NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
653800 | 6vla | 30717 | cing | 4-filtered-FRED | STAR | entry | full | 204 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6vla # This FRED archive file contains, for PDB entry <6vla>: # # - 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_6vla _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6vla _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2065.61 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 $Intragenic_antimicrobial_peptide A . 1 1 stop_ save_ save_Intragenic_antimicrobial_peptide _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Intragenic antimicrobial peptide" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code LMGLFNRIIRKVVKLFN _Entity.Number_of_monomers 17 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 LEU . 1 1 2 MET . 1 1 3 GLY . 1 1 4 LEU . 1 1 5 PHE . 1 1 6 ASN . 1 1 7 ARG . 1 1 8 ILE . 1 1 9 ILE . 1 1 10 ARG . 1 1 11 LYS . 1 1 12 VAL . 1 1 13 VAL . 1 1 14 LYS . 1 1 15 LEU . 1 1 16 PHE . 1 1 17 ASN . 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 LEU 1 1 1 1 MET 2 2 1 1 GLY 3 3 1 1 LEU 4 4 1 1 PHE 5 5 1 1 ASN 6 6 1 1 ARG 7 7 1 1 ILE 8 8 1 1 ILE 9 9 1 1 ARG 10 10 1 1 LYS 11 11 1 1 VAL 12 12 1 1 VAL 13 13 1 1 LYS 14 14 1 1 LEU 15 15 1 1 PHE 16 16 1 1 ASN 17 17 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 LEU HA . 1 . HA 1 1 1 1 2 1 1 1 LEU HB2 . 1 . HB2 1 1 2 1 1 1 1 1 LEU HA . 1 . HA 1 1 2 1 2 1 1 1 LEU HB3 . 1 . HB3 1 1 3 1 1 1 1 1 LEU HA . 1 . HA 1 1 3 1 2 1 1 1 LEU HG . 1 . HG 1 1 4 1 1 1 1 1 LEU HB3 . 1 . HB3 1 1 4 1 2 1 1 1 LEU HG . 1 . HG 1 1 5 1 1 1 1 2 MET HA . 2 . HA 1 1 5 1 2 1 1 2 MET HB3 . 2 . HB3 1 1 6 1 1 1 1 2 MET HA . 2 . HA 1 1 6 1 2 1 1 2 MET HG2 . 2 . HG2 1 1 7 1 1 1 1 2 MET HA . 2 . HA 1 1 7 1 2 1 1 2 MET HG3 . 2 . HG3 1 1 8 1 1 1 1 2 MET HA . 2 . HA 1 1 8 1 2 1 1 5 PHE HB2 . 5 . HB2 1 1 9 1 1 1 1 2 MET HB3 . 2 . HB3 1 1 9 1 2 1 1 2 MET HG2 . 2 . HG2 1 1 10 1 1 1 1 2 MET HB3 . 2 . HB3 1 1 10 1 2 1 1 2 MET HG3 . 2 . HG3 1 1 11 1 1 1 1 2 MET HB3 . 2 . HB3 1 1 11 1 2 1 1 5 PHE QB . 5 . HB2 1 1 12 1 1 1 1 3 GLY HA2 . 3 . HA2 1 1 12 1 2 1 1 4 LEU H . 4 . H 1 1 13 1 1 1 1 4 LEU H . 4 . H 1 1 13 1 2 1 1 4 LEU HA . 4 . HA 1 1 14 1 1 1 1 4 LEU H . 4 . H 1 1 14 1 2 1 1 4 LEU MD2 . 4 . HD2# 1 1 15 1 1 1 1 4 LEU H . 4 . H 1 1 15 1 2 1 1 4 LEU HG . 4 . HG 1 1 16 1 1 1 1 4 LEU HA . 4 . HA 1 1 16 1 2 1 1 4 LEU HB3 . 4 . HB3 1 1 17 1 1 1 1 4 LEU HA . 4 . HA 1 1 17 1 2 1 1 4 LEU MD2 . 4 . HD2# 1 1 18 1 1 1 1 4 LEU HA . 4 . HA 1 1 18 1 2 1 1 4 LEU HG . 4 . HG 1 1 19 1 1 1 1 4 LEU HA . 4 . HA 1 1 19 1 2 1 1 7 ARG HD2 . 7 . HD2 1 1 20 1 1 1 1 4 LEU HB3 . 4 . HB3 1 1 20 1 2 1 1 4 LEU MD2 . 4 . HD2# 1 1 21 1 1 1 1 4 LEU HB3 . 4 . HB3 1 1 21 1 2 1 1 4 LEU HG . 4 . HG 1 1 22 1 1 1 1 4 LEU MD1 . 4 . HD1# 1 1 22 1 2 1 1 5 PHE QB . 5 . HB2 1 1 23 1 1 1 1 4 LEU MD2 . 4 . HD2# 1 1 23 1 2 1 1 4 LEU HG . 4 . HG 1 1 24 1 1 1 1 4 LEU HG . 4 . HG 1 1 24 1 2 1 1 5 PHE H . 5 . H 1 1 25 1 1 1 1 5 PHE H . 5 . H 1 1 25 1 2 1 1 5 PHE HB2 . 5 . HB2 1 1 26 1 1 1 1 5 PHE HA . 5 . HA 1 1 26 1 2 1 1 5 PHE QB . 5 . HB2 1 1 27 1 1 1 1 5 PHE HA . 5 . HA 1 1 27 1 2 1 1 5 PHE QD . 5 . HD# 1 1 28 1 1 1 1 5 PHE HA . 5 . HA 1 1 28 1 2 1 1 6 ASN H . 6 . H 1 1 29 1 1 1 1 5 PHE HA . 5 . HA 1 1 29 1 2 1 1 7 ARG H . 7 . H 1 1 30 1 1 1 1 5 PHE HA . 5 . HA 1 1 30 1 2 1 1 8 ILE H . 8 . H 1 1 31 1 1 1 1 5 PHE HA . 5 . HA 1 1 31 1 2 1 1 8 ILE HB . 8 . HB 1 1 32 1 1 1 1 5 PHE HA . 5 . HA 1 1 32 1 2 1 1 9 ILE H . 9 . H 1 1 33 1 1 1 1 5 PHE QB . 5 . HB2 1 1 33 1 2 1 1 5 PHE QD . 5 . HD# 1 1 34 1 1 1 1 5 PHE QB . 5 . HB2 1 1 34 1 2 1 1 9 ILE MD . 9 . HD1# 1 1 35 1 1 1 1 5 PHE HB3 . 5 . HB3 1 1 35 1 2 1 1 6 ASN H . 6 . H 1 1 36 1 1 1 1 6 ASN H . 6 . H 1 1 36 1 2 1 1 6 ASN HA . 6 . HA 1 1 37 1 1 1 1 6 ASN H . 6 . H 1 1 37 1 2 1 1 6 ASN HB2 . 6 . HB2 1 1 38 1 1 1 1 6 ASN H . 6 . H 1 1 38 1 2 1 1 6 ASN HB3 . 6 . HB3 1 1 39 1 1 1 1 6 ASN H . 6 . H 1 1 39 1 2 1 1 7 ARG H . 7 . H 1 1 40 1 1 1 1 6 ASN H . 6 . H 1 1 40 1 2 1 1 8 ILE H . 8 . H 1 1 41 1 1 1 1 6 ASN HA . 6 . HA 1 1 41 1 2 1 1 6 ASN HB2 . 6 . HB2 1 1 42 1 1 1 1 6 ASN HA . 6 . HA 1 1 42 1 2 1 1 6 ASN HB3 . 6 . HB3 1 1 43 1 1 1 1 6 ASN HA . 6 . HA 1 1 43 1 2 1 1 7 ARG H . 7 . H 1 1 44 1 1 1 1 6 ASN HA . 6 . HA 1 1 44 1 2 1 1 8 ILE H . 8 . H 1 1 45 1 1 1 1 6 ASN HA . 6 . HA 1 1 45 1 2 1 1 9 ILE H . 9 . H 1 1 46 1 1 1 1 6 ASN HA . 6 . HA 1 1 46 1 2 1 1 9 ILE MD . 9 . HD1# 1 1 47 1 1 1 1 6 ASN HA . 6 . HA 1 1 47 1 2 1 1 9 ILE HG12 . 9 . HG12 1 1 48 1 1 1 1 6 ASN HB2 . 6 . HB2 1 1 48 1 2 1 1 7 ARG H . 7 . H 1 1 49 1 1 1 1 6 ASN HB2 . 6 . HB2 1 1 49 1 2 1 1 7 ARG HA . 7 . HA 1 1 50 1 1 1 1 6 ASN HB3 . 6 . HB3 1 1 50 1 2 1 1 7 ARG H . 7 . H 1 1 51 1 1 1 1 6 ASN HB3 . 6 . HB3 1 1 51 1 2 1 1 7 ARG HA . 7 . HA 1 1 52 1 1 1 1 7 ARG H . 7 . H 1 1 52 1 2 1 1 7 ARG HA . 7 . HA 1 1 53 1 1 1 1 7 ARG H . 7 . H 1 1 53 1 2 1 1 7 ARG QD . 7 . HD2 1 1 54 1 1 1 1 7 ARG H . 7 . H 1 1 54 1 2 1 1 8 ILE H . 8 . H 1 1 55 1 1 1 1 7 ARG HA . 7 . HA 1 1 55 1 2 1 1 7 ARG QB . 7 . HB2 1 1 56 1 1 1 1 7 ARG HA . 7 . HA 1 1 56 1 2 1 1 7 ARG HB3 . 7 . HB2 1 1 57 1 1 1 1 7 ARG HA . 7 . HA 1 1 57 1 2 1 1 7 ARG QD . 7 . HD2 1 1 58 1 1 1 1 7 ARG HA . 7 . HA 1 1 58 1 2 1 1 7 ARG HG2 . 7 . HG2 1 1 59 1 1 1 1 7 ARG HA . 7 . HA 1 1 59 1 2 1 1 8 ILE H . 8 . H 1 1 60 1 1 1 1 7 ARG HA . 7 . HA 1 1 60 1 2 1 1 9 ILE H . 9 . H 1 1 61 1 1 1 1 7 ARG HA . 7 . HA 1 1 61 1 2 1 1 11 LYS H . 11 . H 1 1 62 1 1 1 1 7 ARG HB3 . 7 . HB2 1 1 62 1 2 1 1 7 ARG QD . 7 . HD2 1 1 63 1 1 1 1 7 ARG QD . 7 . HD2 1 1 63 1 2 1 1 7 ARG HG2 . 7 . HG2 1 1 64 1 1 1 1 7 ARG HD2 . 7 . HD2 1 1 64 1 2 1 1 7 ARG HG3 . 7 . HG3 1 1 65 1 1 1 1 7 ARG HD3 . 7 . HD3 1 1 65 1 2 1 1 8 ILE H . 8 . H 1 1 66 1 1 1 1 7 ARG HD3 . 7 . HD3 1 1 66 1 2 1 1 11 LYS QB . 11 . HB2 1 1 67 1 1 1 1 7 ARG QG . 7 . HG2 1 1 67 1 2 1 1 8 ILE H . 8 . H 1 1 68 1 1 1 1 8 ILE H . 8 . H 1 1 68 1 2 1 1 8 ILE HA . 8 . HA 1 1 69 1 1 1 1 8 ILE H . 8 . H 1 1 69 1 2 1 1 8 ILE HB . 8 . HB 1 1 70 1 1 1 1 8 ILE H . 8 . H 1 1 70 1 2 1 1 9 ILE H . 9 . H 1 1 71 1 1 1 1 8 ILE HA . 8 . HA 1 1 71 1 2 1 1 8 ILE HB . 8 . HB 1 1 72 1 1 1 1 8 ILE HA . 8 . HA 1 1 72 1 2 1 1 8 ILE MG . 8 . HG2# 1 1 73 1 1 1 1 8 ILE HA . 8 . HA 1 1 73 1 2 1 1 9 ILE H . 9 . H 1 1 74 1 1 1 1 8 ILE HA . 8 . HA 1 1 74 1 2 1 1 11 LYS H . 11 . H 1 1 75 1 1 1 1 8 ILE HB . 8 . HB 1 1 75 1 2 1 1 8 ILE MG . 8 . HG2# 1 1 76 1 1 1 1 8 ILE HB . 8 . HB 1 1 76 1 2 1 1 9 ILE H . 9 . H 1 1 77 1 1 1 1 8 ILE HB . 8 . HB 1 1 77 1 2 1 1 9 ILE MD . 9 . HD1# 1 1 78 1 1 1 1 8 ILE MG . 8 . HG2# 1 1 78 1 2 1 1 12 VAL HB . 12 . HB 1 1 79 1 1 1 1 9 ILE H . 9 . H 1 1 79 1 2 1 1 9 ILE HA . 9 . HA 1 1 80 1 1 1 1 9 ILE H . 9 . H 1 1 80 1 2 1 1 9 ILE HB . 9 . HB 1 1 81 1 1 1 1 9 ILE H . 9 . H 1 1 81 1 2 1 1 9 ILE MD . 9 . HD1# 1 1 82 1 1 1 1 9 ILE H . 9 . H 1 1 82 1 2 1 1 9 ILE HG12 . 9 . HG12 1 1 83 1 1 1 1 9 ILE H . 9 . H 1 1 83 1 2 1 1 9 ILE HG13 . 9 . HG13 1 1 84 1 1 1 1 9 ILE H . 9 . H 1 1 84 1 2 1 1 10 ARG H . 10 . H 1 1 85 1 1 1 1 9 ILE H . 9 . H 1 1 85 1 2 1 1 10 ARG QD . 10 . HD2 1 1 86 1 1 1 1 9 ILE H . 9 . H 1 1 86 1 2 1 1 11 LYS H . 11 . H 1 1 87 1 1 1 1 9 ILE HA . 9 . HA 1 1 87 1 2 1 1 9 ILE HB . 9 . HB 1 1 88 1 1 1 1 9 ILE HA . 9 . HA 1 1 88 1 2 1 1 9 ILE MD . 9 . HD1# 1 1 89 1 1 1 1 9 ILE HA . 9 . HA 1 1 89 1 2 1 1 9 ILE HG12 . 9 . HG12 1 1 90 1 1 1 1 9 ILE HA . 9 . HA 1 1 90 1 2 1 1 9 ILE MG . 9 . HG2# 1 1 91 1 1 1 1 9 ILE HA . 9 . HA 1 1 91 1 2 1 1 10 ARG H . 10 . H 1 1 92 1 1 1 1 9 ILE HA . 9 . HA 1 1 92 1 2 1 1 11 LYS H . 11 . H 1 1 93 1 1 1 1 9 ILE HA . 9 . HA 1 1 93 1 2 1 1 12 VAL H . 12 . H 1 1 94 1 1 1 1 9 ILE HB . 9 . HB 1 1 94 1 2 1 1 9 ILE MD . 9 . HD1# 1 1 95 1 1 1 1 9 ILE HB . 9 . HB 1 1 95 1 2 1 1 9 ILE HG12 . 9 . HG12 1 1 96 1 1 1 1 9 ILE HB . 9 . HB 1 1 96 1 2 1 1 9 ILE HG13 . 9 . HG13 1 1 97 1 1 1 1 9 ILE HB . 9 . HB 1 1 97 1 2 1 1 9 ILE MG . 9 . HG2# 1 1 98 1 1 1 1 9 ILE MD . 9 . HD1# 1 1 98 1 2 1 1 9 ILE HG12 . 9 . HG12 1 1 99 1 1 1 1 9 ILE MD . 9 . HD1# 1 1 99 1 2 1 1 9 ILE HG13 . 9 . HG13 1 1 100 1 1 1 1 9 ILE MD . 9 . HD1# 1 1 100 1 2 1 1 9 ILE MG . 9 . HG2# 1 1 101 1 1 1 1 9 ILE MD . 9 . HD1# 1 1 101 1 2 1 1 12 VAL HB . 12 . HB 1 1 102 1 1 1 1 9 ILE MG . 9 . HG2# 1 1 102 1 2 1 1 13 VAL HB . 13 . HB 1 1 103 1 1 1 1 10 ARG H . 10 . H 1 1 103 1 2 1 1 10 ARG HA . 10 . HA 1 1 104 1 1 1 1 10 ARG H . 10 . H 1 1 104 1 2 1 1 10 ARG QD . 10 . HD2 1 1 105 1 1 1 1 10 ARG HA . 10 . HA 1 1 105 1 2 1 1 10 ARG QB . 10 . HB2 1 1 106 1 1 1 1 10 ARG HA . 10 . HA 1 1 106 1 2 1 1 10 ARG QD . 10 . HD2 1 1 107 1 1 1 1 10 ARG HA . 10 . HA 1 1 107 1 2 1 1 10 ARG HG3 . 10 . HG3 1 1 108 1 1 1 1 10 ARG HA . 10 . HA 1 1 108 1 2 1 1 11 LYS H . 11 . H 1 1 109 1 1 1 1 10 ARG HA . 10 . HA 1 1 109 1 2 1 1 12 VAL H . 12 . H 1 1 110 1 1 1 1 10 ARG HA . 10 . HA 1 1 110 1 2 1 1 12 VAL HB . 12 . HB 1 1 111 1 1 1 1 10 ARG HA . 10 . HA 1 1 111 1 2 1 1 13 VAL H . 13 . H 1 1 112 1 1 1 1 10 ARG HA . 10 . HA 1 1 112 1 2 1 1 13 VAL HB . 13 . HB 1 1 113 1 1 1 1 10 ARG HA . 10 . HA 1 1 113 1 2 1 1 13 VAL MG1 . 13 . HG2# 1 1 114 1 1 1 1 10 ARG HA . 10 . HA 1 1 114 1 2 1 1 13 VAL MG2 . 13 . HG1# 1 1 115 1 1 1 1 10 ARG HA . 10 . HA 1 1 115 1 2 1 1 14 LYS QG . 14 . HG2 1 1 116 1 1 1 1 10 ARG QB . 10 . HB3 1 1 116 1 2 1 1 10 ARG QD . 10 . HD3 1 1 117 1 1 1 1 10 ARG QB . 10 . HB2 1 1 117 1 2 1 1 10 ARG HG3 . 10 . HG3 1 1 118 1 1 1 1 10 ARG QD . 10 . HD3 1 1 118 1 2 1 1 10 ARG HG3 . 10 . HG3 1 1 119 1 1 1 1 10 ARG QD . 10 . HD3 1 1 119 1 2 1 1 13 VAL HB . 13 . HB 1 1 120 1 1 1 1 11 LYS H . 11 . H 1 1 120 1 2 1 1 11 LYS HA . 11 . HA 1 1 121 1 1 1 1 11 LYS H . 11 . H 1 1 121 1 2 1 1 11 LYS HB3 . 11 . HB3 1 1 122 1 1 1 1 11 LYS H . 11 . H 1 1 122 1 2 1 1 12 VAL H . 12 . H 1 1 123 1 1 1 1 11 LYS HA . 11 . HA 1 1 123 1 2 1 1 11 LYS HB3 . 11 . HB3 1 1 124 1 1 1 1 11 LYS HA . 11 . HA 1 1 124 1 2 1 1 12 VAL H . 12 . H 1 1 125 1 1 1 1 11 LYS HA . 11 . HA 1 1 125 1 2 1 1 13 VAL H . 13 . H 1 1 126 1 1 1 1 12 VAL H . 12 . H 1 1 126 1 2 1 1 12 VAL HA . 12 . HA 1 1 127 1 1 1 1 12 VAL H . 12 . H 1 1 127 1 2 1 1 12 VAL HB . 12 . HB 1 1 128 1 1 1 1 12 VAL H . 12 . H 1 1 128 1 2 1 1 12 VAL MG2 . 12 . HG1# 1 1 129 1 1 1 1 12 VAL H . 12 . H 1 1 129 1 2 1 1 13 VAL H . 13 . H 1 1 130 1 1 1 1 12 VAL HA . 12 . HA 1 1 130 1 2 1 1 12 VAL HB . 12 . HB 1 1 131 1 1 1 1 12 VAL HA . 12 . HA 1 1 131 1 2 1 1 12 VAL MG1 . 12 . HG2# 1 1 132 1 1 1 1 12 VAL HA . 12 . HA 1 1 132 1 2 1 1 12 VAL MG2 . 12 . HG1# 1 1 133 1 1 1 1 12 VAL HA . 12 . HA 1 1 133 1 2 1 1 15 LEU H . 15 . H 1 1 134 1 1 1 1 12 VAL HB . 12 . HB 1 1 134 1 2 1 1 12 VAL MG1 . 12 . HG2# 1 1 135 1 1 1 1 12 VAL HB . 12 . HB 1 1 135 1 2 1 1 12 VAL MG2 . 12 . HG1# 1 1 136 1 1 1 1 12 VAL HB . 12 . HB 1 1 136 1 2 1 1 13 VAL H . 13 . H 1 1 137 1 1 1 1 12 VAL MG1 . 12 . HG2# 1 1 137 1 2 1 1 15 LEU H . 15 . H 1 1 138 1 1 1 1 12 VAL MG1 . 12 . HG2# 1 1 138 1 2 1 1 16 PHE H . 16 . H 1 1 139 1 1 1 1 13 VAL H . 13 . H 1 1 139 1 2 1 1 13 VAL HA . 13 . HA 1 1 140 1 1 1 1 13 VAL H . 13 . H 1 1 140 1 2 1 1 13 VAL HB . 13 . HB 1 1 141 1 1 1 1 13 VAL H . 13 . H 1 1 141 1 2 1 1 13 VAL MG1 . 13 . HG2# 1 1 142 1 1 1 1 13 VAL H . 13 . H 1 1 142 1 2 1 1 14 LYS H . 14 . H 1 1 143 1 1 1 1 13 VAL H . 13 . H 1 1 143 1 2 1 1 14 LYS QB . 14 . HB3 1 1 144 1 1 1 1 13 VAL H . 13 . H 1 1 144 1 2 1 1 15 LEU H . 15 . H 1 1 145 1 1 1 1 13 VAL HA . 13 . HA 1 1 145 1 2 1 1 13 VAL HB . 13 . HB 1 1 146 1 1 1 1 13 VAL HA . 13 . HA 1 1 146 1 2 1 1 13 VAL MG2 . 13 . HG1# 1 1 147 1 1 1 1 13 VAL HA . 13 . HA 1 1 147 1 2 1 1 14 LYS H . 14 . H 1 1 148 1 1 1 1 13 VAL HA . 13 . HA 1 1 148 1 2 1 1 16 PHE H . 16 . H 1 1 149 1 1 1 1 13 VAL HA . 13 . HA 1 1 149 1 2 1 1 16 PHE HB2 . 16 . HB2 1 1 150 1 1 1 1 13 VAL HA . 13 . HA 1 1 150 1 2 1 1 16 PHE HB3 . 16 . HB3 1 1 151 1 1 1 1 13 VAL HA . 13 . HA 1 1 151 1 2 1 1 17 ASN H . 17 . H 1 1 152 1 1 1 1 13 VAL HA . 13 . HA 1 1 152 1 2 1 1 17 ASN HD22 . 17 . HD22 1 1 153 1 1 1 1 13 VAL HB . 13 . HB 1 1 153 1 2 1 1 13 VAL MG1 . 13 . HG2# 1 1 154 1 1 1 1 13 VAL HB . 13 . HB 1 1 154 1 2 1 1 13 VAL MG2 . 13 . HG1# 1 1 155 1 1 1 1 13 VAL HB . 13 . HB 1 1 155 1 2 1 1 14 LYS H . 14 . H 1 1 156 1 1 1 1 13 VAL HB . 13 . HB 1 1 156 1 2 1 1 16 PHE H . 16 . H 1 1 157 1 1 1 1 13 VAL MG1 . 13 . HG2# 1 1 157 1 2 1 1 14 LYS H . 14 . H 1 1 158 1 1 1 1 13 VAL MG1 . 13 . HG2# 1 1 158 1 2 1 1 14 LYS HA . 14 . HA 1 1 159 1 1 1 1 13 VAL MG1 . 13 . HG2# 1 1 159 1 2 1 1 17 ASN H . 17 . H 1 1 160 1 1 1 1 13 VAL MG2 . 13 . HG1# 1 1 160 1 2 1 1 17 ASN H . 17 . H 1 1 161 1 1 1 1 13 VAL MG2 . 13 . HG1# 1 1 161 1 2 1 1 17 ASN HD22 . 17 . HD22 1 1 162 1 1 1 1 14 LYS H . 14 . H 1 1 162 1 2 1 1 14 LYS HA . 14 . HA 1 1 163 1 1 1 1 14 LYS H . 14 . H 1 1 163 1 2 1 1 14 LYS QB . 14 . HB3 1 1 164 1 1 1 1 14 LYS H . 14 . H 1 1 164 1 2 1 1 14 LYS QD . 14 . HD2 1 1 165 1 1 1 1 14 LYS H . 14 . H 1 1 165 1 2 1 1 14 LYS QG . 14 . HG3 1 1 166 1 1 1 1 14 LYS H . 14 . H 1 1 166 1 2 1 1 15 LEU H . 15 . H 1 1 167 1 1 1 1 14 LYS H . 14 . H 1 1 167 1 2 1 1 15 LEU HG . 15 . HG 1 1 168 1 1 1 1 14 LYS H . 14 . H 1 1 168 1 2 1 1 16 PHE HB2 . 16 . HB2 1 1 169 1 1 1 1 14 LYS HA . 14 . HA 1 1 169 1 2 1 1 14 LYS QB . 14 . HB2 1 1 170 1 1 1 1 14 LYS HA . 14 . HA 1 1 170 1 2 1 1 14 LYS QD . 14 . HD2 1 1 171 1 1 1 1 14 LYS HA . 14 . HA 1 1 171 1 2 1 1 14 LYS QE . 14 . HE3 1 1 172 1 1 1 1 14 LYS HA . 14 . HA 1 1 172 1 2 1 1 14 LYS QG . 14 . HG2 1 1 173 1 1 1 1 14 LYS HA . 14 . HA 1 1 173 1 2 1 1 17 ASN H . 17 . H 1 1 174 1 1 1 1 14 LYS QB . 14 . HB2 1 1 174 1 2 1 1 14 LYS QD . 14 . HD2 1 1 175 1 1 1 1 14 LYS QB . 14 . HB2 1 1 175 1 2 1 1 14 LYS QE . 14 . HE3 1 1 176 1 1 1 1 14 LYS QB . 14 . HB2 1 1 176 1 2 1 1 14 LYS QG . 14 . HG3 1 1 177 1 1 1 1 14 LYS QD . 14 . HD2 1 1 177 1 2 1 1 14 LYS QG . 14 . HG2 1 1 178 1 1 1 1 14 LYS QE . 14 . HE3 1 1 178 1 2 1 1 14 LYS QG . 14 . HG3 1 1 179 1 1 1 1 15 LEU H . 15 . H 1 1 179 1 2 1 1 15 LEU HA . 15 . HA 1 1 180 1 1 1 1 15 LEU H . 15 . H 1 1 180 1 2 1 1 15 LEU HB3 . 15 . HB3 1 1 181 1 1 1 1 15 LEU H . 15 . H 1 1 181 1 2 1 1 15 LEU HG . 15 . HG 1 1 182 1 1 1 1 15 LEU HA . 15 . HA 1 1 182 1 2 1 1 15 LEU HB3 . 15 . HB3 1 1 183 1 1 1 1 15 LEU HA . 15 . HA 1 1 183 1 2 1 1 16 PHE H . 16 . H 1 1 184 1 1 1 1 15 LEU HB3 . 15 . HB3 1 1 184 1 2 1 1 15 LEU HG . 15 . HG 1 1 185 1 1 1 1 15 LEU HG . 15 . HG 1 1 185 1 2 1 1 16 PHE H . 16 . H 1 1 186 1 1 1 1 15 LEU HG . 15 . HG 1 1 186 1 2 1 1 16 PHE HA . 16 . HA 1 1 187 1 1 1 1 16 PHE H . 16 . H 1 1 187 1 2 1 1 16 PHE HA . 16 . HA 1 1 188 1 1 1 1 16 PHE H . 16 . H 1 1 188 1 2 1 1 16 PHE HB2 . 16 . HB2 1 1 189 1 1 1 1 16 PHE H . 16 . H 1 1 189 1 2 1 1 16 PHE HB3 . 16 . HB3 1 1 190 1 1 1 1 16 PHE HA . 16 . HA 1 1 190 1 2 1 1 16 PHE HB2 . 16 . HB2 1 1 191 1 1 1 1 16 PHE HA . 16 . HA 1 1 191 1 2 1 1 16 PHE HB3 . 16 . HB3 1 1 192 1 1 1 1 16 PHE HA . 16 . HA 1 1 192 1 2 1 1 16 PHE QD . 16 . HD# 1 1 193 1 1 1 1 16 PHE HA . 16 . HA 1 1 193 1 2 1 1 17 ASN H . 17 . H 1 1 194 1 1 1 1 16 PHE HB2 . 16 . HB2 1 1 194 1 2 1 1 17 ASN H . 17 . H 1 1 195 1 1 1 1 16 PHE HB3 . 16 . HB3 1 1 195 1 2 1 1 17 ASN H . 17 . H 1 1 196 1 1 1 1 17 ASN H . 17 . H 1 1 196 1 2 1 1 17 ASN HA . 17 . HA 1 1 197 1 1 1 1 17 ASN H . 17 . H 1 1 197 1 2 1 1 17 ASN HB3 . 17 . HB3 1 1 198 1 1 1 1 17 ASN H . 17 . H 1 1 198 1 2 1 1 17 ASN HD22 . 17 . HD22 1 1 199 1 1 1 1 17 ASN HA . 17 . HA 1 1 199 1 2 1 1 17 ASN HB2 . 17 . HB2 1 1 200 1 1 1 1 17 ASN HA . 17 . HA 1 1 200 1 2 1 1 17 ASN HB3 . 17 . HB3 1 1 201 1 1 1 1 17 ASN HA . 17 . HA 1 1 201 1 2 1 1 17 ASN HD21 . 17 . HD21 1 1 202 1 1 1 1 17 ASN HA . 17 . HA 1 1 202 1 2 1 1 17 ASN HD22 . 17 . HD22 1 1 203 1 1 1 1 17 ASN HB2 . 17 . HB2 1 1 203 1 2 1 1 17 ASN HD22 . 17 . HD22 1 1 204 1 1 1 1 17 ASN HB3 . 17 . HB3 1 1 204 1 2 1 1 17 ASN HD22 . 17 . HD22 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.9 1.9 3.8 1 1 2 1 . . . . . 2.7 1.8 3.4 1 1 3 1 . . . . . 2.4 1.7 3.1 1 1 4 1 . . . . . 2.1 1.5 2.7 1 1 5 1 . . . . . 2.4 1.9 3.1 1 1 6 1 . . . . . 2.9 2.0 4.0 1 1 7 1 . . . . . 2.9 2.0 3.9 1 1 8 1 . . . . . 2.7 2.0 3.6 1 1 9 1 . . . . . 2.3 1.7 3.0 1 1 10 1 . . . . . 2.3 1.6 3.0 1 1 11 1 . . . . . 3.0 1.9 4.1 1 1 12 1 . . . . . 3.6 2.0 5.2 1 1 13 1 . . . . . 3.0 1.9 4.1 1 1 14 1 . . . . . 2.9 1.9 3.9 1 1 15 1 . . . . . 2.7 1.8 3.6 1 1 16 1 . . . . . 2.7 1.8 3.6 1 1 17 1 . . . . . 2.2 1.6 2.8 1 1 18 1 . . . . . 2.3 1.6 3.0 1 1 19 1 . . . . . 2.7 1.8 3.6 1 1 20 1 . . . . . 2.4 1.8 3.1 1 1 21 1 . . . . . 2.7 1.8 3.3 1 1 22 1 . . . . . 2.7 1.8 3.6 1 1 23 1 . . . . . 2.1 1.6 2.6 1 1 24 1 . . . . . 2.9 1.9 3.9 1 1 25 1 . . . . . 2.6 1.7 3.5 1 1 26 1 . . . . . 2.6 1.8 3.4 1 1 27 1 . . . . . 2.4 1.7 3.1 1 1 28 1 . . . . . 3.2 1.9 4.5 1 1 29 1 . . . . . 3.4 1.9 4.9 1 1 30 1 . . . . . 3.1 1.9 4.3 1 1 31 1 . . . . . 2.8 1.9 3.8 1 1 32 1 . . . . . 3.3 1.9 4.7 1 1 33 1 . . . . . 2.4 1.7 3.1 1 1 34 1 . . . . . 3.0 1.9 4.1 1 1 35 1 . . . . . 2.6 1.7 3.5 1 1 36 1 . . . . . 2.8 1.8 3.8 1 1 37 1 . . . . . 2.8 1.8 3.8 1 1 38 1 . . . . . 2.8 1.8 3.8 1 1 39 1 . . . . . 3.1 1.9 4.3 1 1 40 1 . . . . . 3.6 2.0 5.2 1 1 41 1 . . . . . 2.6 1.9 3.4 1 1 42 1 . . . . . 2.5 1.9 3.3 1 1 43 1 . . . . . 3.0 1.9 4.1 1 1 44 1 . . . . . 3.6 1.9 5.3 1 1 45 1 . . . . . 3.1 1.9 4.3 1 1 46 1 . . . . . 3.4 2.0 3.6 1 1 47 1 . . . . . 3.3 1.9 4.7 1 1 48 1 . . . . . 2.9 1.8 4.0 1 1 49 1 . . . . . 3.0 1.9 4.2 1 1 50 1 . . . . . 2.9 1.8 4.0 1 1 51 1 . . . . . 3.1 1.9 4.3 1 1 52 1 . . . . . 2.7 1.8 3.6 1 1 53 1 . . . . . 2.7 1.8 3.6 1 1 54 1 . . . . . 3.0 1.9 3.8 1 1 55 1 . . . . . 2.4 1.7 3.0 1 1 56 1 . . . . . 2.6 1.8 3.4 1 1 57 1 . . . . . 2.7 1.8 3.6 1 1 58 1 . . . . . 2.7 1.8 3.6 1 1 59 1 . . . . . 3.1 1.9 4.3 1 1 60 1 . . . . . 3.6 2.0 5.2 1 1 61 1 . . . . . 3.2 1.9 4.5 1 1 62 1 . . . . . 2.3 1.6 2.8 1 1 63 1 . . . . . 2.4 1.7 3.0 1 1 64 1 . . . . . 2.3 1.6 3.0 1 1 65 1 . . . . . 3.2 1.9 4.5 1 1 66 1 . . . . . 2.5 1.7 3.3 1 1 67 1 . . . . . 3.3 2.0 4.6 1 1 68 1 . . . . . 2.7 1.8 3.6 1 1 69 1 . . . . . 2.7 1.8 3.6 1 1 70 1 . . . . . 2.9 1.9 3.9 1 1 71 1 . . . . . 2.5 1.7 3.0 1 1 72 1 . . . . . 2.1 1.6 2.6 1 1 73 1 . . . . . 3.1 1.9 4.3 1 1 74 1 . . . . . 2.9 1.9 3.9 1 1 75 1 . . . . . 2.1 1.6 2.6 1 1 76 1 . . . . . 2.8 1.8 3.8 1 1 77 1 . . . . . 3.1 1.9 4.3 1 1 78 1 . . . . . 2.8 1.8 3.6 1 1 79 1 . . . . . 2.8 1.8 3.8 1 1 80 1 . . . . . 2.5 1.7 3.3 1 1 81 1 . . . . . 2.9 1.9 3.9 1 1 82 1 . . . . . 2.8 1.8 3.8 1 1 83 1 . . . . . 2.7 1.8 3.6 1 1 84 1 . . . . . 2.9 1.9 3.8 1 1 85 1 . . . . . 3.2 1.9 4.5 1 1 86 1 . . . . . 3.5 2.0 4.7 1 1 87 1 . . . . . 2.6 1.8 3.3 1 1 88 1 . . . . . 2.5 1.7 3.3 1 1 89 1 . . . . . 2.8 1.8 3.6 1 1 90 1 . . . . . 2.2 1.6 2.8 1 1 91 1 . . . . . 3.0 1.9 4.1 1 1 92 1 . . . . . 3.1 1.9 4.3 1 1 93 1 . . . . . 2.9 1.9 3.9 1 1 94 1 . . . . . 2.4 1.8 3.1 1 1 95 1 . . . . . 2.3 1.7 3.0 1 1 96 1 . . . . . 2.5 1.7 3.1 1 1 97 1 . . . . . 1.9 1.5 2.4 1 1 98 1 . . . . . 2.3 1.8 3.0 1 1 99 1 . . . . . 2.2 1.7 2.8 1 1 100 1 . . . . . 2.0 1.5 2.5 1 1 101 1 . . . . . 3.3 2.0 4.6 1 1 102 1 . . . . . 2.9 1.8 3.8 1 1 103 1 . . . . . 2.7 1.8 3.6 1 1 104 1 . . . . . 3.1 1.9 3.6 1 1 105 1 . . . . . 2.3 1.6 2.8 1 1 106 1 . . . . . 3.0 1.9 3.8 1 1 107 1 . . . . . 2.6 1.8 3.4 1 1 108 1 . . . . . 2.9 1.8 4.0 1 1 109 1 . . . . . 3.4 1.9 4.9 1 1 110 1 . . . . . 3.6 2.0 5.2 1 1 111 1 . . . . . 2.9 1.8 4.0 1 1 112 1 . . . . . 2.7 1.8 3.6 1 1 113 1 . . . . . 2.5 1.7 3.3 1 1 114 1 . . . . . 2.7 1.8 3.6 1 1 115 1 . . . . . 3.5 2.0 5.0 1 1 116 1 . . . . . 2.1 1.7 2.7 1 1 117 1 . . . . . 2.1 1.6 2.6 1 1 118 1 . . . . . 2.3 1.8 3.0 1 1 119 1 . . . . . 2.9 1.8 4.0 1 1 120 1 . . . . . 2.3 1.6 3.0 1 1 121 1 . . . . . 2.5 1.7 3.3 1 1 122 1 . . . . . 2.8 1.8 3.6 1 1 123 1 . . . . . 2.5 1.7 3.1 1 1 124 1 . . . . . 3.0 1.9 4.1 1 1 125 1 . . . . . 3.1 1.9 4.3 1 1 126 1 . . . . . 2.6 1.7 3.5 1 1 127 1 . . . . . 2.6 1.7 3.5 1 1 128 1 . . . . . 2.3 1.6 3.0 1 1 129 1 . . . . . 2.9 1.9 3.8 1 1 130 1 . . . . . 2.7 1.8 3.3 1 1 131 1 . . . . . 2.0 1.6 2.5 1 1 132 1 . . . . . 2.0 1.5 2.5 1 1 133 1 . . . . . 2.7 1.8 3.6 1 1 134 1 . . . . . 2.2 1.6 2.8 1 1 135 1 . . . . . 2.1 1.7 2.7 1 1 136 1 . . . . . 2.8 1.8 3.8 1 1 137 1 . . . . . 2.8 1.8 3.8 1 1 138 1 . . . . . 3.0 1.8 4.2 1 1 139 1 . . . . . 2.6 1.8 3.4 1 1 140 1 . . . . . 2.5 1.7 3.3 1 1 141 1 . . . . . 2.3 1.7 2.9 1 1 142 1 . . . . . 2.8 1.8 3.6 1 1 143 1 . . . . . 3.0 1.9 4.1 1 1 144 1 . . . . . 3.2 1.9 4.3 1 1 145 1 . . . . . 2.6 1.7 3.1 1 1 146 1 . . . . . 2.0 1.5 2.5 1 1 147 1 . . . . . 2.8 1.8 3.8 1 1 148 1 . . . . . 2.9 1.8 4.0 1 1 149 1 . . . . . 2.9 1.9 3.9 1 1 150 1 . . . . . 2.8 1.8 3.8 1 1 151 1 . . . . . 3.1 1.9 4.3 1 1 152 1 . . . . . 3.6 2.0 5.2 1 1 153 1 . . . . . 2.1 1.6 2.7 1 1 154 1 . . . . . 2.2 1.6 2.8 1 1 155 1 . . . . . 2.7 1.8 3.6 1 1 156 1 . . . . . 3.6 1.9 5.3 1 1 157 1 . . . . . 2.6 1.8 3.4 1 1 158 1 . . . . . 2.7 1.8 3.6 1 1 159 1 . . . . . 3.4 2.0 4.8 1 1 160 1 . . . . . 3.1 1.9 4.3 1 1 161 1 . . . . . 2.9 1.9 3.9 1 1 162 1 . . . . . 2.6 1.7 3.5 1 1 163 1 . . . . . 2.3 1.6 3.0 1 1 164 1 . . . . . 2.8 1.8 3.8 1 1 165 1 . . . . . 2.8 1.8 3.8 1 1 166 1 . . . . . 2.6 1.8 3.4 1 1 167 1 . . . . . 3.1 1.9 4.3 1 1 168 1 . . . . . 3.5 2.0 5.0 1 1 169 1 . . . . . 2.1 1.6 2.6 1 1 170 1 . . . . . 2.2 1.6 2.8 1 1 171 1 . . . . . 3.0 2.0 3.9 1 1 172 1 . . . . . 2.4 1.7 3.1 1 1 173 1 . . . . . 2.8 1.8 3.8 1 1 174 1 . . . . . 2.3 1.6 3.0 1 1 175 1 . . . . . 3.0 1.9 3.9 1 1 176 1 . . . . . 2.3 1.7 3.0 1 1 177 1 . . . . . 2.0 1.5 2.5 1 1 178 1 . . . . . 2.8 1.9 3.6 1 1 179 1 . . . . . 2.4 1.7 3.1 1 1 180 1 . . . . . 2.1 1.5 2.7 1 1 181 1 . . . . . 2.5 1.7 3.3 1 1 182 1 . . . . . 2.4 1.7 3.1 1 1 183 1 . . . . . 2.8 1.8 3.8 1 1 184 1 . . . . . 2.2 1.7 2.8 1 1 185 1 . . . . . 2.8 1.8 3.8 1 1 186 1 . . . . . 3.4 1.9 4.9 1 1 187 1 . . . . . 2.6 1.8 3.4 1 1 188 1 . . . . . 2.5 1.7 3.3 1 1 189 1 . . . . . 2.6 1.8 3.4 1 1 190 1 . . . . . 2.4 1.9 3.1 1 1 191 1 . . . . . 2.4 1.8 3.1 1 1 192 1 . . . . . 2.4 1.7 3.1 1 1 193 1 . . . . . 2.7 1.8 3.6 1 1 194 1 . . . . . 2.7 1.8 3.6 1 1 195 1 . . . . . 2.7 1.8 3.6 1 1 196 1 . . . . . 2.4 1.7 3.1 1 1 197 1 . . . . . 2.5 1.7 3.3 1 1 198 1 . . . . . 3.5 1.9 4.9 1 1 199 1 . . . . . 2.4 1.7 3.1 1 1 200 1 . . . . . 2.4 1.7 3.1 1 1 201 1 . . . . . 2.9 1.9 3.9 1 1 202 1 . . . . . 3.6 2.0 5.2 1 1 203 1 . . . . . 2.9 1.8 4.0 1 1 204 1 . . . . . 3.0 1.9 4.1 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 LEU C C 14.701 -2.607 2.308 1.00 . A A . 1 LEU C 1 1 1 2 1 1 1 LEU CA C 16.123 -2.133 2.584 1.00 . A A . 1 LEU CA 1 1 1 3 1 1 1 LEU CB C 17.096 -2.858 1.638 1.00 . A A . 1 LEU CB 1 1 1 4 1 1 1 LEU CD1 C 19.315 -2.918 2.837 1.00 . A A . 1 LEU CD1 1 1 1 5 1 1 1 LEU CD2 C 19.239 -2.737 0.347 1.00 . A A . 1 LEU CD2 1 1 1 6 1 1 1 LEU CG C 18.546 -2.363 1.648 1.00 . A A . 1 LEU CG 1 1 1 7 1 1 1 LEU H1 H 17.402 -1.987 4.221 1.00 . A A . 1 LEU H1 1 1 1 8 1 1 1 LEU H2 H 16.465 -3.391 4.205 1.00 . A A . 1 LEU H2 1 1 1 9 1 1 1 LEU H3 H 15.763 -1.911 4.621 1.00 . A A . 1 LEU H3 1 1 1 10 1 1 1 LEU HA H 16.175 -1.070 2.399 1.00 . A A . 1 LEU HA 1 1 1 11 1 1 1 LEU HB2 H 17.098 -3.906 1.895 1.00 . A A . 1 LEU HB2 1 1 1 12 1 1 1 LEU HB3 H 16.718 -2.756 0.633 1.00 . A A . 1 LEU HB3 1 1 1 13 1 1 1 LEU HD11 H 19.330 -3.996 2.785 1.00 . A A . 1 LEU HD11 1 1 1 14 1 1 1 LEU HD12 H 18.837 -2.609 3.753 1.00 . A A . 1 LEU HD12 1 1 1 15 1 1 1 LEU HD13 H 20.328 -2.545 2.816 1.00 . A A . 1 LEU HD13 1 1 1 16 1 1 1 LEU HD21 H 18.708 -2.297 -0.483 1.00 . A A . 