 1 1 20 LYS H H 0.184 -7.872 1.388 1.00 . A A . 20 LYS H 1 1 9 3315 1 1 20 LYS HA H 0.961 -9.881 3.204 1.00 . A A . 20 LYS HA 1 1 9 3316 1 1 20 LYS HB2 H -1.463 -8.403 2.512 1.00 . A A . 20 LYS HB2 1 1 9 3317 1 1 20 LYS HB3 H -1.813 -10.052 3.015 1.00 . A A . 20 LYS HB3 1 1 9 3318 1 1 20 LYS HD2 H -1.945 -7.663 5.935 1.00 . A A . 20 LYS HD2 1 1 9 3319 1 1 20 LYS HD3 H -2.754 -7.854 4.381 1.00 . A A . 20 LYS HD3 1 1 9 3320 1 1 20 LYS HE2 H -3.214 -10.215 4.889 1.00 . A A . 20 LYS HE2 1 1 9 3321 1 1 20 LYS HE3 H -2.366 -10.061 6.428 1.00 . A A . 20 LYS HE3 1 1 9 3322 1 1 20 LYS HG2 H -0.498 -9.713 5.072 1.00 . A A . 20 LYS HG2 1 1 9 3323 1 1 20 LYS HG3 H -0.117 -8.069 4.562 1.00 . A A . 20 LYS HG3 1 1 9 3324 1 1 20 LYS HZ1 H -4.893 -9.822 6.421 1.00 . A A . 20 LYS HZ1 1 1 9 3325 1 1 20 LYS HZ2 H -4.624 -8.286 5.747 1.00 . A A . 20 LYS HZ2 1 1 9 3326 1 1 20 LYS HZ3 H -3.994 -8.668 7.278 1.00 . A A . 20 LYS HZ3 1 1 9 3327 1 1 20 LYS N N 0.728 -8.674 1.538 1.00 . A A . 20 LYS N 1 1 9 3328 1 1 20 LYS NZ N -4.212 -9.042 6.333 1.00 . A A . 20 LYS NZ 1 1 9 3329 1 1 20 LYS O O 0.496 -12.070 2.049 1.00 . A A . 20 LYS O 1 1 9 3330 1 1 21 VAL C C 0.325 -12.501 -1.057 1.00 . A A . 21 VAL C 1 1 9 3331 1 1 21 VAL CA C -0.933 -12.064 -0.317 1.00 . A A . 21 VAL CA 1 1 9 3332 1 1 21 VAL CB C -2.039 -11.760 -1.322 1.00 . A A . 21 VAL CB 1 1 9 3333 1 1 21 VAL CG1 C -2.303 -13.011 -2.155 1.00 . A A . 21 VAL CG1 1 1 9 3334 1 1 21 VAL CG2 C -3.318 -11.369 -0.575 1.00 . A A . 21 VAL CG2 1 1 9 3335 1 1 21 VAL H H -1.018 -10.027 0.247 1.00 . A A . 21 VAL H 1 1 9 3336 1 1 21 VAL HA H -1.256 -12.871 0.306 1.00 . A A . 21 VAL HA 1 1 9 3337 1 1 21 VAL HB H -1.731 -10.951 -1.969 1.00 . A A . 21 VAL HB 1 1 9 3338 1 1 21 VAL HG11 H -3.209 -12.878 -2.725 1.00 . A A . 21 VAL HG11 1 1 9 3339 1 1 21 VAL HG12 H -2.411 -13.862 -1.498 1.00 . A A . 21 VAL HG12 1 1 9 3340 1 1 21 VAL HG13 H -1.475 -13.176 -2.827 1.00 . A A . 21 VAL HG13 1 1 9 3341 1 1 21 VAL HG21 H -3.798 -12.257 -0.192 1.00 . A A . 21 VAL HG21 1 1 9 3342 1 1 21 VAL HG22 H -3.989 -10.861 -1.252 1.00 . A A . 21 VAL HG22 1 1 9 3343 1 1 21 VAL HG23 H -3.070 -10.712 0.246 1.00 . A A . 21 VAL HG23 1 1 9 3344 1 1 21 VAL N N -0.673 -10.901 0.519 1.00 . A A . 21 VAL N 1 1 9 3345 1 1 21 VAL O O 0.593 -13.695 -1.191 1.00 . A A . 21 VAL O 1 1 9 3346 1 1 22 MET C C 3.258 -12.670 -1.385 1.00 . A A . 22 MET C 1 1 9 3347 1 1 22 MET CA C 2.321 -11.843 -2.261 1.00 . A A . 22 MET CA 1 1 9 3348 1 1 22 MET CB C 3.018 -10.549 -2.692 1.00 . A A . 22 MET CB 1 1 9 3349 1 1 22 MET CE C 3.126 -11.119 -6.768 1.00 . A A . 22 MET CE 1 1 9 3350 1 1 22 MET CG C 2.816 -10.319 -4.193 1.00 . A A . 22 MET CG 1 1 9 3351 1 1 22 MET H H 0.833 -10.597 -1.400 1.00 . A A . 22 MET H 1 1 9 3352 1 1 22 MET HA H 2.071 -12.412 -3.139 1.00 . A A . 22 MET HA 1 1 9 3353 1 1 22 MET HB2 H 2.596 -9.726 -2.147 1.00 . A A . 22 MET HB2 1 1 9 3354 1 1 22 MET HB3 H 4.075 -10.615 -2.481 1.00 . A A . 22 MET HB3 1 1 9 3355 1 1 22 MET HE1 H 3.879 -11.360 -7.504 1.00 . A A . 22 MET HE1 1 1 9 3356 1 1 22 MET HE2 H 2.924 -10.060 -6.796 1.00 . A A . 22 MET HE2 1 1 9 3357 1 1 22 MET HE3 H 2.216 -11.663 -6.985 1.00 . A A . 22 MET HE3 1 1 9 3358 1 1 22 MET HG2 H 1.762 -10.387 -4.429 1.00 . A A . 22 MET HG2 1 1 9 3359 1 1 22 MET HG3 H 3.186 -9.338 -4.460 1.00 . A A . 22 MET HG3 1 1 9 3360 1 1 22 MET N N 1.094 -11.532 -1.536 1.00 . A A . 22 MET N 1 1 9 3361 1 1 22 MET O O 3.749 -13.719 -1.800 1.00 . A A . 22 MET O 1 1 9 3362 1 1 22 MET SD S 3.723 -11.579 -5.123 1.00 . A A . 22 MET SD 1 1 9 3363 1 1 23 ASN C C 3.750 -14.210 1.196 1.00 . A A . 23 ASN C 1 1 9 3364 1 1 23 ASN CA C 4.373 -12.888 0.760 1.00 . A A . 23 ASN CA 1 1 9 3365 1 1 23 ASN CB C 4.639 -12.014 1.983 1.00 . A A . 23 ASN CB 1 1 9 3366 1 1 23 ASN CG C 5.951 -12.422 2.647 1.00 . A A . 23 ASN CG 1 1 9 3367 1 1 23 ASN H H 3.078 -11.347 0.105 1.00 . A A . 23 ASN H 1 1 9 3368 1 1 23 ASN HA H 5.307 -13.087 0.273 1.00 . A A . 23 ASN HA 1 1 9 3369 1 1 23 ASN HB2 H 4.696 -10.979 1.679 1.00 . A A . 23 ASN HB2 1 1 9 3370 1 1 23 ASN HB3 H 3.835 -12.137 2.682 1.00 . A A . 23 ASN HB3 1 1 9 3371 1 1 23 ASN HD21 H 5.068 -13.476 4.079 1.00 . A A . 23 ASN HD21 1 1 9 3372 1 1 23 ASN HD22 H 6.763 -13.443 4.143 1.00 . A A . 23 ASN HD22 1 1 9 3373 1 1 23 ASN N N 3.497 -12.188 -0.170 1.00 . A A . 23 ASN N 1 1 9 3374 1 1 23 ASN ND2 N 5.926 -13.177 3.711 1.00 . A A . 