1 LEU HD21 1 1 1 17 1 1 1 LEU HD22 H 19.248 -3.811 0.240 1.00 . A A . 1 LEU HD22 1 1 1 18 1 1 1 LEU HD23 H 20.254 -2.367 0.361 1.00 . A A . 1 LEU HD23 1 1 1 19 1 1 1 LEU HG H 18.545 -1.288 1.724 1.00 . A A . 1 LEU HG 1 1 1 20 1 1 1 LEU N N 16.465 -2.372 4.004 1.00 . A A . 1 LEU N 1 1 1 21 1 1 1 LEU O O 14.070 -3.215 3.176 1.00 . A A . 1 LEU O 1 1 1 22 1 1 2 MET C C 11.795 -1.862 1.432 1.00 . A A . 2 MET C 1 1 1 23 1 1 2 MET CA C 12.848 -2.672 0.681 1.00 . A A . 2 MET CA 1 1 1 24 1 1 2 MET CB C 12.587 -4.174 0.860 1.00 . A A . 2 MET CB 1 1 1 25 1 1 2 MET CE C 11.324 -5.414 -1.849 1.00 . A A . 2 MET CE 1 1 1 26 1 1 2 MET CG C 13.416 -5.054 -0.062 1.00 . A A . 2 MET CG 1 1 1 27 1 1 2 MET H H 14.772 -1.809 0.473 1.00 . A A . 2 MET H 1 1 1 28 1 1 2 MET HA H 12.767 -2.434 -0.371 1.00 . A A . 2 MET HA 1 1 1 29 1 1 2 MET HB2 H 12.812 -4.446 1.880 1.00 . A A . 2 MET HB2 1 1 1 30 1 1 2 MET HB3 H 11.544 -4.371 0.668 1.00 . A A . 2 MET HB3 1 1 1 31 1 1 2 MET HE1 H 10.946 -5.352 -2.859 1.00 . A A . 2 MET HE1 1 1 1 32 1 1 2 MET HE2 H 10.714 -4.806 -1.198 1.00 . A A . 2 MET HE2 1 1 1 33 1 1 2 MET HE3 H 11.294 -6.441 -1.516 1.00 . A A . 2 MET HE3 1 1 1 34 1 1 2 MET HG2 H 14.459 -4.818 0.085 1.00 . A A . 2 MET HG2 1 1 1 35 1 1 2 MET HG3 H 13.242 -6.087 0.200 1.00 . A A . 2 MET HG3 1 1 1 36 1 1 2 MET N N 14.205 -2.307 1.105 1.00 . A A . 2 MET N 1 1 1 37 1 1 2 MET O O 10.597 -2.096 1.273 1.00 . A A . 2 MET O 1 1 1 38 1 1 2 MET SD S 13.014 -4.824 -1.807 1.00 . A A . 2 MET SD 1 1 1 39 1 1 3 GLY C C 10.421 0.736 2.079 1.00 . A A . 3 GLY C 1 1 1 40 1 1 3 GLY CA C 11.328 -0.060 2.986 1.00 . A A . 3 GLY CA 1 1 1 41 1 1 3 GLY H H 13.211 -0.735 2.291 1.00 . A A . 3 GLY H 1 1 1 42 1 1 3 GLY HA2 H 10.725 -0.689 3.624 1.00 . A A . 3 GLY HA2 1 1 1 43 1 1 3 GLY HA3 H 11.897 0.623 3.600 1.00 . A A . 3 GLY HA3 1 1 1 44 1 1 3 GLY N N 12.244 -0.892 2.227 1.00 . A A . 3 GLY N 1 1 1 45 1 1 3 GLY O O 9.253 0.966 2.399 1.00 . A A . 3 GLY O 1 1 1 46 1 1 4 LEU C C 8.987 0.999 -0.449 1.00 . A A . 4 LEU C 1 1 1 47 1 1 4 LEU CA C 10.203 1.826 -0.098 1.00 . A A . 4 LEU CA 1 1 1 48 1 1 4 LEU CB C 11.013 1.970 -1.382 1.00 . A A . 4 LEU CB 1 1 1 49 1 1 4 LEU CD1 C 13.292 1.422 -2.162 1.00 . A A . 4 LEU CD1 1 1 1 50 1 1 4 LEU CD2 C 12.724 3.766 -1.487 1.00 . A A . 4 LEU CD2 1 1 1 51 1 1 4 LEU CG C 12.484 2.294 -1.215 1.00 . A A . 4 LEU CG 1 1 1 52 1 1 4 LEU H H 11.917 0.947 0.781 1.00 . A A . 4 LEU H 1 1 1 53 1 1 4 LEU HA H 9.914 2.799 0.263 1.00 . A A . 4 LEU HA 1 1 1 54 1 1 4 LEU HB2 H 10.936 1.044 -1.931 1.00 . A A . 4 LEU HB2 1 1 1 55 1 1 4 LEU HB3 H 10.564 2.753 -1.975 1.00 . A A . 4 LEU HB3 1 1 1 56 1 1 4 LEU HD11 H 12.949 0.394 -2.079 1.00 . A A . 4 LEU HD11 1 1 1 57 1 1 4 LEU HD12 H 14.338 1.477 -1.900 1.00 . A A . 4 LEU HD12 1 1 1 58 1 1 4 LEU HD13 H 13.153 1.765 -3.176 1.00 . A A . 4 LEU HD13 1 1 1 59 1 1 4 LEU HD21 H 13.759 4.007 -1.291 1.00 . A A . 4 LEU HD21 1 1 1 60 1 1 4 LEU HD22 H 12.085 4.354 -0.843 1.00 . A A . 4 LEU HD22 1 1 1 61 1 1 4 LEU HD23 H 12.491 3.983 -2.518 1.00 . A A . 4 LEU HD23 1 1 1 62 1 1 4 LEU HG H 12.792 2.081 -0.207 1.00 . A A . 4 LEU HG 1 1 1 63 1 1 4 LEU N N 10.969 1.133 0.933 1.00 . A A . 4 LEU N 1 1 1 64 1 1 4 LEU O O 7.843 1.447 -0.373 1.00 . A A . 4 LEU O 1 1 1 65 1 1 5 PHE C C 7.305 -1.561 -0.245 1.00 . A A . 5 PHE C 1 1 1 66 1 1 5 PHE CA C 8.298 -1.158 -1.327 1.00 . A A . 5 PHE CA 1 1 1 67 1 1 5 PHE CB C 9.008 -2.383 -1.894 1.00 . A A . 5 PHE CB 1 1 1 68 1 1 5 PHE CD1 C 7.801 -4.492 -2.504 1.00 . A A . 5 PHE CD1 1 1 1 69 1 1 5 PHE CD2 C 7.675 -2.642 -4.001 1.00 . A A . 5 PHE CD2 1 1 1 70 1 1 5 PHE CE1 C 6.997 -5.234 -3.347 1.00 . A A . 5 PHE CE1 1 1 1 71 1 1 5 PHE CE2 C 6.872 -3.380 -4.849 1.00 . A A . 5 PHE CE2 1 1 1 72 1 1 5 PHE CG C 8.149 -3.190 -2.822 1.00 . A A . 5 PHE CG 1 1 1 73 1 1 5 PHE CZ C 6.533 -4.677 -4.521 1.00 . A A . 5 PHE CZ 1 1 1 74 1 1 5 PHE H H 10.203 -0.546 -0.714 1.00 . A A . 5 PHE H 1 1 1 75 1 1 5 PHE HA H 7.764 -0.663 -2.124 1.00 . A A . 5 PHE HA 1 1 1 76 1 1 5 PHE HB2 H 9.897 -2.061 -2.431 1.00 . A A . 5 PHE HB2 1 1 1 77 1 1 5 PHE HB3 H 9.302 -3.023 -1.075 1.00 . A A . 5 PHE HB3 1 1 1 78 1 1 5 PHE HD1 H 8.167 -4.929 -1.588 1.00 . A A . 5 PHE HD1 1 1 1 79 1 1 5 PHE HD2 H 7.941 -1.627 -4.258 1.00 . A A . 5 PHE HD2 1 1 1 80 1 1 5 PHE HE1 H 6.733 -6.249 -3.088 1.00 . A A . 5 PHE HE1 1 1 1 81 1 1 5 PHE HE2 H 6.511 -2.942 -5.767 1.00 . A A . 5 PHE HE2 1 1 1 82 1 1 5 PHE HZ H 5.903 -5.255 -5.182 1.00 . A A . 5 PHE HZ 1 1 1 83 1 1 5 PHE N N 9.280 -0.240 -0.809 1.00 . A A . 5 PHE N 1 1 1 84 1 1 5 PHE O O 6.105 -1.606 -0.493 1.00 . A A . 5 PHE O 1 1 1 85 1 1 6 ASN C C 5.940 -1.074 2.355 1.00 . A A . 6 ASN C 1 1 1 86 1 1 6 ASN CA C 6.941 -2.177 2.093 1.00 . A A . 6 ASN CA 1 1 1 87 1 1 6 ASN CB C 7.739 -2.413 3.372 1.00 . A A . 6 ASN CB 1 1 1 88 1 1 6 ASN CG C 8.519 -3.721 3.374 1.00 . A A . 6 ASN CG 1 1 1 89 1 1 6 ASN H H 8.781 -1.759 1.101 1.00 . A A . 6 ASN H 1 1 1 90 1 1 6 ASN HA H 6.409 -3.080 1.834 1.00 . A A . 6 ASN HA 1 1 1 91 1 1 6 ASN HB2 H 8.424 -1.591 3.508 1.00 . A A . 6 ASN HB2 1 1 1 92 1 1 6 ASN HB3 H 7.052 -2.431 4.207 1.00 . A A . 6 ASN HB3 1 1 1 93 1 1 6 ASN HD21 H 8.639 -3.718 1.393 1.00 . A A . 6 ASN HD21 1 1 1 94 1 1 6 ASN HD22 H 9.386 -5.057 2.189 1.00 . A A . 6 ASN HD22 1 1 1 95 1 1 6 ASN N N 7.807 -1.819 0.963 1.00 . A A . 6 ASN N 1 1 1 96 1 1 6 ASN ND2 N 8.885 -4.213 2.202 1.00 . A A . 6 ASN ND2 1 1 1 97 1 1 6 ASN O O 4.785 -1.334 2.700 1.00 . A A . 6 ASN O 1 1 1 98 1 1 6 ASN OD1 O 8.775 -4.294 4.431 1.00 . A A . 6 ASN OD1 1 1 1 99 1 1 7 ARG C C 4.484 1.346 1.291 1.00 . A A . 7 ARG C 1 1 1 100 1 1 7 ARG CA C 5.545 1.304 2.387 1.00 . A A . 7 ARG CA 1 1 1 101 1 1 7 ARG CB C 6.405 2.581 2.425 1.00 . A A . 7 ARG CB 1 1 1 102 1 1 7 ARG CD C 5.604 4.119 0.620 1.00 . A A . 7 ARG CD 1 1 1 103 1 1 7 ARG CG C 5.660 3.871 2.117 1.00 . A A . 7 ARG CG 1 1 1 104 1 1 7 ARG CZ C 4.917 5.947 -0.895 1.00 . A A . 7 ARG CZ 1 1 1 105 1 1 7 ARG H H 7.322 0.304 1.904 1.00 . A A . 7 ARG H 1 1 1 106 1 1 7 ARG HA H 5.067 1.173 3.341 1.00 . A A . 7 ARG HA 1 1 1 107 1 1 7 ARG HB2 H 6.838 2.674 3.409 1.00 . A A . 7 ARG HB2 1 1 1 108 1 1 7 ARG HB3 H 7.204 2.477 1.706 1.00 . A A . 7 ARG HB3 1 1 1 109 1 1 7 ARG HD2 H 6.614 4.201 0.245 1.00 . A A . 7 ARG HD2 1 1 1 110 1 1 7 ARG HD3 H 5.118 3.271 0.155 1.00 . A A . 7 ARG HD3 1 1 1 111 1 1 7 ARG HE H 4.286 5.715 0.991 1.00 . A A . 7 ARG HE 1 1 1 112 1 1 7 ARG HG2 H 4.654 3.794 2.498 1.00 . A A . 7 ARG HG2 1 1 1 113 1 1 7 ARG HG3 H 6.169 4.695 2.593 1.00 . A A . 7 ARG HG3 1 1 1 114 1 1 7 ARG HH11 H 6.248 4.652 -1.708 1.00 . A A . 7 ARG HH11 1 1 1 115 1 1 7 ARG HH12 H 5.731 5.934 -2.750 1.00 . A A . 7 ARG HH12 1 1 1 116 1 1 7 ARG HH21 H 3.612 7.412 -0.376 1.00 . A A . 7 ARG HH21 1 1 1 117 1 1 7 ARG HH22 H 4.236 7.509 -1.996 1.00 . A A . 7 ARG HH22 1 1 1 118 1 1 7 ARG N N 6.392 0.161 2.186 1.00 . A A . 7 ARG N 1 1 1 119 1 1 7 ARG NE N 4.865 5.336 0.290 1.00 . A A . 7 ARG NE 1 1 1 120 1 1 7 ARG NH1 N 5.696 5.474 -1.860 1.00 . A A . 7 ARG NH1 1 1 1 121 1 1 7 ARG NH2 N 4.198 7.042 -1.106 1.00 . A A . 7 ARG NH2 1 1 1 122 1 1 7 ARG O O 3.322 1.674 1.540 1.00 . A A . 7 ARG O 1 1 1 123 1 1 8 ILE C C 2.928 -0.150 -0.839 1.00 . A A . 8 ILE C 1 1 1 124 1 1 8 ILE CA C 3.990 0.922 -1.062 1.00 . A A . 8 ILE CA 1 1 1 125 1 1 8 ILE CB C 4.746 0.629 -2.379 1.00 . A A . 8 ILE CB 1 1 1 126 1 1 8 ILE CD1 C 6.571 1.517 -3.923 1.00 . A A . 8 ILE CD1 1 1 1 127 1 1 8 ILE CG1 C 5.738 1.755 -2.682 1.00 . A A . 8 ILE CG1 1 1 1 128 1 1 8 ILE CG2 C 3.768 0.456 -3.536 1.00 . A A . 8 ILE CG2 1 1 1 129 1 1 8 ILE H H 5.844 0.760 -0.056 1.00 . A A . 8 ILE H 1 1 1 130 1 1 8 ILE HA H 3.503 1.882 -1.156 1.00 . A A . 8 ILE HA 1 1 1 131 1 1 8 ILE HB H 5.290 -0.296 -2.258 1.00 . A A . 8 ILE HB 1 1 1 132 1 1 8 ILE HD11 H 7.145 0.609 -3.803 1.00 . A A . 8 ILE HD11 1 1 1 133 1 1 8 ILE HD12 H 7.242 2.350 -4.071 1.00 . A A . 8 ILE HD12 1 1 1 134 1 1 8 ILE HD13 H 5.921 1.420 -4.780 1.00 . A A . 8 ILE HD13 1 1 1 135 1 1 8 ILE HG12 H 5.196 2.677 -2.822 1.00 . A A . 8 ILE HG12 1 1 1 136 1 1 8 ILE HG13 H 6.413 1.864 -1.845 1.00 . A A . 8 ILE HG13 1 1 1 137 1 1 8 ILE HG21 H 4.312 0.194 -4.432 1.00 . A A . 8 ILE HG21 1 1 1 138 1 1 8 ILE HG22 H 3.235 1.380 -3.697 1.00 . A A . 8 ILE HG22 1 1 1 139 1 1 8 ILE HG23 H 3.064 -0.330 -3.298 1.00 . A A . 8 ILE HG23 1 1 1 140 1 1 8 ILE N N 4.896 0.987 0.076 1.00 . A A . 8 ILE N 1 1 1 141 1 1 8 ILE O O 1.778 0.021 -1.229 1.00 . A A . 8 ILE O 1 1 1 142 1 1 9 ILE C C 1.191 -1.821 0.898 1.00 . A A . 9 ILE C 1 1 1 143 1 1 9 ILE CA C 2.388 -2.335 0.100 1.00 . A A . 9 ILE CA 1 1 1 144 1 1 9 ILE CB C 3.069 -3.478 0.896 1.00 . A A . 9 ILE CB 1 1 1 145 1 1 9 ILE CD1 C 4.246 -4.303 -1.210 1.00 . A A . 9 ILE CD1 1 1 1 146 1 1 9 ILE CG1 C 4.383 -3.902 0.238 1.00 . A A . 9 ILE CG1 1 1 1 147 1 1 9 ILE CG2 C 2.138 -4.674 1.029 1.00 . A A . 9 ILE CG2 1 1 1 148 1 1 9 ILE H H 4.255 -1.327 0.086 1.00 . A A . 9 ILE H 1 1 1 149 1 1 9 ILE HA H 2.036 -2.732 -0.838 1.00 . A A . 9 ILE HA 1 1 1 150 1 1 9 ILE HB H 3.281 -3.112 1.884 1.00 . A A . 9 ILE HB 1 1 1 151 1 1 9 ILE HD11 H 3.837 -3.477 -1.771 1.00 . A A . 9 ILE HD11 1 1 1 152 1 1 9 ILE HD12 H 3.589 -5.153 -1.286 1.00 . A A . 9 ILE HD12 1 1 1 153 1 1 9 ILE HD13 H 5.221 -4.559 -1.604 1.00 . A A . 9 ILE HD13 1 1 1 154 1 1 9 ILE HG12 H 5.081 -3.081 0.284 1.00 . A A . 9 ILE HG12 1 1 1 155 1 1 9 ILE HG13 H 4.791 -4.745 0.777 1.00 . A A . 9 ILE HG13 1 1 1 156 1 1 9 ILE HG21 H 2.607 -5.429 1.642 1.00 . A A . 9 ILE HG21 1 1 1 157 1 1 9 ILE HG22 H 1.934 -5.081 0.051 1.00 . A A . 9 ILE HG22 1 1 1 158 1 1 9 ILE HG23 H 1.213 -4.360 1.489 1.00 . A A . 9 ILE HG23 1 1 1 159 1 1 9 ILE N N 3.316 -1.244 -0.191 1.00 . A A . 9 ILE N 1 1 1 160 1 1 9 ILE O O 0.055 -2.240 0.683 1.00 . A A . 9 ILE O 1 1 1 161 1 1 10 ARG C C -0.309 0.806 1.881 1.00 . A A . 10 ARG C 1 1 1 162 1 1 10 ARG CA C 0.400 -0.310 2.629 1.00 . A A . 10 ARG CA 1 1 1 163 1 1 10 ARG CB C 0.960 0.214 3.955 1.00 . A A . 10 ARG CB 1 1 1 164 1 1 10 ARG CD C 2.186 -1.855 4.566 1.00 . A A . 10 ARG CD 1 1 1 165 1 1 10 ARG CG C 1.143 -0.861 5.008 1.00 . A A . 10 ARG CG 1 1 1 166 1 1 10 ARG CZ C 3.173 -3.973 5.333 1.00 . A A . 10 ARG CZ 1 1 1 167 1 1 10 ARG H H 2.379 -0.588 1.924 1.00 . A A . 10 ARG H 1 1 1 168 1 1 10 ARG HA H -0.316 -1.090 2.834 1.00 . A A . 10 ARG HA 1 1 1 169 1 1 10 ARG HB2 H 1.925 0.653 3.766 1.00 . A A . 10 ARG HB2 1 1 1 170 1 1 10 ARG HB3 H 0.296 0.969 4.348 1.00 . A A . 10 ARG HB3 1 1 1 171 1 1 10 ARG HD2 H 1.961 -2.140 3.547 1.00 . A A . 10 ARG HD2 1 1 1 172 1 1 10 ARG HD3 H 3.154 -1.377 4.595 1.00 . A A . 10 ARG HD3 1 1 1 173 1 1 10 ARG HE H 1.480 -3.173 6.045 1.00 . A A . 10 ARG HE 1 1 1 174 1 1 10 ARG HG2 H 1.463 -0.401 5.931 1.00 . A A . 10 ARG HG2 1 1 1 175 1 1 10 ARG HG3 H 0.205 -1.373 5.159 1.00 . A A . 10 ARG HG3 1 1 1 176 1 1 10 ARG HH11 H 4.245 -2.991 3.919 1.00 . A A . 10 ARG HH11 1 1 1 177 1 1 10 ARG HH12 H 4.907 -4.514 4.425 1.00 . A A . 10 ARG HH12 1 1 1 178 1 1 10 ARG HH21 H 2.356 -5.176 6.744 1.00 . A A . 10 ARG HH21 1 1 1 179 1 1 10 ARG HH22 H 3.842 -5.745 6.051 1.00 . A A . 10 ARG HH22 1 1 1 180 1 1 10 ARG N N 1.454 -0.893 1.807 1.00 . A A . 10 ARG N 1 1 1 181 1 1 10 ARG NE N 2.219 -3.048 5.405 1.00 . A A . 10 ARG NE 1 1 1 182 1 1 10 ARG NH1 N 4.191 -3.810 4.495 1.00 . A A . 10 ARG NH1 1 1 1 183 1 1 10 ARG NH2 N 3.118 -5.051 6.104 1.00 . A A . 10 ARG NH2 1 1 1 184 1 1 10 ARG O O -1.486 1.066 2.109 1.00 . A A . 10 ARG O 1 1 1 185 1 1 11 LYS C C -1.143 1.885 -0.856 1.00 . A A . 11 LYS C 1 1 1 186 1 1 11 LYS CA C -0.177 2.498 0.151 1.00 . A A . 11 LYS CA 1 1 1 187 1 1 11 LYS CB C 0.922 3.297 -0.562 1.00 . A A . 11 LYS CB 1 1 1 188 1 1 11 LYS CD C -0.520 5.373 -0.760 1.00 . A A . 11 LYS CD 1 1 1 189 1 1 11 LYS CE C 0.191 6.103 0.369 1.00 . A A . 11 LYS CE 1 1 1 190 1 1 11 LYS CG C 0.401 4.397 -1.481 1.00 . A A . 11 LYS CG 1 1 1 191 1 1 11 LYS H H 1.341 1.183 0.822 1.00 . A A . 11 LYS H 1 1 1 192 1 1 11 LYS HA H -0.728 3.157 0.806 1.00 . A A . 11 LYS HA 1 1 1 193 1 1 11 LYS HB2 H 1.558 3.754 0.182 1.00 . A A . 11 LYS HB2 1 1 1 194 1 1 11 LYS HB3 H 1.514 2.616 -1.156 1.00 . A A . 11 LYS HB3 1 1 1 195 1 1 11 LYS HD2 H -0.880 6.100 -1.470 1.00 . A A . 11 LYS HD2 1 1 1 196 1 1 11 LYS HD3 H -1.356 4.826 -0.350 1.00 . A A . 11 LYS HD3 1 1 1 197 1 1 11 LYS HE2 H 0.472 5.388 1.127 1.00 . A A . 11 LYS HE2 1 1 1 198 1 1 11 LYS HE3 H 1.078 6.575 -0.028 1.00 . A A . 11 LYS HE3 1 1 1 199 1 1 11 LYS HG2 H 1.240 4.945 -1.878 1.00 . A A . 11 LYS HG2 1 1 1 200 1 1 11 LYS HG3 H -0.144 3.939 -2.294 1.00 . A A . 11 LYS HG3 1 1 1 201 1 1 11 LYS HZ1 H -0.949 7.846 0.266 1.00 . A A . 11 LYS HZ1 1 1 1 202 1 1 11 LYS HZ2 H -0.173 7.624 1.752 1.00 . A A . 11 LYS HZ2 1 1 1 203 1 1 11 LYS HZ3 H -1.540 6.708 1.371 1.00 . A A . 11 LYS HZ3 1 1 1 204 1 1 11 LYS N N 0.405 1.441 0.966 1.00 . A A . 11 LYS N 1 1 1 205 1 1 11 LYS NZ N -0.678 7.141 0.982 1.00 . A A . 11 LYS NZ 1 1 1 206 1 1 11 LYS O O -2.183 2.457 -1.174 1.00 . A A . 11 LYS O 1 1 1 207 1 1 12 VAL C C -2.764 -0.741 -1.439 1.00 . A A . 12 VAL C 1 1 1 208 1 1 12 VAL CA C -1.664 -0.039 -2.225 1.00 . A A . 12 VAL CA 1 1 1 209 1 1 12 VAL CB C -0.883 -1.079 -3.049 1.00 . A A . 12 VAL CB 1 1 1 210 1 1 12 VAL CG1 C -1.842 -1.908 -3.889 1.00 . A A . 12 VAL CG1 1 1 1 211 1 1 12 VAL CG2 C 0.147 -0.397 -3.935 1.00 . A A . 12 VAL CG2 1 1 1 212 1 1 12 VAL H H 0.078 0.325 -1.090 1.00 . A A . 12 VAL H 1 1 1 213 1 1 12 VAL HA H -2.117 0.665 -2.908 1.00 . A A . 12 VAL HA 1 1 1 214 1 1 12 VAL HB H -0.364 -1.737 -2.364 1.00 . A A . 12 VAL HB 1 1 1 215 1 1 12 VAL HG11 H -1.306 -2.715 -4.366 1.00 . A A . 12 VAL HG11 1 1 1 216 1 1 12 VAL HG12 H -2.294 -1.278 -4.640 1.00 . A A . 12 VAL HG12 1 1 1 217 1 1 12 VAL HG13 H -2.617 -2.311 -3.250 1.00 . A A . 12 VAL HG13 1 1 1 218 1 1 12 VAL HG21 H 0.831 0.170 -3.321 1.00 . A A . 12 VAL HG21 1 1 1 219 1 1 12 VAL HG22 H -0.353 0.269 -4.625 1.00 . A A . 12 VAL HG22 1 1 1 220 1 1 12 VAL HG23 H 0.695 -1.143 -4.489 1.00 . A A . 12 VAL HG23 1 1 1 221 1 1 12 VAL N N -0.796 0.704 -1.334 1.00 . A A . 12 VAL N 1 1 1 222 1 1 12 VAL O O -3.851 -0.979 -1.952 1.00 . A A . 12 VAL O 1 1 1 223 1 1 13 VAL C C -4.623 -0.755 0.920 1.00 . A A . 13 VAL C 1 1 1 224 1 1 13 VAL CA C -3.474 -1.712 0.654 1.00 . A A . 13 VAL CA 1 1 1 225 1 1 13 VAL CB C -2.831 -2.203 1.970 1.00 . A A . 13 VAL CB 1 1 1 226 1 1 13 VAL CG1 C -3.254 -1.368 3.173 1.00 . A A . 13 VAL CG1 1 1 1 227 1 1 13 VAL CG2 C -3.146 -3.666 2.175 1.00 . A A . 13 VAL CG2 1 1 1 228 1 1 13 VAL H H -1.642 -0.790 0.212 1.00 . A A . 13 VAL H 1 1 1 229 1 1 13 VAL HA H -3.847 -2.568 0.110 1.00 . A A . 13 VAL HA 1 1 1 230 1 1 13 VAL HB H -1.760 -2.109 1.867 1.00 . A A . 13 VAL HB 1 1 1 231 1 1 13 VAL HG11 H -4.326 -1.422 3.289 1.00 . A A . 13 VAL HG11 1 1 1 232 1 1 13 VAL HG12 H -2.959 -0.341 3.016 1.00 . A A . 13 VAL HG12 1 1 1 233 1 1 13 VAL HG13 H -2.775 -1.749 4.061 1.00 . A A . 13 VAL HG13 1 1 1 234 1 1 13 VAL HG21 H -4.215 -3.803 2.203 1.00 . A A . 13 VAL HG21 1 1 1 235 1 1 13 VAL HG22 H -2.712 -4.002 3.104 1.00 . A A . 13 VAL HG22 1 1 1 236 1 1 13 VAL HG23 H -2.730 -4.230 1.354 1.00 . A A . 13 VAL HG23 1 1 1 237 1 1 13 VAL N N -2.500 -1.041 -0.176 1.00 . A A . 13 VAL N 1 1 1 238 1 1 13 VAL O O -5.758 -1.155 1.175 1.00 . A A . 13 VAL O 1 1 1 239 1 1 14 LYS C C -6.233 1.556 -0.258 1.00 . A A . 14 LYS C 1 1 1 240 1 1 14 LYS CA C -5.250 1.592 0.909 1.00 . A A . 14 LYS CA 1 1 1 241 1 1 14 LYS CB C -4.495 2.918 0.931 1.00 . A A . 14 LYS CB 1 1 1 242 1 1 14 LYS CD C -4.662 3.257 3.430 1.00 . A A . 14 LYS CD 1 1 1 243 1 1 14 LYS CE C -5.552 4.486 3.367 1.00 . A A . 14 LYS CE 1 1 1 244 1 1 14 LYS CG C -3.735 3.173 2.227 1.00 . A A . 14 LYS CG 1 1 1 245 1 1 14 LYS H H -3.352 0.744 0.667 1.00 . A A . 14 LYS H 1 1 1 246 1 1 14 LYS HA H -5.795 1.477 1.832 1.00 . A A . 14 LYS HA 1 1 1 247 1 1 14 LYS HB2 H -3.772 2.900 0.124 1.00 . A A . 14 LYS HB2 1 1 1 248 1 1 14 LYS HB3 H -5.190 3.727 0.770 1.00 . A A . 14 LYS HB3 1 1 1 249 1 1 14 LYS HD2 H -5.283 2.376 3.455 1.00 . A A . 14 LYS HD2 1 1 1 250 1 1 14 LYS HD3 H -4.063 3.303 4.327 1.00 . A A . 14 LYS HD3 1 1 1 251 1 1 14 LYS HE2 H -6.074 4.484 2.425 1.00 . A A . 14 LYS HE2 1 1 1 252 1 1 14 LYS HE3 H -6.268 4.437 4.175 1.00 . A A . 14 LYS HE3 1 1 1 253 1 1 14 LYS HG2 H -3.037 2.367 2.384 1.00 . A A . 14 LYS HG2 1 1 1 254 1 1 14 LYS HG3 H -3.194 4.104 2.136 1.00 . A A . 14 LYS HG3 1 1 1 255 1 1 14 LYS HZ1 H -4.062 5.806 2.728 1.00 . A A . 14 LYS HZ1 1 1 1 256 1 1 14 LYS HZ2 H -4.283 5.784 4.403 1.00 . A A . 14 LYS HZ2 1 1 1 257 1 1 14 LYS HZ3 H -5.406 6.569 3.415 1.00 . A A . 14 LYS HZ3 1 1 1 258 1 1 14 LYS N N -4.293 0.518 0.812 1.00 . A A . 14 LYS N 1 1 1 259 1 1 14 LYS NZ N -4.772 5.748 3.485 1.00 . A A . 14 LYS NZ 1 1 1 260 1 1 14 LYS O O -7.417 1.846 -0.084 1.00 . A A . 14 LYS O 1 1 1 261 1 1 15 LEU C C -7.188 -0.305 -2.731 1.00 . A A . 15 LEU C 1 1 1 262 1 1 15 LEU CA C -6.621 1.106 -2.609 1.00 . A A . 15 LEU CA 1 1 1 263 1 1 15 LEU CB C -5.860 1.533 -3.872 1.00 . A A . 15 LEU CB 1 1 1 264 1 1 15 LEU CD1 C -5.183 -0.488 -5.222 1.00 . A A . 15 LEU CD1 1 1 1 265 1 1 15 LEU CD2 C -3.629 1.460 -5.013 1.00 . A A . 15 LEU CD2 1 1 1 266 1 1 15 LEU CG C -4.698 0.634 -4.316 1.00 . A A . 15 LEU CG 1 1 1 267 1 1 15 LEU H H -4.791 0.985 -1.553 1.00 . A A . 15 LEU H 1 1 1 268 1 1 15 LEU HA H -7.443 1.789 -2.450 1.00 . A A . 15 LEU HA 1 1 1 269 1 1 15 LEU HB2 H -6.566 1.596 -4.687 1.00 . A A . 15 LEU HB2 1 1 1 270 1 1 15 LEU HB3 H -5.462 2.519 -3.689 1.00 . A A . 15 LEU HB3 1 1 1 271 1 1 15 LEU HD11 H -5.653 -0.066 -6.097 1.00 . A A . 15 LEU HD11 1 1 1 272 1 1 15 LEU HD12 H -5.897 -1.100 -4.689 1.00 . A A . 15 LEU HD12 1 1 1 273 1 1 15 LEU HD13 H -4.343 -1.096 -5.524 1.00 . A A . 15 LEU HD13 1 1 1 274 1 1 15 LEU HD21 H -4.053 1.938 -5.883 1.00 . A A . 15 LEU HD21 1 1 1 275 1 1 15 LEU HD22 H -2.817 0.814 -5.316 1.00 . A A . 15 LEU HD22 1 1 1 276 1 1 15 LEU HD23 H -3.255 2.212 -4.333 1.00 . A A . 15 LEU HD23 1 1 1 277 1 1 15 LEU HG H -4.252 0.181 -3.442 1.00 . A A . 15 LEU HG 1 1 1 278 1 1 15 LEU N N -5.751 1.196 -1.450 1.00 . A A . 15 LEU N 1 1 1 279 1 1 15 LEU O O -8.185 -0.538 -3.417 1.00 . A A . 15 LEU O 1 1 1 280 1 1 16 PHE C C -8.199 -2.761 -1.121 1.00 . A A . 16 PHE C 1 1 1 281 1 1 16 PHE CA C -6.978 -2.624 -2.020 1.00 . A A . 16 PHE CA 1 1 1 282 1 1 16 PHE CB C -5.847 -3.509 -1.495 1.00 . A A . 16 PHE CB 1 1 1 283 1 1 16 PHE CD1 C -5.802 -5.600 -2.879 1.00 . A A . 16 PHE CD1 1 1 1 284 1 1 16 PHE CD2 C -6.585 -5.748 -0.634 1.00 . A A . 16 PHE CD2 1 1 1 285 1 1 16 PHE CE1 C -6.016 -6.955 -3.044 1.00 . A A . 16 PHE CE1 1 1 1 286 1 1 16 PHE CE2 C -6.801 -7.101 -0.793 1.00 . A A . 16 PHE CE2 1 1 1 287 1 1 16 PHE CG C -6.085 -4.982 -1.675 1.00 . A A . 16 PHE CG 1 1 1 288 1 1 16 PHE CZ C -6.516 -7.706 -1.999 1.00 . A A . 16 PHE CZ 1 1 1 289 1 1 16 PHE H H -5.723 -0.990 -1.555 1.00 . A A . 16 PHE H 1 1 1 290 1 1 16 PHE HA H -7.235 -2.923 -3.024 1.00 . A A . 16 PHE HA 1 1 1 291 1 1 16 PHE HB2 H -4.936 -3.251 -2.007 1.00 . A A . 16 PHE HB2 1 1 1 292 1 1 16 PHE HB3 H -5.722 -3.320 -0.439 1.00 . A A . 16 PHE HB3 1 1 1 293 1 1 16 PHE HD1 H -5.412 -5.014 -3.698 1.00 . A A . 16 PHE HD1 1 1 1 294 1 1 16 PHE HD2 H -6.809 -5.275 0.311 1.00 . A A . 16 PHE HD2 1 1 1 295 1 1 16 PHE HE1 H -5.792 -7.427 -3.988 1.00 . A A . 16 PHE HE1 1 1 1 296 1 1 16 PHE HE2 H -7.194 -7.686 0.027 1.00 . A A . 16 PHE HE2 1 1 1 297 1 1 16 PHE HZ H -6.683 -8.763 -2.127 1.00 . A A . 16 PHE HZ 1 1 1 298 1 1 16 PHE N N -6.539 -1.239 -2.048 1.00 . A A . 16 PHE N 1 1 1 299 1 1 16 PHE O O -9.161 -3.453 -1.449 1.00 . A A . 16 PHE O 1 1 1 300 1 1 17 ASN C C -10.175 -0.946 0.716 1.00 . A A . 17 ASN C 1 1 1 301 1 1 17 ASN CA C -9.234 -2.113 0.981 1.00 . A A . 17 ASN CA 1 1 1 302 1 1 17 ASN CB C -8.703 -2.041 2.421 1.00 . A A . 17 ASN CB 1 1 1 303 1 1 17 ASN CG C -8.092 -3.347 2.904 1.00 . A A . 17 ASN CG 1 1 1 304 1 1 17 ASN H H -7.324 -1.583 0.234 1.00 . A A . 17 ASN H 1 1 1 305 1 1 17 ASN HA H -9.776 -3.036 0.852 1.00 . A A . 17 ASN HA 1 1 1 306 1 1 17 ASN HB2 H -7.943 -1.276 2.476 1.00 . A A . 17 ASN HB2 1 1 1 307 1 1 17 ASN HB3 H -9.515 -1.779 3.083 1.00 . A A . 17 ASN HB3 1 1 1 308 1 1 17 ASN HD21 H -7.654 -3.872 1.045 1.00 . A A . 17 ASN HD21 1 1 1 309 1 1 17 ASN HD22 H -7.213 -5.013 2.267 1.00 . A A . 17 ASN HD22 1 1 1 310 1 1 17 ASN N N -8.136 -2.100 0.026 1.00 . A A . 17 ASN N 1 1 1 311 1 1 17 ASN ND2 N -7.601 -4.157 1.981 1.00 . A A . 17 ASN ND2 1 1 1 312 1 1 17 ASN O O -10.976 -1.034 -0.235 1.00 . A A . 17 ASN O 1 1 1 313 1 1 17 ASN OXT O -10.112 0.055 1.455 1.00 . A A . 17 ASN OXT 1 1 1 314 1 1 17 ASN OD1 O -8.064 -3.628 4.104 1.00 . A A . 17 ASN OD1 1 1 2 315 1 1 1 LEU C C 14.286 -1.979 -0.056 1.00 . A A . 1 LEU C 1 1 2 316 1 1 1 LEU CA C 15.801 -1.881 -0.149 1.00 . A A . 1 LEU CA 1 1 2 317 1 1 1 LEU CB C 16.306 -0.719 0.712 1.00 . A A . 1 LEU CB 1 1 2 318 1 1 1 LEU CD1 C 18.207 0.638 1.620 1.00 . A A . 1 LEU CD1 1 1 2 319 1 1 1 LEU CD2 C 18.480 -1.825 1.304 1.00 . A A . 1 LEU CD2 1 1 2 320 1 1 1 LEU CG C 17.828 -0.561 0.767 1.00 . A A . 1 LEU CG 1 1 2 321 1 1 1 LEU H1 H 17.247 -1.615 -1.627 1.00 . A A . 1 LEU H1 1 1 2 322 1 1 1 LEU H2 H 15.788 -0.828 -1.945 1.00 . A A . 1 LEU H2 1 1 2 323 1 1 1 LEU H3 H 15.901 -2.504 -2.133 1.00 . A A . 1 LEU H3 1 1 2 324 1 1 1 LEU HA H 16.233 -2.804 0.212 1.00 . A A . 1 LEU HA 1 1 2 325 1 1 1 LEU HB2 H 15.883 0.197 0.326 1.00 . A A . 1 LEU HB2 1 1 2 326 1 1 1 LEU HB3 H 15.947 -0.863 1.719 1.00 . A A . 1 LEU HB3 1 1 2 327 1 1 1 LEU HD11 H 17.828 0.500 2.621 1.00 . A A . 1 LEU HD11 1 1 2 328 1 1 1 LEU HD12 H 17.780 1.533 1.194 1.00 . A A . 1 LEU HD12 1 1 2 329 1 1 1 LEU HD13 H 19.283 0.731 1.651 1.00 . A A . 1 LEU HD13 1 1 2 330 1 1 1 LEU HD21 H 18.091 -2.039 2.288 1.00 . A A . 1 LEU HD21 1 1 2 331 1 1 1 LEU HD22 H 19.549 -1.683 1.362 1.00 . A A . 1 LEU HD22 1 1 2 332 1 1 1 LEU HD23 H 18.262 -2.651 0.644 1.00 . A A . 1 LEU HD23 1 1 2 333 1 1 1 LEU HG H 18.201 -0.389 -0.233 1.00 . A A . 1 LEU HG 1 1 2 334 1 1 1 LEU N N 16.214 -1.694 -1.558 1.00 . A A . 1 LEU N 1 1 2 335 1 1 1 LEU O O 13.566 -1.313 -0.797 1.00 . A A . 1 LEU O 1 1 2 336 1 1 2 MET C C 11.644 -1.949 1.700 1.00 . A A . 2 MET C 1 1 2 337 1 1 2 MET CA C 12.372 -3.073 0.970 1.00 . A A . 2 MET CA 1 1 2 338 1 1 2 MET CB C 12.124 -4.412 1.676 1.00 . A A . 2 MET CB 1 1 2 339 1 1 2 MET CE C 13.369 -7.096 2.988 1.00 . A A . 2 MET CE 1 1 2 340 1 1 2 MET CG C 12.565 -4.444 3.131 1.00 . A A . 2 MET CG 1 1 2 341 1 1 2 MET H H 14.421 -3.233 1.497 1.00 . A A . 2 MET H 1 1 2 342 1 1 2 MET HA H 11.981 -3.135 -0.035 1.00 . A A . 2 MET HA 1 1 2 343 1 1 2 MET HB2 H 11.069 -4.631 1.641 1.00 . A A . 2 MET HB2 1 1 2 344 1 1 2 MET HB3 H 12.658 -5.185 1.144 1.00 . A A . 2 MET HB3 1 1 2 345 1 1 2 MET HE1 H 14.379 -6.733 3.092 1.00 . A A . 2 MET HE1 1 1 2 346 1 1 2 MET HE2 H 13.089 -7.087 1.945 1.00 . A A . 2 MET HE2 1 1 2 347 1 1 2 MET HE3 H 13.308 -8.105 3.368 1.00 . A A . 2 MET HE3 1 1 2 348 1 1 2 MET HG2 H 13.624 -4.239 3.177 1.00 . A A . 2 MET HG2 1 1 2 349 1 1 2 MET HG3 H 12.028 -3.682 3.674 1.00 . A A . 2 MET HG3 1 1 2 350 1 1 2 MET N N 13.801 -2.800 0.866 1.00 . A A . 2 MET N 1 1 2 351 1 1 2 MET O O 10.418 -1.931 1.750 1.00 . A A . 2 MET O 1 1 2 352 1 1 2 MET SD S 12.258 -6.040 3.917 1.00 . A A . 2 MET SD 1 1 2 353 1 1 3 GLY C C 10.892 0.937 2.061 1.00 . A A . 