23 ASN ND2 1 1 9 3375 1 1 23 ASN O O 4.435 -15.227 1.297 1.00 . A A . 23 ASN O 1 1 9 3376 1 1 23 ASN OD1 O 7.027 -12.043 2.183 1.00 . A A . 23 ASN OD1 1 1 9 3377 1 1 24 LYS C C 1.851 -16.480 0.821 1.00 . A A . 24 LYS C 1 1 9 3378 1 1 24 LYS CA C 1.740 -15.389 1.881 1.00 . A A . 24 LYS CA 1 1 9 3379 1 1 24 LYS CB C 0.264 -15.066 2.135 1.00 . A A . 24 LYS CB 1 1 9 3380 1 1 24 LYS CD C -1.288 -16.943 1.515 1.00 . A A . 24 LYS CD 1 1 9 3381 1 1 24 LYS CE C -1.881 -18.271 1.989 1.00 . A A . 24 LYS CE 1 1 9 3382 1 1 24 LYS CG C -0.469 -16.317 2.648 1.00 . A A . 24 LYS CG 1 1 9 3383 1 1 24 LYS H H 1.951 -13.347 1.359 1.00 . A A . 24 LYS H 1 1 9 3384 1 1 24 LYS HA H 2.181 -15.747 2.799 1.00 . A A . 24 LYS HA 1 1 9 3385 1 1 24 LYS HB2 H 0.195 -14.280 2.874 1.00 . A A . 24 LYS HB2 1 1 9 3386 1 1 24 LYS HB3 H -0.192 -14.733 1.215 1.00 . A A . 24 LYS HB3 1 1 9 3387 1 1 24 LYS HD2 H -2.085 -16.271 1.235 1.00 . A A . 24 LYS HD2 1 1 9 3388 1 1 24 LYS HD3 H -0.649 -17.120 0.663 1.00 . A A . 24 LYS HD3 1 1 9 3389 1 1 24 LYS HE2 H -2.485 -18.696 1.201 1.00 . A A . 24 LYS HE2 1 1 9 3390 1 1 24 LYS HE3 H -1.082 -18.954 2.238 1.00 . A A . 24 LYS HE3 1 1 9 3391 1 1 24 LYS HG2 H 0.251 -17.037 3.012 1.00 . A A . 24 LYS HG2 1 1 9 3392 1 1 24 LYS HG3 H -1.133 -16.039 3.455 1.00 . A A . 24 LYS HG3 1 1 9 3393 1 1 24 LYS HZ1 H -2.133 -18.054 4.044 1.00 . A A . 24 LYS HZ1 1 1 9 3394 1 1 24 LYS HZ2 H -3.451 -18.780 3.257 1.00 . A A . 24 LYS HZ2 1 1 9 3395 1 1 24 LYS HZ3 H -3.189 -17.107 3.115 1.00 . A A . 24 LYS HZ3 1 1 9 3396 1 1 24 LYS N N 2.446 -14.187 1.455 1.00 . A A . 24 LYS N 1 1 9 3397 1 1 24 LYS NZ N -2.728 -18.035 3.192 1.00 . A A . 24 LYS NZ 1 1 9 3398 1 1 24 LYS O O 2.130 -17.638 1.134 1.00 . A A . 24 LYS O 1 1 9 3399 1 1 25 LEU C C 3.133 -17.574 -1.691 1.00 . A A . 25 LEU C 1 1 9 3400 1 1 25 LEU CA C 1.707 -17.054 -1.532 1.00 . A A . 25 LEU CA 1 1 9 3401 1 1 25 LEU CB C 1.249 -16.377 -2.823 1.00 . A A . 25 LEU CB 1 1 9 3402 1 1 25 LEU CD1 C 1.701 -18.540 -4.007 1.00 . A A . 25 LEU CD1 1 1 9 3403 1 1 25 LEU CD2 C -0.629 -17.998 -3.262 1.00 . A A . 25 LEU CD2 1 1 9 3404 1 1 25 LEU CG C 0.685 -17.415 -3.806 1.00 . A A . 25 LEU CG 1 1 9 3405 1 1 25 LEU H H 1.412 -15.171 -0.627 1.00 . A A . 25 LEU H 1 1 9 3406 1 1 25 LEU HA H 1.056 -17.877 -1.323 1.00 . A A . 25 LEU HA 1 1 9 3407 1 1 25 LEU HB2 H 0.483 -15.647 -2.592 1.00 . A A . 25 LEU HB2 1 1 9 3408 1 1 25 LEU HB3 H 2.091 -15.883 -3.273 1.00 . A A . 25 LEU HB3 1 1 9 3409 1 1 25 LEU HD11 H 1.423 -19.126 -4.871 1.00 . A A . 25 LEU HD11 1 1 9 3410 1 1 25 LEU HD12 H 1.716 -19.176 -3.134 1.00 . A A . 25 LEU HD12 1 1 9 3411 1 1 25 LEU HD13 H 2.683 -18.117 -4.163 1.00 . A A . 25 LEU HD13 1 1 9 3412 1 1 25 LEU HD21 H -1.106 -17.281 -2.610 1.00 . A A . 25 LEU HD21 1 1 9 3413 1 1 25 LEU HD22 H -0.426 -18.905 -2.709 1.00 . A A . 25 LEU HD22 1 1 9 3414 1 1 25 LEU HD23 H -1.288 -18.224 -4.087 1.00 . A A . 25 LEU HD23 1 1 9 3415 1 1 25 LEU HG H 0.496 -16.935 -4.755 1.00 . A A . 25 LEU HG 1 1 9 3416 1 1 25 LEU N N 1.631 -16.104 -0.434 1.00 . A A . 25 LEU N 1 1 9 3417 1 1 25 LEU O O 3.394 -18.758 -1.479 1.00 . A A . 25 LEU O 1 1 9 3418 1 1 26 NH2 HN1 H 3.867 -15.805 -2.225 1.00 . A A . 26 NH2 HN1 1 1 9 3419 1 1 26 NH2 HN2 H 5.000 -17.079 -2.161 1.00 . A A . 26 NH2 HN2 1 1 9 3420 1 1 26 NH2 N N 4.078 -16.752 -2.056 1.00 . A A . 26 NH2 N 1 1 10 3421 1 1 1 GLY C C 4.101 16.706 0.107 1.00 . A A . 1 GLY C 1 1 10 3422 1 1 1 GLY CA C 4.560 17.910 -0.709 1.00 . A A . 1 GLY CA 1 1 10 3423 1 1 1 GLY H1 H 6.405 18.833 -0.425 1.00 . A A . 1 GLY H1 1 1 10 3424 1 1 1 GLY H2 H 5.694 18.247 1.004 1.00 . A A . 1 GLY H2 1 1 10 3425 1 1 1 GLY H3 H 5.102 19.664 0.276 1.00 . A A . 1 GLY H3 1 1 10 3426 1 1 1 GLY HA2 H 3.703 18.516 -0.974 1.00 . A A . 1 GLY HA2 1 1 10 3427 1 1 1 GLY HA3 H 5.049 17.567 -1.608 1.00 . A A . 1 GLY HA3 1 1 10 3428 1 1 1 GLY N N 5.512 18.725 0.097 1.00 . A A . 1 GLY N 1 1 10 3429 1 1 1 GLY O O 3.853 15.632 -0.441 1.00 . A A . 1 GLY O 1 1 10 3430 1 1 2 VAL C C 2.084 15.505 2.088 1.00 . A A . 2 VAL C 1 1 10 3431 1 1 2 VAL CA C 3.562 15.814 2.299 1.00 . A A . 2 VAL CA 1 1 10 3432 1 1 2 VAL CB C 3.800 16.206 3.759 1.00 . A A . 2 VAL CB 1 1 10 3433 1 1 2 VAL CG1 C 2.894 17.383 4.125 1.00 . A A . 2 VAL CG1 1 1 10 3434 1 1 2 VAL CG2 C 3.480 15.016 4.664 1.00 . A A . 2 VAL CG2 1 1 10 3435 1 1 2 VAL H H 4.204 17.770 1.798 1.00 . A A . 2 VAL H 1 1 10 3436 1 1 2 VAL HA H 4.141 14.930 2.078 1.00 . A A . 2 VAL HA 1 1 10 3437 1 1 2 VAL HB H 4.834 16.493 3.890 1.00 . A A . 2 VAL HB 1 1 10 3438 1 1 2 VAL HG11 H 2.965 18.144 3.362 1.00 . A A . 2 VAL HG11 1 1 10 3439 1 1 2 VAL HG12 H 3.204 17.794 5.075 1.00 . A A . 2 VAL HG12 1 1 10 3440 1 1 2 VAL HG13 H 1.872 17.041 4.198 1.00 . A A . 2 VAL HG13 1 1 10 3441 1 1 2 VAL HG21 H 4.049 14.156 4.343 1.00 . A A . 2 VAL HG21 1 1 10 3442 1 1 2 VAL HG22 H 2.425 14.791 4.604 1.00 . A A . 2 VAL HG22 1 1 10 3443 1 1 2 VAL HG23 H 3.739 15.259 5.684 1.00 . A A . 2 VAL HG23 1 1 10 3444 1 1 2 VAL N N 3.992 16.893 1.418 1.00 . A A . 2 VAL N 1 1 10 3445 1 1 2 VAL O O 1.643 14.371 2.277 1.00 . A A . 2 VAL O 1 1 10 3446 1 1 3 VAL C C -0.351 15.234 0.447 1.00 . A A . 3 VAL C 1 1 10 3447 1 1 3 VAL CA C -0.106 16.348 1.459 1.00 . A A . 3 VAL CA 1 1 10 3448 1 1 3 VAL CB C -0.713 17.652 0.942 1.00 . A A . 3 VAL CB 1 1 10 3449 1 1 3 VAL CG1 C -2.236 17.529 0.910 1.00 . A A . 3 VAL CG1 1 1 10 3450 1 1 3 VAL CG2 C -0.315 18.802 1.870 1.00 . A A . 3 VAL CG2 1 1 10 3451 1 1 3 VAL H H 1.729 17.403 1.559 1.00 . A A . 3 VAL H 1 1 10 3452 1 1 3 VAL HA H -0.584 16.086 2.392 1.00 . A A . 3 VAL HA 1 1 10 3453 1 1 3 VAL HB H -0.346 17.849 -0.055 1.00 . A A . 3 VAL HB 1 1 10 3454 1 1 3 VAL HG11 H -2.594 17.214 1.879 1.00 . A A . 3 VAL HG11 1 1 10 3455 1 1 3 VAL HG12 H -2.524 16.802 0.166 1.00 . A A . 3 VAL HG12 1 1 10 3456 1 1 3 VAL HG13 H -2.670 18.487 0.662 1.00 . A A . 3 VAL HG13 1 1 10 3457 1 1 3 VAL HG21 H -0.905 19.675 1.637 1.00 . A A . 3 VAL HG21 1 1 10 3458 1 1 3 VAL HG22 H 0.733 19.028 1.734 1.00 . A A . 3 VAL HG22 1 1 10 3459 1 1 3 VAL HG23 H -0.490 18.513 2.897 1.00 . A A . 3 VAL HG23 1 1 10 3460 1 1 3 VAL N N 1.323 16.522 1.694 1.00 . A A . 3 VAL N 1 1 10 3461 1 1 3 VAL O O -1.390 14.574 0.475 1.00 . A A . 3 VAL O 1 1 10 3462 1 1 4 ASP C C 0.613 12.607 -0.832 1.00 . A A . 4 ASP C 1 1 10 3463 1 1 4 ASP CA C 0.491 13.991 -1.463 1.00 . A A . 4 ASP CA 1 1 10 3464 1 1 4 ASP CB C 1.577 14.169 -2.523 1.00 . A A . 4 ASP CB 1 1 10 3465 1 1 4 ASP CG C 1.474 13.061 -3.565 1.00 . A A . 4 ASP CG 1 1 10 3466 1 1 4 ASP H H 1.418 15.585 -0.419 1.00 . A A . 4 ASP H 1 1 10 3467 1 1 4 ASP HA H -0.476 14.077 -1.935 1.00 . A A . 4 ASP HA 1 1 10 3468 1 1 4 ASP HB2 H 1.451 15.129 -3.007 1.00 . A A . 4 ASP HB2 1 1 10 3469 1 1 4 ASP HB3 H 2.550 14.127 -2.051 1.00 . A A . 4 ASP HB3 1 1 10 3470 1 1 4 ASP N N 0.612 15.028 -0.445 1.00 . A A . 4 ASP N 1 1 10 3471 1 1 4 ASP O O 0.022 11.640 -1.315 1.00 . A A . 4 ASP O 1 1 10 3472 1 1 4 ASP OD1 O 0.423 12.943 -4.174 1.00 . A A . 4 ASP OD1 1 1 10 3473 1 1 4 ASP OD2 O 2.447 12.346 -3.739 1.00 . A A . 4 ASP OD2 1 1 10 3474 1 1 5 ILE C C 0.341 10.885 1.746 1.00 . A A . 5 ILE C 1 1 10 3475 1 1 5 ILE CA C 1.578 11.248 0.934 1.00 . A A . 5 ILE CA 1 1 10 3476 1 1 5 ILE CB C 2.794 11.332 1.858 1.00 . A A . 5 ILE CB 1 1 10 3477 1 1 5 ILE CD1 C 5.200 11.990 2.004 1.00 . A A . 5 ILE CD1 1 1 10 3478 1 1 5 ILE CG1 C 3.971 11.946 1.096 1.00 . A A . 5 ILE CG1 1 1 10 3479 1 1 5 ILE CG2 C 3.173 9.928 2.333 1.00 . A A . 5 ILE CG2 1 1 10 3480 1 1 5 ILE H H 1.831 13.323 0.585 1.00 . A A . 5 ILE H 1 1 10 3481 1 1 5 ILE HA H 1.750 10.479 0.200 1.00 . A A . 5 ILE HA 1 1 10 3482 1 1 5 ILE HB H 2.554 11.948 2.712 1.00 . A A . 5 ILE HB 1 1 10 3483 1 1 5 ILE HD11 H 4.934 12.440 2.949 1.00 . A A . 5 ILE HD11 1 1 10 3484 1 1 5 ILE HD12 H 5.976 12.574 1.533 1.00 . A A . 5 ILE HD12 1 1 10 3485 1 1 5 ILE HD13 H 5.559 10.984 2.172 1.00 . A A . 5 ILE HD13 1 1 10 3486 1 1 5 ILE HG12 H 4.187 11.344 0.223 1.00 . A A . 5 ILE HG12 1 1 10 3487 1 1 5 ILE HG13 H 3.715 12.953 0.790 1.00 . A A . 5 ILE HG13 1 1 10 3488 1 1 5 ILE HG21 H 3.898 10.002 3.129 1.00 . A A . 5 ILE HG21 1 1 10 3489 1 1 5 ILE HG22 H 3.597 9.372 1.509 1.00 . A A . 5 ILE HG22 1 1 10 3490 1 1 5 ILE HG23 H 2.291 9.420 2.694 1.00 . A A . 5 ILE HG23 1 1 10 3491 1 1 5 ILE N N 1.384 12.519 0.246 1.00 . A A . 5 ILE N 1 1 10 3492 1 1 5 ILE O O 0.060 9.708 1.978 1.00 . A A . 5 ILE O 1 1 10 3493 1 1 6 LEU C C -2.652 10.961 2.129 1.00 . A A . 6 LEU C 1 1 10 3494 1 1 6 LEU CA C -1.599 11.690 2.960 1.00 . A A . 6 LEU CA 1 1 10 3495 1 1 6 LEU CB C -2.150 13.042 3.434 1.00 . A A . 6 LEU CB 1 1 10 3496 1 1 6 LEU CD1 C -1.707 14.841 5.122 1.00 . A A . 6 LEU CD1 1 1 10 3497 1 1 6 LEU CD2 C -2.606 12.634 5.866 1.00 . A A . 6 LEU CD2 1 1 10 3498 1 1 6 LEU CG C -1.677 13.332 4.867 1.00 . A A . 