3 GLY C 1 1 2 354 1 1 3 GLY CA C 11.822 0.126 2.944 1.00 . A A . 3 GLY CA 1 1 2 355 1 1 3 GLY H H 13.383 -1.098 2.201 1.00 . A A . 3 GLY H 1 1 2 356 1 1 3 GLY HA2 H 11.267 -0.235 3.794 1.00 . A A . 3 GLY HA2 1 1 2 357 1 1 3 GLY HA3 H 12.617 0.766 3.293 1.00 . A A . 3 GLY HA3 1 1 2 358 1 1 3 GLY N N 12.407 -1.009 2.250 1.00 . A A . 3 GLY N 1 1 2 359 1 1 3 GLY O O 9.915 1.515 2.540 1.00 . A A . 3 GLY O 1 1 2 360 1 1 4 LEU C C 9.129 0.799 -0.483 1.00 . A A . 4 LEU C 1 1 2 361 1 1 4 LEU CA C 10.342 1.658 -0.197 1.00 . A A . 4 LEU CA 1 1 2 362 1 1 4 LEU CB C 11.074 1.854 -1.516 1.00 . A A . 4 LEU CB 1 1 2 363 1 1 4 LEU CD1 C 13.274 1.271 -2.467 1.00 . A A . 4 LEU CD1 1 1 2 364 1 1 4 LEU CD2 C 12.871 3.566 -1.530 1.00 . A A . 4 LEU CD2 1 1 2 365 1 1 4 LEU CG C 12.563 2.085 -1.400 1.00 . A A . 4 LEU CG 1 1 2 366 1 1 4 LEU H H 12.001 0.518 0.458 1.00 . A A . 4 LEU H 1 1 2 367 1 1 4 LEU HA H 10.050 2.614 0.204 1.00 . A A . 4 LEU HA 1 1 2 368 1 1 4 LEU HB2 H 10.914 0.977 -2.126 1.00 . A A . 4 LEU HB2 1 1 2 369 1 1 4 LEU HB3 H 10.640 2.703 -2.020 1.00 . A A . 4 LEU HB3 1 1 2 370 1 1 4 LEU HD11 H 13.052 1.682 -3.440 1.00 . A A . 4 LEU HD11 1 1 2 371 1 1 4 LEU HD12 H 12.919 0.242 -2.423 1.00 . A A . 4 LEU HD12 1 1 2 372 1 1 4 LEU HD13 H 14.338 1.295 -2.295 1.00 . A A . 4 LEU HD13 1 1 2 373 1 1 4 LEU HD21 H 13.929 3.730 -1.387 1.00 . A A . 4 LEU HD21 1 1 2 374 1 1 4 LEU HD22 H 12.316 4.111 -0.781 1.00 . A A . 4 LEU HD22 1 1 2 375 1 1 4 LEU HD23 H 12.582 3.910 -2.512 1.00 . A A . 4 LEU HD23 1 1 2 376 1 1 4 LEU HG H 12.898 1.752 -0.431 1.00 . A A . 4 LEU HG 1 1 2 377 1 1 4 LEU N N 11.191 0.973 0.770 1.00 . A A . 4 LEU N 1 1 2 378 1 1 4 LEU O O 7.980 1.235 -0.408 1.00 . A A . 4 LEU O 1 1 2 379 1 1 5 PHE C C 7.377 -1.645 -0.202 1.00 . A A . 5 PHE C 1 1 2 380 1 1 5 PHE CA C 8.460 -1.420 -1.252 1.00 . A A . 5 PHE CA 1 1 2 381 1 1 5 PHE CB C 9.191 -2.723 -1.575 1.00 . A A . 5 PHE CB 1 1 2 382 1 1 5 PHE CD1 C 8.390 -3.495 -3.826 1.00 . A A . 5 PHE CD1 1 1 2 383 1 1 5 PHE CD2 C 7.721 -4.730 -1.901 1.00 . A A . 5 PHE CD2 1 1 2 384 1 1 5 PHE CE1 C 7.687 -4.368 -4.633 1.00 . A A . 5 PHE CE1 1 1 2 385 1 1 5 PHE CE2 C 7.015 -5.604 -2.703 1.00 . A A . 5 PHE CE2 1 1 2 386 1 1 5 PHE CG C 8.415 -3.666 -2.452 1.00 . A A . 5 PHE CG 1 1 2 387 1 1 5 PHE CZ C 6.998 -5.422 -4.071 1.00 . A A . 5 PHE CZ 1 1 2 388 1 1 5 PHE H H 10.367 -0.736 -0.714 1.00 . A A . 5 PHE H 1 1 2 389 1 1 5 PHE HA H 8.004 -1.040 -2.152 1.00 . A A . 5 PHE HA 1 1 2 390 1 1 5 PHE HB2 H 10.127 -2.483 -2.074 1.00 . A A . 5 PHE HB2 1 1 2 391 1 1 5 PHE HB3 H 9.404 -3.237 -0.649 1.00 . A A . 5 PHE HB3 1 1 2 392 1 1 5 PHE HD1 H 8.927 -2.670 -4.265 1.00 . A A . 5 PHE HD1 1 1 2 393 1 1 5 PHE HD2 H 7.734 -4.873 -0.831 1.00 . A A . 5 PHE HD2 1 1 2 394 1 1 5 PHE HE1 H 7.674 -4.223 -5.704 1.00 . A A . 5 PHE HE1 1 1 2 395 1 1 5 PHE HE2 H 6.478 -6.430 -2.261 1.00 . A A . 5 PHE HE2 1 1 2 396 1 1 5 PHE HZ H 6.447 -6.106 -4.700 1.00 . A A . 5 PHE HZ 1 1 2 397 1 1 5 PHE N N 9.434 -0.451 -0.797 1.00 . A A . 5 PHE N 1 1 2 398 1 1 5 PHE O O 6.192 -1.595 -0.515 1.00 . A A . 5 PHE O 1 1 2 399 1 1 6 ASN C C 5.909 -0.902 2.297 1.00 . A A . 6 ASN C 1 1 2 400 1 1 6 ASN CA C 6.858 -2.077 2.152 1.00 . A A . 6 ASN CA 1 1 2 401 1 1 6 ASN CB C 7.598 -2.274 3.476 1.00 . A A . 6 ASN CB 1 1 2 402 1 1 6 ASN CG C 8.394 -3.565 3.526 1.00 . A A . 6 ASN CG 1 1 2 403 1 1 6 ASN H H 8.761 -1.878 1.229 1.00 . A A . 6 ASN H 1 1 2 404 1 1 6 ASN HA H 6.286 -2.965 1.933 1.00 . A A . 6 ASN HA 1 1 2 405 1 1 6 ASN HB2 H 8.273 -1.446 3.622 1.00 . A A . 6 ASN HB2 1 1 2 406 1 1 6 ASN HB3 H 6.875 -2.284 4.280 1.00 . A A . 6 ASN HB3 1 1 2 407 1 1 6 ASN HD21 H 9.687 -2.748 4.795 1.00 . A A . 6 ASN HD21 1 1 2 408 1 1 6 ASN HD22 H 10.002 -4.391 4.351 1.00 . A A . 6 ASN HD22 1 1 2 409 1 1 6 ASN N N 7.795 -1.860 1.046 1.00 . A A . 6 ASN N 1 1 2 410 1 1 6 ASN ND2 N 9.468 -3.569 4.301 1.00 . A A . 6 ASN ND2 1 1 2 411 1 1 6 ASN O O 4.728 -1.075 2.598 1.00 . A A . 6 ASN O 1 1 2 412 1 1 6 ASN OD1 O 8.043 -4.556 2.884 1.00 . A A . 6 ASN OD1 1 1 2 413 1 1 7 ARG C C 4.607 1.553 1.088 1.00 . A A . 7 ARG C 1 1 2 414 1 1 7 ARG CA C 5.643 1.493 2.203 1.00 . A A . 7 ARG CA 1 1 2 415 1 1 7 ARG CB C 6.576 2.715 2.213 1.00 . A A . 7 ARG CB 1 1 2 416 1 1 7 ARG CD C 5.876 4.284 0.400 1.00 . A A . 7 ARG CD 1 1 2 417 1 1 7 ARG CG C 5.905 4.038 1.897 1.00 . A A . 7 ARG CG 1 1 2 418 1 1 7 ARG CZ C 5.358 6.216 -1.053 1.00 . A A . 7 ARG CZ 1 1 2 419 1 1 7 ARG H H 7.356 0.372 1.763 1.00 . A A . 7 ARG H 1 1 2 420 1 1 7 ARG HA H 5.134 1.430 3.151 1.00 . A A . 7 ARG HA 1 1 2 421 1 1 7 ARG HB2 H 7.024 2.797 3.191 1.00 . A A . 7 ARG HB2 1 1 2 422 1 1 7 ARG HB3 H 7.360 2.555 1.487 1.00 . A A . 7 ARG HB3 1 1 2 423 1 1 7 ARG HD2 H 6.892 4.351 0.042 1.00 . A A . 7 ARG HD2 1 1 2 424 1 1 7 ARG HD3 H 5.382 3.444 -0.070 1.00 . A A . 7 ARG HD3 1 1 2 425 1 1 7 ARG HE H 4.482 5.824 0.702 1.00 . A A . 7 ARG HE 1 1 2 426 1 1 7 ARG HG2 H 4.893 4.016 2.271 1.00 . A A . 7 ARG HG2 1 1 2 427 1 1 7 ARG HG3 H 6.453 4.835 2.375 1.00 . A A . 7 ARG HG3 1 1 2 428 1 1 7 ARG HH11 H 6.855 5.037 -1.746 1.00 . A A . 7 ARG HH11 1 1 2 429 1 1 7 ARG HH12 H 6.436 6.378 -2.762 1.00 . A A . 7 ARG HH12 1 1 2 430 1 1 7 ARG HH21 H 3.925 7.588 -0.636 1.00 . A A . 7 ARG HH21 1 1 2 431 1 1 7 ARG HH22 H 4.769 7.828 -2.132 1.00 . A A . 7 ARG HH22 1 1 2 432 1 1 7 ARG N N 6.428 0.295 2.063 1.00 . A A . 7 ARG N 1 1 2 433 1 1 7 ARG NE N 5.160 5.514 0.062 1.00 . A A . 7 ARG NE 1 1 2 434 1 1 7 ARG NH1 N 6.290 5.847 -1.922 1.00 . A A . 7 ARG NH1 1 1 2 435 1 1 7 ARG NH2 N 4.627 7.297 -1.291 1.00 . A A . 7 ARG NH2 1 1 2 436 1 1 7 ARG O O 3.484 2.020 1.285 1.00 . A A . 7 ARG O 1 1 2 437 1 1 8 ILE C C 3.004 -0.076 -0.949 1.00 . A A . 8 ILE C 1 1 2 438 1 1 8 ILE CA C 4.092 0.960 -1.216 1.00 . A A . 8 ILE CA 1 1 2 439 1 1 8 ILE CB C 4.844 0.593 -2.518 1.00 . A A . 8 ILE CB 1 1 2 440 1 1 8 ILE CD1 C 5.183 3.018 -3.245 1.00 . A A . 8 ILE CD1 1 1 2 441 1 1 8 ILE CG1 C 5.837 1.697 -2.898 1.00 . A A . 8 ILE CG1 1 1 2 442 1 1 8 ILE CG2 C 3.863 0.344 -3.660 1.00 . A A . 8 ILE CG2 1 1 2 443 1 1 8 ILE H H 5.918 0.729 -0.179 1.00 . A A . 8 ILE H 1 1 2 444 1 1 8 ILE HA H 3.627 1.926 -1.350 1.00 . A A . 8 ILE HA 1 1 2 445 1 1 8 ILE HB H 5.388 -0.322 -2.343 1.00 . A A . 8 ILE HB 1 1 2 446 1 1 8 ILE HD11 H 5.941 3.728 -3.541 1.00 . A A . 8 ILE HD11 1 1 2 447 1 1 8 ILE HD12 H 4.653 3.396 -2.383 1.00 . A A . 8 ILE HD12 1 1 2 448 1 1 8 ILE HD13 H 4.489 2.871 -4.060 1.00 . A A . 8 ILE HD13 1 1 2 449 1 1 8 ILE HG12 H 6.507 1.869 -2.069 1.00 . A A . 8 ILE HG12 1 1 2 450 1 1 8 ILE HG13 H 6.411 1.375 -3.755 1.00 . A A . 8 ILE HG13 1 1 2 451 1 1 8 ILE HG21 H 3.291 1.242 -3.845 1.00 . A A . 8 ILE HG21 1 1 2 452 1 1 8 ILE HG22 H 3.192 -0.460 -3.391 1.00 . A A . 8 ILE HG22 1 1 2 453 1 1 8 ILE HG23 H 4.408 0.074 -4.551 1.00 . A A . 8 ILE HG23 1 1 2 454 1 1 8 ILE N N 4.993 1.050 -0.080 1.00 . A A . 8 ILE N 1 1 2 455 1 1 8 ILE O O 1.856 0.114 -1.335 1.00 . A A . 8 ILE O 1 1 2 456 1 1 9 ILE C C 1.231 -1.659 0.802 1.00 . A A . 9 ILE C 1 1 2 457 1 1 9 ILE CA C 2.415 -2.221 0.035 1.00 . A A . 9 ILE CA 1 1 2 458 1 1 9 ILE CB C 3.046 -3.357 0.876 1.00 . A A . 9 ILE CB 1 1 2 459 1 1 9 ILE CD1 C 4.271 -4.289 -1.155 1.00 . A A . 9 ILE CD1 1 1 2 460 1 1 9 ILE CG1 C 4.373 -3.823 0.274 1.00 . A A . 9 ILE CG1 1 1 2 461 1 1 9 ILE CG2 C 2.080 -4.529 1.004 1.00 . A A . 9 ILE CG2 1 1 2 462 1 1 9 ILE H H 4.290 -1.238 0.058 1.00 . A A . 9 ILE H 1 1 2 463 1 1 9 ILE HA H 2.067 -2.631 -0.899 1.00 . A A . 9 ILE HA 1 1 2 464 1 1 9 ILE HB H 3.231 -2.974 1.862 1.00 . A A . 9 ILE HB 1 1 2 465 1 1 9 ILE HD11 H 3.854 -3.499 -1.758 1.00 . A A . 9 ILE HD11 1 1 2 466 1 1 9 ILE HD12 H 3.635 -5.158 -1.205 1.00 . A A . 9 ILE HD12 1 1 2 467 1 1 9 ILE HD13 H 5.259 -4.538 -1.520 1.00 . A A . 9 ILE HD13 1 1 2 468 1 1 9 ILE HG12 H 5.078 -3.007 0.301 1.00 . A A . 9 ILE HG12 1 1 2 469 1 1 9 ILE HG13 H 4.758 -4.643 0.863 1.00 . A A . 9 ILE HG13 1 1 2 470 1 1 9 ILE HG21 H 1.857 -4.922 0.023 1.00 . A A . 9 ILE HG21 1 1 2 471 1 1 9 ILE HG22 H 1.168 -4.192 1.473 1.00 . A A . 9 ILE HG22 1 1 2 472 1 1 9 ILE HG23 H 2.531 -5.302 1.607 1.00 . A A . 9 ILE HG23 1 1 2 473 1 1 9 ILE N N 3.365 -1.156 -0.261 1.00 . A A . 9 ILE N 1 1 2 474 1 1 9 ILE O O 0.078 -1.868 0.435 1.00 . A A . 9 ILE O 1 1 2 475 1 1 10 ARG C C -0.175 0.827 1.986 1.00 . A A . 10 ARG C 1 1 2 476 1 1 10 ARG CA C 0.500 -0.340 2.696 1.00 . A A . 10 ARG CA 1 1 2 477 1 1 10 ARG CB C 1.089 0.116 4.030 1.00 . A A . 10 ARG CB 1 1 2 478 1 1 10 ARG CD C 1.595 -2.294 4.546 1.00 . A A . 10 ARG CD 1 1 2 479 1 1 10 ARG CG C 2.098 -0.864 4.612 1.00 . A A . 10 ARG CG 1 1 2 480 1 1 10 ARG CZ C 2.196 -4.522 5.426 1.00 . A A . 10 ARG CZ 1 1 2 481 1 1 10 ARG H H 2.471 -0.801 2.110 1.00 . A A . 10 ARG H 1 1 2 482 1 1 10 ARG HA H -0.232 -1.105 2.878 1.00 . A A . 10 ARG HA 1 1 2 483 1 1 10 ARG HB2 H 1.581 1.068 3.889 1.00 . A A . 10 ARG HB2 1 1 2 484 1 1 10 ARG HB3 H 0.287 0.238 4.742 1.00 . A A . 10 ARG HB3 1 1 2 485 1 1 10 ARG HD2 H 0.606 -2.332 4.959 1.00 . A A . 10 ARG HD2 1 1 2 486 1 1 10 ARG HD3 H 1.560 -2.594 3.505 1.00 . A A . 10 ARG HD3 1 1 2 487 1 1 10 ARG HE H 3.290 -2.859 5.657 1.00 . A A . 10 ARG HE 1 1 2 488 1 1 10 ARG HG2 H 3.007 -0.793 4.040 1.00 . A A . 10 ARG HG2 1 1 2 489 1 1 10 ARG HG3 H 2.292 -0.603 5.642 1.00 . A A . 10 ARG HG3 1 1 2 490 1 1 10 ARG HH11 H 0.419 -4.460 4.455 1.00 . A A . 10 ARG HH11 1 1 2 491 1 1 10 ARG HH12 H 0.881 -6.020 5.053 1.00 . A A . 10 ARG HH12 1 1 2 492 1 1 10 ARG HH21 H 3.894 -4.920 6.459 1.00 . A A . 10 ARG HH21 1 1 2 493 1 1 10 ARG HH22 H 2.854 -6.282 6.188 1.00 . A A . 10 ARG HH22 1 1 2 494 1 1 10 ARG N N 1.532 -0.925 1.862 1.00 . A A . 10 ARG N 1 1 2 495 1 1 10 ARG NE N 2.461 -3.224 5.272 1.00 . A A . 10 ARG NE 1 1 2 496 1 1 10 ARG NH1 N 1.075 -5.040 4.940 1.00 . A A . 10 ARG NH1 1 1 2 497 1 1 10 ARG NH2 N 3.049 -5.302 6.078 1.00 . A A . 10 ARG NH2 1 1 2 498 1 1 10 ARG O O -1.344 1.126 2.230 1.00 . A A . 10 ARG O 1 1 2 499 1 1 11 LYS C C -1.052 2.027 -0.633 1.00 . A A . 11 LYS C 1 1 2 500 1 1 11 LYS CA C 0.017 2.569 0.307 1.00 . A A . 11 LYS CA 1 1 2 501 1 1 11 LYS CB C 1.133 3.254 -0.492 1.00 . A A . 11 LYS CB 1 1 2 502 1 1 11 LYS CD C 0.036 5.520 -0.516 1.00 . A A . 11 LYS CD 1 1 2 503 1 1 11 LYS CE C -0.412 6.688 -1.380 1.00 . A A . 11 LYS CE 1 1 2 504 1 1 11 LYS CG C 0.661 4.415 -1.354 1.00 . A A . 11 LYS CG 1 1 2 505 1 1 11 LYS H H 1.494 1.200 0.958 1.00 . A A . 11 LYS H 1 1 2 506 1 1 11 LYS HA H -0.432 3.281 0.983 1.00 . A A . 11 LYS HA 1 1 2 507 1 1 11 LYS HB2 H 1.877 3.626 0.197 1.00 . A A . 11 LYS HB2 1 1 2 508 1 1 11 LYS HB3 H 1.595 2.520 -1.138 1.00 . A A . 11 LYS HB3 1 1 2 509 1 1 11 LYS HD2 H -0.819 5.122 0.007 1.00 . A A . 11 LYS HD2 1 1 2 510 1 1 11 LYS HD3 H 0.765 5.870 0.199 1.00 . A A . 11 LYS HD3 1 1 2 511 1 1 11 LYS HE2 H 0.447 7.093 -1.890 1.00 . A A . 11 LYS HE2 1 1 2 512 1 1 11 LYS HE3 H -1.124 6.326 -2.107 1.00 . A A . 11 LYS HE3 1 1 2 513 1 1 11 LYS HG2 H 1.505 4.818 -1.891 1.00 . A A . 11 LYS HG2 1 1 2 514 1 1 11 LYS HG3 H -0.074 4.050 -2.058 1.00 . A A . 11 LYS HG3 1 1 2 515 1 1 11 LYS HZ1 H -0.386 8.115 0.142 1.00 . A A . 11 LYS HZ1 1 1 2 516 1 1 11 LYS HZ2 H -1.896 7.404 -0.101 1.00 . A A . 11 LYS HZ2 1 1 2 517 1 1 11 LYS HZ3 H -1.322 8.557 -1.193 1.00 . A A . 11 LYS HZ3 1 1 2 518 1 1 11 LYS N N 0.562 1.475 1.096 1.00 . A A . 11 LYS N 1 1 2 519 1 1 11 LYS NZ N -1.046 7.764 -0.575 1.00 . A A . 11 LYS NZ 1 1 2 520 1 1 11 LYS O O -2.142 2.584 -0.754 1.00 . A A . 11 LYS O 1 1 2 521 1 1 12 VAL C C -2.764 -0.451 -1.437 1.00 . A A . 12 VAL C 1 1 2 522 1 1 12 VAL CA C -1.638 0.252 -2.187 1.00 . A A . 12 VAL CA 1 1 2 523 1 1 12 VAL CB C -0.891 -0.784 -3.047 1.00 . A A . 12 VAL CB 1 1 2 524 1 1 12 VAL CG1 C -1.867 -1.582 -3.897 1.00 . A A . 12 VAL CG1 1 1 2 525 1 1 12 VAL CG2 C 0.141 -0.103 -3.931 1.00 . A A . 12 VAL CG2 1 1 2 526 1 1 12 VAL H H 0.165 0.529 -1.127 1.00 . A A . 12 VAL H 1 1 2 527 1 1 12 VAL HA H -2.060 1.000 -2.843 1.00 . A A . 12 VAL HA 1 1 2 528 1 1 12 VAL HB H -0.373 -1.465 -2.379 1.00 . A A . 12 VAL HB 1 1 2 529 1 1 12 VAL HG11 H -1.332 -2.334 -4.456 1.00 . A A . 12 VAL HG11 1 1 2 530 1 1 12 VAL HG12 H -2.375 -0.915 -4.579 1.00 . A A . 12 VAL HG12 1 1 2 531 1 1 12 VAL HG13 H -2.597 -2.057 -3.255 1.00 . A A . 12 VAL HG13 1 1 2 532 1 1 12 VAL HG21 H -0.357 0.580 -4.603 1.00 . A A . 12 VAL HG21 1 1 2 533 1 1 12 VAL HG22 H 0.674 -0.849 -4.502 1.00 . A A . 12 VAL HG22 1 1 2 534 1 1 12 VAL HG23 H 0.838 0.444 -3.314 1.00 . A A . 12 VAL HG23 1 1 2 535 1 1 12 VAL N N -0.729 0.916 -1.271 1.00 . A A . 12 VAL N 1 1 2 536 1 1 12 VAL O O -3.858 -0.622 -1.963 1.00 . A A . 12 VAL O 1 1 2 537 1 1 13 VAL C C -4.687 -0.736 0.836 1.00 . A A . 13 VAL C 1 1 2 538 1 1 13 VAL CA C -3.462 -1.589 0.580 1.00 . A A . 13 VAL CA 1 1 2 539 1 1 13 VAL CB C -2.824 -2.071 1.901 1.00 . A A . 13 VAL CB 1 1 2 540 1 1 13 VAL CG1 C -3.341 -1.309 3.113 1.00 . A A . 13 VAL CG1 1 1 2 541 1 1 13 VAL CG2 C -3.026 -3.561 2.061 1.00 . A A . 13 VAL CG2 1 1 2 542 1 1 13 VAL H H -1.680 -0.540 0.233 1.00 . A A . 13 VAL H 1 1 2 543 1 1 13 VAL HA H -3.746 -2.453 -0.003 1.00 . A A . 13 VAL HA 1 1 2 544 1 1 13 VAL HB H -1.763 -1.892 1.831 1.00 . A A . 13 VAL HB 1 1 2 545 1 1 13 VAL HG11 H -4.408 -1.449 3.199 1.00 . A A . 13 VAL HG11 1 1 2 546 1 1 13 VAL HG12 H -3.124 -0.258 2.992 1.00 . A A . 13 VAL HG12 1 1 2 547 1 1 13 VAL HG13 H -2.855 -1.677 4.004 1.00 . A A . 13 VAL HG13 1 1 2 548 1 1 13 VAL HG21 H -2.572 -4.066 1.222 1.00 . A A . 13 VAL HG21 1 1 2 549 1 1 13 VAL HG22 H -4.082 -3.779 2.087 1.00 . A A . 13 VAL HG22 1 1 2 550 1 1 13 VAL HG23 H -2.560 -3.891 2.977 1.00 . A A . 13 VAL HG23 1 1 2 551 1 1 13 VAL N N -2.510 -0.819 -0.192 1.00 . A A . 13 VAL N 1 1 2 552 1 1 13 VAL O O -5.795 -1.228 1.031 1.00 . A A . 13 VAL O 1 1 2 553 1 1 14 LYS C C -6.467 1.498 -0.243 1.00 . A A . 14 LYS C 1 1 2 554 1 1 14 LYS CA C -5.490 1.542 0.929 1.00 . A A . 14 LYS CA 1 1 2 555 1 1 14 LYS CB C -4.829 2.909 1.040 1.00 . A A . 14 LYS CB 1 1 2 556 1 1 14 LYS CD C -4.979 3.079 3.476 1.00 . A A . 14 LYS CD 1 1 2 557 1 1 14 LYS CE C -4.155 2.591 4.592 1.00 . A A . 14 LYS CE 1 1 2 558 1 1 14 LYS CG C -4.078 3.114 2.292 1.00 . A A . 14 LYS CG 1 1 2 559 1 1 14 LYS H H -3.538 0.865 0.644 1.00 . A A . 14 LYS H 1 1 2 560 1 1 14 LYS HA H -6.026 1.324 1.837 1.00 . A A . 14 LYS HA 1 1 2 561 1 1 14 LYS HB2 H -4.111 3.005 0.258 1.00 . A A . 14 LYS HB2 1 1 2 562 1 1 14 LYS HB3 H -5.569 3.675 0.975 1.00 . A A . 14 LYS HB3 1 1 2 563 1 1 14 LYS HD2 H -5.353 4.070 3.689 1.00 . A A . 14 LYS HD2 1 1 2 564 1 1 14 LYS HD3 H -5.785 2.393 3.296 1.00 . A A . 14 LYS HD3 1 1 2 565 1 1 14 LYS HE2 H -4.274 1.524 4.644 1.00 . A A . 14 LYS HE2 1 1 2 566 1 1 14 LYS HE3 H -3.143 2.831 4.326 1.00 . A A . 14 LYS HE3 1 1 2 567 1 1 14 LYS HG2 H -3.346 2.330 2.390 1.00 . A A . 14 LYS HG2 1 1 2 568 1 1 14 LYS HG3 H -3.583 4.074 2.255 1.00 . A A . 14 LYS HG3 1 1 2 569 1 1 14 LYS HZ1 H -4.300 4.218 5.890 1.00 . A A . 14 LYS HZ1 1 1 2 570 1 1 14 LYS HZ2 H -3.977 2.752 6.666 1.00 . A A . 14 LYS HZ2 1 1 2 571 1 1 14 LYS HZ3 H -5.529 3.076 6.084 1.00 . A A . 14 LYS HZ3 1 1 2 572 1 1 14 LYS N N -4.457 0.558 0.782 1.00 . A A . 14 LYS N 1 1 2 573 1 1 14 LYS NZ N -4.514 3.201 5.898 1.00 . A A . 14 LYS NZ 1 1 2 574 1 1 14 LYS O O -7.659 1.733 -0.066 1.00 . A A . 14 LYS O 1 1 2 575 1 1 15 LEU C C -7.296 -0.408 -2.706 1.00 . A A . 15 LEU C 1 1 2 576 1 1 15 LEU CA C -6.854 1.047 -2.585 1.00 . A A . 15 LEU CA 1 1 2 577 1 1 15 LEU CB C -6.158 1.544 -3.863 1.00 . A A . 15 LEU CB 1 1 2 578 1 1 15 LEU CD1 C -5.383 -0.446 -5.214 1.00 . A A . 15 LEU CD1 1 1 2 579 1 1 15 LEU CD2 C -3.994 1.631 -5.128 1.00 . A A . 15 LEU CD2 1 1 2 580 1 1 15 LEU CG C -4.948 0.735 -4.355 1.00 . A A . 15 LEU CG 1 1 2 581 1 1 15 LEU H H -5.005 1.063 -1.557 1.00 . A A . 15 LEU H 1 1 2 582 1 1 15 LEU HA H -7.727 1.654 -2.404 1.00 . A A . 15 LEU HA 1 1 2 583 1 1 15 LEU HB2 H -6.889 1.570 -4.656 1.00 . A A . 15 LEU HB2 1 1 2 584 1 1 15 LEU HB3 H -5.824 2.553 -3.675 1.00 . A A . 15 LEU HB3 1 1 2 585 1 1 15 LEU HD11 H -5.943 -0.086 -6.066 1.00 . A A . 15 LEU HD11 1 1 2 586 1 1 15 LEU HD12 H -6.005 -1.107 -4.628 1.00 . A A . 15 LEU HD12 1 1 2 587 1 1 15 LEU HD13 H -4.510 -0.982 -5.557 1.00 . A A . 15 LEU HD13 1 1 2 588 1 1 15 LEU HD21 H -4.501 2.035 -5.993 1.00 . A A . 15 LEU HD21 1 1 2 589 1 1 15 LEU HD22 H -3.139 1.055 -5.449 1.00 . A A . 15 LEU HD22 1 1 2 590 1 1 15 LEU HD23 H -3.667 2.440 -4.493 1.00 . A A . 15 LEU HD23 1 1 2 591 1 1 15 LEU HG H -4.415 0.344 -3.499 1.00 . A A . 15 LEU HG 1 1 2 592 1 1 15 LEU N N -5.975 1.195 -1.439 1.00 . A A . 15 LEU N 1 1 2 593 1 1 15 LEU O O -8.306 -0.717 -3.336 1.00 . A A . 15 LEU O 1 1 2 594 1 1 16 PHE C C -8.037 -3.017 -1.239 1.00 . A A . 16 PHE C 1 1 2 595 1 1 16 PHE CA C -6.808 -2.716 -2.078 1.00 . A A . 16 PHE CA 1 1 2 596 1 1 16 PHE CB C -5.611 -3.478 -1.513 1.00 . A A . 16 PHE CB 1 1 2 597 1 1 16 PHE CD1 C -5.662 -5.674 -2.721 1.00 . A A . 16 PHE CD1 1 1 2 598 1 1 16 PHE CD2 C -6.023 -5.667 -0.366 1.00 . A A . 16 PHE CD2 1 1 2 599 1 1 16 PHE CE1 C -5.805 -7.047 -2.741 1.00 . A A . 16 PHE CE1 1 1 2 600 1 1 16 PHE CE2 C -6.168 -7.039 -0.381 1.00 . A A . 16 PHE CE2 1 1 2 601 1 1 16 PHE CG C -5.770 -4.969 -1.536 1.00 . A A . 16 PHE CG 1 1 2 602 1 1 16 PHE CZ C -6.059 -7.730 -1.570 1.00 . A A . 16 PHE CZ 1 1 2 603 1 1 16 PHE H H -5.722 -0.967 -1.615 1.00 . A A . 16 PHE H 1 1 2 604 1 1 16 PHE HA H -6.984 -3.032 -3.095 1.00 . A A . 16 PHE HA 1 1 2 605 1 1 16 PHE HB2 H -4.734 -3.224 -2.079 1.00 . A A . 16 PHE HB2 1 1 2 606 1 1 16 PHE HB3 H -5.465 -3.178 -0.485 1.00 . A A . 16 PHE HB3 1 1 2 607 1 1 16 PHE HD1 H -5.463 -5.140 -3.639 1.00 . A A . 16 PHE HD1 1 1 2 608 1 1 16 PHE HD2 H -6.110 -5.128 0.565 1.00 . A A . 16 PHE HD2 1 1 2 609 1 1 16 PHE HE1 H -5.720 -7.585 -3.672 1.00 . A A . 16 PHE HE1 1 1 2 610 1 1 16 PHE HE2 H -6.367 -7.571 0.536 1.00 . A A . 16 PHE HE2 1 1 2 611 1 1 16 PHE HZ H -6.171 -8.804 -1.583 1.00 . A A . 16 PHE HZ 1 1 2 612 1 1 16 PHE N N -6.524 -1.289 -2.082 1.00 . A A . 16 PHE N 1 1 2 613 1 1 16 PHE O O -8.942 -3.726 -1.676 1.00 . A A . 16 PHE O 1 1 2 614 1 1 17 ASN C C -10.405 -1.991 0.386 1.00 . A A . 17 ASN C 1 1 2 615 1 1 17 ASN CA C -9.159 -2.704 0.892 1.00 . A A . 17 ASN CA 1 1 2 616 1 1 17 ASN CB C -8.814 -2.212 2.304 1.00 . A A . 17 ASN CB 1 1 2 617 1 1 17 ASN CG C -7.590 -2.884 2.910 1.00 . A A . 17 ASN CG 1 1 2 618 1 1 17 ASN H H -7.285 -1.925 0.261 1.00 . A A . 17 ASN H 1 1 2 619 1 1 17 ASN HA H -9.359 -3.764 0.924 1.00 . A A . 17 ASN HA 1 1 2 620 1 1 17 ASN HB2 H -8.628 -1.150 2.267 1.00 . A A . 17 ASN HB2 1 1 2 621 1 1 17 ASN HB3 H -9.658 -2.398 2.952 1.00 . A A . 17 ASN HB3 1 1 2 622 1 1 17 ASN HD21 H -7.973 -4.591 1.961 1.00 . A A . 17 ASN HD21 1 1 2 623 1 1 17 ASN HD22 H -6.564 -4.585 2.962 1.00 . A A . 17 ASN HD22 1 1 2 624 1 1 17 ASN N N -8.049 -2.484 -0.027 1.00 . A A . 17 ASN N 1 1 2 625 1 1 17 ASN ND2 N -7.354 -4.146 2.579 1.00 . A A . 17 ASN ND2 1 1 2 626 1 1 17 ASN O O -11.279 -2.657 -0.206 1.00 . A A . 17 ASN O 1 1 2 627 1 1 17 ASN OXT O -10.498 -0.758 0.557 1.00 . A A . 17 ASN OXT 1 1 2 628 1 1 17 ASN OD1 O -6.863 -2.270 3.692 1.00 . A A . 17 ASN OD1 1 1 3 629 1 1 1 LEU C C 14.029 -2.588 3.662 1.00 . A A . 1 LEU C 1 1 3 630 1 1 1 LEU CA C 15.331 -2.468 4.436 1.00 . A A . 1 LEU CA 1 1 3 631 1 1 1 LEU CB C 16.117 -3.784 4.346 1.00 . A A . 1 LEU CB 1 1 3 632 1 1 1 LEU CD1 C 17.977 -3.120 5.924 1.00 . A A . 1 LEU CD1 1 1 3 633 1 1 1 LEU CD2 C 18.286 -5.037 4.365 1.00 . A A . 1 LEU CD2 1 1 3 634 1 1 1 LEU CG C 17.636 -3.678 4.554 1.00 . A A . 1 LEU CG 1 1 3 635 1 1 1 LEU H1 H 14.490 -2.863 6.296 1.00 . A A . 1 LEU H1 1 1 3 636 1 1 1 LEU H2 H 14.517 -1.225 5.891 1.00 . A A . 1 LEU H2 1 1 3 637 1 1 1 LEU H3 H 15.939 -1.998 6.373 1.00 . A A . 1 LEU H3 1 1 3 638 1 1 1 LEU HA H 15.920 -1.675 3.999 1.00 . A A . 1 LEU HA 1 1 3 639 1 1 1 LEU HB2 H 15.724 -4.460 5.092 1.00 . A A . 1 LEU HB2 1 1 3 640 1 1 1 LEU HB3 H 15.941 -4.214 3.371 1.00 . A A . 1 LEU HB3 1 1 3 641 1 1 1 LEU HD11 H 17.616 -2.106 6.000 1.00 . A A . 1 LEU HD11 1 1 3 642 1 1 1 LEU HD12 H 19.047 -3.131 6.060 1.00 . A A . 1 LEU HD12 1 1 3 643 1 1 1 LEU HD13 H 17.512 -3.726 6.687 1.00 . A A . 1 LEU HD13 1 1 3 644 1 1 1 LEU HD21 H 17.848 -5.745 5.053 1.00 . A A . 1 LEU HD21 1 1 3 645 1 1 1 LEU HD22 H 19.346 -4.957 4.558 1.00 . A A . 1 LEU HD22 1 1 3 646 1 1 1 LEU HD23 H 18.130 -5.373 3.351 1.00 . A A . 1 LEU HD23 1 1 3 647 1 1 1 LEU HG H 18.046 -3.008 3.813 1.00 . A A . 1 LEU HG 1 1 3 648 1 1 1 LEU N N 15.053 -2.114 5.846 1.00 . A A . 1 LEU N 1 1 3 649 1 1 1 LEU O O 12.995 -2.938 4.233 1.00 . A A . 1 LEU O 1 1 3 650 1 1 2 MET C C 11.853 -1.338 1.958 1.00 . A A . 2 MET C 1 1 3 651 1 1 2 MET CA C 12.912 -2.334 1.493 1.00 . A A . 2 MET CA 1 1 3 652 1 1 2 MET CB C 12.323 -3.751 1.447 1.00 . A A . 2 MET CB 1 1 3 653 1 1 2 MET CE C 14.503 -5.882 -1.397 1.00 . A A . 2 MET CE 1 1 3 654 1 1 2 MET CG C 13.236 -4.779 0.799 1.00 . A A . 2 MET CG 1 1 3 655 1 1 2 MET H H 14.948 -2.011 1.979 1.00 . A A . 2 MET H 1 1 3 656 1 1 2 MET HA H 13.230 -2.057 0.498 1.00 . A A . 2 MET HA 1 1 3 657 1 1 2 MET HB2 H 12.117 -4.073 2.457 1.00 . A A . 2 MET HB2 1 1 3 658 1 1 2 MET HB3 H 11.398 -3.725 0.892 1.00 . A A . 2 MET HB3 1 1 3 659 1 1 2 MET HE1 H 13.956 -6.790 -1.189 1.00 . A A . 2 MET HE1 1 1 3 660 1 1 2 MET HE2 H 15.414 -5.872 -0.819 1.00 . A A . 2 MET HE2 1 1 3 661 1 1 2 MET HE3 H 14.743 -5.841 -2.449 1.00 . A A . 2 MET HE3 1 1 3 662 1 1 2 MET HG2 H 14.194 -4.757 1.300 1.00 . A A . 2 MET HG2 1 1 3 663 1 1 2 MET HG3 H 12.795 -5.757 0.914 1.00 . A A . 2 MET HG3 1 1 3 664 1 1 2 MET N N 14.087 -2.283 2.363 1.00 . A A . 2 MET N 1 1 3 665 1 1 2 MET O O 10.653 -1.604 1.877 1.00 . A A . 2 MET O 1 1 3 666 1 1 2 MET SD S 13.499 -4.466 -0.958 1.00 . A A . 2 MET SD 1 1 3 667 1 1 3 GLY C C 10.469 1.376 1.915 1.00 . A A . 3 GLY C 1 1 3 668 1 1 3 GLY CA C 11.413 0.829 2.964 1.00 . A A . 3 GLY CA 1 1 3 669 1 1 3 GLY H H 13.280 -0.013 2.422 1.00 . A A . 3 GLY H 1 1 3 670 1 1 3 GLY HA2 H 10.831 0.397 3.764 1.00 . A A . 3 GLY HA2 1 1 3 671 1 1 3 GLY HA3 H 12.001 1.643 3.361 1.00 . A A . 3 GLY HA3 1 1 3 672 1 1 3 GLY N N 12.311 -0.183 2.435 1.00 . A A . 3 GLY N 1 1 3 673 1 1 3 GLY O O 9.377 1.839 2.233 1.00 . A A . 3 GLY O 1 1 3 674 1 1 4 LEU C C 8.933 0.757 -0.616 1.00 . A A . 4 LEU C 1 1 3 675 1 1 4 LEU CA C 10.072 1.739 -0.458 1.00 . A A . 4 LEU CA 1 1 3 676 1 1 4 LEU CB C 10.887 1.704 -1.732 1.00 . A A . 4 LEU CB 1 1 3 677 1 1 4 LEU CD1 C 13.218 1.008 -2.114 1.00 . A A . 4 LEU CD1 1 1 3 678 1 1 4 LEU CD2 C 12.554 3.432 -2.240 1.00 . A A . 4 LEU CD2 1 1 3 679 1 1 4 LEU CG C 12.328 2.103 -1.560 1.00 . A A . 4 LEU CG 1 1 3 680 1 1 4 LEU H H 11.800 0.980 0.495 1.00 . A A . 4 LEU H 1 1 3 681 1 1 4 LEU HA H 9.709 2.741 -0.289 1.00 . A A . 4 LEU HA 1 1 3 682 1 1 4 LEU HB2 H 10.855 0.701 -2.130 1.00 . A A . 4 LEU HB2 1 1 3 683 1 1 4 LEU HB3 H 10.432 2.373 -2.447 1.00 . A A . 4 LEU HB3 1 1 3 684 1 1 4 LEU HD11 H 14.244 1.196 -1.837 1.00 . A A . 4 LEU HD11 1 1 3 685 1 1 4 LEU HD12 H 13.131 0.987 -3.189 1.00 . A A . 4 LEU HD12 1 1 3 686 1 1 4 LEU HD13 H 12.898 0.048 -1.705 1.00 . A A . 4 LEU HD13 1 1 3 687 1 1 4 LEU HD21 H 13.545 3.792 -2.015 1.00 . A A . 4 LEU HD21 1 1 3 688 1 1 4 LEU HD22 H 11.814 4.134 -1.871 1.00 . A A . 4 LEU HD22 1 1 3 689 1 1 4 LEU HD23 H 12.440 3.315 -3.306 1.00 . A A . 4 LEU HD23 1 1 3 690 1 1 4 LEU HG H 12.549 2.220 -0.510 1.00 . A A . 