6 LEU CG 1 1 10 3499 1 1 6 LEU H H -0.116 12.816 1.955 1.00 . A A . 6 LEU H 1 1 10 3500 1 1 6 LEU HA H -1.355 11.086 3.820 1.00 . A A . 6 LEU HA 1 1 10 3501 1 1 6 LEU HB2 H -1.791 13.822 2.774 1.00 . A A . 6 LEU HB2 1 1 10 3502 1 1 6 LEU HB3 H -3.231 13.021 3.411 1.00 . A A . 6 LEU HB3 1 1 10 3503 1 1 6 LEU HD11 H -2.642 15.247 4.765 1.00 . A A . 6 LEU HD11 1 1 10 3504 1 1 6 LEU HD12 H -0.888 15.310 4.597 1.00 . A A . 6 LEU HD12 1 1 10 3505 1 1 6 LEU HD13 H -1.613 15.029 6.181 1.00 . A A . 6 LEU HD13 1 1 10 3506 1 1 6 LEU HD21 H -2.564 11.565 5.714 1.00 . A A . 6 LEU HD21 1 1 10 3507 1 1 6 LEU HD22 H -3.619 12.980 5.718 1.00 . A A . 6 LEU HD22 1 1 10 3508 1 1 6 LEU HD23 H -2.290 12.866 6.873 1.00 . A A . 6 LEU HD23 1 1 10 3509 1 1 6 LEU HG H -0.668 12.967 4.994 1.00 . A A . 6 LEU HG 1 1 10 3510 1 1 6 LEU N N -0.391 11.903 2.174 1.00 . A A . 6 LEU N 1 1 10 3511 1 1 6 LEU O O -3.338 10.066 2.624 1.00 . A A . 6 LEU O 1 1 10 3512 1 1 7 LYS C C -3.259 9.336 -0.465 1.00 . A A . 7 LYS C 1 1 10 3513 1 1 7 LYS CA C -3.750 10.716 -0.025 1.00 . A A . 7 LYS CA 1 1 10 3514 1 1 7 LYS CB C -4.044 11.595 -1.261 1.00 . A A . 7 LYS CB 1 1 10 3515 1 1 7 LYS CD C -5.435 13.188 0.085 1.00 . A A . 7 LYS CD 1 1 10 3516 1 1 7 LYS CE C -6.529 14.242 -0.102 1.00 . A A . 7 LYS CE 1 1 10 3517 1 1 7 LYS CG C -5.429 12.232 -1.116 1.00 . A A . 7 LYS CG 1 1 10 3518 1 1 7 LYS H H -2.196 12.063 0.526 1.00 . A A . 7 LYS H 1 1 10 3519 1 1 7 LYS HA H -4.669 10.584 0.524 1.00 . A A . 7 LYS HA 1 1 10 3520 1 1 7 LYS HB2 H -3.303 12.375 -1.357 1.00 . A A . 7 LYS HB2 1 1 10 3521 1 1 7 LYS HB3 H -4.030 10.983 -2.150 1.00 . A A . 7 LYS HB3 1 1 10 3522 1 1 7 LYS HD2 H -5.626 12.628 0.989 1.00 . A A . 7 LYS HD2 1 1 10 3523 1 1 7 LYS HD3 H -4.476 13.679 0.163 1.00 . A A . 7 LYS HD3 1 1 10 3524 1 1 7 LYS HE2 H -6.260 14.898 -0.916 1.00 . A A . 7 LYS HE2 1 1 10 3525 1 1 7 LYS HE3 H -7.464 13.752 -0.328 1.00 . A A . 7 LYS HE3 1 1 10 3526 1 1 7 LYS HG2 H -5.662 12.779 -2.012 1.00 . A A . 7 LYS HG2 1 1 10 3527 1 1 7 LYS HG3 H -6.167 11.461 -0.963 1.00 . A A . 7 LYS HG3 1 1 10 3528 1 1 7 LYS HZ1 H -5.774 15.028 1.672 1.00 . A A . 7 LYS HZ1 1 1 10 3529 1 1 7 LYS HZ2 H -7.422 14.619 1.741 1.00 . A A . 7 LYS HZ2 1 1 10 3530 1 1 7 LYS HZ3 H -6.923 16.016 0.912 1.00 . A A . 7 LYS HZ3 1 1 10 3531 1 1 7 LYS N N -2.773 11.348 0.863 1.00 . A A . 7 LYS N 1 1 10 3532 1 1 7 LYS NZ N -6.673 15.037 1.150 1.00 . A A . 7 LYS NZ 1 1 10 3533 1 1 7 LYS O O -4.061 8.440 -0.728 1.00 . A A . 7 LYS O 1 1 10 3534 1 1 8 GLY C C -1.694 6.797 0.055 1.00 . A A . 8 GLY C 1 1 10 3535 1 1 8 GLY CA C -1.369 7.890 -0.957 1.00 . A A . 8 GLY CA 1 1 10 3536 1 1 8 GLY H H -1.341 9.911 -0.323 1.00 . A A . 8 GLY H 1 1 10 3537 1 1 8 GLY HA2 H -1.772 7.615 -1.920 1.00 . A A . 8 GLY HA2 1 1 10 3538 1 1 8 GLY HA3 H -0.296 7.989 -1.035 1.00 . A A . 8 GLY HA3 1 1 10 3539 1 1 8 GLY N N -1.940 9.167 -0.546 1.00 . A A . 8 GLY N 1 1 10 3540 1 1 8 GLY O O -1.935 5.648 -0.315 1.00 . A A . 8 GLY O 1 1 10 3541 1 1 9 ALA C C -3.312 5.482 2.108 1.00 . A A . 9 ALA C 1 1 10 3542 1 1 9 ALA CA C -1.997 6.201 2.390 1.00 . A A . 9 ALA CA 1 1 10 3543 1 1 9 ALA CB C -2.083 6.917 3.739 1.00 . A A . 9 ALA CB 1 1 10 3544 1 1 9 ALA H H -1.499 8.091 1.570 1.00 . A A . 9 ALA H 1 1 10 3545 1 1 9 ALA HA H -1.202 5.470 2.433 1.00 . A A . 9 ALA HA 1 1 10 3546 1 1 9 ALA HB1 H -2.719 7.785 3.644 1.00 . A A . 9 ALA HB1 1 1 10 3547 1 1 9 ALA HB2 H -1.095 7.227 4.046 1.00 . A A . 9 ALA HB2 1 1 10 3548 1 1 9 ALA HB3 H -2.495 6.246 4.477 1.00 . A A . 9 ALA HB3 1 1 10 3549 1 1 9 ALA N N -1.699 7.160 1.333 1.00 . A A . 9 ALA N 1 1 10 3550 1 1 9 ALA O O -3.448 4.289 2.378 1.00 . A A . 9 ALA O 1 1 10 3551 1 1 10 ALA C C -5.413 4.466 0.280 1.00 . A A . 10 ALA C 1 1 10 3552 1 1 10 ALA CA C -5.576 5.633 1.248 1.00 . A A . 10 ALA CA 1 1 10 3553 1 1 10 ALA CB C -6.487 6.693 0.628 1.00 . A A . 10 ALA CB 1 1 10 3554 1 1 10 ALA H H -4.113 7.161 1.368 1.00 . A A . 10 ALA H 1 1 10 3555 1 1 10 ALA HA H -6.029 5.273 2.159 1.00 . A A . 10 ALA HA 1 1 10 3556 1 1 10 ALA HB1 H -6.650 7.489 1.339 1.00 . A A . 10 ALA HB1 1 1 10 3557 1 1 10 ALA HB2 H -7.435 6.244 0.366 1.00 . A A . 10 ALA HB2 1 1 10 3558 1 1 10 ALA HB3 H -6.021 7.093 -0.261 1.00 . A A . 10 ALA HB3 1 1 10 3559 1 1 10 ALA N N -4.277 6.215 1.563 1.00 . A A . 10 ALA N 1 1 10 3560 1 1 10 ALA O O -5.918 3.370 0.524 1.00 . A A . 