4 LEU HG 1 1 3 691 1 1 4 LEU N N 10.900 1.322 0.667 1.00 . A A . 4 LEU N 1 1 3 692 1 1 4 LEU O O 7.761 1.078 -0.429 1.00 . A A . 4 LEU O 1 1 3 693 1 1 5 PHE C C 7.423 -1.696 -0.047 1.00 . A A . 5 PHE C 1 1 3 694 1 1 5 PHE CA C 8.485 -1.610 -1.128 1.00 . A A . 5 PHE CA 1 1 3 695 1 1 5 PHE CB C 9.381 -2.854 -1.135 1.00 . A A . 5 PHE CB 1 1 3 696 1 1 5 PHE CD1 C 8.026 -4.852 -1.825 1.00 . A A . 5 PHE CD1 1 1 3 697 1 1 5 PHE CD2 C 8.766 -4.724 0.437 1.00 . A A . 5 PHE CD2 1 1 3 698 1 1 5 PHE CE1 C 7.422 -6.066 -1.558 1.00 . A A . 5 PHE CE1 1 1 3 699 1 1 5 PHE CE2 C 8.159 -5.933 0.709 1.00 . A A . 5 PHE CE2 1 1 3 700 1 1 5 PHE CG C 8.704 -4.166 -0.831 1.00 . A A . 5 PHE CG 1 1 3 701 1 1 5 PHE CZ C 7.487 -6.607 -0.290 1.00 . A A . 5 PHE CZ 1 1 3 702 1 1 5 PHE H H 10.309 -0.588 -1.085 1.00 . A A . 5 PHE H 1 1 3 703 1 1 5 PHE HA H 8.003 -1.522 -2.089 1.00 . A A . 5 PHE HA 1 1 3 704 1 1 5 PHE HB2 H 9.796 -2.944 -2.108 1.00 . A A . 5 PHE HB2 1 1 3 705 1 1 5 PHE HB3 H 10.190 -2.706 -0.430 1.00 . A A . 5 PHE HB3 1 1 3 706 1 1 5 PHE HD1 H 7.971 -4.431 -2.817 1.00 . A A . 5 PHE HD1 1 1 3 707 1 1 5 PHE HD2 H 9.290 -4.198 1.221 1.00 . A A . 5 PHE HD2 1 1 3 708 1 1 5 PHE HE1 H 6.896 -6.590 -2.341 1.00 . A A . 5 PHE HE1 1 1 3 709 1 1 5 PHE HE2 H 8.212 -6.354 1.703 1.00 . A A . 5 PHE HE2 1 1 3 710 1 1 5 PHE HZ H 7.015 -7.555 -0.082 1.00 . A A . 5 PHE HZ 1 1 3 711 1 1 5 PHE N N 9.350 -0.459 -0.948 1.00 . A A . 5 PHE N 1 1 3 712 1 1 5 PHE O O 6.240 -1.531 -0.326 1.00 . A A . 5 PHE O 1 1 3 713 1 1 6 ASN C C 5.953 -0.921 2.397 1.00 . A A . 6 ASN C 1 1 3 714 1 1 6 ASN CA C 6.946 -2.069 2.323 1.00 . A A . 6 ASN CA 1 1 3 715 1 1 6 ASN CB C 7.692 -2.133 3.657 1.00 . A A . 6 ASN CB 1 1 3 716 1 1 6 ASN CG C 8.416 -3.449 3.881 1.00 . A A . 6 ASN CG 1 1 3 717 1 1 6 ASN H H 8.833 -2.025 1.314 1.00 . A A . 6 ASN H 1 1 3 718 1 1 6 ASN HA H 6.397 -2.991 2.184 1.00 . A A . 6 ASN HA 1 1 3 719 1 1 6 ASN HB2 H 8.410 -1.328 3.693 1.00 . A A . 6 ASN HB2 1 1 3 720 1 1 6 ASN HB3 H 6.980 -1.998 4.458 1.00 . A A . 6 ASN HB3 1 1 3 721 1 1 6 ASN HD21 H 10.108 -2.692 3.163 1.00 . A A . 6 ASN HD21 1 1 3 722 1 1 6 ASN HD22 H 10.177 -4.344 3.682 1.00 . A A . 6 ASN HD22 1 1 3 723 1 1 6 ASN N N 7.863 -1.925 1.180 1.00 . A A . 6 ASN N 1 1 3 724 1 1 6 ASN ND2 N 9.692 -3.501 3.541 1.00 . A A . 6 ASN ND2 1 1 3 725 1 1 6 ASN O O 4.765 -1.131 2.654 1.00 . A A . 6 ASN O 1 1 3 726 1 1 6 ASN OD1 O 7.831 -4.411 4.382 1.00 . A A . 6 ASN OD1 1 1 3 727 1 1 7 ARG C C 4.568 1.484 1.158 1.00 . A A . 7 ARG C 1 1 3 728 1 1 7 ARG CA C 5.600 1.457 2.282 1.00 . A A . 7 ARG CA 1 1 3 729 1 1 7 ARG CB C 6.479 2.717 2.310 1.00 . A A . 7 ARG CB 1 1 3 730 1 1 7 ARG CD C 5.775 4.235 0.462 1.00 . A A . 7 ARG CD 1 1 3 731 1 1 7 ARG CG C 5.766 4.009 1.961 1.00 . A A . 7 ARG CG 1 1 3 732 1 1 7 ARG CZ C 5.220 6.078 -1.080 1.00 . A A . 7 ARG CZ 1 1 3 733 1 1 7 ARG H H 7.364 0.397 1.870 1.00 . A A . 7 ARG H 1 1 3 734 1 1 7 ARG HA H 5.084 1.374 3.222 1.00 . A A . 7 ARG HA 1 1 3 735 1 1 7 ARG HB2 H 6.892 2.825 3.302 1.00 . A A . 7 ARG HB2 1 1 3 736 1 1 7 ARG HB3 H 7.293 2.584 1.611 1.00 . A A . 7 ARG HB3 1 1 3 737 1 1 7 ARG HD2 H 6.800 4.304 0.131 1.00 . A A . 7 ARG HD2 1 1 3 738 1 1 7 ARG HD3 H 5.302 3.386 -0.011 1.00 . A A . 7 ARG HD3 1 1 3 739 1 1 7 ARG HE H 4.435 5.829 0.745 1.00 . A A . 7 ARG HE 1 1 3 740 1 1 7 ARG HG2 H 4.743 3.953 2.303 1.00 . A A . 7 ARG HG2 1 1 3 741 1 1 7 ARG HG3 H 6.267 4.834 2.445 1.00 . A A . 7 ARG HG3 1 1 3 742 1 1 7 ARG HH11 H 6.568 4.752 -1.813 1.00 . A A . 7 ARG HH11 1 1 3 743 1 1 7 ARG HH12 H 6.161 6.057 -2.877 1.00 . A A . 7 ARG HH12 1 1 3 744 1 1 7 ARG HH21 H 3.911 7.565 -0.647 1.00 . A A . 7 ARG HH21 1 1 3 745 1 1 7 ARG HH22 H 4.677 7.675 -2.200 1.00 . A A . 7 ARG HH22 1 1 3 746 1 1 7 ARG N N 6.433 0.289 2.160 1.00 . A A . 7 ARG N 1 1 3 747 1 1 7 ARG NE N 5.063 5.453 0.085 1.00 . A A . 7 ARG NE 1 1 3 748 1 1 7 ARG NH1 N 6.051 5.593 -1.994 1.00 . A A . 7 ARG NH1 1 1 3 749 1 1 7 ARG NH2 N 4.546 7.191 -1.331 1.00 . A A . 7 ARG NH2 1 1 3 750 1 1 7 ARG O O 3.420 1.879 1.364 1.00 . A A . 7 ARG O 1 1 3 751 1 1 8 ILE C C 3.010 -0.102 -0.932 1.00 . A A . 8 ILE C 1 1 3 752 1 1 8 ILE CA C 4.079 0.961 -1.166 1.00 . A A . 8 ILE CA 1 1 3 753 1 1 8 ILE CB C 4.840 0.642 -2.475 1.00 . A A . 8 ILE CB 1 1 3 754 1 1 8 ILE CD1 C 6.745 1.441 -3.971 1.00 . A A . 8 ILE CD1 1 1 3 755 1 1 8 ILE CG1 C 5.868 1.738 -2.772 1.00 . A A . 8 ILE CG1 1 1 3 756 1 1 8 ILE CG2 C 3.865 0.499 -3.640 1.00 . A A . 8 ILE CG2 1 1 3 757 1 1 8 ILE H H 5.915 0.755 -0.131 1.00 . A A . 8 ILE H 1 1 3 758 1 1 8 ILE HA H 3.598 1.921 -1.278 1.00 . A A . 8 ILE HA 1 1 3 759 1 1 8 ILE HB H 5.354 -0.300 -2.348 1.00 . A A . 8 ILE HB 1 1 3 760 1 1 8 ILE HD11 H 6.129 1.334 -4.850 1.00 . A A . 8 ILE HD11 1 1 3 761 1 1 8 ILE HD12 H 7.290 0.524 -3.799 1.00 . A A . 8 ILE HD12 1 1 3 762 1 1 8 ILE HD13 H 7.442 2.253 -4.116 1.00 . A A . 8 ILE HD13 1 1 3 763 1 1 8 ILE HG12 H 5.349 2.665 -2.966 1.00 . A A . 8 ILE HG12 1 1 3 764 1 1 8 ILE HG13 H 6.510 1.863 -1.913 1.00 . A A . 8 ILE HG13 1 1 3 765 1 1 8 ILE HG21 H 3.335 1.429 -3.781 1.00 . A A . 8 ILE HG21 1 1 3 766 1 1 8 ILE HG22 H 3.155 -0.289 -3.423 1.00 . A A . 8 ILE HG22 1 1 3 767 1 1 8 ILE HG23 H 4.411 0.255 -4.538 1.00 . A A . 8 ILE HG23 1 1 3 768 1 1 8 ILE N N 4.979 1.039 -0.023 1.00 . A A . 8 ILE N 1 1 3 769 1 1 8 ILE O O 1.854 0.087 -1.301 1.00 . A A . 8 ILE O 1 1 3 770 1 1 9 ILE C C 1.246 -1.785 0.722 1.00 . A A . 9 ILE C 1 1 3 771 1 1 9 ILE CA C 2.467 -2.300 -0.027 1.00 . A A . 9 ILE CA 1 1 3 772 1 1 9 ILE CB C 3.108 -3.433 0.811 1.00 . A A . 9 ILE CB 1 1 3 773 1 1 9 ILE CD1 C 4.544 -4.120 -1.185 1.00 . A A . 9 ILE CD1 1 1 3 774 1 1 9 ILE CG1 C 4.498 -3.801 0.288 1.00 . A A . 9 ILE CG1 1 1 3 775 1 1 9 ILE CG2 C 2.209 -4.659 0.823 1.00 . A A . 9 ILE CG2 1 1 3 776 1 1 9 ILE H H 4.329 -1.283 0.009 1.00 . A A . 9 ILE H 1 1 3 777 1 1 9 ILE HA H 2.151 -2.709 -0.975 1.00 . A A . 9 ILE HA 1 1 3 778 1 1 9 ILE HB H 3.202 -3.082 1.823 1.00 . A A . 9 ILE HB 1 1 3 779 1 1 9 ILE HD11 H 4.094 -3.311 -1.738 1.00 . A A . 9 ILE HD11 1 1 3 780 1 1 9 ILE HD12 H 4.005 -5.033 -1.373 1.00 . A A . 9 ILE HD12 1 1 3 781 1 1 9 ILE HD13 H 5.577 -4.234 -1.490 1.00 . A A . 9 ILE HD13 1 1 3 782 1 1 9 ILE HG12 H 5.169 -2.973 0.464 1.00 . A A . 9 ILE HG12 1 1 3 783 1 1 9 ILE HG13 H 4.857 -4.666 0.826 1.00 . A A . 9 ILE HG13 1 1 3 784 1 1 9 ILE HG21 H 1.264 -4.408 1.282 1.00 . A A . 9 ILE HG21 1 1 3 785 1 1 9 ILE HG22 H 2.684 -5.448 1.385 1.00 . A A . 9 ILE HG22 1 1 3 786 1 1 9 ILE HG23 H 2.040 -4.991 -0.191 1.00 . A A . 9 ILE HG23 1 1 3 787 1 1 9 ILE N N 3.396 -1.204 -0.290 1.00 . A A . 9 ILE N 1 1 3 788 1 1 9 ILE O O 0.107 -2.068 0.351 1.00 . A A . 9 ILE O 1 1 3 789 1 1 10 ARG C C -0.190 0.792 1.942 1.00 . A A . 10 ARG C 1 1 3 790 1 1 10 ARG CA C 0.418 -0.453 2.574 1.00 . A A . 10 ARG CA 1 1 3 791 1 1 10 ARG CB C 0.902 -0.161 3.996 1.00 . A A . 10 ARG CB 1 1 3 792 1 1 10 ARG CD C 1.733 -2.394 4.644 1.00 . A A . 10 ARG CD 1 1 3 793 1 1 10 ARG CG C 0.722 -1.316 4.936 1.00 . A A . 10 ARG CG 1 1 3 794 1 1 10 ARG CZ C 3.997 -2.944 5.430 1.00 . A A . 10 ARG CZ 1 1 3 795 1 1 10 ARG H H 2.425 -0.779 1.982 1.00 . A A . 10 ARG H 1 1 3 796 1 1 10 ARG HA H -0.351 -1.209 2.624 1.00 . A A . 10 ARG HA 1 1 3 797 1 1 10 ARG HB2 H 1.956 0.048 3.965 1.00 . A A . 10 ARG HB2 1 1 3 798 1 1 10 ARG HB3 H 0.375 0.687 4.390 1.00 . A A . 10 ARG HB3 1 1 3 799 1 1 10 ARG HD2 H 1.420 -3.275 5.138 1.00 . A A . 10 ARG HD2 1 1 3 800 1 1 10 ARG HD3 H 1.761 -2.567 3.577 1.00 . A A . 10 ARG HD3 1 1 3 801 1 1 10 ARG HE H 3.293 -1.088 5.180 1.00 . A A . 10 ARG HE 1 1 3 802 1 1 10 ARG HG2 H 0.855 -0.971 5.951 1.00 . A A . 10 ARG HG2 1 1 3 803 1 1 10 ARG HG3 H -0.272 -1.720 4.814 1.00 . A A . 10 ARG HG3 1 1 3 804 1 1 10 ARG HH11 H 2.841 -4.544 4.966 1.00 . A A . 10 ARG HH11 1 1 3 805 1 1 10 ARG HH12 H 4.422 -4.917 5.566 1.00 . A A . 10 ARG HH12 1 1 3 806 1 1 10 ARG HH21 H 5.387 -1.569 5.971 1.00 . A A . 10 ARG HH21 1 1 3 807 1 1 10 ARG HH22 H 5.877 -3.226 6.131 1.00 . A A . 10 ARG HH22 1 1 3 808 1 1 10 ARG N N 1.493 -0.998 1.760 1.00 . A A . 10 ARG N 1 1 3 809 1 1 10 ARG NE N 3.075 -2.044 5.101 1.00 . A A . 10 ARG NE 1 1 3 810 1 1 10 ARG NH1 N 3.734 -4.239 5.308 1.00 . A A . 10 ARG NH1 1 1 3 811 1 1 10 ARG NH2 N 5.183 -2.550 5.878 1.00 . A A . 10 ARG NH2 1 1 3 812 1 1 10 ARG O O -1.299 1.190 2.293 1.00 . A A . 10 ARG O 1 1 3 813 1 1 11 LYS C C -1.059 2.027 -0.727 1.00 . A A . 11 LYS C 1 1 3 814 1 1 11 LYS CA C -0.024 2.536 0.271 1.00 . A A . 11 LYS CA 1 1 3 815 1 1 11 LYS CB C 1.079 3.304 -0.465 1.00 . A A . 11 LYS CB 1 1 3 816 1 1 11 LYS CD C 1.643 5.144 -2.090 1.00 . A A . 11 LYS CD 1 1 3 817 1 1 11 LYS CE C 1.088 6.299 -2.910 1.00 . A A . 11 LYS CE 1 1 3 818 1 1 11 LYS CG C 0.562 4.511 -1.230 1.00 . A A . 11 LYS CG 1 1 3 819 1 1 11 LYS H H 1.438 1.101 0.821 1.00 . A A . 11 LYS H 1 1 3 820 1 1 11 LYS HA H -0.510 3.195 0.975 1.00 . A A . 11 LYS HA 1 1 3 821 1 1 11 LYS HB2 H 1.808 3.644 0.255 1.00 . A A . 11 LYS HB2 1 1 3 822 1 1 11 LYS HB3 H 1.560 2.638 -1.165 1.00 . A A . 11 LYS HB3 1 1 3 823 1 1 11 LYS HD2 H 2.430 5.515 -1.450 1.00 . A A . 11 LYS HD2 1 1 3 824 1 1 11 LYS HD3 H 2.042 4.397 -2.760 1.00 . A A . 11 LYS HD3 1 1 3 825 1 1 11 LYS HE2 H 0.256 5.940 -3.496 1.00 . A A . 11 LYS HE2 1 1 3 826 1 1 11 LYS HE3 H 0.742 7.067 -2.234 1.00 . A A . 11 LYS HE3 1 1 3 827 1 1 11 LYS HG2 H -0.251 4.198 -1.867 1.00 . A A . 11 LYS HG2 1 1 3 828 1 1 11 LYS HG3 H 0.201 5.244 -0.522 1.00 . A A . 11 LYS HG3 1 1 3 829 1 1 11 LYS HZ1 H 2.894 7.276 -3.274 1.00 . A A . 11 LYS HZ1 1 1 3 830 1 1 11 LYS HZ2 H 1.688 7.633 -4.399 1.00 . A A . 11 LYS HZ2 1 1 3 831 1 1 11 LYS HZ3 H 2.481 6.141 -4.456 1.00 . A A . 11 LYS HZ3 1 1 3 832 1 1 11 LYS N N 0.525 1.409 1.013 1.00 . A A . 11 LYS N 1 1 3 833 1 1 11 LYS NZ N 2.108 6.878 -3.822 1.00 . A A . 11 LYS NZ 1 1 3 834 1 1 11 LYS O O -2.098 2.648 -0.947 1.00 . A A . 11 LYS O 1 1 3 835 1 1 12 VAL C C -2.772 -0.512 -1.541 1.00 . A A . 12 VAL C 1 1 3 836 1 1 12 VAL CA C -1.666 0.250 -2.266 1.00 . A A . 12 VAL CA 1 1 3 837 1 1 12 VAL CB C -0.907 -0.710 -3.203 1.00 . A A . 12 VAL CB 1 1 3 838 1 1 12 VAL CG1 C -1.877 -1.424 -4.130 1.00 . A A . 12 VAL CG1 1 1 3 839 1 1 12 VAL CG2 C 0.138 0.048 -4.008 1.00 . A A . 12 VAL CG2 1 1 3 840 1 1 12 VAL H H 0.098 0.449 -1.121 1.00 . A A . 12 VAL H 1 1 3 841 1 1 12 VAL HA H -2.113 1.029 -2.868 1.00 . A A . 12 VAL HA 1 1 3 842 1 1 12 VAL HB H -0.398 -1.449 -2.598 1.00 . A A . 12 VAL HB 1 1 3 843 1 1 12 VAL HG11 H -2.319 -0.708 -4.805 1.00 . A A . 12 VAL HG11 1 1 3 844 1 1 12 VAL HG12 H -2.658 -1.883 -3.539 1.00 . A A . 12 VAL HG12 1 1 3 845 1 1 12 VAL HG13 H -1.353 -2.182 -4.693 1.00 . A A . 12 VAL HG13 1 1 3 846 1 1 12 VAL HG21 H 0.653 -0.636 -4.665 1.00 . A A . 12 VAL HG21 1 1 3 847 1 1 12 VAL HG22 H 0.849 0.505 -3.335 1.00 . A A . 12 VAL HG22 1 1 3 848 1 1 12 VAL HG23 H -0.347 0.815 -4.594 1.00 . A A . 12 VAL HG23 1 1 3 849 1 1 12 VAL N N -0.765 0.881 -1.318 1.00 . A A . 12 VAL N 1 1 3 850 1 1 12 VAL O O -3.874 -0.676 -2.059 1.00 . A A . 12 VAL O 1 1 3 851 1 1 13 VAL C C -4.622 -0.796 0.810 1.00 . A A . 13 VAL C 1 1 3 852 1 1 13 VAL CA C -3.455 -1.699 0.458 1.00 . A A . 13 VAL CA 1 1 3 853 1 1 13 VAL CB C -2.794 -2.280 1.725 1.00 . A A . 13 VAL CB 1 1 3 854 1 1 13 VAL CG1 C -3.163 -1.510 2.989 1.00 . A A . 13 VAL CG1 1 1 3 855 1 1 13 VAL CG2 C -3.128 -3.747 1.852 1.00 . A A . 13 VAL CG2 1 1 3 856 1 1 13 VAL H H -1.628 -0.739 0.076 1.00 . A A . 13 VAL H 1 1 3 857 1 1 13 VAL HA H -3.812 -2.516 -0.152 1.00 . A A . 13 VAL HA 1 1 3 858 1 1 13 VAL HB H -1.728 -2.201 1.595 1.00 . A A . 13 VAL HB 1 1 3 859 1 1 13 VAL HG11 H -2.833 -0.486 2.894 1.00 . A A . 13 VAL HG11 1 1 3 860 1 1 13 VAL HG12 H -2.683 -1.965 3.843 1.00 . A A . 13 VAL HG12 1 1 3 861 1 1 13 VAL HG13 H -4.234 -1.532 3.124 1.00 . A A . 13 VAL HG13 1 1 3 862 1 1 13 VAL HG21 H -2.661 -4.148 2.736 1.00 . A A . 13 VAL HG21 1 1 3 863 1 1 13 VAL HG22 H -2.758 -4.265 0.980 1.00 . A A . 13 VAL HG22 1 1 3 864 1 1 13 VAL HG23 H -4.197 -3.868 1.917 1.00 . A A . 13 VAL HG23 1 1 3 865 1 1 13 VAL N N -2.494 -0.944 -0.320 1.00 . A A . 13 VAL N 1 1 3 866 1 1 13 VAL O O -5.731 -1.245 1.096 1.00 . A A . 13 VAL O 1 1 3 867 1 1 14 LYS C C -6.368 1.480 -0.183 1.00 . A A . 14 LYS C 1 1 3 868 1 1 14 LYS CA C -5.331 1.521 0.933 1.00 . A A . 14 LYS CA 1 1 3 869 1 1 14 LYS CB C -4.628 2.872 0.963 1.00 . A A . 14 LYS CB 1 1 3 870 1 1 14 LYS CD C -4.781 3.118 3.477 1.00 . A A . 14 LYS CD 1 1 3 871 1 1 14 LYS CE C -5.860 4.188 3.418 1.00 . A A . 14 LYS CE 1 1 3 872 1 1 14 LYS CG C -3.873 3.153 2.257 1.00 . A A . 14 LYS CG 1 1 3 873 1 1 14 LYS H H -3.417 0.757 0.565 1.00 . A A . 14 LYS H 1 1 3 874 1 1 14 LYS HA H -5.822 1.351 1.877 1.00 . A A . 14 LYS HA 1 1 3 875 1 1 14 LYS HB2 H -3.903 2.883 0.154 1.00 . A A . 14 LYS HB2 1 1 3 876 1 1 14 LYS HB3 H -5.352 3.656 0.805 1.00 . A A . 14 LYS HB3 1 1 3 877 1 1 14 LYS HD2 H -5.254 2.149 3.534 1.00 . A A . 14 LYS HD2 1 1 3 878 1 1 14 LYS HD3 H -4.181 3.277 4.361 1.00 . A A . 14 LYS HD3 1 1 3 879 1 1 14 LYS HE2 H -6.419 4.061 2.506 1.00 . A A . 14 LYS HE2 1 1 3 880 1 1 14 LYS HE3 H -6.519 4.063 4.265 1.00 . A A . 14 LYS HE3 1 1 3 881 1 1 14 LYS HG2 H -3.103 2.409 2.379 1.00 . A A . 14 LYS HG2 1 1 3 882 1 1 14 LYS HG3 H -3.419 4.131 2.189 1.00 . A A . 14 LYS HG3 1 1 3 883 1 1 14 LYS HZ1 H -4.729 5.738 2.589 1.00 . A A . 14 LYS HZ1 1 1 3 884 1 1 14 LYS HZ2 H -4.680 5.681 4.277 1.00 . A A . 14 LYS HZ2 1 1 3 885 1 1 14 LYS HZ3 H -6.057 6.264 3.492 1.00 . A A . 14 LYS HZ3 1 1 3 886 1 1 14 LYS N N -4.341 0.490 0.747 1.00 . A A . 14 LYS N 1 1 3 887 1 1 14 LYS NZ N -5.292 5.563 3.445 1.00 . A A . 14 LYS NZ 1 1 3 888 1 1 14 LYS O O -7.560 1.643 0.067 1.00 . A A . 14 LYS O 1 1 3 889 1 1 15 LEU C C -7.389 -0.257 -2.646 1.00 . A A . 15 LEU C 1 1 3 890 1 1 15 LEU CA C -6.849 1.161 -2.528 1.00 . A A . 15 LEU CA 1 1 3 891 1 1 15 LEU CB C -6.179 1.634 -3.830 1.00 . A A . 15 LEU CB 1 1 3 892 1 1 15 LEU CD1 C -5.541 -0.382 -5.214 1.00 . A A . 15 LEU CD1 1 1 3 893 1 1 15 LEU CD2 C -4.071 1.639 -5.184 1.00 . A A . 15 LEU CD2 1 1 3 894 1 1 15 LEU CG C -5.025 0.778 -4.372 1.00 . A A . 15 LEU CG 1 1 3 895 1 1 15 LEU H H -4.960 1.106 -1.577 1.00 . A A . 15 LEU H 1 1 3 896 1 1 15 LEU HA H -7.676 1.820 -2.304 1.00 . A A . 15 LEU HA 1 1 3 897 1 1 15 LEU HB2 H -6.937 1.697 -4.595 1.00 . A A . 15 LEU HB2 1 1 3 898 1 1 15 LEU HB3 H -5.794 2.627 -3.652 1.00 . A A . 15 LEU HB3 1 1 3 899 1 1 15 LEU HD11 H -6.094 0.003 -6.058 1.00 . A A . 15 LEU HD11 1 1 3 900 1 1 15 LEU HD12 H -6.190 -1.003 -4.614 1.00 . A A . 15 LEU HD12 1 1 3 901 1 1 15 LEU HD13 H -4.707 -0.970 -5.568 1.00 . A A . 15 LEU HD13 1 1 3 902 1 1 15 LEU HD21 H -4.607 2.098 -6.001 1.00 . A A . 15 LEU HD21 1 1 3 903 1 1 15 LEU HD22 H -3.277 1.024 -5.578 1.00 . A A . 15 LEU HD22 1 1 3 904 1 1 15 LEU HD23 H -3.651 2.407 -4.552 1.00 . A A . 15 LEU HD23 1 1 3 905 1 1 15 LEU HG H -4.473 0.363 -3.541 1.00 . A A . 15 LEU HG 1 1 3 906 1 1 15 LEU N N -5.923 1.240 -1.414 1.00 . A A . 15 LEU N 1 1 3 907 1 1 15 LEU O O -8.443 -0.487 -3.240 1.00 . A A . 15 LEU O 1 1 3 908 1 1 16 PHE C C -8.247 -2.809 -1.100 1.00 . A A . 16 PHE C 1 1 3 909 1 1 16 PHE CA C -7.077 -2.595 -2.055 1.00 . A A . 16 PHE CA 1 1 3 910 1 1 16 PHE CB C -5.909 -3.488 -1.641 1.00 . A A . 16 PHE CB 1 1 3 911 1 1 16 PHE CD1 C -6.645 -5.769 -0.879 1.00 . A A . 16 PHE CD1 1 1 3 912 1 1 16 PHE CD2 C -5.898 -5.511 -3.128 1.00 . A A . 16 PHE CD2 1 1 3 913 1 1 16 PHE CE1 C -6.877 -7.112 -1.107 1.00 . A A . 16 PHE CE1 1 1 3 914 1 1 16 PHE CE2 C -6.127 -6.855 -3.361 1.00 . A A . 16 PHE CE2 1 1 3 915 1 1 16 PHE CG C -6.153 -4.953 -1.886 1.00 . A A . 16 PHE CG 1 1 3 916 1 1 16 PHE CZ C -6.618 -7.655 -2.350 1.00 . A A . 16 PHE CZ 1 1 3 917 1 1 16 PHE H H -5.823 -0.953 -1.611 1.00 . A A . 16 PHE H 1 1 3 918 1 1 16 PHE HA H -7.386 -2.854 -3.056 1.00 . A A . 16 PHE HA 1 1 3 919 1 1 16 PHE HB2 H -5.028 -3.195 -2.189 1.00 . A A . 16 PHE HB2 1 1 3 920 1 1 16 PHE HB3 H -5.725 -3.356 -0.585 1.00 . A A . 16 PHE HB3 1 1 3 921 1 1 16 PHE HD1 H -6.849 -5.347 0.093 1.00 . A A . 16 PHE HD1 1 1 3 922 1 1 16 PHE HD2 H -5.513 -4.887 -3.919 1.00 . A A . 16 PHE HD2 1 1 3 923 1 1 16 PHE HE1 H -7.261 -7.736 -0.314 1.00 . A A . 16 PHE HE1 1 1 3 924 1 1 16 PHE HE2 H -5.923 -7.278 -4.332 1.00 . A A . 16 PHE HE2 1 1 3 925 1 1 16 PHE HZ H -6.800 -8.704 -2.530 1.00 . A A . 16 PHE HZ 1 1 3 926 1 1 16 PHE N N -6.668 -1.202 -2.052 1.00 . A A . 16 PHE N 1 1 3 927 1 1 16 PHE O O -9.240 -3.439 -1.451 1.00 . A A . 16 PHE O 1 1 3 928 1 1 17 ASN C C -10.250 -1.425 0.960 1.00 . A A . 17 ASN C 1 1 3 929 1 1 17 ASN CA C -9.136 -2.447 1.137 1.00 . A A . 17 ASN CA 1 1 3 930 1 1 17 ASN CB C -8.530 -2.308 2.538 1.00 . A A . 17 ASN CB 1 1 3 931 1 1 17 ASN CG C -7.699 -3.510 2.956 1.00 . A A . 17 ASN CG 1 1 3 932 1 1 17 ASN H H -7.304 -1.757 0.315 1.00 . A A . 17 ASN H 1 1 3 933 1 1 17 ASN HA H -9.554 -3.437 1.031 1.00 . A A . 17 ASN HA 1 1 3 934 1 1 17 ASN HB2 H -7.894 -1.436 2.560 1.00 . A A . 17 ASN HB2 1 1 3 935 1 1 17 ASN HB3 H -9.328 -2.180 3.254 1.00 . A A . 17 ASN HB3 1 1 3 936 1 1 17 ASN HD21 H -7.206 -3.881 1.074 1.00 . A A . 17 ASN HD21 1 1 3 937 1 1 17 ASN HD22 H -6.559 -4.975 2.246 1.00 . A A . 17 ASN HD22 1 1 3 938 1 1 17 ASN N N -8.113 -2.281 0.107 1.00 . A A . 17 ASN N 1 1 3 939 1 1 17 ASN ND2 N -7.092 -4.187 1.996 1.00 . A A . 17 ASN ND2 1 1 3 940 1 1 17 ASN O O -10.115 -0.302 1.485 1.00 . A A . 17 ASN O 1 1 3 941 1 1 17 ASN OXT O -11.262 -1.749 0.297 1.00 . A A . 17 ASN OXT 1 1 3 942 1 1 17 ASN OD1 O -7.603 -3.824 4.142 1.00 . A A . 17 ASN OD1 1 1 4 943 1 1 1 LEU C C 14.424 -2.846 2.700 1.00 . A A . 1 LEU C 1 1 4 944 1 1 1 LEU CA C 15.935 -2.672 2.755 1.00 . A A . 1 LEU CA 1 1 4 945 1 1 1 LEU CB C 16.483 -3.273 4.052 1.00 . A A . 1 LEU CB 1 1 4 946 1 1 1 LEU CD1 C 18.428 -3.815 5.529 1.00 . A A . 1 LEU CD1 1 1 4 947 1 1 1 LEU CD2 C 18.604 -4.179 3.066 1.00 . A A . 1 LEU CD2 1 1 4 948 1 1 1 LEU CG C 18.008 -3.308 4.162 1.00 . A A . 1 LEU CG 1 1 4 949 1 1 1 LEU H1 H 17.333 -1.129 2.703 1.00 . A A . 1 LEU H1 1 1 4 950 1 1 1 LEU H2 H 15.870 -0.708 3.434 1.00 . A A . 1 LEU H2 1 1 4 951 1 1 1 LEU H3 H 15.965 -0.848 1.754 1.00 . A A . 1 LEU H3 1 1 4 952 1 1 1 LEU HA H 16.374 -3.189 1.915 1.00 . A A . 1 LEU HA 1 1 4 953 1 1 1 LEU HB2 H 16.097 -2.698 4.881 1.00 . A A . 1 LEU HB2 1 1 4 954 1 1 1 LEU HB3 H 16.116 -4.285 4.137 1.00 . A A . 1 LEU HB3 1 1 4 955 1 1 1 LEU HD11 H 18.055 -4.818 5.671 1.00 . A A . 1 LEU HD11 1 1 4 956 1 1 1 LEU HD12 H 18.023 -3.168 6.294 1.00 . A A . 1 LEU HD12 1 1 4 957 1 1 1 LEU HD13 H 19.506 -3.820 5.595 1.00 . A A . 1 LEU HD13 1 1 4 958 1 1 1 LEU HD21 H 18.186 -5.172 3.129 1.00 . A A . 1 LEU HD21 1 1 4 959 1 1 1 LEU HD22 H 19.675 -4.231 3.191 1.00 . A A . 1 LEU HD22 1 1 4 960 1 1 1 LEU HD23 H 18.374 -3.751 2.102 1.00 . A A . 1 LEU HD23 1 1 4 961 1 1 1 LEU HG H 18.396 -2.307 4.043 1.00 . A A . 1 LEU HG 1 1 4 962 1 1 1 LEU N N 16.301 -1.242 2.656 1.00 . A A . 1 LEU N 1 1 4 963 1 1 1 LEU O O 13.766 -2.928 3.738 1.00 . A A . 1 LEU O 1 1 4 964 1 1 2 MET C C 11.538 -2.116 1.936 1.00 . A A . 2 MET C 1 1 4 965 1 1 2 MET CA C 12.463 -3.081 1.183 1.00 . A A . 2 MET CA 1 1 4 966 1 1 2 MET CB C 12.042 -4.543 1.437 1.00 . A A . 2 MET CB 1 1 4 967 1 1 2 MET CE C 9.875 -6.742 2.179 1.00 . A A . 2 MET CE 1 1 4 968 1 1 2 MET CG C 11.838 -4.917 2.900 1.00 . A A . 2 MET CG 1 1 4 969 1 1 2 MET H H 14.501 -2.738 0.711 1.00 . A A . 2 MET H 1 1 4 970 1 1 2 MET HA H 12.339 -2.884 0.127 1.00 . A A . 2 MET HA 1 1 4 971 1 1 2 MET HB2 H 11.115 -4.728 0.917 1.00 . A A . 2 MET HB2 1 1 4 972 1 1 2 MET HB3 H 12.801 -5.194 1.029 1.00 . A A . 2 MET HB3 1 1 4 973 1 1 2 MET HE1 H 9.163 -6.029 2.569 1.00 . A A . 2 MET HE1 1 1 4 974 1 1 2 MET HE2 H 9.464 -7.738 2.252 1.00 . A A . 2 MET HE2 1 1 4 975 1 1 2 MET HE3 H 10.083 -6.513 1.144 1.00 . A A . 2 MET HE3 1 1 4 976 1 1 2 MET HG2 H 12.755 -4.725 3.437 1.00 . A A . 2 MET HG2 1 1 4 977 1 1 2 MET HG3 H 11.050 -4.301 3.307 1.00 . A A . 2 MET HG3 1 1 4 978 1 1 2 MET N N 13.893 -2.867 1.475 1.00 . A A . 2 MET N 1 1 4 979 1 1 2 MET O O 10.322 -2.304 1.950 1.00 . A A . 2 MET O 1 1 4 980 1 1 2 MET SD S 11.392 -6.651 3.128 1.00 . A A . 2 MET SD 1 1 4 981 1 1 3 GLY C C 10.475 0.736 2.274 1.00 . A A . 3 GLY C 1 1 4 982 1 1 3 GLY CA C 11.297 -0.092 3.232 1.00 . A A . 3 GLY CA 1 1 4 983 1 1 3 GLY H H 13.073 -0.948 2.466 1.00 . A A . 3 GLY H 1 1 4 984 1 1 3 GLY HA2 H 10.635 -0.608 3.913 1.00 . A A . 3 GLY HA2 1 1 4 985 1 1 3 GLY HA3 H 11.945 0.560 3.796 1.00 . A A . 3 GLY HA3 1 1 4 986 1 1 3 GLY N N 12.102 -1.067 2.522 1.00 . A A . 3 GLY N 1 1 4 987 1 1 3 GLY O O 9.355 1.141 2.585 1.00 . A A . 3 GLY O 1 1 4 988 1 1 4 LEU C C 9.117 0.863 -0.360 1.00 . A A . 4 LEU C 1 1 4 989 1 1 4 LEU CA C 10.341 1.665 0.024 1.00 . A A . 4 LEU CA 1 1 4 990 1 1 4 LEU CB C 11.221 1.758 -1.216 1.00 . A A . 4 LEU CB 1 1 4 991 1 1 4 LEU CD1 C 13.511 1.053 -1.830 1.00 . A A . 4 LEU CD1 1 1 4 992 1 1 4 LEU CD2 C 13.039 3.448 -1.254 1.00 . A A . 4 LEU CD2 1 1 4 993 1 1 4 LEU CG C 12.696 2.000 -0.965 1.00 . A A . 4 LEU CG 1 1 4 994 1 1 4 LEU H H 11.954 0.649 0.947 1.00 . A A . 4 LEU H 1 1 4 995 1 1 4 LEU HA H 10.067 2.654 0.356 1.00 . A A . 4 LEU HA 1 1 4 996 1 1 4 LEU HB2 H 11.121 0.835 -1.767 1.00 . A A . 4 LEU HB2 1 1 4 997 1 1 4 LEU HB3 H 10.848 2.562 -1.832 1.00 . A A . 4 LEU HB3 1 1 4 998 1 1 4 LEU HD11 H 13.125 0.043 -1.716 1.00 . A A . 4 LEU HD11 1 1 4 999 1 1 4 LEU HD12 H 14.545 1.083 -1.521 1.00 . A A . 4 LEU HD12 1 1 4 1000 1 1 4 LEU HD13 H 13.432 1.351 -2.864 1.00 . A A . 4 LEU HD13 1 1 4 1001 1 1 4 LEU HD21 H 12.908 3.647 -2.307 1.00 . A A . 4 LEU HD21 1 1 4 1002 1 1 4 LEU HD22 H 14.062 3.641 -0.971 1.00 . A A . 4 LEU HD22 1 1 4 1003 1 1 4 LEU HD23 H 12.377 4.086 -0.682 1.00 . A A . 4 LEU HD23 1 1 4 1004 1 1 4 LEU HG H 12.923 1.799 0.068 1.00 . A A . 4 LEU HG 1 1 4 1005 1 1 4 LEU N N 11.041 0.969 1.098 1.00 . A A . 4 LEU N 1 1 4 1006 1 1 4 LEU O O 7.997 1.368 -0.441 1.00 . A A . 4 LEU O 1 1 4 1007 1 1 5 PHE C C 7.269 -1.572 -0.122 1.00 . A A . 5 PHE C 1 1 4 1008 1 1 5 PHE CA C 8.414 -1.351 -1.101 1.00 . A A . 5 PHE CA 1 1 4 1009 1 1 5 PHE CB C 9.130 -2.662 -1.412 1.00 . A A . 5 PHE CB 1 1 4 1010 1 1 5 PHE CD1 C 7.807 -4.734 -1.899 1.00 . A A . 5 PHE CD1 1 1 4 1011 1 1 5 PHE CD2 C 8.250 -3.223 -3.688 1.00 . A A . 5 PHE CD2 1 1 4 1012 1 1 5 PHE CE1 C 7.117 -5.560 -2.764 1.00 . A A . 5 PHE CE1 1 1 4 1013 1 1 5 PHE CE2 C 7.561 -4.045 -4.555 1.00 . A A . 5 PHE CE2 1 1 4 1014 1 1 5 PHE CG C 8.381 -3.558 -2.352 1.00 . A A . 5 PHE CG 1 1 4 1015 1 1 5 PHE CZ C 6.994 -5.215 -4.093 1.00 . A A . 5 PHE CZ 1 1 4 1016 1 1 5 PHE H H 10.275 -0.749 -0.355 1.00 . A A . 5 PHE H 1 1 4 1017 1 1 5 PHE HA H 8.019 -0.941 -2.017 1.00 . A A . 5 PHE HA 1 1 4 1018 1 1 5 PHE HB2 H 10.097 -2.436 -1.852 1.00 . A A . 5 PHE HB2 1 1 4 1019 1 1 5 PHE HB3 H 9.280 -3.204 -0.490 1.00 . A A . 5 PHE HB3 1 1 4 1020 1 1 5 PHE HD1 H 7.903 -5.003 -0.858 1.00 . A A . 5 PHE HD1 1 1 4 1021 1 1 5 PHE HD2 H 8.694 -2.309 -4.052 1.00 . A A . 5 PHE HD2 1 1 4 1022 1 1 5 PHE HE1 H 6.674 -6.476 -2.399 1.00 . A A . 5 PHE HE1 1 1 4 1023 1 1 5 PHE HE2 H 7.465 -3.775 -5.594 1.00 . A A . 5 PHE HE2 1 1 4 1024 1 1 5 PHE HZ H 6.455 -5.858 -4.772 1.00 . A A . 5 PHE HZ 1 1 4 1025 1 1 5 PHE N N 9.379 -0.417 -0.570 1.00 . A A . 5 PHE N 1 1 4 1026 1 1 5 PHE O O 6.108 -1.503 -0.507 1.00 . A A . 5 PHE O 1 1 4 1027 1 1 6 ASN C C 5.647 -0.828 2.254 1.00 . A A . 6 ASN C 1 1 4 1028 1 1 6 ASN CA C 6.587 -2.015 2.182 1.00 . A A . 6 ASN CA 1 1 4 1029 1 1 6 ASN CB C 7.223 -2.209 3.557 1.00 . A A . 6 ASN CB 1 1 4 1030 1 1 6 ASN CG C 7.978 -3.516 3.686 1.00 . A A . 6 ASN CG 1 1 4 1031 1 1 6 ASN H H 8.554 -1.870 1.387 1.00 . A A . 6 ASN H 1 1 4 1032 1 1 6 ASN HA H 6.019 -2.898 1.926 1.00 . A A . 6 ASN HA 1 1 4 1033 1 1 6 ASN HB2 H 7.906 -1.393 3.743 1.00 . A A . 6 ASN HB2 1 1 4 1034 1 1 6 ASN HB3 H 6.444 -2.189 4.304 1.00 . A A . 6 ASN HB3 1 1 4 1035 1 1 6 ASN HD21 H 9.195 -2.711 5.034 1.00 . A A . 6 ASN HD21 1 1 4 1036 1 1 6 ASN HD22 H 9.496 -4.366 4.644 1.00 . A A . 6 ASN HD22 1 1 4 1037 1 1 6 ASN N N 7.603 -1.814 1.144 1.00 . A A . 6 ASN N 1 1 4 1038 1 1 6 ASN ND2 N 8.991 -3.533 4.539 1.00 . A A . 6 ASN ND2 1 1 4 1039 1 1 6 ASN O O 4.437 -0.983 2.435 1.00 . A A . 6 ASN O 1 1 4 1040 1 1 6 ASN OD1 O 7.649 -4.505 3.033 1.00 . A A . 6 ASN OD1 1 1 4 1041 1 1 7 ARG C C 4.480 1.627 0.963 1.00 . A A . 7 ARG C 1 1 4 1042 1 1 7 ARG CA C 5.443 1.578 2.147 1.00 . A A . 7 ARG CA 1 1 4 1043 1 1 7 ARG CB C 6.401 2.782 2.201 1.00 . A A . 7 ARG CB 1 1 4 1044 1 1 7 ARG CD C 5.961 4.252 0.234 1.00 . A A . 7 ARG CD 1 1 4 1045 1 1 7 ARG CG C 5.824 4.108 1.738 1.00 . A A . 7 ARG CG 1 1 4 1046 1 1 7 ARG CZ C 6.023 6.122 -1.378 1.00 . A A . 7 ARG CZ 1 1 4 1047 1 1 7 ARG H H 7.176 0.417 1.926 1.00 . A A . 7 ARG H 1 1 4 1048 1 1 7 ARG HA H 4.868 1.551 3.057 1.00 . A A . 7 ARG HA 1 1 4 1049 1 1 7 ARG HB2 H 6.733 2.908 3.220 1.00 . A A . 7 ARG HB2 1 1 4 1050 1 1 7 ARG HB3 H 7.262 2.559 1.585 1.00 . A A . 7 ARG HB3 1 1 4 1051 1 1 7 ARG HD2 H 6.986 4.051 -0.037 1.00 . A A . 7 ARG HD2 1 1 4 1052 1 1 7 ARG HD3 H 5.319 3.518 -0.235 1.00 . A A . 7 ARG HD3 1 1 4 1053 1 1 7 ARG HE H 4.975 6.108 0.331 1.00 . A A . 7 ARG HE 1 1 4 1054 1 1 7 ARG HG2 H 4.777 4.149 2.003 1.00 . A A . 7 ARG HG2 1 1 4 1055 1 1 7 ARG HG3 H 6.356 4.914 2.220 1.00 . A A . 7 ARG HG3 1 1 4 1056 1 1 7 ARG HH11 H 7.173 4.535 -1.893 1.00 . A A . 7 ARG HH11 1 1 4 1057 1 1 7 ARG HH12 H 7.188 5.856 -3.014 1.00 . A A . 7 ARG HH12 1 1 4 1058 1 1 7 ARG HH21 H 4.978 7.844 -1.160 1.00 . A A . 7 ARG HH21 1 1 4 1059 1 1 7 ARG HH22 H 5.939 7.736 -2.599 1.00 . A A . 7 ARG HH22 1 1 4 1060 1 1 7 ARG N N 6.213 0.361 2.098 1.00 . A A . 7 ARG N 1 1 4 1061 1 1 7 ARG NE N 5.589 5.585 -0.236 1.00 . A A . 7 ARG NE 1 1 4 1062 1 1 7 ARG NH1 N 6.861 5.451 -2.155 1.00 . A A . 7 ARG NH1 1 1 4 1063 1 1 7 ARG NH2 N 5.615 7.330 -1.741 1.00 . A A . 7 ARG NH2 1 1 4 1064 1 1 7 ARG O O 3.359 2.117 1.080 1.00 . A A . 7 ARG O 1 1 4 1065 1 1 8 ILE C C 2.962 -0.071 -1.085 1.00 . A A . 8 ILE C 1 1 4 1066 1 1 8 ILE CA C 4.059 0.957 -1.338 1.00 . A A . 8 ILE CA 1 1 4 1067 1 1 8 ILE CB C 4.863 0.550 -2.596 1.00 . A A . 8 ILE CB 1 1 4 1068 1 1 8 ILE CD1 C 5.079 2.961 -3.408 1.00 . A A . 8 ILE CD1 1 1 4 1069 1 1 8 ILE CG1 C 5.800 1.684 -3.022 1.00 . A A . 8 ILE CG1 1 1 4 1070 1 1 8 ILE CG2 C 3.930 0.167 -3.742 1.00 . A A . 8 ILE CG2 1 1 4 1071 1 1 8 ILE H H 5.841 0.755 -0.215 1.00 . A A . 8 ILE H 1 1 4 1072 1 1 8 ILE HA H 3.603 1.918 -1.520 1.00 . A A . 8 ILE HA 1 1 4 1073 1 1 8 ILE HB H 5.457 -0.318 -2.347 1.00 . A A . 8 ILE HB 1 1 4 1074 1 1 8 ILE HD11 H 4.369 2.750 -4.193 1.00 . A A . 8 ILE HD11 1 1 4 1075 1 1 8 ILE HD12 H 5.797 3.687 -3.758 1.00 . A A . 8 ILE HD12 1 1 4 1076 1 1 8 ILE HD13 H 4.558 3.356 -2.549 1.00 . A A . 8 ILE HD13 1 1 4 1077 1 1 8 ILE HG12 H 6.465 1.916 -2.205 1.00 . A A . 8 ILE HG12 1 1 4 1078 1 1 8 ILE HG13 H 6.381 1.360 -3.873 1.00 . A A . 8 ILE HG13 1 1 4 1079 1 1 8 ILE HG21 H 4.514 -0.168 -4.586 1.00 . A A . 8 ILE HG21 1 1 4 1080 1 1 8 ILE HG22 H 3.343 1.026 -4.030 1.00 . A A . 8 ILE HG22 1 1 4 1081 1 1 8 ILE HG23 H 3.270 -0.627 -3.422 1.00 . A A . 8 ILE HG23 1 1 4 1082 1 1 8 ILE N N 4.917 1.083 -0.167 1.00 . A A . 8 ILE N 1 1 4 1083 1 1 8 ILE O O 1.814 0.132 -1.475 1.00 . A A . 8 ILE O 1 1 4 1084 1 1 9 ILE C C 1.172 -1.678 0.632 1.00 . A A . 9 ILE C 1 1 4 1085 1 1 9 ILE CA C 2.362 -2.230 -0.132 1.00 . A A . 9 ILE CA 1 1 4 1086 1 1 9 ILE CB C 2.981 -3.384 0.694 1.00 . A A . 9 ILE CB 1 1 4 1087 1 1 9 ILE CD1 C 4.264 -4.224 -1.339 1.00 . A A . 9 ILE CD1 1 1 4 1088 1 1 9 ILE CG1 C 4.324 -3.823 0.112 1.00 . A A . 9 ILE CG1 1 1 4 1089 1 1 9 ILE CG2 C 2.024 -4.567 0.761 1.00 . A A . 9 ILE CG2 1 1 4 1090 1 1 9 ILE H H 4.239 -1.246 -0.078 1.00 . A A . 9 ILE H 1 1 4 1091 1 1 9 ILE HA H 2.020 -2.623 -1.076 1.00 . A A . 9 ILE HA 1 1 4 1092 1 1 9 ILE HB H 3.138 -3.029 1.697 1.00 . A A . 9 ILE HB 1 1 4 1093 1 1 9 ILE HD11 H 3.599 -5.065 -1.451 1.00 . A A . 9 ILE HD11 1 1 4 1094 1 1 9 ILE HD12 H 5.256 -4.495 -1.673 1.00 . A A . 9 ILE HD12 1 1 4 1095 1 1 9 ILE HD13 H 3.900 -3.393 -1.922 1.00 . A A . 9 ILE HD13 1 1 4 1096 1 1 9 ILE HG12 H 5.026 -3.008 0.197 1.00 . A A . 9 ILE HG12 1 1 4 1097 1 1 9 ILE HG13 H 4.693 -4.668 0.675 1.00 . A A . 9 ILE HG13 1 1 4 1098 1 1 9 ILE HG21 H 1.093 -4.253 1.211 1.00 . A A . 9 ILE HG21 1 1 4 1099 1 1 9 ILE HG22 H 2.463 -5.354 1.358 1.00 . A A . 9 ILE HG22 1 1 4 1100 1 1 9 ILE HG23 H 1.836 -4.934 -0.236 1.00 . A A . 9 ILE HG23 1 1 4 1101 1 1 9 ILE N N 3.315 -1.161 -0.404 1.00 . A A . 9 ILE N 1 1 4 1102 1 1 9 ILE O O 0.026 -1.987 0.329 1.00 . A A . 9 ILE O 1 1 4 1103 1 1 10 ARG C C -0.215 0.960 1.730 1.00 . A A . 10 ARG C 1 1 4 1104 1 1 10 ARG CA C 0.418 -0.233 2.425 1.00 . A A . 10 ARG CA 1 1 4 1105 1 1 10 ARG CB C 0.973 0.162 3.793 1.00 . A A . 10 ARG CB 1 1 4 1106 1 1 10 ARG CD C 0.924 -2.299 4.333 1.00 . A A . 10 ARG CD 1 1 4 1107 1 1 10 ARG CG C 0.740 -0.888 4.870 1.00 . A A . 10 ARG CG 1 1 4 1108 1 1 10 ARG CZ C 0.763 -4.606 5.186 1.00 . A A . 10 ARG CZ 1 1 4 1109 1 1 10 ARG H H 2.401 -0.607 1.786 1.00 . A A . 10 ARG H 1 1 4 1110 1 1 10 ARG HA H -0.346 -0.979 2.567 1.00 . A A . 10 ARG HA 1 1 4 1111 1 1 10 ARG HB2 H 2.036 0.327 3.704 1.00 . A A . 10 ARG HB2 1 1 4 1112 1 1 10 ARG HB3 H 0.500 1.081 4.108 1.00 . A A . 10 ARG HB3 1 1 4 1113 1 1 10 ARG HD2 H 0.122 -2.512 3.643 1.00 . A A . 10 ARG HD2 1 1 4 1114 1 1 10 ARG HD3 H 1.865 -2.353 3.810 1.00 . A A . 10 ARG HD3 1 1 4 1115 1 1 10 ARG HE H 0.986 -2.972 6.322 1.00 . A A . 10 ARG HE 1 1 4 1116 1 1 10 ARG HG2 H 1.442 -0.727 5.675 1.00 . A A . 10 ARG HG2 1 1 4 1117 1 1 10 ARG HG3 H -0.267 -0.786 5.245 1.00 . A A . 10 ARG HG3 1 1 4 1118 1 1 10 ARG HH11 H 0.672 -4.448 3.170 1.00 . A A . 10 ARG HH11 1 1 4 1119 1 1 10 ARG HH12 H 0.554 -6.062 3.785 1.00 . A A . 10 ARG HH12 1 1 4 1120 1 1 10 ARG HH21 H 0.805 -5.097 7.152 1.00 . A A . 10 ARG HH21 1 1 4 1121 1 1 10 ARG HH22 H 0.618 -6.429 6.058 1.00 . A A . 10 ARG HH22 1 1 4 1122 1 1 10 ARG N N 1.459 -0.832 1.609 1.00 . A A . 10 ARG N 1 1 4 1123 1 1 10 ARG NE N 0.900 -3.298 5.396 1.00 . A A . 10 ARG NE 1 1 4 1124 1 1 10 ARG NH1 N 0.655 -5.075 3.948 1.00 . A A . 10 ARG NH1 1 1 4 1125 1 1 10 ARG NH2 N 0.729 -5.445 6.214 1.00 . A A . 10 ARG NH2 1 1 4 1126 1 1 10 ARG O O -1.355 1.311 2.016 1.00 . A A . 10 ARG O 1 1 4 1127 1 1 11 LYS C C -1.101 2.121 -0.925 1.00 . A A . 11 LYS C 1 1 4 1128 1 1 11 LYS CA C -0.048 2.669 0.029 1.00 . A A . 11 LYS CA 1 1 4 1129 1 1 11 LYS CB C 1.047 3.396 -0.757 1.00 . A A . 11 LYS CB 1 1 4 1130 1 1 11 LYS CD C 1.655 5.342 -2.230 1.00 . A A . 11 LYS CD 1 1 4 1131 1 1 11 LYS CE C 1.247 6.734 -2.687 1.00 . A A . 11 LYS CE 1 1 4 1132 1 1 11 LYS CG C 0.578 4.705 -1.369 1.00 . A A . 11 LYS CG 1 1 4 1133 1 1 11 LYS H H 1.432 1.276 0.637 1.00 . A A . 11 LYS H 1 1 4 1134 1 1 11 LYS HA H -0.518 3.360 0.714 1.00 . A A . 11 LYS HA 1 1 4 1135 1 1 11 LYS HB2 H 1.875 3.606 -0.096 1.00 . A A . 11 LYS HB2 1 1 4 1136 1 1 11 LYS HB3 H 1.389 2.753 -1.555 1.00 . A A . 11 LYS HB3 1 1 4 1137 1 1 11 LYS HD2 H 2.566 5.415 -1.655 1.00 . A A . 11 LYS HD2 1 1 4 1138 1 1 11 LYS HD3 H 1.823 4.721 -3.098 1.00 . A A . 11 LYS HD3 1 1 4 1139 1 1 11 LYS HE2 H 1.181 7.377 -1.824 1.00 . A A . 11 LYS HE2 1 1 4 1140 1 1 11 LYS HE3 H 2.003 7.112 -3.360 1.00 . A A . 11 LYS HE3 1 1 4 1141 1 1 11 LYS HG2 H -0.291 4.514 -1.982 1.00 . A A . 11 LYS HG2 1 1 4 1142 1 1 11 LYS HG3 H 0.316 5.388 -0.574 1.00 . A A . 11 LYS HG3 1 1 4 1143 1 1 11 LYS HZ1 H -0.024 6.135 -4.234 1.00 . A A . 11 LYS HZ1 1 1 4 1144 1 1 11 LYS HZ2 H -0.317 7.702 -3.673 1.00 . A A . 11 LYS HZ2 1 1 4 1145 1 1 11 LYS HZ3 H -0.808 6.374 -2.757 1.00 . A A . 11 LYS HZ3 1 1 4 1146 1 1 11 LYS N N 0.509 1.570 0.804 1.00 . A A . 11 LYS N 1 1 4 1147 1 1 11 LYS NZ N -0.065 6.736 -3.387 1.00 . A A . 11 LYS NZ 1 1 4 1148 1 1 11 LYS O O -2.142 2.736 -1.159 1.00 . A A . 11 LYS O 1 1 4 1149 1 1 12 VAL C C -2.793 -0.507 -1.545 1.00 . A A . 12 VAL C 1 1 4 1150 1 1 12 VAL CA C -1.737 0.254 -2.342 1.00 . A A . 12 VAL CA 1 1 4 1151 1 1 12 VAL CB C -0.992 -0.728 -3.267 1.00 . A A . 12 VAL CB 1 1 4 1152 1 1 12 VAL CG1 C -1.980 -1.515 -4.112 1.00 . A A . 12 VAL CG1 1 1 4 1153 1 1 12 VAL CG2 C -0.008 0.017 -4.156 1.00 . A A . 12 VAL CG2 1 1 4 1154 1 1 12 VAL H H 0.050 0.522 -1.252 1.00 . A A . 12 VAL H 1 1 4 1155 1 1 12 VAL HA H -2.227 0.995 -2.956 1.00 . A A . 12 VAL HA 1 1 4 1156 1 1 12 VAL HB H -0.435 -1.422 -2.650 1.00 . A A . 12 VAL HB 1 1 4 1157 1 1 12 VAL HG11 H -2.706 -1.986 -3.463 1.00 . A A . 12 VAL HG11 1 1 4 1158 1 1 12 VAL HG12 H -1.455 -2.268 -4.677 1.00 . A A . 12 VAL HG12 1 1 4 1159 1 1 12 VAL HG13 H -2.488 -0.841 -4.786 1.00 . A A . 12 VAL HG13 1 1 4 1160 1 1 12 VAL HG21 H 0.502 -0.686 -4.798 1.00 . A A . 12 VAL HG21 1 1 4 1161 1 1 12 VAL HG22 H 0.713 0.534 -3.541 1.00 . A A . 12 VAL HG22 1 1 4 1162 1 1 12 VAL HG23 H -0.543 0.733 -4.763 1.00 . A A . 12 VAL HG23 1 1 4 1163 1 1 12 VAL N N -0.818 0.941 -1.455 1.00 . A A . 12 VAL N 1 1 4 1164 1 1 12 VAL O O -3.913 -0.703 -2.006 1.00 . A A . 12 VAL O 1 1 4 1165 1 1 13 VAL C C -4.526 -0.793 0.896 1.00 . A A . 13 VAL C 1 1 4 1166 1 1 13 VAL CA C -3.349 -1.670 0.507 1.00 . A A . 13 VAL CA 1 1 4 1167 1 1 13 VAL CB C -2.610 -2.210 1.753 1.00 . A A . 13 VAL CB 1 1 4 1168 1 1 13 VAL CG1 C -2.965 -1.448 3.021 1.00 . A A . 13 VAL CG1 1 1 4 1169 1 1 13 VAL CG2 C -2.874 -3.688 1.906 1.00 . A A . 13 VAL CG2 1 1 4 1170 1 1 13 VAL H H -1.575 -0.662 0.025 1.00 . A A . 13 VAL H 1 1 4 1171 1 1 13 VAL HA H -3.710 -2.509 -0.072 1.00 . A A . 13 VAL HA 1 1 4 1172 1 1 13 VAL HB H -1.550 -2.086 1.584 1.00 . A A . 13 VAL HB 1 1 4 1173 1 1 13 VAL HG11 H -2.415 -1.859 3.853 1.00 . A A . 13 VAL HG11 1 1 4 1174 1 1 13 VAL HG12 H -4.025 -1.538 3.208 1.00 . A A . 13 VAL HG12 1 1 4 1175 1 1 13 VAL HG13 H -2.708 -0.406 2.896 1.00 . A A . 13 VAL HG13 1 1 4 1176 1 1 13 VAL HG21 H -2.351 -4.060 2.773 1.00 . A A . 13 VAL HG21 1 1 4 1177 1 1 13 VAL HG22 H -2.522 -4.198 1.023 1.00 . A A . 13 VAL HG22 1 1 4 1178 1 1 13 VAL HG23 H -3.933 -3.854 2.022 1.00 . A A . 13 VAL HG23 1 1 4 1179 1 1 13 VAL N N -2.449 -0.903 -0.328 1.00 . A A . 13 VAL N 1 1 4 1180 1 1 13 VAL O O -5.609 -1.266 1.226 1.00 . A A . 13 VAL O 1 1 4 1181 1 1 14 LYS C C -6.348 1.474 -0.085 1.00 . A A . 14 LYS C 1 1 4 1182 1 1 14 LYS CA C -5.291 1.508 1.017 1.00 . A A . 14 LYS CA 1 1 4 1183 1 1 14 LYS CB C -4.607 2.868 1.052 1.00 . A A . 14 LYS CB 1 1 4 1184 1 1 14 LYS CD C -4.670 3.104 3.564 1.00 . A A . 14 LYS CD 1 1 4 1185 1 1 14 LYS CE C -5.620 4.290 3.613 1.00 . A A . 14 LYS CE 1 1 4 1186 1 1 14 LYS CG C -3.803 3.128 2.318 1.00 . A A . 14 LYS CG 1 1 4 1187 1 1 14 LYS H H -3.374 0.787 0.596 1.00 . A A . 14 LYS H 1 1 4 1188 1 1 14 LYS HA H -5.765 1.321 1.967 1.00 . A A . 14 LYS HA 1 1 4 1189 1 1 14 LYS HB2 H -3.919 2.908 0.216 1.00 . A A . 14 LYS HB2 1 1 4 1190 1 1 14 LYS HB3 H -5.348 3.644 0.945 1.00 . A A . 14 LYS HB3 1 1 4 1191 1 1 14 LYS HD2 H -5.246 2.192 3.567 1.00 . A A . 14 LYS HD2 1 1 4 1192 1 1 14 LYS HD3 H -4.030 3.129 4.434 1.00 . A A . 14 LYS HD3 1 1 4 1193 1 1 14 LYS HE2 H -6.191 4.309 2.699 1.00 . A A . 14 LYS HE2 1 1 4 1194 1 1 14 LYS HE3 H -6.288 4.167 4.451 1.00 . A A . 14 LYS HE3 1 1 4 1195 1 1 14 LYS HG2 H -3.045 2.367 2.411 1.00 . A A . 14 LYS HG2 1 1 4 1196 1 1 14 LYS HG3 H -3.331 4.096 2.239 1.00 . A A . 14 LYS HG3 1 1 4 1197 1 1 14 LYS HZ1 H -5.571 6.368 3.823 1.00 . A A . 14 LYS HZ1 1 1 4 1198 1 1 14 LYS HZ2 H -4.281 5.742 2.930 1.00 . A A . 14 LYS HZ2 1 1 4 1199 1 1 14 LYS HZ3 H -4.306 5.570 4.612 1.00 . A A . 14 LYS HZ3 1 1 4 1200 1 1 14 LYS N N -4.285 0.499 0.806 1.00 . A A . 14 LYS N 1 1 4 1201 1 1 14 LYS NZ N -4.895 5.582 3.753 1.00 . A A . 14 LYS NZ 1 1 4 1202 1 1 14 LYS O O -7.528 1.721 0.171 1.00 . A A . 14 LYS O 1 1 4 1203 1 1 15 LEU C C -7.351 -0.355 -2.566 1.00 . A A . 15 LEU C 1 1 4 1204 1 1 15 LEU CA C -6.866 1.082 -2.422 1.00 . A A . 15 LEU CA 1 1 4 1205 1 1 15 LEU CB C -6.219 1.603 -3.714 1.00 . A A . 15 LEU CB 1 1 4 1206 1 1 15 LEU CD1 C -5.517 -0.330 -5.181 1.00 . A A . 15 LEU CD1 1 1 4 1207 1 1 15 LEU CD2 C -4.088 1.713 -5.022 1.00 . A A . 15 LEU CD2 1 1 4 1208 1 1 15 LEU CG C -5.040 0.796 -4.274 1.00 . A A . 15 LEU CG 1 1 4 1209 1 1 15 LEU H H -4.971 1.025 -1.486 1.00 . A A . 15 LEU H 1 1 4 1210 1 1 15 LEU HA H -7.715 1.705 -2.183 1.00 . A A . 15 LEU HA 1 1 4 1211 1 1 15 LEU HB2 H -6.981 1.655 -4.477 1.00 . A A . 15 LEU HB2 1 1 4 1212 1 1 15 LEU HB3 H -5.867 2.602 -3.516 1.00 . A A . 15 LEU HB3 1 1 4 1213 1 1 15 LEU HD11 H -6.089 0.083 -5.999 1.00 . A A . 15 LEU HD11 1 1 4 1214 1 1 15 LEU HD12 H -6.138 -1.010 -4.615 1.00 . A A . 15 LEU HD12 1 1 4 1215 1 1 15 LEU HD13 H -4.664 -0.863 -5.573 1.00 . A A . 15 LEU HD13 1 1 4 1216 1 1 15 LEU HD21 H -3.270 1.133 -5.423 1.00 . A A . 15 LEU HD21 1 1 4 1217 1 1 15 LEU HD22 H -3.700 2.459 -4.344 1.00 . A A . 15 LEU HD22 1 1 4 1218 1 1 15 LEU HD23 H -4.616 2.200 -5.828 1.00 . A A . 15 LEU HD23 1 1 4 1219 1 1 15 LEU HG H -4.497 0.352 -3.452 1.00 . A A . 15 LEU HG 1 1 4 1220 1 1 15 LEU N N -5.929 1.182 -1.315 1.00 . A A . 15 LEU N 1 1 4 1221 1 1 15 LEU O O -8.346 -0.630 -3.241 1.00 . A A . 15 LEU O 1 1 4 1222 1 1 16 PHE C C -8.023 -2.996 -0.889 1.00 . A A . 16 PHE C 1 1 4 1223 1 1 16 PHE CA C -6.978 -2.680 -1.955 1.00 . A A . 16 PHE CA 1 1 4 1224 1 1 16 PHE CB C -5.721 -3.520 -1.728 1.00 . A A . 16 PHE CB 1 1 4 1225 1 1 16 PHE CD1 C -5.804 -5.961 -1.163 1.00 . A A . 16 PHE CD1 1 1 4 1226 1 1 16 PHE CD2 C -6.084 -5.317 -3.440 1.00 . A A . 16 PHE CD2 1 1 4 1227 1 1 16 PHE CE1 C -5.939 -7.289 -1.519 1.00 . A A . 16 PHE CE1 1 1 4 1228 1 1 16 PHE CE2 C -6.221 -6.644 -3.802 1.00 . A A . 16 PHE CE2 1 1 4 1229 1 1 16 PHE CG C -5.874 -4.962 -2.118 1.00 . A A . 16 PHE CG 1 1 4 1230 1 1 16 PHE CZ C -6.148 -7.631 -2.839 1.00 . A A . 16 PHE CZ 1 1 4 1231 1 1 16 PHE H H -5.838 -0.985 -1.420 1.00 . A A . 16 PHE H 1 1 4 1232 1 1 16 PHE HA H -7.386 -2.906 -2.929 1.00 . A A . 16 PHE HA 1 1 4 1233 1 1 16 PHE HB2 H -4.910 -3.101 -2.302 1.00 . A A . 16 PHE HB2 1 1 4 1234 1 1 16 PHE HB3 H -5.466 -3.485 -0.680 1.00 . A A . 16 PHE HB3 1 1 4 1235 1 1 16 PHE HD1 H -5.641 -5.696 -0.129 1.00 . A A . 16 PHE HD1 1 1 4 1236 1 1 16 PHE HD2 H -6.142 -4.546 -4.193 1.00 . A A . 16 PHE HD2 1 1 4 1237 1 1 16 PHE HE1 H -5.882 -8.060 -0.765 1.00 . A A . 16 PHE HE1 1 1 4 1238 1 1 16 PHE HE2 H -6.385 -6.907 -4.836 1.00 . A A . 16 PHE HE2 1 1 4 1239 1 1 16 PHE HZ H -6.254 -8.669 -3.119 1.00 . A A . 16 PHE HZ 1 1 4 1240 1 1 16 PHE N N -6.635 -1.269 -1.922 1.00 . A A . 16 PHE N 1 1 4 1241 1 1 16 PHE O O -8.982 -3.722 -1.137 1.00 . A A . 16 PHE O 1 1 4 1242 1 1 17 ASN C C -9.637 -1.374 1.492 1.00 . A A . 17 ASN C 1 1 4 1243 1 1 17 ASN CA C -8.775 -2.620 1.391 1.00 . A A . 17 ASN CA 1 1 4 1244 1 1 17 ASN CB C -8.069 -2.862 2.736 1.00 . A A . 17 ASN CB 1 1 4 1245 1 1 17 ASN CG C -7.463 -4.249 2.878 1.00 . A A . 17 ASN CG 1 1 4 1246 1 1 17 ASN H H -7.003 -1.928 0.462 1.00 . A A . 17 ASN H 1 1 4 1247 1 1 17 ASN HA H -9.404 -3.467 1.162 1.00 . A A . 17 ASN HA 1 1 4 1248 1 1 17 ASN HB2 H -7.276 -2.140 2.847 1.00 . A A . 17 ASN HB2 1 1 4 1249 1 1 17 ASN HB3 H -8.783 -2.721 3.533 1.00 . A A . 17 ASN HB3 1 1 4 1250 1 1 17 ASN HD21 H -7.066 -4.325 0.939 1.00 . A A . 17 ASN HD21 1 1 4 1251 1 1 17 ASN HD22 H -6.590 -5.710 1.858 1.00 . A A . 17 ASN HD22 1 1 4 1252 1 1 17 ASN N N -7.818 -2.460 0.305 1.00 . A A . 17 ASN N 1 1 4 1253 1 1 17 ASN ND2 N -6.997 -4.820 1.782 1.00 . A A . 17 ASN ND2 1 1 4 1254 1 1 17 ASN O O -9.253 -0.444 2.225 1.00 . A A . 17 ASN O 1 1 4 1255 1 1 17 ASN OXT O -10.688 -1.316 0.820 1.00 . A A . 17 ASN OXT 1 1 4 1256 1 1 17 ASN OD1 O -7.409 -4.801 3.980 1.00 . A A . 17 ASN OD1 1 1 5 1257 1 1 1 LEU C C 14.907 -1.074 -0.416 1.00 . A A . 1 LEU C 1 1 5 1258 1 1 1 LEU CA C 16.413 -0.925 -0.220 1.00 . A A . 1 LEU CA 1 1 5 1259 1 1 1 LEU CB C 17.141 -1.930 -1.115 1.00 . A A . 1 LEU CB 1 1 5 1260 1 1 1 LEU CD1 C 17.598 -0.488 -3.116 1.00 . A A . 1 LEU CD1 1 1 5 1261 1 1 1 LEU CD2 C 17.374 -2.962 -3.385 1.00 . A A . 1 LEU CD2 1 1 5 1262 1 1 1 LEU CG C 16.903 -1.744 -2.615 1.00 . A A . 1 LEU CG 1 1 5 1263 1 1 1 LEU H1 H 16.286 -0.444 1.798 1.00 . A A . 1 LEU H1 1 1 5 1264 1 1 1 LEU H2 H 17.806 -1.009 1.323 1.00 . A A . 1 LEU H2 1 1 5 1265 1 1 1 LEU H3 H 16.520 -2.090 1.501 1.00 . A A . 1 LEU H3 1 1 5 1266 1 1 1 LEU HA H 16.703 0.075 -0.503 1.00 . A A . 1 LEU HA 1 1 5 1267 1 1 1 LEU HB2 H 18.202 -1.847 -0.925 1.00 . A A . 1 LEU HB2 1 1 5 1268 1 1 1 LEU HB3 H 16.820 -2.922 -0.843 1.00 . A A . 1 LEU HB3 1 1 5 1269 1 1 1 LEU HD11 H 18.658 -0.563 -2.926 1.00 . A A . 1 LEU HD11 1 1 5 1270 1 1 1 LEU HD12 H 17.200 0.374 -2.601 1.00 . A A . 1 LEU HD12 1 1 5 1271 1 1 1 LEU HD13 H 17.428 -0.383 -4.177 1.00 . A A . 1 LEU HD13 1 1 5 1272 1 1 1 LEU HD21 H 16.806 -3.826 -3.077 1.00 . A A . 1 LEU HD21 1 1 5 1273 1 1 1 LEU HD22 H 18.421 -3.130 -3.185 1.00 . A A . 1 LEU HD22 1 1 5 1274 1 1 1 LEU HD23 H 17.233 -2.797 -4.443 1.00 . A A . 1 LEU HD23 1 1 5 1275 1 1 1 LEU HG H 15.843 -1.628 -2.789 1.00 . A A . 1 LEU HG 1 1 5 1276 1 1 1 LEU N N 16.783 -1.132 1.197 1.00 . A A . 1 LEU N 1 1 5 1277 1 1 1 LEU O O 14.277 -0.258 -1.082 1.00 . A A . 1 LEU O 1 1 5 1278 1 1 2 MET C C 12.040 -1.536 0.915 1.00 . A A . 2 MET C 1 1 5 1279 1 1 2 MET CA C 12.909 -2.398 0.005 1.00 . A A . 2 MET CA 1 1 5 1280 1 1 2 MET CB C 12.615 -3.881 0.258 1.00 . A A . 2 MET CB 1 1 5 1281 1 1 2 MET CE C 14.689 -5.867 -2.781 1.00 . A A . 2 MET CE 1 1 5 1282 1 1 2 MET CG C 12.949 -4.793 -0.918 1.00 . A A . 2 MET CG 1 1 5 1283 1 1 2 MET H H 14.866 -2.700 0.755 1.00 . A A . 2 MET H 1 1 5 1284 1 1 2 MET HA H 12.657 -2.168 -1.020 1.00 . A A . 2 MET HA 1 1 5 1285 1 1 2 MET HB2 H 13.191 -4.206 1.110 1.00 . A A . 2 MET HB2 1 1 5 1286 1 1 2 MET HB3 H 11.565 -3.993 0.484 1.00 . A A . 2 MET HB3 1 1 5 1287 1 1 2 MET HE1 H 15.693 -5.959 -3.172 1.00 . A A . 2 MET HE1 1 1 5 1288 1 1 2 MET HE2 H 14.041 -5.468 -3.547 1.00 . A A . 2 MET HE2 1 1 5 1289 1 1 2 MET HE3 H 14.332 -6.839 -2.478 1.00 . A A . 2 MET HE3 1 1 5 1290 1 1 2 MET HG2 H 12.679 -5.805 -0.655 1.00 . A A . 2 MET HG2 1 1 5 1291 1 1 2 MET HG3 H 12.366 -4.480 -1.772 1.00 . A A . 2 MET HG3 1 1 5 1292 1 1 2 MET N N 14.328 -2.111 0.182 1.00 . A A . 2 MET N 1 1 5 1293 1 1 2 MET O O 10.822 -1.693 0.939 1.00 . A A . 2 MET O 1 1 5 1294 1 1 2 MET SD S 14.696 -4.766 -1.369 1.00 . A A . 2 MET SD 1 1 5 1295 1 1 3 GLY C C 10.864 1.067 1.752 1.00 . A A . 3 GLY C 1 1 5 1296 1 1 3 GLY CA C 11.930 0.296 2.506 1.00 . A A . 3 GLY CA 1 1 5 1297 1 1 3 GLY H H 13.643 -0.548 1.590 1.00 . A A . 3 GLY H 1 1 5 1298 1 1 3 GLY HA2 H 11.459 -0.276 3.293 1.00 . A A . 3 GLY HA2 1 1 5 1299 1 1 3 GLY HA3 H 12.622 0.997 2.948 1.00 . A A . 3 GLY HA3 1 1 5 1300 1 1 3 GLY N N 12.667 -0.612 1.639 1.00 . A A . 3 GLY N 1 1 5 1301 1 1 3 GLY O O 9.839 1.450 2.319 1.00 . A A . 3 GLY O 1 1 5 1302 1 1 4 LEU C C 8.920 1.010 -0.531 1.00 . A A . 4 LEU C 1 1 5 1303 1 1 4 LEU CA C 10.127 1.915 -0.407 1.00 . A A . 4 LEU CA 1 1 5 1304 1 1 4 LEU CB C 10.680 2.100 -1.816 1.00 . A A . 4 LEU CB 1 1 5 1305 1 1 4 LEU CD1 C 12.787 1.747 -3.059 1.00 . A A . 4 LEU CD1 1 1 5 1306 1 1 4 LEU CD2 C 12.259 4.004 -2.110 1.00 . A A . 4 LEU CD2 1 1 5 1307 1 1 4 LEU CG C 12.138 2.503 -1.911 1.00 . A A . 4 LEU CG 1 1 5 1308 1 1 4 LEU H H 11.971 1.009 0.094 1.00 . A A . 4 LEU H 1 1 5 1309 1 1 4 LEU HA H 9.848 2.868 0.007 1.00 . A A . 4 LEU HA 1 1 5 1310 1 1 4 LEU HB2 H 10.554 1.170 -2.349 1.00 . A A . 4 LEU HB2 1 1 5 1311 1 1 4 LEU HB3 H 10.090 2.856 -2.312 1.00 . A A . 4 LEU HB3 1 1 5 1312 1 1 4 LEU HD11 H 12.419 2.132 -3.998 1.00 . A A . 4 LEU HD11 1 1 5 1313 1 1 4 LEU HD12 H 12.534 0.694 -2.981 1.00 . A A . 4 LEU HD12 1 1 5 1314 1 1 4 LEU HD13 H 13.860 1.867 -3.013 1.00 . A A . 4 LEU HD13 1 1 5 1315 1 1 4 LEU HD21 H 11.774 4.514 -1.291 1.00 . A A . 4 LEU HD21 1 1 5 1316 1 1 4 LEU HD22 H 11.787 4.284 -3.040 1.00 . A A . 4 LEU HD22 1 1 5 1317 1 1 4 LEU HD23 H 13.302 4.280 -2.137 1.00 . A A . 4 LEU HD23 1 1 5 1318 1 1 4 LEU HG H 12.640 2.239 -0.995 1.00 . A A . 4 LEU HG 1 1 5 1319 1 1 4 LEU N N 11.109 1.286 0.464 1.00 . A A . 4 LEU N 1 1 5 1320 1 1 4 LEU O O 7.787 1.387 -0.238 1.00 . A A . 4 LEU O 1 1 5 1321 1 1 5 PHE C C 7.388 -1.630 -0.135 1.00 . A A . 5 PHE C 1 1 5 1322 1 1 5 PHE CA C 8.203 -1.171 -1.339 1.00 . A A . 5 PHE CA 1 1 5 1323 1 1 5 PHE CB C 8.880 -2.351 -2.032 1.00 . A A . 5 PHE CB 1 1 5 1324 1 1 5 PHE CD1 C 7.837 -2.690 -4.287 1.00 . A A . 5 PHE CD1 1 1 5 1325 1 1 5 PHE CD2 C 7.247 -4.187 -2.531 1.00 . A A . 5 PHE CD2 1 1 5 1326 1 1 5 PHE CE1 C 6.997 -3.365 -5.151 1.00 . A A . 5 PHE CE1 1 1 5 1327 1 1 5 PHE CE2 C 6.406 -4.866 -3.391 1.00 . A A . 5 PHE CE2 1 1 5 1328 1 1 5 PHE CG C 7.971 -3.093 -2.969 1.00 . A A . 5 PHE CG 1 1 5 1329 1 1 5 PHE CZ C 6.280 -4.455 -4.701 1.00 . A A . 5 PHE CZ 1 1 5 1330 1 1 5 PHE H H 10.152 -0.479 -0.991 1.00 . A A . 5 PHE H 1 1 5 1331 1 1 5 PHE HA H 7.542 -0.688 -2.041 1.00 . A A . 5 PHE HA 1 1 5 1332 1 1 5 PHE HB2 H 9.731 -1.983 -2.602 1.00 . A A . 5 PHE HB2 1 1 5 1333 1 1 5 PHE HB3 H 9.226 -3.047 -1.282 1.00 . A A . 5 PHE HB3 1 1 5 1334 1 1 5 PHE HD1 H 8.399 -1.836 -4.639 1.00 . A A . 5 PHE HD1 1 1 5 1335 1 1 5 PHE HD2 H 7.343 -4.510 -1.505 1.00 . A A . 5 PHE HD2 1 1 5 1336 1 1 5 PHE HE1 H 6.902 -3.041 -6.175 1.00 . A A . 5 PHE HE1 1 1 5 1337 1 1 5 PHE HE2 H 5.844 -5.718 -3.036 1.00 . A A . 5 PHE HE2 1 1 5 1338 1 1 5 PHE HZ H 5.623 -4.983 -5.374 1.00 . A A . 5 PHE HZ 1 1 5 1339 1 1 5 PHE N N 9.211 -0.212 -0.950 1.00 . A A . 5 PHE N 1 1 5 1340 1 1 5 PHE O O 6.179 -1.815 -0.243 1.00 . A A . 5 PHE O 1 1 5 1341 1 1 6 ASN C C 6.284 -1.094 2.548 1.00 . A A . 6 ASN C 1 1 5 1342 1 1 6 ASN CA C 7.360 -2.125 2.257 1.00 . A A . 6 ASN CA 1 1 5 1343 1 1 6 ASN CB C 8.331 -2.146 3.440 1.00 . A A . 6 ASN CB 1 1 5 1344 1 1 6 ASN CG C 9.319 -3.304 3.403 1.00 . A A . 6 ASN CG 1 1 5 1345 1 1 6 ASN H H 9.031 -1.703 1.012 1.00 . A A . 6 ASN H 1 1 5 1346 1 1 6 ASN HA H 6.903 -3.098 2.145 1.00 . A A . 6 ASN HA 1 1 5 1347 1 1 6 ASN HB2 H 8.883 -1.220 3.448 1.00 . A A . 6 ASN HB2 1 1 5 1348 1 1 6 ASN HB3 H 7.759 -2.217 4.355 1.00 . A A . 6 ASN HB3 1 1 5 1349 1 1 6 ASN HD21 H 9.539 -3.206 5.374 1.00 . A A . 6 ASN HD21 1 1 5 1350 1 1 6 ASN HD22 H 10.468 -4.425 4.573 1.00 . A A . 6 ASN HD22 1 1 5 1351 1 1 6 ASN N N 8.050 -1.794 1.009 1.00 . A A . 6 ASN N 1 1 5 1352 1 1 6 ASN ND2 N 9.826 -3.684 4.566 1.00 . A A . 6 ASN ND2 1 1 5 1353 1 1 6 ASN O O 5.186 -1.423 3.002 1.00 . A A . 6 ASN O 1 1 5 1354 1 1 6 ASN OD1 O 9.636 -3.845 2.345 1.00 . A A . 6 ASN OD1 1 1 5 1355 1 1 7 ARG C C 4.615 1.251 1.420 1.00 . A A . 7 ARG C 1 1 5 1356 1 1 7 ARG CA C 5.693 1.247 2.505 1.00 . A A . 7 ARG CA 1 1 5 1357 1 1 7 ARG CB C 6.476 2.569 2.574 1.00 . A A . 