10 ALA O 1 1 10 3561 1 1 11 LYS C C -3.451 2.675 -1.334 1.00 . A A . 11 LYS C 1 1 10 3562 1 1 11 LYS CA C -4.482 3.680 -1.816 1.00 . A A . 11 LYS CA 1 1 10 3563 1 1 11 LYS CB C -4.020 4.305 -3.113 1.00 . A A . 11 LYS CB 1 1 10 3564 1 1 11 LYS CD C -4.185 3.688 -5.496 1.00 . A A . 11 LYS CD 1 1 10 3565 1 1 11 LYS CE C -3.868 2.635 -6.559 1.00 . A A . 11 LYS CE 1 1 10 3566 1 1 11 LYS CG C -3.720 3.210 -4.140 1.00 . A A . 11 LYS CG 1 1 10 3567 1 1 11 LYS H H -4.332 5.602 -0.958 1.00 . A A . 11 LYS H 1 1 10 3568 1 1 11 LYS HA H -5.401 3.174 -2.000 1.00 . A A . 11 LYS HA 1 1 10 3569 1 1 11 LYS HB2 H -4.792 4.960 -3.489 1.00 . A A . 11 LYS HB2 1 1 10 3570 1 1 11 LYS HB3 H -3.139 4.866 -2.930 1.00 . A A . 11 LYS HB3 1 1 10 3571 1 1 11 LYS HD2 H -5.249 3.863 -5.456 1.00 . A A . 11 LYS HD2 1 1 10 3572 1 1 11 LYS HD3 H -3.678 4.603 -5.727 1.00 . A A . 11 LYS HD3 1 1 10 3573 1 1 11 LYS HE2 H -2.829 2.351 -6.486 1.00 . A A . 11 LYS HE2 1 1 10 3574 1 1 11 LYS HE3 H -4.491 1.767 -6.403 1.00 . A A . 11 LYS HE3 1 1 10 3575 1 1 11 LYS HG2 H -2.658 3.014 -4.169 1.00 . A A . 11 LYS HG2 1 1 10 3576 1 1 11 LYS HG3 H -4.246 2.311 -3.887 1.00 . A A . 11 LYS HG3 1 1 10 3577 1 1 11 LYS HZ1 H -3.421 3.925 -8.132 1.00 . A A . 11 LYS HZ1 1 1 10 3578 1 1 11 LYS HZ2 H -5.082 3.628 -7.930 1.00 . A A . 11 LYS HZ2 1 1 10 3579 1 1 11 LYS HZ3 H -4.082 2.441 -8.622 1.00 . A A . 11 LYS HZ3 1 1 10 3580 1 1 11 LYS N N -4.707 4.712 -0.818 1.00 . A A . 11 LYS N 1 1 10 3581 1 1 11 LYS NZ N -4.133 3.200 -7.912 1.00 . A A . 11 LYS NZ 1 1 10 3582 1 1 11 LYS O O -3.508 1.498 -1.693 1.00 . A A . 11 LYS O 1 1 10 3583 1 1 12 ASP C C -2.154 0.960 0.515 1.00 . A A . 12 ASP C 1 1 10 3584 1 1 12 ASP CA C -1.493 2.245 0.033 1.00 . A A . 12 ASP CA 1 1 10 3585 1 1 12 ASP CB C -0.763 2.921 1.195 1.00 . A A . 12 ASP CB 1 1 10 3586 1 1 12 ASP CG C 0.413 2.061 1.642 1.00 . A A . 12 ASP CG 1 1 10 3587 1 1 12 ASP H H -2.525 4.081 -0.247 1.00 . A A . 12 ASP H 1 1 10 3588 1 1 12 ASP HA H -0.781 2.010 -0.745 1.00 . A A . 12 ASP HA 1 1 10 3589 1 1 12 ASP HB2 H -0.400 3.888 0.877 1.00 . A A . 12 ASP HB2 1 1 10 3590 1 1 12 ASP HB3 H -1.447 3.049 2.022 1.00 . A A . 12 ASP HB3 1 1 10 3591 1 1 12 ASP N N -2.516 3.136 -0.506 1.00 . A A . 12 ASP N 1 1 10 3592 1 1 12 ASP O O -1.492 -0.036 0.799 1.00 . A A . 12 ASP O 1 1 10 3593 1 1 12 ASP OD1 O 1.237 1.737 0.803 1.00 . A A . 12 ASP OD1 1 1 10 3594 1 1 12 ASP OD2 O 0.474 1.740 2.818 1.00 . A A . 12 ASP OD2 1 1 10 3595 1 1 13 ILE C C -3.987 -1.336 0.148 1.00 . A A . 13 ILE C 1 1 10 3596 1 1 13 ILE CA C -4.281 -0.120 1.012 1.00 . A A . 13 ILE CA 1 1 10 3597 1 1 13 ILE CB C -5.743 0.297 0.838 1.00 . A A . 13 ILE CB 1 1 10 3598 1 1 13 ILE CD1 C -6.853 -0.241 2.999 1.00 . A A . 13 ILE CD1 1 1 10 3599 1 1 13 ILE CG1 C -6.249 0.878 2.160 1.00 . A A . 13 ILE CG1 1 1 10 3600 1 1 13 ILE CG2 C -6.607 -0.898 0.398 1.00 . A A . 13 ILE CG2 1 1 10 3601 1 1 13 ILE H H -3.940 1.839 0.340 1.00 . A A . 13 ILE H 1 1 10 3602 1 1 13 ILE HA H -4.090 -0.345 2.048 1.00 . A A . 13 ILE HA 1 1 10 3603 1 1 13 ILE HB H -5.796 1.060 0.075 1.00 . A A . 13 ILE HB 1 1 10 3604 1 1 13 ILE HD11 H -6.934 0.082 4.022 1.00 . A A . 13 ILE HD11 1 1 10 3605 1 1 13 ILE HD12 H -6.214 -1.112 2.943 1.00 . A A . 13 ILE HD12 1 1 10 3606 1 1 13 ILE HD13 H -7.831 -0.487 2.614 1.00 . A A . 13 ILE HD13 1 1 10 3607 1 1 13 ILE HG12 H -5.423 1.328 2.697 1.00 . A A . 13 ILE HG12 1 1 10 3608 1 1 13 ILE HG13 H -6.995 1.631 1.962 1.00 . A A . 13 ILE HG13 1 1 10 3609 1 1 13 ILE HG21 H -6.340 -1.772 0.972 1.00 . A A . 13 ILE HG21 1 1 10 3610 1 1 13 ILE HG22 H -6.442 -1.094 -0.653 1.00 . A A . 13 ILE HG22 1 1 10 3611 1 1 13 ILE HG23 H -7.649 -0.666 0.558 1.00 . A A . 13 ILE HG23 1 1 10 3612 1 1 13 ILE N N -3.479 1.009 0.587 1.00 . A A . 13 ILE N 1 1 10 3613 1 1 13 ILE O O -3.621 -2.403 0.642 1.00 . A A . 13 ILE O 1 1 10 3614 1 1 14 ALA C C -2.514 -2.794 -1.926 1.00 . A A . 14 ALA C 1 1 10 3615 1 1 14 ALA CA C -3.913 -2.214 -2.108 1.00 . A A . 14 ALA CA 1 1 10 3616 1 1 14 ALA CB C -4.061 -1.674 -3.533 1.00 . A A . 14 ALA CB 1 1 10 3617 1 1 14 ALA H H -4.456 -0.270 -1.451 1.00 . A A . 14 ALA H 1 1 10 3618 1 1 14 ALA HA H -4.641 -2.997 -1.955 1.00 . A A . 14 ALA HA 1 1 10 3619 1 1 14 ALA HB1 H -3.405 -0.827 -3.667 1.00 . A A . 14 ALA HB1 1 1 10 3620 1 1 14 ALA HB2 H -5.084 -1.367 -3.696 1.00 . A A . 14 ALA HB2 1 1 10 3621 1 1 14 ALA HB3 H -3.801 -2.448 -4.240 1.00 . A A . 14 ALA HB3 1 1 10 3622 1 1 14 ALA N N -4.154 -1.147 -1.144 1.00 . A A . 14 ALA N 1 1 10 3623 1 1 14 ALA O O -2.304 -3.996 -2.090 1.00 . A A . 14 ALA O 1 1 10 3624 1 1 15 GLY C C -0.067 -3.221 -0.123 1.00 . A A . 15 GLY C 1 1 10 3625 1 1 15 GLY CA C -0.185 -2.371 -1.383 1.00 . A A . 15 GLY CA 1 1 10 3626 1 1 15 GLY H H -1.788 -0.986 -1.468 1.00 . A A . 15 GLY H 1 1 10 3627 1 1 15 GLY HA2 H 0.131 -2.954 -2.237 1.00 . A A . 15 GLY HA2 1 1 10 3628 1 1 15 GLY HA3 H 0.453 -1.506 -1.287 1.00 . A A . 15 GLY HA3 1 1 10 3629 1 1 15 GLY N N -1.562 -1.933 -1.585 1.00 . A A . 15 GLY N 1 1 10 3630 1 1 15 GLY O O 0.750 -4.140 -0.057 1.00 . A A . 15 GLY O 1 1 10 3631 1 1 16 HIS C C -1.466 -5.040 1.935 1.00 . A A . 16 HIS C 1 1 10 3632 1 1 16 HIS CA C -0.865 -3.651 2.130 1.00 . A A . 16 HIS CA 1 1 10 3633 1 1 16 HIS CB C -1.655 -2.892 3.198 1.00 . A A . 16 HIS CB 1 1 10 3634 1 1 16 HIS CD2 C -2.741 -4.485 4.982 1.00 . A A . 16 HIS CD2 1 1 10 3635 1 1 16 HIS CE1 C -1.060 -4.632 6.341 1.00 . A A . 16 HIS CE1 1 1 10 3636 1 1 16 HIS CG C -1.733 -3.720 4.451 1.00 . A A . 16 HIS CG 1 1 10 3637 1 1 16 HIS H H -1.517 -2.166 0.767 1.00 . A A . 16 HIS H 1 1 10 3638 1 1 16 HIS HA H 0.158 -3.754 2.459 1.00 . A A . 16 HIS HA 1 1 10 3639 1 1 16 HIS HB2 H -1.158 -1.956 3.415 1.00 . A A . 16 HIS HB2 1 1 10 3640 1 1 16 HIS HB3 H -2.652 -2.693 2.835 1.00 . A A . 16 HIS HB3 1 1 10 3641 1 1 16 HIS HD2 H -3.717 -4.620 4.540 1.00 . A A . 16 HIS HD2 1 1 10 3642 1 1 16 HIS HE1 H -0.434 -4.897 7.180 1.00 . A A . 16 HIS HE1 1 1 10 3643 1 1 16 HIS HE2 H -2.825 -5.651 6.767 1.00 . A A . 16 HIS HE2 1 1 10 3644 1 1 16 HIS N N -0.886 -2.908 0.876 1.00 . A A . 16 HIS N 1 1 10 3645 1 1 16 HIS ND1 N -0.671 -3.828 5.335 1.00 . A A . 16 HIS ND1 1 1 10 3646 1 1 16 HIS NE2 N -2.314 -5.060 6.175 1.00 . A A . 16 HIS NE2 1 1 10 3647 1 1 16 HIS O O -0.949 -6.029 2.455 1.00 . A A . 16 HIS O 1 1 10 3648 1 1 17 LEU C C -2.386 -7.218 -0.032 1.00 . A A . 17 LEU C 1 1 10 3649 1 1 17 LEU CA C -3.222 -6.369 0.920 1.00 . A A . 17 LEU CA 1 1 10 3650 1 1 17 LEU CB C -4.602 -6.098 0.317 1.00 . A A . 17 LEU CB 1 1 10 3651 1 1 17 LEU CD1 C -5.032 -8.566 0.405 1.00 . A A . 17 LEU CD1 1 1 10 3652 1 1 17 LEU CD2 C -5.880 -7.090 2.248 1.00 . A A . 17 LEU CD2 1 1 10 3653 1 1 17 LEU CG C -5.601 -7.184 0.739 1.00 . A A . 17 LEU CG 1 1 10 3654 1 1 17 LEU H H -2.926 -4.289 0.793 1.00 . A A . 17 LEU H 1 1 10 3655 1 1 17 LEU HA H -3.343 -6.896 1.844 1.00 . A A . 17 LEU HA 1 1 10 3656 1 1 17 LEU HB2 H -4.956 -5.134 0.654 1.00 . A A . 17 LEU HB2 1 1 10 3657 1 1 17 LEU HB3 H -4.517 -6.088 -0.751 1.00 . A A . 17 LEU HB3 1 1 10 3658 1 1 17 LEU HD11 H -5.835 -9.286 0.376 1.00 . A A . 17 LEU HD11 1 1 10 3659 1 1 17 LEU HD12 H -4.318 -8.855 1.162 1.00 . A A . 17 LEU HD12 1 1 10 3660 1 1 17 LEU HD13 H -4.544 -8.532 -0.558 1.00 . A A . 17 LEU HD13 1 1 10 3661 1 1 17 LEU HD21 H -5.715 -6.078 2.588 1.00 . A A . 17 LEU HD21 1 1 10 3662 1 1 17 LEU HD22 H -5.224 -7.760 2.783 1.00 . A A . 17 LEU HD22 1 1 10 3663 1 1 17 LEU HD23 H -6.907 -7.368 2.439 1.00 . A A . 17 LEU HD23 1 1 10 3664 1 1 17 LEU HG H -6.525 -7.043 0.195 1.00 . A A . 17 LEU HG 1 1 10 3665 1 1 17 LEU N N -2.558 -5.105 1.182 1.00 . A A . 17 LEU N 1 1 10 3666 1 1 17 LEU O O -2.304 -8.436 0.118 1.00 . A A . 17 LEU O 1 1 10 3667 1 1 18 ALA C C 0.197 -7.998 -1.233 1.00 . A A . 18 ALA C 1 1 10 3668 1 1 18 ALA CA C -0.925 -7.280 -1.962 1.00 . A A . 18 ALA CA 1 1 10 3669 1 1 18 ALA CB C -0.338 -6.303 -2.983 1.00 . A A . 18 ALA CB 1 1 10 3670 1 1 18 ALA H H -1.846 -5.595 -1.072 1.00 . A A . 18 ALA H 1 1 10 3671 1 1 18 ALA HA H -1.525 -8.014 -2.479 1.00 . A A . 18 ALA HA 1 1 10 3672 1 1 18 ALA HB1 H -1.139 -5.753 -3.455 1.00 . A A . 18 ALA HB1 1 1 10 3673 1 1 18 ALA HB2 H 0.212 -6.853 -3.732 1.00 . A A . 18 ALA HB2 1 1 10 3674 1 1 18 ALA HB3 H 0.326 -5.615 -2.481 1.00 . A A . 18 ALA HB3 1 1 10 3675 1 1 18 ALA N N -1.757 -6.567 -1.004 1.00 . A A . 18 ALA N 1 1 10 3676 1 1 18 ALA O O 0.318 -9.216 -1.316 1.00 . A A . 18 ALA O 1 1 10 3677 1 1 19 SER C C 1.587 -9.006 1.062 1.00 . A A . 19 SER C 1 1 10 3678 1 1 19 SER CA C 2.103 -7.833 0.241 1.00 . A A . 19 SER CA 1 1 10 3679 1 1 19 SER CB C 2.742 -6.787 1.159 1.00 . A A . 19 SER CB 1 1 10 3680 1 1 19 SER H H 0.857 -6.271 -0.464 1.00 . A A . 19 SER H 1 1 10 3681 1 1 19 SER HA H 2.845 -8.196 -0.455 1.00 . A A . 