7 ARG CB 1 1 5 1358 1 1 7 ARG CD C 5.615 4.136 0.831 1.00 . A A . 7 ARG CD 1 1 5 1359 1 1 7 ARG CG C 5.660 3.826 2.314 1.00 . A A . 7 ARG CG 1 1 5 1360 1 1 7 ARG CZ C 4.926 6.002 -0.626 1.00 . A A . 7 ARG CZ 1 1 5 1361 1 1 7 ARG H H 7.496 0.358 1.901 1.00 . A A . 7 ARG H 1 1 5 1362 1 1 7 ARG HA H 5.227 1.069 3.456 1.00 . A A . 7 ARG HA 1 1 5 1363 1 1 7 ARG HB2 H 6.913 2.656 3.556 1.00 . A A . 7 ARG HB2 1 1 5 1364 1 1 7 ARG HB3 H 7.273 2.532 1.844 1.00 . A A . 7 ARG HB3 1 1 5 1365 1 1 7 ARG HD2 H 6.626 4.257 0.476 1.00 . A A . 7 ARG HD2 1 1 5 1366 1 1 7 ARG HD3 H 5.159 3.296 0.326 1.00 . A A . 7 ARG HD3 1 1 5 1367 1 1 7 ARG HE H 4.252 5.690 1.235 1.00 . A A . 7 ARG HE 1 1 5 1368 1 1 7 ARG HG2 H 4.654 3.674 2.674 1.00 . A A . 7 ARG HG2 1 1 5 1369 1 1 7 ARG HG3 H 6.113 4.656 2.836 1.00 . A A . 7 ARG HG3 1 1 5 1370 1 1 7 ARG HH11 H 6.311 4.764 -1.428 1.00 . A A . 7 ARG HH11 1 1 5 1371 1 1 7 ARG HH12 H 5.803 6.068 -2.453 1.00 . A A . 7 ARG HH12 1 1 5 1372 1 1 7 ARG HH21 H 3.577 7.424 -0.107 1.00 . A A . 7 ARG HH21 1 1 5 1373 1 1 7 ARG HH22 H 4.247 7.581 -1.699 1.00 . A A . 7 ARG HH22 1 1 5 1374 1 1 7 ARG N N 6.611 0.161 2.278 1.00 . A A . 7 ARG N 1 1 5 1375 1 1 7 ARG NE N 4.853 5.348 0.532 1.00 . A A . 7 ARG NE 1 1 5 1376 1 1 7 ARG NH1 N 5.743 5.577 -1.577 1.00 . A A . 7 ARG NH1 1 1 5 1377 1 1 7 ARG NH2 N 4.192 7.088 -0.827 1.00 . A A . 7 ARG NH2 1 1 5 1378 1 1 7 ARG O O 3.458 1.593 1.675 1.00 . A A . 7 ARG O 1 1 5 1379 1 1 8 ILE C C 2.998 -0.300 -0.628 1.00 . A A . 8 ILE C 1 1 5 1380 1 1 8 ILE CA C 4.078 0.740 -0.906 1.00 . A A . 8 ILE CA 1 1 5 1381 1 1 8 ILE CB C 4.806 0.383 -2.224 1.00 . A A . 8 ILE CB 1 1 5 1382 1 1 8 ILE CD1 C 6.555 1.209 -3.880 1.00 . A A . 8 ILE CD1 1 1 5 1383 1 1 8 ILE CG1 C 5.781 1.495 -2.613 1.00 . A A . 8 ILE CG1 1 1 5 1384 1 1 8 ILE CG2 C 3.806 0.137 -3.350 1.00 . A A . 8 ILE CG2 1 1 5 1385 1 1 8 ILE H H 5.946 0.594 0.079 1.00 . A A . 8 ILE H 1 1 5 1386 1 1 8 ILE HA H 3.609 1.705 -1.033 1.00 . A A . 8 ILE HA 1 1 5 1387 1 1 8 ILE HB H 5.361 -0.531 -2.065 1.00 . A A . 8 ILE HB 1 1 5 1388 1 1 8 ILE HD11 H 7.241 2.018 -4.073 1.00 . A A . 8 ILE HD11 1 1 5 1389 1 1 8 ILE HD12 H 5.868 1.114 -4.708 1.00 . A A . 8 ILE HD12 1 1 5 1390 1 1 8 ILE HD13 H 7.107 0.287 -3.766 1.00 . A A . 8 ILE HD13 1 1 5 1391 1 1 8 ILE HG12 H 5.230 2.411 -2.762 1.00 . A A . 8 ILE HG12 1 1 5 1392 1 1 8 ILE HG13 H 6.494 1.636 -1.813 1.00 . A A . 8 ILE HG13 1 1 5 1393 1 1 8 ILE HG21 H 3.135 -0.662 -3.067 1.00 . A A . 8 ILE HG21 1 1 5 1394 1 1 8 ILE HG22 H 4.335 -0.140 -4.250 1.00 . A A . 8 ILE HG22 1 1 5 1395 1 1 8 ILE HG23 H 3.237 1.037 -3.529 1.00 . A A . 8 ILE HG23 1 1 5 1396 1 1 8 ILE N N 5.005 0.840 0.215 1.00 . A A . 8 ILE N 1 1 5 1397 1 1 8 ILE O O 1.849 -0.117 -1.021 1.00 . A A . 8 ILE O 1 1 5 1398 1 1 9 ILE C C 1.189 -1.848 1.076 1.00 . A A . 9 ILE C 1 1 5 1399 1 1 9 ILE CA C 2.412 -2.435 0.395 1.00 . A A . 9 ILE CA 1 1 5 1400 1 1 9 ILE CB C 3.026 -3.500 1.338 1.00 . A A . 9 ILE CB 1 1 5 1401 1 1 9 ILE CD1 C 4.286 -4.611 -0.573 1.00 . A A . 9 ILE CD1 1 1 5 1402 1 1 9 ILE CG1 C 4.365 -4.010 0.805 1.00 . A A . 9 ILE CG1 1 1 5 1403 1 1 9 ILE CG2 C 2.059 -4.662 1.538 1.00 . A A . 9 ILE CG2 1 1 5 1404 1 1 9 ILE H H 4.292 -1.458 0.372 1.00 . A A . 9 ILE H 1 1 5 1405 1 1 9 ILE HA H 2.112 -2.913 -0.523 1.00 . A A . 9 ILE HA 1 1 5 1406 1 1 9 ILE HB H 3.188 -3.039 2.297 1.00 . A A . 9 ILE HB 1 1 5 1407 1 1 9 ILE HD11 H 3.871 -3.886 -1.256 1.00 . A A . 9 ILE HD11 1 1 5 1408 1 1 9 ILE HD12 H 3.655 -5.487 -0.547 1.00 . A A . 9 ILE HD12 1 1 5 1409 1 1 9 ILE HD13 H 5.277 -4.885 -0.899 1.00 . A A . 9 ILE HD13 1 1 5 1410 1 1 9 ILE HG12 H 5.064 -3.187 0.765 1.00 . A A . 9 ILE HG12 1 1 5 1411 1 1 9 ILE HG13 H 4.747 -4.766 1.476 1.00 . A A . 9 ILE HG13 1 1 5 1412 1 1 9 ILE HG21 H 2.500 -5.386 2.207 1.00 . A A . 9 ILE HG21 1 1 5 1413 1 1 9 ILE HG22 H 1.855 -5.128 0.586 1.00 . A A . 9 ILE HG22 1 1 5 1414 1 1 9 ILE HG23 H 1.138 -4.293 1.964 1.00 . A A . 9 ILE HG23 1 1 5 1415 1 1 9 ILE N N 3.362 -1.374 0.071 1.00 . A A . 9 ILE N 1 1 5 1416 1 1 9 ILE O O 0.052 -2.104 0.681 1.00 . A A . 9 ILE O 1 1 5 1417 1 1 10 ARG C C -0.296 0.677 2.075 1.00 . A A . 10 ARG C 1 1 5 1418 1 1 10 ARG CA C 0.378 -0.437 2.863 1.00 . A A . 10 ARG CA 1 1 5 1419 1 1 10 ARG CB C 0.930 0.103 4.182 1.00 . A A . 10 ARG CB 1 1 5 1420 1 1 10 ARG CD C 1.466 -2.264 4.834 1.00 . A A . 10 ARG CD 1 1 5 1421 1 1 10 ARG CG C 1.945 -0.824 4.831 1.00 . A A . 10 ARG CG 1 1 5 1422 1 1 10 ARG CZ C 2.029 -4.396 5.942 1.00 . A A . 10 ARG CZ 1 1 5 1423 1 1 10 ARG H H 2.368 -0.869 2.343 1.00 . A A . 10 ARG H 1 1 5 1424 1 1 10 ARG HA H -0.345 -1.204 3.073 1.00 . A A . 10 ARG HA 1 1 5 1425 1 1 10 ARG HB2 H 1.407 1.053 3.998 1.00 . A A . 10 ARG HB2 1 1 5 1426 1 1 10 ARG HB3 H 0.113 0.246 4.872 1.00 . A A . 10 ARG HB3 1 1 5 1427 1 1 10 ARG HD2 H 0.465 -2.295 5.215 1.00 . A A . 10 ARG HD2 1 1 5 1428 1 1 10 ARG HD3 H 1.470 -2.623 3.813 1.00 . A A . 10 ARG HD3 1 1 5 1429 1 1 10 ARG HE H 3.178 -2.758 5.952 1.00 . A A . 10 ARG HE 1 1 5 1430 1 1 10 ARG HG2 H 2.862 -0.770 4.272 1.00 . A A . 10 ARG HG2 1 1 5 1431 1 1 10 ARG HG3 H 2.117 -0.506 5.847 1.00 . A A . 10 ARG HG3 1 1 5 1432 1 1 10 ARG HH11 H 0.203 -4.370 5.063 1.00 . A A . 10 ARG HH11 1 1 5 1433 1 1 10 ARG HH12 H 0.653 -5.877 5.791 1.00 . A A . 10 ARG HH12 1 1 5 1434 1 1 10 ARG HH21 H 3.760 -4.735 6.935 1.00 . A A . 10 ARG HH21 1 1 5 1435 1 1 10 ARG HH22 H 2.668 -6.079 6.870 1.00 . A A . 10 ARG HH22 1 1 5 1436 1 1 10 ARG N N 1.441 -1.042 2.090 1.00 . A A . 10 ARG N 1 1 5 1437 1 1 10 ARG NE N 2.325 -3.133 5.638 1.00 . A A . 10 ARG NE 1 1 5 1438 1 1 10 ARG NH1 N 0.869 -4.921 5.571 1.00 . A A . 10 ARG NH1 1 1 5 1439 1 1 10 ARG NH2 N 2.888 -5.128 6.637 1.00 . A A . 10 ARG NH2 1 1 5 1440 1 1 10 ARG O O -1.481 0.948 2.256 1.00 . A A . 10 ARG O 1 1 5 1441 1 1 11 LYS C C -1.081 1.781 -0.639 1.00 . A A . 11 LYS C 1 1 5 1442 1 1 11 LYS CA C -0.084 2.366 0.350 1.00 . A A . 11 LYS CA 1 1 5 1443 1 1 11 LYS CB C 1.032 3.093 -0.405 1.00 . A A . 11 LYS CB 1 1 5 1444 1 1 11 LYS CD C 1.633 4.842 -2.115 1.00 . A A . 11 LYS CD 1 1 5 1445 1 1 11 LYS CE C 1.101 5.945 -3.019 1.00 . A A . 11 LYS CE 1 1 5 1446 1 1 11 LYS CG C 0.524 4.227 -1.281 1.00 . A A . 11 LYS CG 1 1 5 1447 1 1 11 LYS H H 1.394 1.028 1.067 1.00 . A A . 11 LYS H 1 1 5 1448 1 1 11 LYS HA H -0.595 3.067 0.993 1.00 . A A . 11 LYS HA 1 1 5 1449 1 1 11 LYS HB2 H 1.730 3.502 0.310 1.00 . A A . 11 LYS HB2 1 1 5 1450 1 1 11 LYS HB3 H 1.547 2.384 -1.035 1.00 . A A . 11 LYS HB3 1 1 5 1451 1 1 11 LYS HD2 H 2.378 5.260 -1.454 1.00 . A A . 11 LYS HD2 1 1 5 1452 1 1 11 LYS HD3 H 2.083 4.072 -2.725 1.00 . A A . 11 LYS HD3 1 1 5 1453 1 1 11 LYS HE2 H 0.728 6.749 -2.402 1.00 . A A . 11 LYS HE2 1 1 5 1454 1 1 11 LYS HE3 H 1.911 6.310 -3.633 1.00 . A A . 11 LYS HE3 1 1 5 1455 1 1 11 LYS HG2 H -0.235 3.840 -1.944 1.00 . A A . 11 LYS HG2 1 1 5 1456 1 1 11 LYS HG3 H 0.095 4.990 -0.649 1.00 . A A . 11 LYS HG3 1 1 5 1457 1 1 11 LYS HZ1 H 0.345 4.701 -4.518 1.00 . A A . 11 LYS HZ1 1 1 5 1458 1 1 11 LYS HZ2 H -0.343 6.245 -4.501 1.00 . A A . 11 LYS HZ2 1 1 5 1459 1 1 11 LYS HZ3 H -0.792 5.110 -3.332 1.00 . A A . 11 LYS HZ3 1 1 5 1460 1 1 11 LYS N N 0.458 1.302 1.181 1.00 . A A . 11 LYS N 1 1 5 1461 1 1 11 LYS NZ N 0.001 5.467 -3.903 1.00 . A A . 11 LYS NZ 1 1 5 1462 1 1 11 LYS O O -2.131 2.361 -0.909 1.00 . A A . 11 LYS O 1 1 5 1463 1 1 12 VAL C C -2.779 -0.726 -1.357 1.00 . A A . 12 VAL C 1 1 5 1464 1 1 12 VAL CA C -1.608 -0.084 -2.090 1.00 . A A . 12 VAL CA 1 1 5 1465 1 1 12 VAL CB C -0.845 -1.172 -2.863 1.00 . A A . 12 VAL CB 1 1 5 1466 1 1 12 VAL CG1 C -1.805 -1.964 -3.735 1.00 . A A . 12 VAL CG1 1 1 5 1467 1 1 12 VAL CG2 C 0.255 -0.556 -3.712 1.00 . A A . 12 VAL CG2 1 1 5 1468 1 1 12 VAL H H 0.127 0.220 -0.929 1.00 . A A . 12 VAL H 1 1 5 1469 1 1 12 VAL HA H -1.990 0.634 -2.801 1.00 . A A . 12 VAL HA 1 1 5 1470 1 1 12 VAL HB H -0.390 -1.844 -2.145 1.00 . A A . 12 VAL HB 1 1 5 1471 1 1 12 VAL HG11 H -1.304 -2.831 -4.135 1.00 . A A . 12 VAL HG11 1 1 5 1472 1 1 12 VAL HG12 H -2.148 -1.337 -4.545 1.00 . A A . 12 VAL HG12 1 1 5 1473 1 1 12 VAL HG13 H -2.653 -2.273 -3.139 1.00 . A A . 12 VAL HG13 1 1 5 1474 1 1 12 VAL HG21 H -0.182 0.122 -4.430 1.00 . A A . 12 VAL HG21 1 1 5 1475 1 1 12 VAL HG22 H 0.788 -1.337 -4.235 1.00 . A A . 12 VAL HG22 1 1 5 1476 1 1 12 VAL HG23 H 0.939 -0.015 -3.076 1.00 . A A . 12 VAL HG23 1 1 5 1477 1 1 12 VAL N N -0.743 0.617 -1.164 1.00 . A A . 12 VAL N 1 1 5 1478 1 1 12 VAL O O -3.856 -0.900 -1.918 1.00 . A A . 12 VAL O 1 1 5 1479 1 1 13 VAL C C -4.760 -0.724 0.887 1.00 . A A . 13 VAL C 1 1 5 1480 1 1 13 VAL CA C -3.614 -1.698 0.689 1.00 . A A . 13 VAL CA 1 1 5 1481 1 1 13 VAL CB C -3.049 -2.183 2.040 1.00 . A A . 13 VAL CB 1 1 5 1482 1 1 13 VAL CG1 C -3.536 -1.345 3.214 1.00 . A A . 13 VAL CG1 1 1 5 1483 1 1 13 VAL CG2 C -3.375 -3.645 2.231 1.00 . A A . 13 VAL CG2 1 1 5 1484 1 1 13 VAL H H -1.741 -0.817 0.344 1.00 . A A . 13 VAL H 1 1 5 1485 1 1 13 VAL HA H -3.967 -2.553 0.131 1.00 . A A . 13 VAL HA 1 1 5 1486 1 1 13 VAL HB H -1.976 -2.091 1.997 1.00 . A A . 13 VAL HB 1 1 5 1487 1 1 13 VAL HG11 H -3.126 -1.738 4.132 1.00 . A A . 13 VAL HG11 1 1 5 1488 1 1 13 VAL HG12 H -4.614 -1.375 3.257 1.00 . A A . 13 VAL HG12 1 1 5 1489 1 1 13 VAL HG13 H -3.208 -0.323 3.081 1.00 . A A . 13 VAL HG13 1 1 5 1490 1 1 13 VAL HG21 H -2.988 -3.978 3.180 1.00 . A A . 13 VAL HG21 1 1 5 1491 1 1 13 VAL HG22 H -2.917 -4.211 1.434 1.00 . A A . 13 VAL HG22 1 1 5 1492 1 1 13 VAL HG23 H -4.444 -3.782 2.205 1.00 . A A . 13 VAL HG23 1 1 5 1493 1 1 13 VAL N N -2.584 -1.047 -0.089 1.00 . A A . 13 VAL N 1 1 5 1494 1 1 13 VAL O O -5.914 -1.106 1.063 1.00 . A A . 13 VAL O 1 1 5 1495 1 1 14 LYS C C -6.289 1.598 -0.337 1.00 . A A . 14 LYS C 1 1 5 1496 1 1 14 LYS CA C -5.354 1.624 0.868 1.00 . A A . 14 LYS CA 1 1 5 1497 1 1 14 LYS CB C -4.591 2.941 0.934 1.00 . A A . 14 LYS CB 1 1 5 1498 1 1 14 LYS CD C -4.859 3.051 3.447 1.00 . A A . 14 LYS CD 1 1 5 1499 1 1 14 LYS CE C -6.007 4.041 3.357 1.00 . A A . 14 LYS CE 1 1 5 1500 1 1 14 LYS CG C -3.901 3.187 2.271 1.00 . A A . 14 LYS CG 1 1 5 1501 1 1 14 LYS H H -3.454 0.759 0.705 1.00 . A A . 14 LYS H 1 1 5 1502 1 1 14 LYS HA H -5.939 1.509 1.767 1.00 . A A . 14 LYS HA 1 1 5 1503 1 1 14 LYS HB2 H -3.822 2.915 0.169 1.00 . A A . 14 LYS HB2 1 1 5 1504 1 1 14 LYS HB3 H -5.267 3.758 0.735 1.00 . A A . 14 LYS HB3 1 1 5 1505 1 1 14 LYS HD2 H -5.260 2.049 3.462 1.00 . A A . 14 LYS HD2 1 1 5 1506 1 1 14 LYS HD3 H -4.313 3.232 4.362 1.00 . A A . 14 LYS HD3 1 1 5 1507 1 1 14 LYS HE2 H -5.610 5.040 3.436 1.00 . A A . 14 LYS HE2 1 1 5 1508 1 1 14 LYS HE3 H -6.492 3.923 2.400 1.00 . A A . 14 LYS HE3 1 1 5 1509 1 1 14 LYS HG2 H -3.104 2.469 2.389 1.00 . A A . 14 LYS HG2 1 1 5 1510 1 1 14 LYS HG3 H -3.488 4.185 2.270 1.00 . A A . 14 LYS HG3 1 1 5 1511 1 1 14 LYS HZ1 H -7.467 2.904 4.323 1.00 . A A . 14 LYS HZ1 1 1 5 1512 1 1 14 LYS HZ2 H -7.731 4.572 4.400 1.00 . A A . 14 LYS HZ2 1 1 5 1513 1 1 14 LYS HZ3 H -6.541 3.863 5.365 1.00 . A A . 14 LYS HZ3 1 1 5 1514 1 1 14 LYS N N -4.405 0.543 0.807 1.00 . A A . 14 LYS N 1 1 5 1515 1 1 14 LYS NZ N -7.006 3.830 4.435 1.00 . A A . 14 LYS NZ 1 1 5 1516 1 1 14 LYS O O -7.477 1.891 -0.209 1.00 . A A . 14 LYS O 1 1 5 1517 1 1 15 LEU C C -7.150 -0.252 -2.855 1.00 . A A . 15 LEU C 1 1 5 1518 1 1 15 LEU CA C -6.580 1.155 -2.703 1.00 . A A . 15 LEU CA 1 1 5 1519 1 1 15 LEU CB C -5.762 1.581 -3.931 1.00 . A A . 15 LEU CB 1 1 5 1520 1 1 15 LEU CD1 C -4.997 -0.428 -5.250 1.00 . A A . 15 LEU CD1 1 1 5 1521 1 1 15 LEU CD2 C -3.465 1.526 -4.934 1.00 . A A . 15 LEU CD2 1 1 5 1522 1 1 15 LEU CG C -4.572 0.691 -4.310 1.00 . A A . 15 LEU CG 1 1 5 1523 1 1 15 LEU H H -4.800 1.023 -1.570 1.00 . A A . 15 LEU H 1 1 5 1524 1 1 15 LEU HA H -7.403 1.843 -2.579 1.00 . A A . 15 LEU HA 1 1 5 1525 1 1 15 LEU HB2 H -6.427 1.632 -4.778 1.00 . A A . 15 LEU HB2 1 1 5 1526 1 1 15 LEU HB3 H -5.380 2.570 -3.735 1.00 . A A . 15 LEU HB3 1 1 5 1527 1 1 15 LEU HD11 H -5.424 -0.003 -6.146 1.00 . A A . 15 LEU HD11 1 1 5 1528 1 1 15 LEU HD12 H -5.733 -1.050 -4.761 1.00 . A A . 15 LEU HD12 1 1 5 1529 1 1 15 LEU HD13 H -4.136 -1.027 -5.510 1.00 . A A . 15 LEU HD13 1 1 5 1530 1 1 15 LEU HD21 H -2.635 0.887 -5.195 1.00 . A A . 15 LEU HD21 1 1 5 1531 1 1 15 LEU HD22 H -3.135 2.273 -4.227 1.00 . A A . 15 LEU HD22 1 1 5 1532 1 1 15 LEU HD23 H -3.838 2.013 -5.822 1.00 . A A . 15 LEU HD23 1 1 5 1533 1 1 15 LEU HG H -4.178 0.234 -3.413 1.00 . A A . 15 LEU HG 1 1 5 1534 1 1 15 LEU N N -5.760 1.239 -1.507 1.00 . A A . 15 LEU N 1 1 5 1535 1 1 15 LEU O O -8.143 -0.466 -3.551 1.00 . A A . 15 LEU O 1 1 5 1536 1 1 16 PHE C C -8.201 -2.737 -1.335 1.00 . A A . 16 PHE C 1 1 5 1537 1 1 16 PHE CA C -6.958 -2.591 -2.197 1.00 . A A . 16 PHE CA 1 1 5 1538 1 1 16 PHE CB C -5.846 -3.488 -1.664 1.00 . A A . 16 PHE CB 1 1 5 1539 1 1 16 PHE CD1 C -5.779 -5.448 -3.227 1.00 . A A . 16 PHE CD1 1 1 5 1540 1 1 16 PHE CD2 C -6.463 -5.821 -0.972 1.00 . A A . 16 PHE CD2 1 1 5 1541 1 1 16 PHE CE1 C -5.943 -6.791 -3.503 1.00 . A A . 16 PHE CE1 1 1 5 1542 1 1 16 PHE CE2 C -6.631 -7.165 -1.243 1.00 . A A . 16 PHE CE2 1 1 5 1543 1 1 16 PHE CG C -6.037 -4.949 -1.960 1.00 . A A . 16 PHE CG 1 1 5 1544 1 1 16 PHE CZ C -6.370 -7.650 -2.510 1.00 . A A . 16 PHE CZ 1 1 5 1545 1 1 16 PHE H H -5.706 -0.972 -1.674 1.00 . A A . 16 PHE H 1 1 5 1546 1 1 16 PHE HA H -7.191 -2.868 -3.215 1.00 . A A . 16 PHE HA 1 1 5 1547 1 1 16 PHE HB2 H -4.910 -3.179 -2.097 1.00 . A A . 16 PHE HB2 1 1 5 1548 1 1 16 PHE HB3 H -5.792 -3.373 -0.591 1.00 . A A . 16 PHE HB3 1 1 5 1549 1 1 16 PHE HD1 H -5.446 -4.775 -4.004 1.00 . A A . 16 PHE HD1 1 1 5 1550 1 1 16 PHE HD2 H -6.666 -5.442 0.018 1.00 . A A . 16 PHE HD2 1 1 5 1551 1 1 16 PHE HE1 H -5.740 -7.168 -4.494 1.00 . A A . 16 PHE HE1 1 1 5 1552 1 1 16 PHE HE2 H -6.963 -7.836 -0.466 1.00 . A A . 16 PHE HE2 1 1 5 1553 1 1 16 PHE HZ H -6.500 -8.700 -2.724 1.00 . A A . 16 PHE HZ 1 1 5 1554 1 1 16 PHE N N -6.513 -1.205 -2.186 1.00 . A A . 16 PHE N 1 1 5 1555 1 1 16 PHE O O -9.109 -3.505 -1.647 1.00 . A A . 16 PHE O 1 1 5 1556 1 1 17 ASN C C -10.417 -1.021 0.094 1.00 . A A . 17 ASN C 1 1 5 1557 1 1 17 ASN CA C -9.369 -1.971 0.652 1.00 . A A . 17 ASN CA 1 1 5 1558 1 1 17 ASN CB C -8.967 -1.543 2.070 1.00 . A A . 17 ASN CB 1 1 5 1559 1 1 17 ASN CG C -8.253 -2.635 2.853 1.00 . A A . 17 ASN CG 1 1 5 1560 1 1 17 ASN H H -7.419 -1.474 -0.006 1.00 . A A . 17 ASN H 1 1 5 1561 1 1 17 ASN HA H -9.789 -2.965 0.690 1.00 . A A . 17 ASN HA 1 1 5 1562 1 1 17 ASN HB2 H -8.307 -0.691 2.004 1.00 . A A . 17 ASN HB2 1 1 5 1563 1 1 17 ASN HB3 H -9.853 -1.259 2.616 1.00 . A A . 17 ASN HB3 1 1 5 1564 1 1 17 ASN HD21 H -7.503 -3.408 1.186 1.00 . A A . 17 ASN HD21 1 1 5 1565 1 1 17 ASN HD22 H -7.068 -4.217 2.649 1.00 . A A . 17 ASN HD22 1 1 5 1566 1 1 17 ASN N N -8.214 -2.008 -0.232 1.00 . A A . 17 ASN N 1 1 5 1567 1 1 17 ASN ND2 N -7.537 -3.508 2.159 1.00 . A A . 17 ASN ND2 1 1 5 1568 1 1 17 ASN O O -10.297 0.201 0.314 1.00 . A A . 17 ASN O 1 1 5 1569 1 1 17 ASN OXT O -11.351 -1.497 -0.582 1.00 . A A . 17 ASN OXT 1 1 5 1570 1 1 17 ASN OD1 O -8.342 -2.689 4.080 1.00 . A A . 17 ASN OD1 1 1 6 1571 1 1 1 LEU C C 13.890 -2.470 -0.921 1.00 . A A . 1 LEU C 1 1 6 1572 1 1 1 LEU CA C 15.332 -2.163 -1.312 1.00 . A A . 1 LEU CA 1 1 6 1573 1 1 1 LEU CB C 15.368 -1.333 -2.605 1.00 . A A . 1 LEU CB 1 1 6 1574 1 1 1 LEU CD1 C 17.808 -1.533 -3.256 1.00 . A A . 1 LEU CD1 1 1 6 1575 1 1 1 LEU CD2 C 16.470 0.438 -3.999 1.00 . A A . 1 LEU CD2 1 1 6 1576 1 1 1 LEU CG C 16.678 -0.581 -2.891 1.00 . A A . 1 LEU CG 1 1 6 1577 1 1 1 LEU H1 H 16.047 -3.983 -0.606 1.00 . A A . 1 LEU H1 1 1 6 1578 1 1 1 LEU H2 H 17.082 -3.220 -1.693 1.00 . A A . 1 LEU H2 1 1 6 1579 1 1 1 LEU H3 H 15.685 -3.981 -2.255 1.00 . A A . 1 LEU H3 1 1 6 1580 1 1 1 LEU HA H 15.793 -1.597 -0.517 1.00 . A A . 1 LEU HA 1 1 6 1581 1 1 1 LEU HB2 H 15.178 -1.998 -3.436 1.00 . A A . 1 LEU HB2 1 1 6 1582 1 1 1 LEU HB3 H 14.569 -0.610 -2.561 1.00 . A A . 1 LEU HB3 1 1 6 1583 1 1 1 LEU HD11 H 17.494 -2.170 -4.070 1.00 . A A . 1 LEU HD11 1 1 6 1584 1 1 1 LEU HD12 H 18.061 -2.139 -2.401 1.00 . A A . 1 LEU HD12 1 1 6 1585 1 1 1 LEU HD13 H 18.674 -0.963 -3.560 1.00 . A A . 1 LEU HD13 1 1 6 1586 1 1 1 LEU HD21 H 17.406 0.930 -4.216 1.00 . A A . 1 LEU HD21 1 1 6 1587 1 1 1 LEU HD22 H 15.743 1.172 -3.682 1.00 . A A . 1 LEU HD22 1 1 6 1588 1 1 1 LEU HD23 H 16.111 -0.062 -4.885 1.00 . A A . 1 LEU HD23 1 1 6 1589 1 1 1 LEU HG H 16.973 -0.045 -2.001 1.00 . A A . 1 LEU HG 1 1 6 1590 1 1 1 LEU N N 16.091 -3.421 -1.478 1.00 . A A . 1 LEU N 1 1 6 1591 1 1 1 LEU O O 12.950 -2.151 -1.650 1.00 . A A . 1 LEU O 1 1 6 1592 1 1 2 MET C C 11.716 -2.376 1.481 1.00 . A A . 2 MET C 1 1 6 1593 1 1 2 MET CA C 12.394 -3.497 0.699 1.00 . A A . 2 MET CA 1 1 6 1594 1 1 2 MET CB C 12.480 -4.752 1.577 1.00 . A A . 2 MET CB 1 1 6 1595 1 1 2 MET CE C 13.860 -7.252 3.006 1.00 . A A . 2 MET CE 1 1 6 1596 1 1 2 MET CG C 13.257 -4.545 2.870 1.00 . A A . 2 MET CG 1 1 6 1597 1 1 2 MET H H 14.500 -3.283 0.805 1.00 . A A . 2 MET H 1 1 6 1598 1 1 2 MET HA H 11.797 -3.721 -0.171 1.00 . A A . 2 MET HA 1 1 6 1599 1 1 2 MET HB2 H 11.481 -5.067 1.832 1.00 . A A . 2 MET HB2 1 1 6 1600 1 1 2 MET HB3 H 12.964 -5.535 1.014 1.00 . A A . 2 MET HB3 1 1 6 1601 1 1 2 MET HE1 H 14.876 -6.988 2.749 1.00 . A A . 2 MET HE1 1 1 6 1602 1 1 2 MET HE2 H 13.282 -7.382 2.104 1.00 . A A . 2 MET HE2 1 1 6 1603 1 1 2 MET HE3 H 13.860 -8.174 3.569 1.00 . A A . 2 MET HE3 1 1 6 1604 1 1 2 MET HG2 H 14.296 -4.389 2.628 1.00 . A A . 2 MET HG2 1 1 6 1605 1 1 2 MET HG3 H 12.872 -3.667 3.366 1.00 . A A . 2 MET HG3 1 1 6 1606 1 1 2 MET N N 13.717 -3.093 0.240 1.00 . A A . 2 MET N 1 1 6 1607 1 1 2 MET O O 10.489 -2.317 1.547 1.00 . A A . 2 MET O 1 1 6 1608 1 1 2 MET SD S 13.136 -5.947 3.998 1.00 . A A . 2 MET SD 1 1 6 1609 1 1 3 GLY C C 10.986 0.450 2.178 1.00 . A A . 3 GLY C 1 1 6 1610 1 1 3 GLY CA C 11.992 -0.424 2.901 1.00 . A A . 3 GLY CA 1 1 6 1611 1 1 3 GLY H H 13.489 -1.543 1.900 1.00 . A A . 3 GLY H 1 1 6 1612 1 1 3 GLY HA2 H 11.511 -0.870 3.760 1.00 . A A . 3 GLY HA2 1 1 6 1613 1 1 3 GLY HA3 H 12.809 0.194 3.239 1.00 . A A . 3 GLY HA3 1 1 6 1614 1 1 3 GLY N N 12.521 -1.486 2.057 1.00 . A A . 3 GLY N 1 1 6 1615 1 1 3 GLY O O 9.944 0.800 2.734 1.00 . A A . 3 GLY O 1 1 6 1616 1 1 4 LEU C C 9.144 0.793 -0.198 1.00 . A A . 4 LEU C 1 1 6 1617 1 1 4 LEU CA C 10.392 1.590 0.110 1.00 . A A . 4 LEU CA 1 1 6 1618 1 1 4 LEU CB C 11.030 1.926 -1.228 1.00 . A A . 4 LEU CB 1 1 6 1619 1 1 4 LEU CD1 C 13.178 1.498 -2.364 1.00 . A A . 4 LEU CD1 1 1 6 1620 1 1 4 LEU CD2 C 12.769 3.703 -1.243 1.00 . A A . 4 LEU CD2 1 1 6 1621 1 1 4 LEU CG C 12.516 2.207 -1.196 1.00 . A A . 4 LEU CG 1 1 6 1622 1 1 4 LEU H H 12.146 0.484 0.557 1.00 . A A . 4 LEU H 1 1 6 1623 1 1 4 LEU HA H 10.146 2.497 0.636 1.00 . A A . 4 LEU HA 1 1 6 1624 1 1 4 LEU HB2 H 10.859 1.097 -1.897 1.00 . A A . 4 LEU HB2 1 1 6 1625 1 1 4 LEU HB3 H 10.533 2.795 -1.629 1.00 . A A . 4 LEU HB3 1 1 6 1626 1 1 4 LEU HD11 H 12.917 1.998 -3.284 1.00 . A A . 4 LEU HD11 1 1 6 1627 1 1 4 LEU HD12 H 12.822 0.470 -2.404 1.00 . A A . 4 LEU HD12 1 1 6 1628 1 1 4 LEU HD13 H 14.249 1.507 -2.234 1.00 . A A . 4 LEU HD13 1 1 6 1629 1 1 4 LEU HD21 H 13.827 3.894 -1.145 1.00 . A A . 4 LEU HD21 1 1 6 1630 1 1 4 LEU HD22 H 12.237 4.178 -0.431 1.00 . A A . 4 LEU HD22 1 1 6 1631 1 1 4 LEU HD23 H 12.418 4.098 -2.186 1.00 . A A . 4 LEU HD23 1 1 6 1632 1 1 4 LEU HG H 12.933 1.821 -0.281 1.00 . A A . 4 LEU HG 1 1 6 1633 1 1 4 LEU N N 11.293 0.788 0.934 1.00 . A A . 4 LEU N 1 1 6 1634 1 1 4 LEU O O 8.015 1.235 0.016 1.00 . A A . 4 LEU O 1 1 6 1635 1 1 5 PHE C C 7.317 -1.631 -0.225 1.00 . A A . 5 PHE C 1 1 6 1636 1 1 5 PHE CA C 8.366 -1.253 -1.266 1.00 . A A . 5 PHE CA 1 1 6 1637 1 1 5 PHE CB C 9.027 -2.493 -1.862 1.00 . A A . 5 PHE CB 1 1 6 1638 1 1 5 PHE CD1 C 7.981 -2.647 -4.136 1.00 . A A . 5 PHE CD1 1 1 6 1639 1 1 5 PHE CD2 C 7.604 -4.428 -2.597 1.00 . A A . 5 PHE CD2 1 1 6 1640 1 1 5 PHE CE1 C 7.214 -3.298 -5.082 1.00 . A A . 5 PHE CE1 1 1 6 1641 1 1 5 PHE CE2 C 6.835 -5.083 -3.539 1.00 . A A . 5 PHE CE2 1 1 6 1642 1 1 5 PHE CG C 8.185 -3.203 -2.884 1.00 . A A . 5 PHE CG 1 1 6 1643 1 1 5 PHE CZ C 6.639 -4.517 -4.783 1.00 . A A . 5 PHE CZ 1 1 6 1644 1 1 5 PHE H H 10.314 -0.733 -0.687 1.00 . A A . 5 PHE H 1 1 6 1645 1 1 5 PHE HA H 7.885 -0.700 -2.058 1.00 . A A . 5 PHE HA 1 1 6 1646 1 1 5 PHE HB2 H 9.959 -2.195 -2.336 1.00 . A A . 5 PHE HB2 1 1 6 1647 1 1 5 PHE HB3 H 9.242 -3.190 -1.066 1.00 . A A . 5 PHE HB3 1 1 6 1648 1 1 5 PHE HD1 H 8.429 -1.695 -4.371 1.00 . A A . 5 PHE HD1 1 1 6 1649 1 1 5 PHE HD2 H 7.757 -4.871 -1.623 1.00 . A A . 5 PHE HD2 1 1 6 1650 1 1 5 PHE HE1 H 7.064 -2.853 -6.055 1.00 . A A . 5 PHE HE1 1 1 6 1651 1 1 5 PHE HE2 H 6.387 -6.036 -3.304 1.00 . A A . 5 PHE HE2 1 1 6 1652 1 1 5 PHE HZ H 6.039 -5.027 -5.522 1.00 . A A . 5 PHE HZ 1 1 6 1653 1 1 5 PHE N N 9.392 -0.406 -0.700 1.00 . A A . 5 PHE N 1 1 6 1654 1 1 5 PHE O O 6.127 -1.620 -0.521 1.00 . A A . 5 PHE O 1 1 6 1655 1 1 6 ASN C C 5.869 -1.130 2.332 1.00 . A A . 6 ASN C 1 1 6 1656 1 1 6 ASN CA C 6.833 -2.272 2.082 1.00 . A A . 6 ASN CA 1 1 6 1657 1 1 6 ASN CB C 7.579 -2.568 3.382 1.00 . A A . 6 ASN CB 1 1 6 1658 1 1 6 ASN CG C 8.401 -3.841 3.317 1.00 . A A . 6 ASN CG 1 1 6 1659 1 1 6 ASN H H 8.726 -1.947 1.167 1.00 . A A . 6 ASN H 1 1 6 1660 1 1 6 ASN HA H 6.273 -3.148 1.786 1.00 . A A . 6 ASN HA 1 1 6 1661 1 1 6 ASN HB2 H 8.237 -1.741 3.600 1.00 . A A . 6 ASN HB2 1 1 6 1662 1 1 6 ASN HB3 H 6.860 -2.663 4.183 1.00 . A A . 6 ASN HB3 1 1 6 1663 1 1 6 ASN HD21 H 9.685 -3.118 4.651 1.00 . A A . 6 ASN HD21 1 1 6 1664 1 1 6 ASN HD22 H 10.024 -4.708 4.063 1.00 . A A . 6 ASN HD22 1 1 6 1665 1 1 6 ASN N N 7.757 -1.940 0.994 1.00 . A A . 6 ASN N 1 1 6 1666 1 1 6 ASN ND2 N 9.478 -3.895 4.086 1.00 . A A . 6 ASN ND2 1 1 6 1667 1 1 6 ASN O O 4.678 -1.342 2.572 1.00 . A A . 6 ASN O 1 1 6 1668 1 1 6 ASN OD1 O 8.065 -4.776 2.589 1.00 . A A . 6 ASN OD1 1 1 6 1669 1 1 7 ARG C C 4.580 1.413 1.334 1.00 . A A . 7 ARG C 1 1 6 1670 1 1 7 ARG CA C 5.581 1.262 2.477 1.00 . A A . 7 ARG CA 1 1 6 1671 1 1 7 ARG CB C 6.495 2.491 2.636 1.00 . A A . 7 ARG CB 1 1 6 1672 1 1 7 ARG CD C 5.934 4.141 0.844 1.00 . A A . 7 ARG CD 1 1 6 1673 1 1 7 ARG CG C 5.842 3.830 2.328 1.00 . A A . 7 ARG CG 1 1 6 1674 1 1 7 ARG CZ C 5.650 6.155 -0.557 1.00 . A A . 7 ARG CZ 1 1 6 1675 1 1 7 ARG H H 7.336 0.195 2.038 1.00 . A A . 7 ARG H 1 1 6 1676 1 1 7 ARG HA H 5.039 1.109 3.393 1.00 . A A . 7 ARG HA 1 1 6 1677 1 1 7 ARG HB2 H 6.850 2.523 3.655 1.00 . A A . 7 ARG HB2 1 1 6 1678 1 1 7 ARG HB3 H 7.344 2.373 1.979 1.00 . A A . 7 ARG HB3 1 1 6 1679 1 1 7 ARG HD2 H 6.976 4.176 0.567 1.00 . A A . 7 ARG HD2 1 1 6 1680 1 1 7 ARG HD3 H 5.448 3.342 0.302 1.00 . A A . 7 ARG HD3 1 1 6 1681 1 1 7 ARG HE H 4.565 5.724 1.071 1.00 . A A . 7 ARG HE 1 1 6 1682 1 1 7 ARG HG2 H 4.802 3.791 2.615 1.00 . A A . 7 ARG HG2 1 1 6 1683 1 1 7 ARG HG3 H 6.346 4.606 2.883 1.00 . A A . 7 ARG HG3 1 1 6 1684 1 1 7 ARG HH11 H 7.170 4.946 -1.125 1.00 . A A . 7 ARG HH11 1 1 6 1685 1 1 7 ARG HH12 H 6.928 6.343 -2.124 1.00 . A A . 7 ARG HH12 1 1 6 1686 1 1 7 ARG HH21 H 4.245 7.571 -0.229 1.00 . A A . 7 ARG HH21 1 1 6 1687 1 1 7 ARG HH22 H 5.254 7.838 -1.614 1.00 . A A . 7 ARG HH22 1 1 6 1688 1 1 7 ARG N N 6.388 0.086 2.261 1.00 . A A . 7 ARG N 1 1 6 1689 1 1 7 ARG NE N 5.301 5.412 0.495 1.00 . A A . 7 ARG NE 1 1 6 1690 1 1 7 ARG NH1 N 6.661 5.783 -1.330 1.00 . A A . 7 ARG NH1 1 1 6 1691 1 1 7 ARG NH2 N 4.997 7.277 -0.821 1.00 . A A . 7 ARG NH2 1 1 6 1692 1 1 7 ARG O O 3.439 1.825 1.539 1.00 . A A . 7 ARG O 1 1 6 1693 1 1 8 ILE C C 3.038 0.035 -0.897 1.00 . A A . 8 ILE C 1 1 6 1694 1 1 8 ILE CA C 4.153 1.065 -1.038 1.00 . A A . 8 ILE CA 1 1 6 1695 1 1 8 ILE CB C 4.943 0.789 -2.338 1.00 . A A . 8 ILE CB 1 1 6 1696 1 1 8 ILE CD1 C 6.919 1.600 -3.733 1.00 . A A . 8 ILE CD1 1 1 6 1697 1 1 8 ILE CG1 C 6.044 1.836 -2.520 1.00 . A A . 8 ILE CG1 1 1 6 1698 1 1 8 ILE CG2 C 4.008 0.780 -3.543 1.00 . A A . 8 ILE CG2 1 1 6 1699 1 1 8 ILE H H 5.947 0.743 0.037 1.00 . A A . 8 ILE H 1 1 6 1700 1 1 8 ILE HA H 3.713 2.050 -1.110 1.00 . A A . 8 ILE HA 1 1 6 1701 1 1 8 ILE HB H 5.394 -0.189 -2.257 1.00 . A A . 8 ILE HB 1 1 6 1702 1 1 8 ILE HD11 H 7.390 0.631 -3.653 1.00 . A A . 8 ILE HD11 1 1 6 1703 1 1 8 ILE HD12 H 7.678 2.365 -3.783 1.00 . A A . 8 ILE HD12 1 1 6 1704 1 1 8 ILE HD13 H 6.313 1.634 -4.626 1.00 . A A . 8 ILE HD13 1 1 6 1705 1 1 8 ILE HG12 H 5.591 2.812 -2.626 1.00 . A A . 8 ILE HG12 1 1 6 1706 1 1 8 ILE HG13 H 6.680 1.833 -1.647 1.00 . A A . 8 ILE HG13 1 1 6 1707 1 1 8 ILE HG21 H 3.560 1.755 -3.659 1.00 . A A . 8 ILE HG21 1 1 6 1708 1 1 8 ILE HG22 H 3.229 0.043 -3.390 1.00 . A A . 8 ILE HG22 1 1 6 1709 1 1 8 ILE HG23 H 4.569 0.532 -4.433 1.00 . A A . 8 ILE HG23 1 1 6 1710 1 1 8 ILE N N 5.015 1.042 0.134 1.00 . A A . 8 ILE N 1 1 6 1711 1 1 8 ILE O O 1.908 0.274 -1.316 1.00 . A A . 8 ILE O 1 1 6 1712 1 1 9 ILE C C 1.176 -1.633 0.701 1.00 . A A . 9 ILE C 1 1 6 1713 1 1 9 ILE CA C 2.375 -2.163 -0.074 1.00 . A A . 9 ILE CA 1 1 6 1714 1 1 9 ILE CB C 2.965 -3.365 0.702 1.00 . A A . 9 ILE CB 1 1 6 1715 1 1 9 ILE CD1 C 4.153 -4.189 -1.392 1.00 . A A . 9 ILE CD1 1 1 6 1716 1 1 9 ILE CG1 C 4.270 -3.845 0.070 1.00 . A A . 9 ILE CG1 1 1 6 1717 1 1 9 ILE CG2 C 1.960 -4.505 0.772 1.00 . A A . 9 ILE CG2 1 1 6 1718 1 1 9 ILE H H 4.283 -1.238 0.021 1.00 . A A . 9 ILE H 1 1 6 1719 1 1 9 ILE HA H 2.042 -2.508 -1.040 1.00 . A A . 9 ILE HA 1 1 6 1720 1 1 9 ILE HB H 3.166 -3.042 1.708 1.00 . A A . 9 ILE HB 1 1 6 1721 1 1 9 ILE HD11 H 3.445 -4.993 -1.516 1.00 . A A . 9 ILE HD11 1 1 6 1722 1 1 9 ILE HD12 H 5.121 -4.495 -1.764 1.00 . A A . 9 ILE HD12 1 1 6 1723 1 1 9 ILE HD13 H 3.813 -3.320 -1.936 1.00 . A A . 9 ILE HD13 1 1 6 1724 1 1 9 ILE HG12 H 5.013 -3.068 0.165 1.00 . A A . 9 ILE HG12 1 1 6 1725 1 1 9 ILE HG13 H 4.612 -4.728 0.592 1.00 . A A . 9 ILE HG13 1 1 6 1726 1 1 9 ILE HG21 H 1.726 -4.842 -0.228 1.00 . A A . 9 ILE HG21 1 1 6 1727 1 1 9 ILE HG22 H 1.058 -4.159 1.255 1.00 . A A . 9 ILE HG22 1 1 6 1728 1 1 9 ILE HG23 H 2.381 -5.321 1.339 1.00 . A A . 9 ILE HG23 1 1 6 1729 1 1 9 ILE N N 3.357 -1.103 -0.286 1.00 . A A . 9 ILE N 1 1 6 1730 1 1 9 ILE O O 0.031 -1.913 0.362 1.00 . A A . 9 ILE O 1 1 6 1731 1 1 10 ARG C C -0.202 0.956 1.954 1.00 . A A . 10 ARG C 1 1 6 1732 1 1 10 ARG CA C 0.388 -0.304 2.571 1.00 . A A . 10 ARG CA 1 1 6 1733 1 1 10 ARG CB C 0.902 -0.042 3.988 1.00 . A A . 10 ARG CB 1 1 6 1734 1 1 10 ARG CD C 0.881 -2.557 4.266 1.00 . A A . 10 ARG CD 1 1 6 1735 1 1 10 ARG CG C 0.678 -1.209 4.947 1.00 . A A . 10 ARG CG 1 1 6 1736 1 1 10 ARG CZ C 0.444 -4.896 4.930 1.00 . A A . 10 ARG CZ 1 1 6 1737 1 1 10 ARG H H 2.386 -0.636 1.941 1.00 . A A . 10 ARG H 1 1 6 1738 1 1 10 ARG HA H -0.389 -1.045 2.619 1.00 . A A . 10 ARG HA 1 1 6 1739 1 1 10 ARG HB2 H 1.962 0.159 3.942 1.00 . A A . 10 ARG HB2 1 1 6 1740 1 1 10 ARG HB3 H 0.397 0.825 4.387 1.00 . A A . 10 ARG HB3 1 1 6 1741 1 1 10 ARG HD2 H 0.082 -2.707 3.556 1.00 . A A . 10 ARG HD2 1 1 6 1742 1 1 10 ARG HD3 H 1.821 -2.541 3.742 1.00 . A A . 10 ARG HD3 1 1 6 1743 1 1 10 ARG HE H 1.231 -3.487 6.119 1.00 . A A . 10 ARG HE 1 1 6 1744 1 1 10 ARG HG2 H 1.376 -1.127 5.767 1.00 . A A . 10 ARG HG2 1 1 6 1745 1 1 10 ARG HG3 H -0.330 -1.159 5.328 1.00 . A A . 10 ARG HG3 1 1 6 1746 1 1 10 ARG HH11 H -0.095 -4.461 3.027 1.00 . A A . 10 ARG HH11 1 1 6 1747 1 1 10 ARG HH12 H -0.373 -6.100 3.518 1.00 . A A . 10 ARG HH12 1 1 6 1748 1 1 10 ARG HH21 H 0.870 -5.655 6.761 1.00 . A A . 10 ARG HH21 1 1 6 1749 1 1 10 ARG HH22 H 0.164 -6.773 5.636 1.00 . A A . 10 ARG HH22 1 1 6 1750 1 1 10 ARG N N 1.449 -0.851 1.735 1.00 . A A . 10 ARG N 1 1 6 1751 1 1 10 ARG NE N 0.878 -3.666 5.216 1.00 . A A . 10 ARG NE 1 1 6 1752 1 1 10 ARG NH1 N -0.046 -5.171 3.728 1.00 . A A . 10 ARG NH1 1 1 6 1753 1 1 10 ARG NH2 N 0.500 -5.850 5.847 1.00 . A A . 10 ARG NH2 1 1 6 1754 1 1 10 ARG O O -1.333 1.334 2.260 1.00 . A A . 10 ARG O 1 1 6 1755 1 1 11 LYS C C -0.968 2.269 -0.698 1.00 . A A . 11 LYS C 1 1 6 1756 1 1 11 LYS CA C 0.069 2.730 0.320 1.00 . A A . 11 LYS CA 1 1 6 1757 1 1 11 LYS CB C 1.241 3.426 -0.380 1.00 . A A . 11 LYS CB 1 1 6 1758 1 1 11 LYS CD C 2.065 5.294 -1.832 1.00 . A A . 11 LYS CD 1 1 6 1759 1 1 11 LYS CE C 1.695 6.549 -2.604 1.00 . A A . 11 LYS CE 1 1 6 1760 1 1 11 LYS CG C 0.852 4.664 -1.169 1.00 . A A . 11 LYS CG 1 1 6 1761 1 1 11 LYS H H 1.472 1.263 0.916 1.00 . A A . 11 LYS H 1 1 6 1762 1 1 11 LYS HA H -0.394 3.413 1.014 1.00 . A A . 11 LYS HA 1 1 6 1763 1 1 11 LYS HB2 H 1.969 3.715 0.364 1.00 . A A . 11 LYS HB2 1 1 6 1764 1 1 11 LYS HB3 H 1.700 2.723 -1.060 1.00 . A A . 11 LYS HB3 1 1 6 1765 1 1 11 LYS HD2 H 2.785 5.553 -1.071 1.00 . A A . 11 LYS HD2 1 1 6 1766 1 1 11 LYS HD3 H 2.502 4.579 -2.514 1.00 . A A . 11 LYS HD3 1 1 6 1767 1 1 11 LYS HE2 H 1.230 7.247 -1.926 1.00 . A A . 11 LYS HE2 1 1 6 1768 1 1 11 LYS HE3 H 2.595 6.986 -3.005 1.00 . A A . 11 LYS HE3 1 1 6 1769 1 1 11 LYS HG2 H 0.141 4.386 -1.931 1.00 . A A . 11 LYS HG2 1 1 6 1770 1 1 11 LYS HG3 H 0.403 5.383 -0.499 1.00 . A A . 11 LYS HG3 1 1 6 1771 1 1 11 LYS HZ1 H -0.121 5.843 -3.355 1.00 . A A . 11 LYS HZ1 1 1 6 1772 1 1 11 LYS HZ2 H 1.186 5.598 -4.392 1.00 . A A . 11 LYS HZ2 1 1 6 1773 1 1 11 LYS HZ3 H 0.521 7.142 -4.226 1.00 . A A . 11 LYS HZ3 1 1 6 1774 1 1 11 LYS N N 0.556 1.581 1.069 1.00 . A A . 11 LYS N 1 1 6 1775 1 1 11 LYS NZ N 0.757 6.263 -3.720 1.00 . A A . 11 LYS NZ 1 1 6 1776 1 1 11 LYS O O -1.974 2.935 -0.939 1.00 . A A . 11 LYS O 1 1 6 1777 1 1 12 VAL C C -2.707 -0.314 -1.522 1.00 . A A . 12 VAL C 1 1 6 1778 1 1 12 VAL CA C -1.627 0.499 -2.235 1.00 . A A . 12 VAL CA 1 1 6 1779 1 1 12 VAL CB C -0.856 -0.409 -3.216 1.00 . A A . 12 VAL CB 1 1 6 1780 1 1 12 VAL CG1 C -1.812 -1.120 -4.161 1.00 . A A . 12 VAL CG1 1 1 6 1781 1 1 12 VAL CG2 C 0.163 0.401 -4.002 1.00 . A A . 12 VAL CG2 1 1 6 1782 1 1 12 VAL H H 0.125 0.641 -1.063 1.00 . A A . 12 VAL H 1 1 6 1783 1 1 12 VAL HA H -2.096 1.292 -2.800 1.00 . A A . 12 VAL HA 1 1 6 1784 1 1 12 VAL HB H -0.323 -1.154 -2.637 1.00 . A A . 12 VAL HB 1 1 6 1785 1 1 12 VAL HG11 H -2.511 -1.711 -3.586 1.00 . A A . 12 VAL HG11 1 1 6 1786 1 1 12 VAL HG12 H -1.254 -1.762 -4.824 1.00 . A A . 12 VAL HG12 1 1 6 1787 1 1 12 VAL HG13 H -2.356 -0.386 -4.739 1.00 . A A . 12 VAL HG13 1 1 6 1788 1 1 12 VAL HG21 H 0.705 -0.252 -4.669 1.00 . A A . 12 VAL HG21 1 1 6 1789 1 1 12 VAL HG22 H 0.853 0.872 -3.318 1.00 . A A . 12 VAL HG22 1 1 6 1790 1 1 12 VAL HG23 H -0.347 1.160 -4.577 1.00 . A A . 12 VAL HG23 1 1 6 1791 1 1 12 VAL N N -0.716 1.105 -1.276 1.00 . A A . 12 VAL N 1 1 6 1792 1 1 12 VAL O O -3.788 -0.549 -2.059 1.00 . A A . 12 VAL O 1 1 6 1793 1 1 13 VAL C C -4.585 -0.692 0.807 1.00 . A A . 13 VAL C 1 1 6 1794 1 1 13 VAL CA C -3.355 -1.520 0.479 1.00 . A A . 13 VAL CA 1 1 6 1795 1 1 13 VAL CB C -2.684 -2.063 1.761 1.00 . A A . 13 VAL CB 1 1 6 1796 1 1 13 VAL CG1 C -3.121 -1.315 3.015 1.00 . A A . 13 VAL CG1 1 1 6 1797 1 1 13 VAL CG2 C -2.938 -3.545 1.884 1.00 . A A . 13 VAL CG2 1 1 6 1798 1 1 13 VAL H H -1.602 -0.422 0.132 1.00 . A A . 13 VAL H 1 1 6 1799 1 1 13 VAL HA H -3.648 -2.357 -0.137 1.00 . A A . 13 VAL HA 1 1 6 1800 1 1 13 VAL HB H -1.618 -1.927 1.655 1.00 . A A . 13 VAL HB 1 1 6 1801 1 1 13 VAL HG11 H -2.867 -0.271 2.915 1.00 . A A . 13 VAL HG11 1 1 6 1802 1 1 13 VAL HG12 H -2.615 -1.728 3.874 1.00 . A A . 13 VAL HG12 1 1 6 1803 1 1 13 VAL HG13 H -4.188 -1.417 3.141 1.00 . A A . 13 VAL HG13 1 1 6 1804 1 1 13 VAL HG21 H -2.526 -4.042 1.018 1.00 . A A . 13 VAL HG21 1 1 6 1805 1 1 13 VAL HG22 H -4.000 -3.725 1.934 1.00 . A A . 13 VAL HG22 1 1 6 1806 1 1 13 VAL HG23 H -2.462 -3.920 2.775 1.00 . A A . 13 VAL HG23 1 1 6 1807 1 1 13 VAL N N -2.432 -0.704 -0.284 1.00 . A A . 13 VAL N 1 1 6 1808 1 1 13 VAL O O -5.654 -1.211 1.119 1.00 . A A . 13 VAL O 1 1 6 1809 1 1 14 LYS C C -6.547 1.308 -0.229 1.00 . A A . 14 LYS C 1 1 6 1810 1 1 14 LYS CA C -5.449 1.579 0.796 1.00 . A A . 14 LYS CA 1 1 6 1811 1 1 14 LYS CB C -4.831 2.948 0.559 1.00 . A A . 14 LYS CB 1 1 6 1812 1 1 14 LYS CD C -4.607 3.464 2.939 1.00 . A A . 14 LYS CD 1 1 6 1813 1 1 14 LYS CE C -4.183 2.357 3.867 1.00 . A A . 14 LYS CE 1 1 6 1814 1 1 14 LYS CG C -3.883 3.391 1.650 1.00 . A A . 14 LYS CG 1 1 6 1815 1 1 14 LYS H H -3.484 0.938 0.591 1.00 . A A . 14 LYS H 1 1 6 1816 1 1 14 LYS HA H -5.870 1.539 1.785 1.00 . A A . 14 LYS HA 1 1 6 1817 1 1 14 LYS HB2 H -4.272 2.907 -0.362 1.00 . A A . 14 LYS HB2 1 1 6 1818 1 1 14 LYS HB3 H -5.620 3.677 0.485 1.00 . A A . 14 LYS HB3 1 1 6 1819 1 1 14 LYS HD2 H -4.435 4.420 3.406 1.00 . A A . 14 LYS HD2 1 1 6 1820 1 1 14 LYS HD3 H -5.635 3.339 2.716 1.00 . A A . 14 LYS HD3 1 1 6 1821 1 1 14 LYS HE2 H -4.914 2.276 4.645 1.00 . A A . 14 LYS HE2 1 1 6 1822 1 1 14 LYS HE3 H -4.155 1.437 3.300 1.00 . A A . 14 LYS HE3 1 1 6 1823 1 1 14 LYS HG2 H -3.109 2.668 1.747 1.00 . A A . 14 LYS HG2 1 1 6 1824 1 1 14 LYS HG3 H -3.471 4.359 1.408 1.00 . A A . 14 LYS HG3 1 1 6 1825 1 1 14 LYS HZ1 H -2.621 1.858 5.154 1.00 . A A . 14 LYS HZ1 1 1 6 1826 1 1 14 LYS HZ2 H -2.822 3.521 4.938 1.00 . A A . 14 LYS HZ2 1 1 6 1827 1 1 14 LYS HZ3 H -2.113 2.591 3.717 1.00 . A A . 14 LYS HZ3 1 1 6 1828 1 1 14 LYS N N -4.394 0.609 0.711 1.00 . A A . 14 LYS N 1 1 6 1829 1 1 14 LYS NZ N -2.843 2.598 4.461 1.00 . A A . 14 LYS NZ 1 1 6 1830 1 1 14 LYS O O -7.731 1.318 0.105 1.00 . A A . 14 LYS O 1 1 6 1831 1 1 15 LEU C C -7.476 -0.706 -2.530 1.00 . A A . 15 LEU C 1 1 6 1832 1 1 15 LEU CA C -7.122 0.778 -2.526 1.00 . A A . 15 LEU CA 1 1 6 1833 1 1 15 LEU CB C -6.568 1.236 -3.883 1.00 . A A . 15 LEU CB 1 1 6 1834 1 1 15 LEU CD1 C -5.544 -0.769 -5.029 1.00 . A A . 15 LEU CD1 1 1 6 1835 1 1 15 LEU CD2 C -4.513 1.493 -5.296 1.00 . A A . 15 LEU CD2 1 1 6 1836 1 1 15 LEU CG C -5.269 0.568 -4.355 1.00 . A A . 15 LEU CG 1 1 6 1837 1 1 15 LEU H H -5.198 1.072 -1.703 1.00 . A A . 15 LEU H 1 1 6 1838 1 1 15 LEU HA H -8.017 1.343 -2.306 1.00 . A A . 15 LEU HA 1 1 6 1839 1 1 15 LEU HB2 H -7.326 1.065 -4.633 1.00 . A A . 15 LEU HB2 1 1 6 1840 1 1 15 LEU HB3 H -6.387 2.297 -3.816 1.00 . A A . 15 LEU HB3 1 1 6 1841 1 1 15 LEU HD11 H -4.612 -1.205 -5.360 1.00 . A A . 15 LEU HD11 1 1 6 1842 1 1 15 LEU HD12 H -6.192 -0.617 -5.880 1.00 . A A . 15 LEU HD12 1 1 6 1843 1 1 15 LEU HD13 H -6.024 -1.435 -4.327 1.00 . A A . 15 LEU HD13 1 1 6 1844 1 1 15 LEU HD21 H -3.617 1.001 -5.642 1.00 . A A . 15 LEU HD21 1 1 6 1845 1 1 15 LEU HD22 H -4.246 2.397 -4.772 1.00 . A A . 15 LEU HD22 1 1 6 1846 1 1 15 LEU HD23 H -5.138 1.736 -6.139 1.00 . A A . 15 LEU HD23 1 1 6 1847 1 1 15 LEU HG H -4.639 0.382 -3.495 1.00 . A A . 15 LEU HG 1 1 6 1848 1 1 15 LEU N N -6.156 1.061 -1.478 1.00 . A A . 15 LEU N 1 1 6 1849 1 1 15 LEU O O -8.481 -1.123 -3.109 1.00 . A A . 15 LEU O 1 1 6 1850 1 1 16 PHE C C -7.961 -3.209 -0.745 1.00 . A A . 16 PHE C 1 1 6 1851 1 1 16 PHE CA C -6.852 -2.926 -1.751 1.00 . A A . 16 PHE CA 1 1 6 1852 1 1 16 PHE CB C -5.555 -3.604 -1.307 1.00 . A A . 16 PHE CB 1 1 6 1853 1 1 16 PHE CD1 C -5.891 -6.008 -0.671 1.00 . A A . 16 PHE CD1 1 1 6 1854 1 1 16 PHE CD2 C -5.010 -5.518 -2.832 1.00 . A A . 16 PHE CD2 1 1 6 1855 1 1 16 PHE CE1 C -5.823 -7.361 -0.947 1.00 . A A . 16 PHE CE1 1 1 6 1856 1 1 16 PHE CE2 C -4.940 -6.868 -3.114 1.00 . A A . 16 PHE CE2 1 1 6 1857 1 1 16 PHE CG C -5.488 -5.073 -1.609 1.00 . A A . 16 PHE CG 1 1 6 1858 1 1 16 PHE CZ C -5.345 -7.791 -2.169 1.00 . A A . 16 PHE CZ 1 1 6 1859 1 1 16 PHE H H -5.848 -1.093 -1.449 1.00 . A A . 16 PHE H 1 1 6 1860 1 1 16 PHE HA H -7.143 -3.305 -2.719 1.00 . A A . 16 PHE HA 1 1 6 1861 1 1 16 PHE HB2 H -4.726 -3.126 -1.800 1.00 . A A . 16 PHE HB2 1 1 6 1862 1 1 16 PHE HB3 H -5.446 -3.481 -0.238 1.00 . A A . 16 PHE HB3 1 1 6 1863 1 1 16 PHE HD1 H -6.266 -5.673 0.285 1.00 . A A . 16 PHE HD1 1 1 6 1864 1 1 16 PHE HD2 H -4.692 -4.798 -3.572 1.00 . A A . 16 PHE HD2 1 1 6 1865 1 1 16 PHE HE1 H -6.140 -8.079 -0.207 1.00 . A A . 16 PHE HE1 1 1 6 1866 1 1 16 PHE HE2 H -4.566 -7.203 -4.070 1.00 . A A . 16 PHE HE2 1 1 6 1867 1 1 16 PHE HZ H -5.290 -8.847 -2.387 1.00 . A A . 16 PHE HZ 1 1 6 1868 1 1 16 PHE N N -6.640 -1.491 -1.866 1.00 . A A . 16 PHE N 1 1 6 1869 1 1 16 PHE O O -8.776 -4.113 -0.932 1.00 . A A . 16 PHE O 1 1 6 1870 1 1 17 ASN C C -10.186 -1.658 1.096 1.00 . A A . 17 ASN C 1 1 6 1871 1 1 17 ASN CA C -9.004 -2.580 1.357 1.00 . A A . 17 ASN CA 1 1 6 1872 1 1 17 ASN CB C -8.422 -2.310 2.742 1.00 . A A . 17 ASN CB 1 1 6 1873 1 1 17 ASN CG C -7.641 -3.494 3.259 1.00 . A A . 17 ASN CG 1 1 6 1874 1 1 17 ASN H H -7.302 -1.721 0.421 1.00 . A A . 17 ASN H 1 1 6 1875 1 1 17 ASN HA H -9.342 -3.603 1.324 1.00 . A A . 17 ASN HA 1 1 6 1876 1 1 17 ASN HB2 H -7.759 -1.459 2.690 1.00 . A A . 17 ASN HB2 1 1 6 1877 1 1 17 ASN HB3 H -9.225 -2.099 3.432 1.00 . A A . 17 ASN HB3 1 1 6 1878 1 1 17 ASN HD21 H -6.008 -2.834 2.358 1.00 . A A . 17 ASN HD21 1 1 6 1879 1 1 17 ASN HD22 H -5.849 -4.319 3.224 1.00 . A A . 17 ASN HD22 1 1 6 1880 1 1 17 ASN N N -7.988 -2.424 0.323 1.00 . A A . 17 ASN N 1 1 6 1881 1 1 17 ASN ND2 N -6.370 -3.555 2.916 1.00 . A A . 17 ASN ND2 1 1 6 1882 1 1 17 ASN O O -11.103 -2.061 0.349 1.00 . A A . 17 ASN O 1 1 6 1883 1 1 17 ASN OXT O -10.194 -0.531 1.629 1.00 . A A . 17 ASN OXT 1 1 6 1884 1 1 17 ASN OD1 O -8.181 -4.358 3.952 1.00 . A A . 17 ASN OD1 1 1 7 1885 1 1 1 LEU C C 15.033 -1.652 -0.581 1.00 . A A . 1 LEU C 1 1 7 1886 1 1 1 LEU CA C 16.472 -1.282 -0.237 1.00 . A A . 1 LEU CA 1 1 7 1887 1 1 1 LEU CB C 16.853 0.017 -0.951 1.00 . A A . 1 LEU CB 1 1 7 1888 1 1 1 LEU CD1 C 18.519 1.819 -1.419 1.00 . A A . 1 LEU CD1 1 1 7 1889 1 1 1 LEU CD2 C 18.213 1.001 0.913 1.00 . A A . 1 LEU CD2 1 1 7 1890 1 1 1 LEU CG C 18.205 0.612 -0.556 1.00 . A A . 1 LEU CG 1 1 7 1891 1 1 1 LEU H1 H 18.377 -2.105 -0.405 1.00 . A A . 1 LEU H1 1 1 7 1892 1 1 1 LEU H2 H 17.319 -2.560 -1.640 1.00 . A A . 1 LEU H2 1 1 7 1893 1 1 1 LEU H3 H 17.160 -3.239 -0.101 1.00 . A A . 1 LEU H3 1 1 7 1894 1 1 1 LEU HA H 16.547 -1.136 0.829 1.00 . A A . 1 LEU HA 1 1 7 1895 1 1 1 LEU HB2 H 16.864 -0.173 -2.014 1.00 . A A . 1 LEU HB2 1 1 7 1896 1 1 1 LEU HB3 H 16.090 0.752 -0.745 1.00 . A A . 1 LEU HB3 1 1 7 1897 1 1 1 LEU HD11 H 17.752 2.565 -1.285 1.00 . A A . 1 LEU HD11 1 1 7 1898 1 1 1 LEU HD12 H 18.554 1.519 -2.457 1.00 . A A . 1 LEU HD12 1 1 7 1899 1 1 1 LEU HD13 H 19.473 2.228 -1.130 1.00 . A A . 1 LEU HD13 1 1 7 1900 1 1 1 LEU HD21 H 18.073 0.119 1.519 1.00 . A A . 1 LEU HD21 1 1 7 1901 1 1 1 LEU HD22 H 17.414 1.701 1.105 1.00 . A A . 1 LEU HD22 1 1 7 1902 1 1 1 LEU HD23 H 19.159 1.459 1.158 1.00 . A A . 1 LEU HD23 1 1 7 1903 1 1 1 LEU HG H 18.977 -0.125 -0.714 1.00 . A A . 1 LEU HG 1 1 7 1904 1 1 1 LEU N N 17.397 -2.371 -0.623 1.00 . A A . 1 LEU N 1 1 7 1905 1 1 1 LEU O O 14.525 -1.287 -1.640 1.00 . A A . 1 LEU O 1 1 7 1906 1 1 2 MET C C 12.046 -1.955 0.951 1.00 . A A . 2 MET C 1 1 7 1907 1 1 2 MET CA C 12.991 -2.774 0.083 1.00 . A A . 2 MET CA 1 1 7 1908 1 1 2 MET CB C 12.779 -4.265 0.360 1.00 . A A . 2 MET CB 1 1 7 1909 1 1 2 MET CE C 13.101 -7.299 0.925 1.00 . A A . 2 MET CE 1 1 7 1910 1 1 2 MET CG C 13.055 -4.671 1.800 1.00 . A A . 2 MET CG 1 1 7 1911 1 1 2 MET H H 14.832 -2.657 1.140 1.00 . A A . 2 MET H 1 1 7 1912 1 1 2 MET HA H 12.764 -2.577 -0.954 1.00 . A A . 2 MET HA 1 1 7 1913 1 1 2 MET HB2 H 11.756 -4.518 0.129 1.00 . A A . 2 MET HB2 1 1 7 1914 1 1 2 MET HB3 H 13.435 -4.834 -0.282 1.00 . A A . 2 MET HB3 1 1 7 1915 1 1 2 MET HE1 H 14.177 -7.234 0.988 1.00 . A A . 2 MET HE1 1 1 7 1916 1 1 2 MET HE2 H 12.776 -6.948 -0.041 1.00 . A A . 2 MET HE2 1 1 7 1917 1 1 2 MET HE3 H 12.794 -8.326 1.057 1.00 . A A . 2 MET HE3 1 1 7 1918 1 1 2 MET HG2 H 14.123 -4.701 1.955 1.00 . A A . 2 MET HG2 1 1 7 1919 1 1 2 MET HG3 H 12.618 -3.934 2.458 1.00 . A A . 2 MET HG3 1 1 7 1920 1 1 2 MET N N 14.377 -2.381 0.311 1.00 . A A . 2 MET N 1 1 7 1921 1 1 2 MET O O 10.826 -2.065 0.819 1.00 . A A . 2 MET O 1 1 7 1922 1 1 2 MET SD S 12.367 -6.287 2.206 1.00 . A A . 2 MET SD 1 1 7 1923 1 1 3 GLY C C 10.810 0.545 2.028 1.00 . A A . 3 GLY C 1 1 7 1924 1 1 3 GLY CA C 11.823 -0.327 2.741 1.00 . A A . 3 GLY CA 1 1 7 1925 1 1 3 GLY H H 13.597 -1.046 1.834 1.00 . A A . 3 GLY H 1 1 7 1926 1 1 3 GLY HA2 H 11.300 -0.989 3.414 1.00 . A A . 3 GLY HA2 1 1 7 1927 1 1 3 GLY HA3 H 12.485 0.305 3.316 1.00 . A A . 3 GLY HA3 1 1 7 1928 1 1 3 GLY N N 12.617 -1.124 1.821 1.00 . A A . 3 GLY N 1 1 7 1929 1 1 3 GLY O O 9.705 0.761 2.530 1.00 . A A . 3 GLY O 1 1 7 1930 1 1 4 LEU C C 9.055 1.008 -0.302 1.00 . A A . 4 LEU C 1 1 7 1931 1 1 4 LEU CA C 10.299 1.818 0.002 1.00 . A A . 4 LEU CA 1 1 7 1932 1 1 4 LEU CB C 10.953 2.123 -1.340 1.00 . A A . 4 LEU CB 1 1 7 1933 1 1 4 LEU CD1 C 13.135 1.729 -2.435 1.00 . A A . 4 LEU CD1 1 1 7 1934 1 1 4 LEU CD2 C 12.621 3.963 -1.425 1.00 . A A . 4 LEU CD2 1 1 7 1935 1 1 4 LEU CG C 12.431 2.462 -1.306 1.00 . A A . 4 LEU CG 1 1 7 1936 1 1 4 LEU H H 12.105 0.852 0.547 1.00 . A A . 4 LEU H 1 1 7 1937 1 1 4 LEU HA H 10.043 2.739 0.504 1.00 . A A . 4 LEU HA 1 1 7 1938 1 1 4 LEU HB2 H 10.823 1.261 -1.978 1.00 . A A . 4 LEU HB2 1 1 7 1939 1 1 4 LEU HB3 H 10.430 2.956 -1.787 1.00 . A A . 4 LEU HB3 1 1 7 1940 1 1 4 LEU HD11 H 12.808 0.691 -2.446 1.00 . A A . 4 LEU HD11 1 1 7 1941 1 1 4 LEU HD12 H 14.203 1.771 -2.283 1.00 . A A . 4 LEU HD12 1 1 7 1942 1 1 4 LEU HD13 H 12.883 2.193 -3.378 1.00 . A A . 4 LEU HD13 1 1 7 1943 1 1 4 LEU HD21 H 13.669 4.204 -1.339 1.00 . A A . 4 LEU HD21 1 1 7 1944 1 1 4 LEU HD22 H 12.069 4.453 -0.636 1.00 . A A . 4 LEU HD22 1 1 7 1945 1 1 4 LEU HD23 H 12.250 4.297 -2.383 1.00 . A A . 4 LEU HD23 1 1 7 1946 1 1 4 LEU HG H 12.856 2.139 -0.369 1.00 . A A . 4 LEU HG 1 1 7 1947 1 1 4 LEU N N 11.192 1.033 0.852 1.00 . A A . 4 LEU N 1 1 7 1948 1 1 4 LEU O O 7.922 1.438 -0.086 1.00 . A A . 4 LEU O 1 1 7 1949 1 1 5 PHE C C 7.352 -1.563 -0.254 1.00 . A A . 5 PHE C 1 1 7 1950 1 1 5 PHE CA C 8.280 -1.042 -1.343 1.00 . A A . 5 PHE CA 1 1 7 1951 1 1 5 PHE CB C 8.927 -2.190 -2.112 1.00 . A A . 5 PHE CB 1 1 7 1952 1 1 5 PHE CD1 C 7.402 -4.035 -2.867 1.00 . A A . 5 PHE CD1 1 1 7 1953 1 1 5 PHE CD2 C 7.737 -2.176 -4.319 1.00 . A A . 5 PHE CD2 1 1 7 1954 1 1 5 PHE CE1 C 6.546 -4.604 -3.789 1.00 . A A . 5 PHE CE1 1 1 7 1955 1 1 5 PHE CE2 C 6.885 -2.742 -5.246 1.00 . A A . 5 PHE CE2 1 1 7 1956 1 1 5 PHE CG C 8.008 -2.817 -3.120 1.00 . A A . 5 PHE CG 1 1 7 1957 1 1 5 PHE CZ C 6.287 -3.957 -4.980 1.00 . A A . 5 PHE CZ 1 1 7 1958 1 1 5 PHE H H 10.229 -0.526 -0.768 1.00 . A A . 5 PHE H 1 1 7 1959 1 1 5 PHE HA H 7.702 -0.446 -2.032 1.00 . A A . 5 PHE HA 1 1 7 1960 1 1 5 PHE HB2 H 9.807 -1.817 -2.630 1.00 . A A . 5 PHE HB2 1 1 7 1961 1 1 5 PHE HB3 H 9.223 -2.958 -1.411 1.00 . A A . 5 PHE HB3 1 1 7 1962 1 1 5 PHE HD1 H 7.603 -4.543 -1.935 1.00 . A A . 5 PHE HD1 1 1 7 1963 1 1 5 PHE HD2 H 8.204 -1.225 -4.528 1.00 . A A . 5 PHE HD2 1 1 7 1964 1 1 5 PHE HE1 H 6.080 -5.556 -3.579 1.00 . A A . 5 PHE HE1 1 1 7 1965 1 1 5 PHE HE2 H 6.683 -2.233 -6.176 1.00 . A A . 5 PHE HE2 1 1 7 1966 1 1 5 PHE HZ H 5.618 -4.400 -5.703 1.00 . A A . 5 PHE HZ 1 1 7 1967 1 1 5 PHE N N 9.308 -0.194 -0.790 1.00 . A A . 5 PHE N 1 1 7 1968 1 1 5 PHE O O 6.156 -1.701 -0.482 1.00 . A A . 5 PHE O 1 1 7 1969 1 1 6 ASN C C 6.064 -1.138 2.386 1.00 . A A . 6 ASN C 1 1 7 1970 1 1 6 ASN CA C 7.063 -2.229 2.070 1.00 . A A . 6 ASN CA 1 1 7 1971 1 1 6 ASN CB C 7.888 -2.500 3.323 1.00 . A A . 6 ASN CB 1 1 7 1972 1 1 6 ASN CG C 8.722 -3.762 3.219 1.00 . A A . 6 ASN CG 1 1 7 1973 1 1 6 ASN H H 8.872 -1.771 1.043 1.00 . A A . 6 ASN H 1 1 7 1974 1 1 6 ASN HA H 6.529 -3.126 1.797 1.00 . A A . 6 ASN HA 1 1 7 1975 1 1 6 ASN HB2 H 8.542 -1.658 3.496 1.00 . A A . 6 ASN HB2 1 1 7 1976 1 1 6 ASN HB3 H 7.218 -2.600 4.165 1.00 . A A . 6 ASN HB3 1 1 7 1977 1 1 6 ASN HD21 H 7.170 -4.862 3.797 1.00 . A A . 6 ASN HD21 1 1 7 1978 1 1 6 ASN HD22 H 8.629 -5.730 3.465 1.00 . A A . 6 ASN HD22 1 1 7 1979 1 1 6 ASN N N 7.897 -1.833 0.933 1.00 . A A . 6 ASN N 1 1 7 1980 1 1 6 ASN ND2 N 8.115 -4.898 3.525 1.00 . A A . 6 ASN ND2 1 1 7 1981 1 1 6 ASN O O 4.918 -1.408 2.748 1.00 . A A . 6 ASN O 1 1 7 1982 1 1 6 ASN OD1 O 9.895 -3.724 2.854 1.00 . A A . 6 ASN OD1 1 1 7 1983 1 1 7 ARG C C 4.591 1.321 1.395 1.00 . A A . 7 ARG C 1 1 7 1984 1 1 7 ARG CA C 5.657 1.233 2.488 1.00 . A A . 7 ARG CA 1 1 7 1985 1 1 7 ARG CB C 6.516 2.507 2.593 1.00 . A A . 7 ARG CB 1 1 7 1986 1 1 7 ARG CD C 5.748 4.137 0.862 1.00 . A A . 7 ARG CD 1 1 7 1987 1 1 7 ARG CG C 5.776 3.812 2.343 1.00 . A A . 7 ARG CG 1 1 7 1988 1 1 7 ARG CZ C 4.881 5.903 -0.635 1.00 . A A . 7 ARG CZ 1 1 7 1989 1 1 7 ARG H H 7.425 0.254 1.931 1.00 . A A . 7 ARG H 1 1 7 1990 1 1 7 ARG HA H 5.175 1.056 3.434 1.00 . A A . 7 ARG HA 1 1 7 1991 1 1 7 ARG HB2 H 6.942 2.552 3.585 1.00 . A A . 7 ARG HB2 1 1 7 1992 1 1 7 ARG HB3 H 7.321 2.436 1.876 1.00 . A A . 7 ARG HB3 1 1 7 1993 1 1 7 ARG HD2 H 6.764 4.274 0.519 1.00 . A A . 7 ARG HD2 1 1 7 1994 1 1 7 ARG HD3 H 5.306 3.297 0.341 1.00 . A A . 7 ARG HD3 1 1 7 1995 1 1 7 ARG HE H 4.484 5.754 1.321 1.00 . A A . 7 ARG HE 1 1 7 1996 1 1 7 ARG HG2 H 4.762 3.719 2.702 1.00 . A A . 7 ARG HG2 1 1 7 1997 1 1 7 ARG HG3 H 6.280 4.609 2.871 1.00 . A A . 7 ARG HG3 1 1 7 1998 1 1 7 ARG HH11 H 6.145 4.600 -1.534 1.00 . A A . 7 ARG HH11 1 1 7 1999 1 1 7 ARG HH12 H 5.480 5.827 -2.565 1.00 . A A . 7 ARG HH12 1 1 7 2000 1 1 7 ARG HH21 H 3.622 7.372 -0.038 1.00 . A A . 7 ARG HH21 1 1 7 2001 1 1 7 ARG HH22 H 4.057 7.407 -1.718 1.00 . A A . 7 ARG HH22 1 1 7 2002 1 1 7 ARG N N 6.506 0.100 2.236 1.00 . A A . 7 ARG N 1 1 7 2003 1 1 7 ARG NE N 4.973 5.344 0.572 1.00 . A A . 7 ARG NE 1 1 7 2004 1 1 7 ARG NH1 N 5.554 5.403 -1.659 1.00 . A A . 7 ARG NH1 1 1 7 2005 1 1 7 ARG NH2 N 4.125 6.978 -0.810 1.00 . A A . 7 ARG NH2 1 1 7 2006 1 1 7 ARG O O 3.443 1.691 1.648 1.00 . A A . 7 ARG O 1 1 7 2007 1 1 8 ILE C C 2.989 -0.171 -0.733 1.00 . A A . 8 ILE C 1 1 7 2008 1 1 8 ILE CA C 4.059 0.899 -0.948 1.00 . A A . 8 ILE CA 1 1 7 2009 1 1 8 ILE CB C 4.803 0.627 -2.276 1.00 . A A . 8 ILE CB 1 1 7 2010 1 1 8 ILE CD1 C 6.639 1.525 -3.803 1.00 . A A . 8 ILE CD1 1 1 7 2011 1 1 8 ILE CG1 C 5.825 1.737 -2.546 1.00 . A A . 8 ILE CG1 1 1 7 2012 1 1 8 ILE CG2 C 3.818 0.512 -3.436 1.00 . A A . 8 ILE CG2 1 1 7 2013 1 1 8 ILE H H 5.917 0.683 0.042 1.00 . A A . 8 ILE H 1 1 7 2014 1 1 8 ILE HA H 3.579 1.864 -1.019 1.00 . A A . 8 ILE HA 1 1 7 2015 1 1 8 ILE HB H 5.323 -0.314 -2.184 1.00 . A A . 8 ILE HB 1 1 7 2016 1 1 8 ILE HD11 H 7.334 2.343 -3.925 1.00 . A A . 8 ILE HD11 1 1 7 2017 1 1 8 ILE HD12 H 5.978 1.484 -4.657 1.00 . A A . 8 ILE HD12 1 1 7 2018 1 1 8 ILE HD13 H 7.186 0.597 -3.728 1.00 . A A . 8 ILE HD13 1 1 7 2019 1 1 8 ILE HG12 H 5.304 2.678 -2.646 1.00 . A A . 8 ILE HG12 1 1 7 2020 1 1 8 ILE HG13 H 6.509 1.798 -1.712 1.00 . A A . 8 ILE HG13 1 1 7 2021 1 1 8 ILE HG21 H 4.354 0.269 -4.341 1.00 . A A . 