19 SER HA 1 1 10 3682 1 1 19 SER HB2 H 3.814 -6.880 1.128 1.00 . A A . 19 SER HB2 1 1 10 3683 1 1 19 SER HB3 H 2.459 -5.797 0.823 1.00 . A A . 19 SER HB3 1 1 10 3684 1 1 19 SER HG H 1.380 -6.706 2.547 1.00 . A A . 19 SER HG 1 1 10 3685 1 1 19 SER N N 1.006 -7.239 -0.507 1.00 . A A . 19 SER N 1 1 10 3686 1 1 19 SER O O 2.278 -10.009 1.241 1.00 . A A . 19 SER O 1 1 10 3687 1 1 19 SER OG O 2.295 -6.992 2.494 1.00 . A A . 19 SER OG 1 1 10 3688 1 1 20 LYS C C -0.430 -11.174 1.464 1.00 . A A . 20 LYS C 1 1 10 3689 1 1 20 LYS CA C -0.261 -9.932 2.327 1.00 . A A . 20 LYS CA 1 1 10 3690 1 1 20 LYS CB C -1.626 -9.459 2.835 1.00 . A A . 20 LYS CB 1 1 10 3691 1 1 20 LYS CD C -1.456 -10.786 4.964 1.00 . A A . 20 LYS CD 1 1 10 3692 1 1 20 LYS CE C -2.272 -10.890 6.255 1.00 . A A . 20 LYS CE 1 1 10 3693 1 1 20 LYS CG C -1.609 -9.379 4.364 1.00 . A A . 20 LYS CG 1 1 10 3694 1 1 20 LYS H H -0.150 -8.059 1.359 1.00 . A A . 20 LYS H 1 1 10 3695 1 1 20 LYS HA H 0.369 -10.162 3.170 1.00 . A A . 20 LYS HA 1 1 10 3696 1 1 20 LYS HB2 H -1.834 -8.484 2.424 1.00 . A A . 20 LYS HB2 1 1 10 3697 1 1 20 LYS HB3 H -2.396 -10.147 2.520 1.00 . A A . 20 LYS HB3 1 1 10 3698 1 1 20 LYS HD2 H -1.808 -11.524 4.257 1.00 . A A . 20 LYS HD2 1 1 10 3699 1 1 20 LYS HD3 H -0.415 -10.972 5.185 1.00 . A A . 20 LYS HD3 1 1 10 3700 1 1 20 LYS HE2 H -2.018 -11.805 6.769 1.00 . A A . 20 LYS HE2 1 1 10 3701 1 1 20 LYS HE3 H -2.049 -10.046 6.890 1.00 . A A . 20 LYS HE3 1 1 10 3702 1 1 20 LYS HG2 H -0.781 -8.759 4.681 1.00 . A A . 20 LYS HG2 1 1 10 3703 1 1 20 LYS HG3 H -2.530 -8.942 4.705 1.00 . A A . 20 LYS HG3 1 1 10 3704 1 1 20 LYS HZ1 H -4.236 -11.482 6.610 1.00 . A A . 20 LYS HZ1 1 1 10 3705 1 1 20 LYS HZ2 H -3.861 -11.278 4.966 1.00 . A A . 20 LYS HZ2 1 1 10 3706 1 1 20 LYS HZ3 H -4.092 -9.921 5.963 1.00 . A A . 20 LYS HZ3 1 1 10 3707 1 1 20 LYS N N 0.357 -8.876 1.544 1.00 . A A . 20 LYS N 1 1 10 3708 1 1 20 LYS NZ N -3.725 -10.894 5.923 1.00 . A A . 20 LYS NZ 1 1 10 3709 1 1 20 LYS O O -0.006 -12.270 1.834 1.00 . A A . 20 LYS O 1 1 10 3710 1 1 21 VAL C C 0.011 -12.507 -1.299 1.00 . A A . 21 VAL C 1 1 10 3711 1 1 21 VAL CA C -1.285 -12.087 -0.617 1.00 . A A . 21 VAL CA 1 1 10 3712 1 1 21 VAL CB C -2.311 -11.683 -1.674 1.00 . A A . 21 VAL CB 1 1 10 3713 1 1 21 VAL CG1 C -2.643 -12.902 -2.534 1.00 . A A . 21 VAL CG1 1 1 10 3714 1 1 21 VAL CG2 C -3.587 -11.186 -0.988 1.00 . A A . 21 VAL CG2 1 1 10 3715 1 1 21 VAL H H -1.370 -10.088 0.076 1.00 . A A . 21 VAL H 1 1 10 3716 1 1 21 VAL HA H -1.670 -12.922 -0.070 1.00 . A A . 21 VAL HA 1 1 10 3717 1 1 21 VAL HB H -1.903 -10.901 -2.297 1.00 . A A . 21 VAL HB 1 1 10 3718 1 1 21 VAL HG11 H -3.439 -12.653 -3.219 1.00 . A A . 21 VAL HG11 1 1 10 3719 1 1 21 VAL HG12 H -2.958 -13.716 -1.895 1.00 . A A . 21 VAL HG12 1 1 10 3720 1 1 21 VAL HG13 H -1.766 -13.199 -3.089 1.00 . A A . 21 VAL HG13 1 1 10 3721 1 1 21 VAL HG21 H -4.207 -10.675 -1.709 1.00 . A A . 21 VAL HG21 1 1 10 3722 1 1 21 VAL HG22 H -3.327 -10.506 -0.192 1.00 . A A . 21 VAL HG22 1 1 10 3723 1 1 21 VAL HG23 H -4.128 -12.027 -0.580 1.00 . A A . 21 VAL HG23 1 1 10 3724 1 1 21 VAL N N -1.056 -10.986 0.308 1.00 . A A . 21 VAL N 1 1 10 3725 1 1 21 VAL O O 0.257 -13.697 -1.502 1.00 . A A . 21 VAL O 1 1 10 3726 1 1 22 MET C C 2.972 -12.706 -1.410 1.00 . A A . 22 MET C 1 1 10 3727 1 1 22 MET CA C 2.107 -11.826 -2.306 1.00 . A A . 22 MET CA 1 1 10 3728 1 1 22 MET CB C 2.847 -10.525 -2.636 1.00 . A A . 22 MET CB 1 1 10 3729 1 1 22 MET CE C 1.403 -9.753 -6.416 1.00 . A A . 22 MET CE 1 1 10 3730 1 1 22 MET CG C 2.799 -10.264 -4.145 1.00 . A A . 22 MET CG 1 1 10 3731 1 1 22 MET H H 0.592 -10.601 -1.460 1.00 . A A . 22 MET H 1 1 10 3732 1 1 22 MET HA H 1.905 -12.355 -3.222 1.00 . A A . 22 MET HA 1 1 10 3733 1 1 22 MET HB2 H 2.375 -9.711 -2.119 1.00 . A A . 22 MET HB2 1 1 10 3734 1 1 22 MET HB3 H 3.879 -10.601 -2.321 1.00 . A A . 22 MET HB3 1 1 10 3735 1 1 22 MET HE1 H 1.624 -8.700 -6.507 1.00 . A A . 22 MET HE1 1 1 10 3736 1 1 22 MET HE2 H 0.534 -9.988 -7.011 1.00 . A A . 22 MET HE2 1 1 10 3737 1 1 22 MET HE3 H 2.244 -10.336 -6.765 1.00 . A A . 22 MET HE3 1 1 10 3738 1 1 22 MET HG2 H 3.306 -9.333 -4.365 1.00 . A A . 22 MET HG2 1 1 10 3739 1 1 22 MET HG3 H 3.288 -11.077 -4.667 1.00 . A A . 22 MET HG3 1 1 10 3740 1 1 22 MET N N 0.838 -11.531 -1.648 1.00 . A A . 22 MET N 1 1 10 3741 1 1 22 MET O O 3.438 -13.767 -1.824 1.00 . A A . 22 MET O 1 1 10 3742 1 1 22 MET SD S 1.074 -10.152 -4.682 1.00 . A A . 22 MET SD 1 1 10 3743 1 1 23 ASN C C 3.374 -14.376 1.040 1.00 . A A . 23 ASN C 1 1 10 3744 1 1 23 ASN CA C 3.989 -13.006 0.774 1.00 . A A . 23 ASN CA 1 1 10 3745 1 1 23 ASN CB C 4.106 -12.235 2.082 1.00 . A A . 23 ASN CB 1 1 10 3746 1 1 23 ASN CG C 5.237 -12.806 2.929 1.00 . A A . 23 ASN CG 1 1 10 3747 1 1 23 ASN H H 2.782 -11.402 0.096 1.00 . A A . 23 ASN H 1 1 10 3748 1 1 23 ASN HA H 4.973 -13.139 0.368 1.00 . A A . 23 ASN HA 1 1 10 3749 1 1 23 ASN HB2 H 4.305 -11.194 1.871 1.00 . A A . 23 ASN HB2 1 1 10 3750 1 1 23 ASN HB3 H 3.182 -12.320 2.620 1.00 . A A . 23 ASN HB3 1 1 10 3751 1 1 23 ASN HD21 H 4.026 -13.858 4.101 1.00 . A A . 23 ASN HD21 1 1 10 3752 1 1 23 ASN HD22 H 5.679 -13.991 4.461 1.00 . A A . 23 ASN HD22 1 1 10 3753 1 1 23 ASN N N 3.180 -12.255 -0.178 1.00 . A A . 23 ASN N 1 1 10 3754 1 1 23 ASN ND2 N 4.958 -13.620 3.912 1.00 . A A . 23 ASN ND2 1 1 10 3755 1 1 23 ASN O O 4.087 -15.360 1.234 1.00 . A A . 23 ASN O 1 1 10 3756 1 1 23 ASN OD1 O 6.406 -12.505 2.692 1.00 . A A . 23 ASN OD1 1 1 10 3757 1 1 24 LYS C C 1.710 -16.720 0.235 1.00 . A A . 24 LYS C 1 1 10 3758 1 1 24 LYS CA C 1.345 -15.685 1.294 1.00 . A A . 24 LYS CA 1 1 10 3759 1 1 24 LYS CB C -0.167 -15.451 1.283 1.00 . A A . 24 LYS CB 1 1 10 3760 1 1 24 LYS CD C -2.341 -16.444 2.017 1.00 . A A . 24 LYS CD 1 1 10 3761 1 1 24 LYS CE C -3.048 -17.737 2.428 1.00 . A A . 24 LYS CE 1 1 10 3762 1 1 24 LYS CG C -0.889 -16.751 1.642 1.00 . A A . 24 LYS CG 1 1 10 3763 1 1 24 LYS H H 1.528 -13.614 0.890 1.00 . A A . 24 LYS H 1 1 10 3764 1 1 24 LYS HA H 1.632 -16.062 2.265 1.00 . A A . 24 LYS HA 1 1 10 3765 1 1 24 LYS HB2 H -0.417 -14.687 2.006 1.00 . A A . 24 LYS HB2 1 1 10 3766 1 1 24 LYS HB3 H -0.474 -15.130 0.300 1.00 . A A . 24 LYS HB3 1 1 10 3767 1 1 24 LYS HD2 H -2.359 -15.745 2.840 1.00 . A A . 24 LYS HD2 1 1 10 3768 1 1 24 LYS HD3 H -2.849 -16.013 1.167 1.00 . A A . 24 LYS HD3 1 1 10 3769 1 1 24 LYS HE2 H -3.278 -18.317 1.546 1.00 . A A . 24 LYS HE2 1 1 10 3770 1 1 24 LYS HE3 H -2.402 -18.311 3.077 1.00 . A A . 24 LYS HE3 1 1 10 3771 1 1 24 LYS HG2 H -0.869 -17.419 0.793 1.00 . A A . 24 LYS HG2 1 1 10 3772 1 1 24 LYS HG3 H -0.394 -17.220 2.480 1.00 . A A . 24 LYS HG3 1 1 10 3773 1 1 24 LYS HZ1 H -4.250 -17.747 4.129 1.00 . A A . 24 LYS HZ1 1 1 10 3774 1 1 24 LYS HZ2 H -5.112 -17.863 2.669 1.00 . A A . 24 LYS HZ2 1 1 10 3775 1 1 24 LYS HZ3 H -4.447 -16.375 3.151 1.00 . A A . 24 LYS HZ3 1 1 10 3776 1 1 24 LYS N N 2.046 -14.431 1.050 1.00 . A A . 24 LYS N 1 1 10 3777 1 1 24 LYS NZ N -4.310 -17.405 3.149 1.00 . A A . 24 LYS NZ 1 1 10 3778 1 1 24 LYS O O 1.787 -17.915 0.521 1.00 . A A . 24 LYS O 1 1 10 3779 1 1 25 LEU C C 3.654 -17.776 -1.835 1.00 . A A . 25 LEU C 1 1 10 3780 1 1 25 LEU CA C 2.287 -17.143 -2.082 1.00 . A A . 25 LEU CA 1 1 10 3781 1 1 25 LEU CB C 2.304 -16.359 -3.395 1.00 . A A . 25 LEU CB 1 1 10 3782 1 1 25 LEU CD1 C 2.969 -18.484 -4.547 1.00 . A A . 25 LEU CD1 1 1 10 3783 1 1 25 LEU CD2 C 0.560 -17.788 -4.522 1.00 . A A . 25 LEU CD2 1 1 10 3784 1 1 25 LEU CG C 2.013 -17.289 -4.582 1.00 . A A . 25 LEU CG 1 1 10 3785 1 1 25 LEU H H 1.858 -15.295 -1.161 1.00 . A A . 25 LEU H 1 1 10 3786 1 1 25 LEU HA H 1.552 -17.917 -2.152 1.00 . A A . 25 LEU HA 1 1 10 3787 1 1 25 LEU HB2 H 1.552 -15.580 -3.355 1.00 . A A . 25 LEU HB2 1 1 10 3788 1 1 25 LEU HB3 H 3.274 -15.914 -3.521 1.00 . A A . 25 LEU HB3 1 1 10 3789 1 1 25 LEU HD11 H 3.973 -18.137 -4.356 1.00 . A A . 25 LEU HD11 1 1 10 3790 1 1 25 LEU HD12 H 2.939 -18.994 -5.499 1.00 . A A . 25 LEU HD12 1 1 10 3791 1 1 25 LEU HD13 H 2.667 -19.165 -3.765 1.00 . A A . 25 LEU HD13 1 1 10 3792 1 1 25 LEU HD21 H 0.184 -17.914 -5.526 1.00 . A A . 25 LEU HD21 1 1 10 3793 1 1 25 LEU HD22 H -0.052 -17.069 -3.998 1.00 . A A . 25 LEU HD22 1 1 10 3794 1 1 25 LEU HD23 H 0.522 -18.736 -4.004 1.00 . A A . 25 LEU HD23 1 1 10 3795 1 1 25 LEU HG H 2.165 -16.743 -5.503 1.00 . A A . 25 LEU HG 1 1 10 3796 1 1 25 LEU N N 1.933 -16.253 -0.990 1.00 . A A . 25 LEU N 1 1 10 3797 1 1 25 LEU O O 3.752 -18.978 -1.586 1.00 . A A . 25 LEU O 1 1 10 3798 1 1 26 NH2 HN1 H 4.646 -16.071 -2.088 1.00 . A A . 26 NH2 HN1 1 1 10 3799 1 1 26 NH2 HN2 H 5.610 -17.432 -1.730 1.00 . A A . 26 NH2 HN2 1 1 10 3800 1 1 26 NH2 N N 4.725 -17.032 -1.888 1.00 . A A . 26 NH2 N 1 1 stop_ save_
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