8 ILE HG21 1 1 7 2022 1 1 8 ILE HG22 H 3.302 1.453 -3.564 1.00 . A A . 8 ILE HG22 1 1 7 2023 1 1 8 ILE HG23 H 3.097 -0.266 -3.221 1.00 . A A . 8 ILE HG23 1 1 7 2024 1 1 8 ILE N N 4.979 0.940 0.182 1.00 . A A . 8 ILE N 1 1 7 2025 1 1 8 ILE O O 1.859 -0.028 -1.198 1.00 . A A . 8 ILE O 1 1 7 2026 1 1 9 ILE C C 1.176 -1.780 0.996 1.00 . A A . 9 ILE C 1 1 7 2027 1 1 9 ILE CA C 2.401 -2.313 0.262 1.00 . A A . 9 ILE CA 1 1 7 2028 1 1 9 ILE CB C 3.047 -3.443 1.099 1.00 . A A . 9 ILE CB 1 1 7 2029 1 1 9 ILE CD1 C 4.205 -4.421 -0.954 1.00 . A A . 9 ILE CD1 1 1 7 2030 1 1 9 ILE CG1 C 4.354 -3.917 0.462 1.00 . A A . 9 ILE CG1 1 1 7 2031 1 1 9 ILE CG2 C 2.085 -4.610 1.261 1.00 . A A . 9 ILE CG2 1 1 7 2032 1 1 9 ILE H H 4.248 -1.279 0.362 1.00 . A A . 9 ILE H 1 1 7 2033 1 1 9 ILE HA H 2.088 -2.723 -0.685 1.00 . A A . 9 ILE HA 1 1 7 2034 1 1 9 ILE HB H 3.260 -3.052 2.077 1.00 . A A . 9 ILE HB 1 1 7 2035 1 1 9 ILE HD11 H 5.181 -4.669 -1.349 1.00 . A A . 9 ILE HD11 1 1 7 2036 1 1 9 ILE HD12 H 3.754 -3.651 -1.560 1.00 . A A . 9 ILE HD12 1 1 7 2037 1 1 9 ILE HD13 H 3.580 -5.299 -0.957 1.00 . A A . 9 ILE HD13 1 1 7 2038 1 1 9 ILE HG12 H 5.053 -3.096 0.444 1.00 . A A . 9 ILE HG12 1 1 7 2039 1 1 9 ILE HG13 H 4.764 -4.719 1.058 1.00 . A A . 9 ILE HG13 1 1 7 2040 1 1 9 ILE HG21 H 1.851 -5.021 0.290 1.00 . A A . 9 ILE HG21 1 1 7 2041 1 1 9 ILE HG22 H 1.178 -4.263 1.733 1.00 . A A . 9 ILE HG22 1 1 7 2042 1 1 9 ILE HG23 H 2.544 -5.371 1.874 1.00 . A A . 9 ILE HG23 1 1 7 2043 1 1 9 ILE N N 3.338 -1.227 -0.004 1.00 . A A . 9 ILE N 1 1 7 2044 1 1 9 ILE O O 0.044 -2.165 0.704 1.00 . A A . 9 ILE O 1 1 7 2045 1 1 10 ARG C C -0.290 0.898 1.893 1.00 . A A . 10 ARG C 1 1 7 2046 1 1 10 ARG CA C 0.324 -0.247 2.680 1.00 . A A . 10 ARG CA 1 1 7 2047 1 1 10 ARG CB C 0.826 0.254 4.032 1.00 . A A . 10 ARG CB 1 1 7 2048 1 1 10 ARG CD C 0.875 -2.128 4.823 1.00 . A A . 10 ARG CD 1 1 7 2049 1 1 10 ARG CG C 0.560 -0.691 5.188 1.00 . A A . 10 ARG CG 1 1 7 2050 1 1 10 ARG CZ C 1.050 -4.232 6.115 1.00 . A A . 10 ARG CZ 1 1 7 2051 1 1 10 ARG H H 2.336 -0.601 2.117 1.00 . A A . 10 ARG H 1 1 7 2052 1 1 10 ARG HA H -0.431 -0.998 2.841 1.00 . A A . 10 ARG HA 1 1 7 2053 1 1 10 ARG HB2 H 1.891 0.406 3.967 1.00 . A A . 10 ARG HB2 1 1 7 2054 1 1 10 ARG HB3 H 0.350 1.197 4.249 1.00 . A A . 10 ARG HB3 1 1 7 2055 1 1 10 ARG HD2 H 0.000 -2.559 4.369 1.00 . A A . 10 ARG HD2 1 1 7 2056 1 1 10 ARG HD3 H 1.686 -2.139 4.110 1.00 . A A . 10 ARG HD3 1 1 7 2057 1 1 10 ARG HE H 1.675 -2.438 6.739 1.00 . A A . 10 ARG HE 1 1 7 2058 1 1 10 ARG HG2 H 1.175 -0.400 6.026 1.00 . A A . 10 ARG HG2 1 1 7 2059 1 1 10 ARG HG3 H -0.482 -0.620 5.465 1.00 . A A . 10 ARG HG3 1 1 7 2060 1 1 10 ARG HH11 H 0.150 -4.457 4.312 1.00 . A A . 10 ARG HH11 1 1 7 2061 1 1 10 ARG HH12 H 0.313 -5.905 5.248 1.00 . A A . 10 ARG HH12 1 1 7 2062 1 1 10 ARG HH21 H 1.890 -4.356 7.956 1.00 . A A . 10 ARG HH21 1 1 7 2063 1 1 10 ARG HH22 H 1.298 -5.852 7.303 1.00 . A A . 10 ARG HH22 1 1 7 2064 1 1 10 ARG N N 1.408 -0.867 1.930 1.00 . A A . 10 ARG N 1 1 7 2065 1 1 10 ARG NE N 1.245 -2.919 5.997 1.00 . A A . 10 ARG NE 1 1 7 2066 1 1 10 ARG NH1 N 0.457 -4.917 5.146 1.00 . A A . 10 ARG NH1 1 1 7 2067 1 1 10 ARG NH2 N 1.444 -4.863 7.213 1.00 . A A . 10 ARG NH2 1 1 7 2068 1 1 10 ARG O O -1.451 1.247 2.092 1.00 . A A . 10 ARG O 1 1 7 2069 1 1 11 LYS C C -1.040 1.923 -0.836 1.00 . A A . 11 LYS C 1 1 7 2070 1 1 11 LYS CA C -0.013 2.521 0.121 1.00 . A A . 11 LYS CA 1 1 7 2071 1 1 11 LYS CB C 1.136 3.158 -0.662 1.00 . A A . 11 LYS CB 1 1 7 2072 1 1 11 LYS CD C 1.841 4.767 -2.455 1.00 . A A . 11 LYS CD 1 1 7 2073 1 1 11 LYS CE C 1.373 5.801 -3.464 1.00 . A A . 11 LYS CE 1 1 7 2074 1 1 11 LYS CG C 0.694 4.272 -1.594 1.00 . A A . 11 LYS CG 1 1 7 2075 1 1 11 LYS H H 1.430 1.200 0.926 1.00 . A A . 11 LYS H 1 1 7 2076 1 1 11 LYS HA H -0.493 3.273 0.729 1.00 . A A . 11 LYS HA 1 1 7 2077 1 1 11 LYS HB2 H 1.854 3.564 0.036 1.00 . A A . 11 LYS HB2 1 1 7 2078 1 1 11 LYS HB3 H 1.616 2.393 -1.255 1.00 . A A . 11 LYS HB3 1 1 7 2079 1 1 11 LYS HD2 H 2.589 5.214 -1.817 1.00 . A A . 11 LYS HD2 1 1 7 2080 1 1 11 LYS HD3 H 2.269 3.928 -2.982 1.00 . A A . 11 LYS HD3 1 1 7 2081 1 1 11 LYS HE2 H 1.028 6.675 -2.934 1.00 . A A . 11 LYS HE2 1 1 7 2082 1 1 11 LYS HE3 H 2.207 6.071 -4.094 1.00 . A A . 11 LYS HE3 1 1 7 2083 1 1 11 LYS HG2 H -0.090 3.901 -2.236 1.00 . A A . 11 LYS HG2 1 1 7 2084 1 1 11 LYS HG3 H 0.317 5.095 -1.003 1.00 . A A . 11 LYS HG3 1 1 7 2085 1 1 11 LYS HZ1 H -0.568 5.076 -3.739 1.00 . A A . 11 LYS HZ1 1 1 7 2086 1 1 11 LYS HZ2 H 0.569 4.418 -4.803 1.00 . A A . 11 LYS HZ2 1 1 7 2087 1 1 11 LYS HZ3 H 0.012 5.995 -5.035 1.00 . A A . 11 LYS HZ3 1 1 7 2088 1 1 11 LYS N N 0.491 1.480 0.999 1.00 . A A . 11 LYS N 1 1 7 2089 1 1 11 LYS NZ N 0.270 5.286 -4.319 1.00 . A A . 11 LYS NZ 1 1 7 2090 1 1 11 LYS O O -2.078 2.519 -1.118 1.00 . A A . 11 LYS O 1 1 7 2091 1 1 12 VAL C C -2.749 -0.687 -1.424 1.00 . A A . 12 VAL C 1 1 7 2092 1 1 12 VAL CA C -1.634 0.008 -2.204 1.00 . A A . 12 VAL CA 1 1 7 2093 1 1 12 VAL CB C -0.863 -1.033 -3.039 1.00 . A A . 12 VAL CB 1 1 7 2094 1 1 12 VAL CG1 C -1.819 -1.853 -3.891 1.00 . A A . 12 VAL CG1 1 1 7 2095 1 1 12 VAL CG2 C 0.176 -0.351 -3.915 1.00 . A A . 12 VAL CG2 1 1 7 2096 1 1 12 VAL H H 0.120 0.314 -1.067 1.00 . A A . 12 VAL H 1 1 7 2097 1 1 12 VAL HA H -2.075 0.725 -2.881 1.00 . A A . 12 VAL HA 1 1 7 2098 1 1 12 VAL HB H -0.348 -1.698 -2.358 1.00 . A A . 12 VAL HB 1 1 7 2099 1 1 12 VAL HG11 H -2.599 -2.259 -3.259 1.00 . A A . 12 VAL HG11 1 1 7 2100 1 1 12 VAL HG12 H -1.282 -2.658 -4.368 1.00 . A A . 12 VAL HG12 1 1 7 2101 1 1 12 VAL HG13 H -2.264 -1.218 -4.644 1.00 . A A . 12 VAL HG13 1 1 7 2102 1 1 12 VAL HG21 H -0.314 0.350 -4.576 1.00 . A A . 12 VAL HG21 1 1 7 2103 1 1 12 VAL HG22 H 0.697 -1.094 -4.500 1.00 . A A . 12 VAL HG22 1 1 7 2104 1 1 12 VAL HG23 H 0.882 0.177 -3.290 1.00 . A A . 12 VAL HG23 1 1 7 2105 1 1 12 VAL N N -0.742 0.725 -1.312 1.00 . A A . 12 VAL N 1 1 7 2106 1 1 12 VAL O O -3.836 -0.919 -1.945 1.00 . A A . 12 VAL O 1 1 7 2107 1 1 13 VAL C C -4.654 -0.737 0.899 1.00 . A A . 13 VAL C 1 1 7 2108 1 1 13 VAL CA C -3.474 -1.661 0.668 1.00 . A A . 13 VAL CA 1 1 7 2109 1 1 13 VAL CB C -2.840 -2.106 2.006 1.00 . A A . 13 VAL CB 1 1 7 2110 1 1 13 VAL CG1 C -3.258 -1.224 3.175 1.00 . A A . 13 VAL CG1 1 1 7 2111 1 1 13 VAL CG2 C -3.168 -3.554 2.266 1.00 . A A . 13 VAL CG2 1 1 7 2112 1 1 13 VAL H H -1.654 -0.709 0.244 1.00 . A A . 13 VAL H 1 1 7 2113 1 1 13 VAL HA H -3.810 -2.540 0.135 1.00 . A A . 13 VAL HA 1 1 7 2114 1 1 13 VAL HB H -1.768 -2.027 1.901 1.00 . A A . 13 VAL HB 1 1 7 2115 1 1 13 VAL HG11 H -2.938 -0.209 2.989 1.00 . A A . 13 VAL HG11 1 1 7 2116 1 1 13 VAL HG12 H -2.797 -1.587 4.081 1.00 . A A . 13 VAL HG12 1 1 7 2117 1 1 13 VAL HG13 H -4.332 -1.250 3.279 1.00 . A A . 13 VAL HG13 1 1 7 2118 1 1 13 VAL HG21 H -2.761 -4.152 1.467 1.00 . A A . 13 VAL HG21 1 1 7 2119 1 1 13 VAL HG22 H -4.238 -3.679 2.304 1.00 . A A . 13 VAL HG22 1 1 7 2120 1 1 13 VAL HG23 H -2.731 -3.857 3.203 1.00 . A A . 13 VAL HG23 1 1 7 2121 1 1 13 VAL N N -2.499 -0.977 -0.154 1.00 . A A . 13 VAL N 1 1 7 2122 1 1 13 VAL O O -5.781 -1.164 1.145 1.00 . A A . 13 VAL O 1 1 7 2123 1 1 14 LYS C C -6.290 1.568 -0.336 1.00 . A A . 14 LYS C 1 1 7 2124 1 1 14 LYS CA C -5.345 1.591 0.860 1.00 . A A . 14 LYS CA 1 1 7 2125 1 1 14 LYS CB C -4.619 2.930 0.955 1.00 . A A . 14 LYS CB 1 1 7 2126 1 1 14 LYS CD C -4.910 3.131 3.459 1.00 . A A . 14 LYS CD 1 1 7 2127 1 1 14 LYS CE C -5.834 4.335 3.449 1.00 . A A . 14 LYS CE 1 1 7 2128 1 1 14 LYS CG C -3.931 3.161 2.295 1.00 . A A . 14 LYS CG 1 1 7 2129 1 1 14 LYS H H -3.430 0.790 0.595 1.00 . A A . 14 LYS H 1 1 7 2130 1 1 14 LYS HA H -5.917 1.432 1.758 1.00 . A A . 14 LYS HA 1 1 7 2131 1 1 14 LYS HB2 H -3.855 2.946 0.186 1.00 . A A . 14 LYS HB2 1 1 7 2132 1 1 14 LYS HB3 H -5.321 3.730 0.782 1.00 . A A . 14 LYS HB3 1 1 7 2133 1 1 14 LYS HD2 H -5.503 2.233 3.393 1.00 . A A . 14 LYS HD2 1 1 7 2134 1 1 14 LYS HD3 H -4.352 3.125 4.384 1.00 . A A . 14 LYS HD3 1 1 7 2135 1 1 14 LYS HE2 H -6.322 4.385 2.489 1.00 . A A . 14 LYS HE2 1 1 7 2136 1 1 14 LYS HE3 H -6.575 4.211 4.224 1.00 . A A . 14 LYS HE3 1 1 7 2137 1 1 14 LYS HG2 H -3.195 2.390 2.444 1.00 . A A . 14 LYS HG2 1 1 7 2138 1 1 14 LYS HG3 H -3.444 4.124 2.272 1.00 . A A . 14 LYS HG3 1 1 7 2139 1 1 14 LYS HZ1 H -4.406 5.767 2.920 1.00 . A A . 14 LYS HZ1 1 1 7 2140 1 1 14 LYS HZ2 H -4.589 5.568 4.589 1.00 . A A . 14 LYS HZ2 1 1 7 2141 1 1 14 LYS HZ3 H -5.761 6.405 3.704 1.00 . A A . 14 LYS HZ3 1 1 7 2142 1 1 14 LYS N N -4.362 0.542 0.762 1.00 . A A . 14 LYS N 1 1 7 2143 1 1 14 LYS NZ N -5.096 5.607 3.682 1.00 . A A . 14 LYS NZ 1 1 7 2144 1 1 14 LYS O O -7.466 1.900 -0.207 1.00 . A A . 14 LYS O 1 1 7 2145 1 1 15 LEU C C -7.211 -0.350 -2.755 1.00 . A A . 15 LEU C 1 1 7 2146 1 1 15 LEU CA C -6.639 1.059 -2.669 1.00 . A A . 15 LEU CA 1 1 7 2147 1 1 15 LEU CB C -5.868 1.452 -3.939 1.00 . A A . 15 LEU CB 1 1 7 2148 1 1 15 LEU CD1 C -5.206 -0.648 -5.175 1.00 . A A . 15 LEU CD1 1 1 7 2149 1 1 15 LEU CD2 C -3.678 1.331 -5.150 1.00 . A A . 15 LEU CD2 1 1 7 2150 1 1 15 LEU CG C -4.709 0.539 -4.361 1.00 . A A . 15 LEU CG 1 1 7 2151 1 1 15 LEU H H -4.828 0.958 -1.586 1.00 . A A . 15 LEU H 1 1 7 2152 1 1 15 LEU HA H -7.460 1.749 -2.535 1.00 . A A . 15 LEU HA 1 1 7 2153 1 1 15 LEU HB2 H -6.569 1.504 -4.757 1.00 . A A . 15 LEU HB2 1 1 7 2154 1 1 15 LEU HB3 H -5.464 2.439 -3.776 1.00 . A A . 15 LEU HB3 1 1 7 2155 1 1 15 LEU HD11 H -4.366 -1.263 -5.465 1.00 . A A . 15 LEU HD11 1 1 7 2156 1 1 15 LEU HD12 H -5.712 -0.292 -6.060 1.00 . A A . 15 LEU HD12 1 1 7 2157 1 1 15 LEU HD13 H -5.890 -1.232 -4.579 1.00 . A A . 15 LEU HD13 1 1 7 2158 1 1 15 LEU HD21 H -3.282 2.123 -4.532 1.00 . A A . 15 LEU HD21 1 1 7 2159 1 1 15 LEU HD22 H -4.146 1.756 -6.025 1.00 . A A . 15 LEU HD22 1 1 7 2160 1 1 15 LEU HD23 H -2.876 0.675 -5.454 1.00 . A A . 15 LEU HD23 1 1 7 2161 1 1 15 LEU HG H -4.225 0.154 -3.475 1.00 . A A . 15 LEU HG 1 1 7 2162 1 1 15 LEU N N -5.786 1.176 -1.504 1.00 . A A . 15 LEU N 1 1 7 2163 1 1 15 LEU O O -8.190 -0.599 -3.460 1.00 . A A . 15 LEU O 1 1 7 2164 1 1 16 PHE C C -8.270 -2.772 -1.065 1.00 . A A . 16 PHE C 1 1 7 2165 1 1 16 PHE CA C -7.057 -2.650 -1.980 1.00 . A A . 16 PHE CA 1 1 7 2166 1 1 16 PHE CB C -5.931 -3.563 -1.491 1.00 . A A . 16 PHE CB 1 1 7 2167 1 1 16 PHE CD1 C -6.516 -5.871 -0.692 1.00 . A A . 16 PHE CD1 1 1 7 2168 1 1 16 PHE CD2 C -6.093 -5.549 -3.017 1.00 . A A . 16 PHE CD2 1 1 7 2169 1 1 16 PHE CE1 C -6.753 -7.214 -0.919 1.00 . A A . 16 PHE CE1 1 1 7 2170 1 1 16 PHE CE2 C -6.328 -6.891 -3.249 1.00 . A A . 16 PHE CE2 1 1 7 2171 1 1 16 PHE CG C -6.184 -5.024 -1.737 1.00 . A A . 16 PHE CG 1 1 7 2172 1 1 16 PHE CZ C -6.659 -7.724 -2.198 1.00 . A A . 16 PHE CZ 1 1 7 2173 1 1 16 PHE H H -5.804 -1.017 -1.493 1.00 . A A . 16 PHE H 1 1 7 2174 1 1 16 PHE HA H -7.339 -2.937 -2.982 1.00 . A A . 16 PHE HA 1 1 7 2175 1 1 16 PHE HB2 H -5.014 -3.291 -1.989 1.00 . A A . 16 PHE HB2 1 1 7 2176 1 1 16 PHE HB3 H -5.807 -3.423 -0.426 1.00 . A A . 16 PHE HB3 1 1 7 2177 1 1 16 PHE HD1 H -6.591 -5.475 0.309 1.00 . A A . 16 PHE HD1 1 1 7 2178 1 1 16 PHE HD2 H -5.833 -4.899 -3.839 1.00 . A A . 16 PHE HD2 1 1 7 2179 1 1 16 PHE HE1 H -7.010 -7.865 -0.096 1.00 . A A . 16 PHE HE1 1 1 7 2180 1 1 16 PHE HE2 H -6.254 -7.287 -4.249 1.00 . A A . 16 PHE HE2 1 1 7 2181 1 1 16 PHE HZ H -6.844 -8.773 -2.377 1.00 . A A . 16 PHE HZ 1 1 7 2182 1 1 16 PHE N N -6.598 -1.272 -2.019 1.00 . A A . 16 PHE N 1 1 7 2183 1 1 16 PHE O O -9.263 -3.412 -1.411 1.00 . A A . 16 PHE O 1 1 7 2184 1 1 17 ASN C C -10.081 -0.857 0.921 1.00 . A A . 17 ASN C 1 1 7 2185 1 1 17 ASN CA C -9.279 -2.144 1.066 1.00 . A A . 17 ASN CA 1 1 7 2186 1 1 17 ASN CB C -8.767 -2.283 2.507 1.00 . A A . 17 ASN CB 1 1 7 2187 1 1 17 ASN CG C -8.339 -3.699 2.859 1.00 . A A . 17 ASN CG 1 1 7 2188 1 1 17 ASN H H -7.336 -1.700 0.344 1.00 . A A . 17 ASN H 1 1 7 2189 1 1 17 ASN HA H -9.923 -2.981 0.839 1.00 . A A . 17 ASN HA 1 1 7 2190 1 1 17 ASN HB2 H -7.918 -1.632 2.640 1.00 . A A . 17 ASN HB2 1 1 7 2191 1 1 17 ASN HB3 H -9.550 -1.984 3.189 1.00 . A A . 17 ASN HB3 1 1 7 2192 1 1 17 ASN HD21 H -7.877 -4.074 0.970 1.00 . A A . 17 ASN HD21 1 1 7 2193 1 1 17 ASN HD22 H -7.622 -5.374 2.078 1.00 . A A . 17 ASN HD22 1 1 7 2194 1 1 17 ASN N N -8.175 -2.159 0.111 1.00 . A A . 17 ASN N 1 1 7 2195 1 1 17 ASN ND2 N -7.901 -4.458 1.871 1.00 . A A . 17 ASN ND2 1 1 7 2196 1 1 17 ASN O O -9.774 0.128 1.625 1.00 . A A . 17 ASN O 1 1 7 2197 1 1 17 ASN OXT O -11.004 -0.825 0.083 1.00 . A A . 17 ASN OXT 1 1 7 2198 1 1 17 ASN OD1 O -8.410 -4.111 4.018 1.00 . A A . 17 ASN OD1 1 1 8 2199 1 1 1 LEU C C 12.997 -1.670 -1.281 1.00 . A A . 1 LEU C 1 1 8 2200 1 1 1 LEU CA C 14.196 -1.485 -2.206 1.00 . A A . 1 LEU CA 1 1 8 2201 1 1 1 LEU CB C 14.215 -2.604 -3.250 1.00 . A A . 1 LEU CB 1 1 8 2202 1 1 1 LEU CD1 C 15.174 -3.631 -5.321 1.00 . A A . 1 LEU CD1 1 1 8 2203 1 1 1 LEU CD2 C 15.039 -1.146 -5.117 1.00 . A A . 1 LEU CD2 1 1 8 2204 1 1 1 LEU CG C 15.250 -2.452 -4.366 1.00 . A A . 1 LEU CG 1 1 8 2205 1 1 1 LEU H1 H 16.267 -1.317 -2.082 1.00 . A A . 1 LEU H1 1 1 8 2206 1 1 1 LEU H2 H 15.597 -2.361 -0.940 1.00 . A A . 1 LEU H2 1 1 8 2207 1 1 1 LEU H3 H 15.445 -0.692 -0.745 1.00 . A A . 1 LEU H3 1 1 8 2208 1 1 1 LEU HA H 14.095 -0.536 -2.713 1.00 . A A . 1 LEU HA 1 1 8 2209 1 1 1 LEU HB2 H 14.408 -3.535 -2.738 1.00 . A A . 1 LEU HB2 1 1 8 2210 1 1 1 LEU HB3 H 13.236 -2.660 -3.703 1.00 . A A . 1 LEU HB3 1 1 8 2211 1 1 1 LEU HD11 H 15.897 -3.502 -6.112 1.00 . A A . 1 LEU HD11 1 1 8 2212 1 1 1 LEU HD12 H 14.182 -3.688 -5.746 1.00 . A A . 1 LEU HD12 1 1 8 2213 1 1 1 LEU HD13 H 15.386 -4.544 -4.784 1.00 . A A . 1 LEU HD13 1 1 8 2214 1 1 1 LEU HD21 H 15.183 -0.315 -4.444 1.00 . A A . 1 LEU HD21 1 1 8 2215 1 1 1 LEU HD22 H 14.035 -1.118 -5.512 1.00 . A A . 1 LEU HD22 1 1 8 2216 1 1 1 LEU HD23 H 15.747 -1.080 -5.929 1.00 . A A . 1 LEU HD23 1 1 8 2217 1 1 1 LEU HG H 16.239 -2.436 -3.932 1.00 . A A . 1 LEU HG 1 1 8 2218 1 1 1 LEU N N 15.462 -1.464 -1.442 1.00 . A A . 1 LEU N 1 1 8 2219 1 1 1 LEU O O 11.944 -1.069 -1.492 1.00 . A A . 1 LEU O 1 1 8 2220 1 1 2 MET C C 11.674 -1.517 1.453 1.00 . A A . 2 MET C 1 1 8 2221 1 1 2 MET CA C 12.075 -2.771 0.686 1.00 . A A . 2 MET CA 1 1 8 2222 1 1 2 MET CB C 12.467 -3.882 1.659 1.00 . A A . 2 MET CB 1 1 8 2223 1 1 2 MET CE C 12.876 -7.998 1.139 1.00 . A A . 2 MET CE 1 1 8 2224 1 1 2 MET CG C 12.545 -5.256 1.014 1.00 . A A . 2 MET CG 1 1 8 2225 1 1 2 MET H H 14.029 -2.928 -0.112 1.00 . A A . 2 MET H 1 1 8 2226 1 1 2 MET HA H 11.225 -3.103 0.108 1.00 . A A . 2 MET HA 1 1 8 2227 1 1 2 MET HB2 H 13.434 -3.651 2.083 1.00 . A A . 2 MET HB2 1 1 8 2228 1 1 2 MET HB3 H 11.736 -3.922 2.453 1.00 . A A . 2 MET HB3 1 1 8 2229 1 1 2 MET HE1 H 13.534 -7.907 0.288 1.00 . A A . 2 MET HE1 1 1 8 2230 1 1 2 MET HE2 H 11.857 -8.086 0.795 1.00 . A A . 2 MET HE2 1 1 8 2231 1 1 2 MET HE3 H 13.142 -8.877 1.707 1.00 . A A . 2 MET HE3 1 1 8 2232 1 1 2 MET HG2 H 11.575 -5.504 0.611 1.00 . A A . 2 MET HG2 1 1 8 2233 1 1 2 MET HG3 H 13.267 -5.220 0.213 1.00 . A A . 2 MET HG3 1 1 8 2234 1 1 2 MET N N 13.159 -2.494 -0.250 1.00 . A A . 2 MET N 1 1 8 2235 1 1 2 MET O O 10.515 -1.361 1.831 1.00 . A A . 2 MET O 1 1 8 2236 1 1 2 MET SD S 13.034 -6.546 2.175 1.00 . A A . 2 MET SD 1 1 8 2237 1 1 3 GLY C C 11.258 1.430 1.596 1.00 . A A . 3 GLY C 1 1 8 2238 1 1 3 GLY CA C 12.343 0.649 2.312 1.00 . A A . 3 GLY CA 1 1 8 2239 1 1 3 GLY H H 13.547 -0.816 1.367 1.00 . A A . 3 GLY H 1 1 8 2240 1 1 3 GLY HA2 H 12.024 0.452 3.325 1.00 . A A . 3 GLY HA2 1 1 8 2241 1 1 3 GLY HA3 H 13.243 1.243 2.336 1.00 . A A . 3 GLY HA3 1 1 8 2242 1 1 3 GLY N N 12.632 -0.616 1.655 1.00 . A A . 3 GLY N 1 1 8 2243 1 1 3 GLY O O 10.510 2.191 2.213 1.00 . A A . 3 GLY O 1 1 8 2244 1 1 4 LEU C C 8.937 0.868 -0.539 1.00 . A A . 4 LEU C 1 1 8 2245 1 1 4 LEU CA C 10.107 1.827 -0.508 1.00 . A A . 4 LEU CA 1 1 8 2246 1 1 4 LEU CB C 10.552 2.034 -1.949 1.00 . A A . 4 LEU CB 1 1 8 2247 1 1 4 LEU CD1 C 12.581 1.598 -3.291 1.00 . A A . 4 LEU CD1 1 1 8 2248 1 1 4 LEU CD2 C 12.157 3.883 -2.343 1.00 . A A . 4 LEU CD2 1 1 8 2249 1 1 4 LEU CG C 12.009 2.388 -2.126 1.00 . A A . 4 LEU CG 1 1 8 2250 1 1 4 LEU H H 11.854 0.690 -0.158 1.00 . A A . 4 LEU H 1 1 8 2251 1 1 4 LEU HA H 9.820 2.768 -0.075 1.00 . A A . 4 LEU HA 1 1 8 2252 1 1 4 LEU HB2 H 10.355 1.125 -2.497 1.00 . A A . 4 LEU HB2 1 1 8 2253 1 1 4 LEU HB3 H 9.957 2.827 -2.378 1.00 . A A . 4 LEU HB3 1 1 8 2254 1 1 4 LEU HD11 H 13.655 1.697 -3.304 1.00 . A A . 4 LEU HD11 1 1 8 2255 1 1 4 LEU HD12 H 12.173 1.977 -4.216 1.00 . A A . 4 LEU HD12 1 1 8 2256 1 1 4 LEU HD13 H 12.311 0.550 -3.181 1.00 . A A . 4 LEU HD13 1 1 8 2257 1 1 4 LEU HD21 H 11.707 4.408 -1.512 1.00 . A A . 4 LEU HD21 1 1 8 2258 1 1 4 LEU HD22 H 11.660 4.164 -3.260 1.00 . A A . 4 LEU HD22 1 1 8 2259 1 1 4 LEU HD23 H 13.203 4.138 -2.407 1.00 . A A . 4 LEU HD23 1 1 8 2260 1 1 4 LEU HG H 12.546 2.120 -1.230 1.00 . A A . 4 LEU HG 1 1 8 2261 1 1 4 LEU N N 11.177 1.242 0.287 1.00 . A A . 4 LEU N 1 1 8 2262 1 1 4 LEU O O 7.816 1.198 -0.163 1.00 . A A . 4 LEU O 1 1 8 2263 1 1 5 PHE C C 7.320 -1.654 -0.152 1.00 . A A . 5 PHE C 1 1 8 2264 1 1 5 PHE CA C 8.261 -1.345 -1.313 1.00 . A A . 5 PHE CA 1 1 8 2265 1 1 5 PHE CB C 8.980 -2.607 -1.782 1.00 . A A . 5 PHE CB 1 1 8 2266 1 1 5 PHE CD1 C 7.437 -3.239 -3.654 1.00 . A A . 5 PHE CD1 1 1 8 2267 1 1 5 PHE CD2 C 7.895 -4.860 -1.966 1.00 . A A . 5 PHE CD2 1 1 8 2268 1 1 5 PHE CE1 C 6.615 -4.140 -4.302 1.00 . A A . 5 PHE CE1 1 1 8 2269 1 1 5 PHE CE2 C 7.073 -5.765 -2.609 1.00 . A A . 5 PHE CE2 1 1 8 2270 1 1 5 PHE CG C 8.084 -3.589 -2.481 1.00 . A A . 5 PHE CG 1 1 8 2271 1 1 5 PHE CZ C 6.432 -5.405 -3.778 1.00 . A A . 5 PHE CZ 1 1 8 2272 1 1 5 PHE H H 10.201 -0.574 -1.067 1.00 . A A . 5 PHE H 1 1 8 2273 1 1 5 PHE HA H 7.676 -0.960 -2.134 1.00 . A A . 5 PHE HA 1 1 8 2274 1 1 5 PHE HB2 H 9.777 -2.323 -2.464 1.00 . A A . 5 PHE HB2 1 1 8 2275 1 1 5 PHE HB3 H 9.406 -3.104 -0.923 1.00 . A A . 5 PHE HB3 1 1 8 2276 1 1 5 PHE HD1 H 7.580 -2.251 -4.063 1.00 . A A . 5 PHE HD1 1 1 8 2277 1 1 5 PHE HD2 H 8.395 -5.142 -1.052 1.00 . A A . 5 PHE HD2 1 1 8 2278 1 1 5 PHE HE1 H 6.116 -3.855 -5.215 1.00 . A A . 5 PHE HE1 1 1 8 2279 1 1 5 PHE HE2 H 6.932 -6.754 -2.198 1.00 . A A . 5 PHE HE2 1 1 8 2280 1 1 5 PHE HZ H 5.789 -6.111 -4.283 1.00 . A A . 5 PHE HZ 1 1 8 2281 1 1 5 PHE N N 9.250 -0.343 -0.972 1.00 . A A . 5 PHE N 1 1 8 2282 1 1 5 PHE O O 6.111 -1.717 -0.346 1.00 . A A . 5 PHE O 1 1 8 2283 1 1 6 ASN C C 5.959 -1.129 2.456 1.00 . A A . 6 ASN C 1 1 8 2284 1 1 6 ASN CA C 7.036 -2.170 2.211 1.00 . A A . 6 ASN CA 1 1 8 2285 1 1 6 ASN CB C 7.874 -2.315 3.482 1.00 . A A . 6 ASN CB 1 1 8 2286 1 1 6 ASN CG C 8.848 -3.478 3.419 1.00 . A A . 6 ASN CG 1 1 8 2287 1 1 6 ASN H H 8.830 -1.690 1.170 1.00 . A A . 6 ASN H 1 1 8 2288 1 1 6 ASN HA H 6.561 -3.116 1.995 1.00 . A A . 6 ASN HA 1 1 8 2289 1 1 6 ASN HB2 H 8.430 -1.403 3.639 1.00 . A A . 6 ASN HB2 1 1 8 2290 1 1 6 ASN HB3 H 7.212 -2.471 4.320 1.00 . A A . 6 ASN HB3 1 1 8 2291 1 1 6 ASN HD21 H 10.098 -2.534 4.637 1.00 . A A . 6 ASN HD21 1 1 8 2292 1 1 6 ASN HD22 H 10.608 -4.094 4.096 1.00 . A A . 6 ASN HD22 1 1 8 2293 1 1 6 ASN N N 7.861 -1.814 1.053 1.00 . A A . 6 ASN N 1 1 8 2294 1 1 6 ASN ND2 N 9.963 -3.356 4.121 1.00 . A A . 6 ASN ND2 1 1 8 2295 1 1 6 ASN O O 4.791 -1.468 2.656 1.00 . A A . 6 ASN O 1 1 8 2296 1 1 6 ASN OD1 O 8.593 -4.482 2.753 1.00 . A A . 6 ASN OD1 1 1 8 2297 1 1 7 ARG C C 4.455 1.352 1.467 1.00 . A A . 7 ARG C 1 1 8 2298 1 1 7 ARG CA C 5.378 1.198 2.670 1.00 . A A . 7 ARG CA 1 1 8 2299 1 1 7 ARG CB C 6.068 2.519 3.046 1.00 . A A . 7 ARG CB 1 1 8 2300 1 1 7 ARG CD C 6.151 3.917 0.970 1.00 . A A . 7 ARG CD 1 1 8 2301 1 1 7 ARG CG C 6.950 3.089 1.960 1.00 . A A . 7 ARG CG 1 1 8 2302 1 1 7 ARG CZ C 5.778 6.359 0.929 1.00 . A A . 7 ARG CZ 1 1 8 2303 1 1 7 ARG H H 7.274 0.366 2.235 1.00 . A A . 7 ARG H 1 1 8 2304 1 1 7 ARG HA H 4.788 0.883 3.501 1.00 . A A . 7 ARG HA 1 1 8 2305 1 1 7 ARG HB2 H 5.310 3.251 3.281 1.00 . A A . 7 ARG HB2 1 1 8 2306 1 1 7 ARG HB3 H 6.676 2.353 3.924 1.00 . A A . 7 ARG HB3 1 1 8 2307 1 1 7 ARG HD2 H 6.765 4.121 0.108 1.00 . A A . 7 ARG HD2 1 1 8 2308 1 1 7 ARG HD3 H 5.282 3.339 0.671 1.00 . A A . 7 ARG HD3 1 1 8 2309 1 1 7 ARG HE H 5.294 5.146 2.448 1.00 . A A . 7 ARG HE 1 1 8 2310 1 1 7 ARG HG2 H 7.710 3.711 2.410 1.00 . A A . 7 ARG HG2 1 1 8 2311 1 1 7 ARG HG3 H 7.410 2.267 1.439 1.00 . A A . 7 ARG HG3 1 1 8 2312 1 1 7 ARG HH11 H 6.757 5.639 -0.696 1.00 . A A . 7 ARG HH11 1 1 8 2313 1 1 7 ARG HH12 H 6.423 7.337 -0.722 1.00 . A A . 7 ARG HH12 1 1 8 2314 1 1 7 ARG HH21 H 4.871 7.395 2.415 1.00 . A A . 7 ARG HH21 1 1 8 2315 1 1 7 ARG HH22 H 5.359 8.338 1.043 1.00 . A A . 7 ARG HH22 1 1 8 2316 1 1 7 ARG N N 6.340 0.142 2.428 1.00 . A A . 7 ARG N 1 1 8 2317 1 1 7 ARG NE N 5.695 5.181 1.549 1.00 . A A . 7 ARG NE 1 1 8 2318 1 1 7 ARG NH1 N 6.366 6.451 -0.257 1.00 . A A . 7 ARG NH1 1 1 8 2319 1 1 7 ARG NH2 N 5.297 7.449 1.508 1.00 . A A . 7 ARG NH2 1 1 8 2320 1 1 7 ARG O O 3.329 1.833 1.594 1.00 . A A . 7 ARG O 1 1 8 2321 1 1 8 ILE C C 3.008 -0.145 -0.732 1.00 . A A . 8 ILE C 1 1 8 2322 1 1 8 ILE CA C 4.114 0.885 -0.901 1.00 . A A . 8 ILE CA 1 1 8 2323 1 1 8 ILE CB C 4.936 0.547 -2.170 1.00 . A A . 8 ILE CB 1 1 8 2324 1 1 8 ILE CD1 C 5.267 3.010 -2.771 1.00 . A A . 8 ILE CD1 1 1 8 2325 1 1 8 ILE CG1 C 5.924 1.673 -2.498 1.00 . A A . 8 ILE CG1 1 1 8 2326 1 1 8 ILE CG2 C 4.017 0.283 -3.358 1.00 . A A . 8 ILE CG2 1 1 8 2327 1 1 8 ILE H H 5.873 0.627 0.248 1.00 . A A . 8 ILE H 1 1 8 2328 1 1 8 ILE HA H 3.668 1.860 -1.031 1.00 . A A . 8 ILE HA 1 1 8 2329 1 1 8 ILE HB H 5.492 -0.358 -1.973 1.00 . A A . 8 ILE HB 1 1 8 2330 1 1 8 ILE HD11 H 4.558 2.903 -3.580 1.00 . A A . 8 ILE HD11 1 1 8 2331 1 1 8 ILE HD12 H 6.021 3.731 -3.047 1.00 . A A . 8 ILE HD12 1 1 8 2332 1 1 8 ILE HD13 H 4.754 3.348 -1.883 1.00 . A A . 8 ILE HD13 1 1 8 2333 1 1 8 ILE HG12 H 6.600 1.804 -1.665 1.00 . A A . 8 ILE HG12 1 1 8 2334 1 1 8 ILE HG13 H 6.493 1.399 -3.374 1.00 . A A . 8 ILE HG13 1 1 8 2335 1 1 8 ILE HG21 H 3.308 -0.493 -3.100 1.00 . A A . 8 ILE HG21 1 1 8 2336 1 1 8 ILE HG22 H 4.606 -0.037 -4.205 1.00 . A A . 8 ILE HG22 1 1 8 2337 1 1 8 ILE HG23 H 3.484 1.188 -3.611 1.00 . A A . 8 ILE HG23 1 1 8 2338 1 1 8 ILE N N 4.937 0.924 0.299 1.00 . A A . 8 ILE N 1 1 8 2339 1 1 8 ILE O O 1.870 0.096 -1.121 1.00 . A A . 8 ILE O 1 1 8 2340 1 1 9 ILE C C 1.191 -1.755 0.915 1.00 . A A . 9 ILE C 1 1 8 2341 1 1 9 ILE CA C 2.351 -2.329 0.121 1.00 . A A . 9 ILE CA 1 1 8 2342 1 1 9 ILE CB C 2.931 -3.524 0.915 1.00 . A A . 9 ILE CB 1 1 8 2343 1 1 9 ILE CD1 C 4.274 -4.333 -1.092 1.00 . A A . 9 ILE CD1 1 1 8 2344 1 1 9 ILE CG1 C 4.289 -3.959 0.367 1.00 . A A . 9 ILE CG1 1 1 8 2345 1 1 9 ILE CG2 C 1.957 -4.695 0.899 1.00 . A A . 9 ILE CG2 1 1 8 2346 1 1 9 ILE H H 4.272 -1.425 0.152 1.00 . A A . 9 ILE H 1 1 8 2347 1 1 9 ILE HA H 1.989 -2.684 -0.830 1.00 . A A . 9 ILE HA 1 1 8 2348 1 1 9 ILE HB H 3.053 -3.212 1.936 1.00 . A A . 9 ILE HB 1 1 8 2349 1 1 9 ILE HD11 H 5.283 -4.557 -1.411 1.00 . A A . 9 ILE HD11 1 1 8 2350 1 1 9 ILE HD12 H 3.886 -3.508 -1.668 1.00 . A A . 9 ILE HD12 1 1 8 2351 1 1 9 ILE HD13 H 3.648 -5.199 -1.233 1.00 . A A . 9 ILE HD13 1 1 8 2352 1 1 9 ILE HG12 H 4.993 -3.149 0.491 1.00 . A A . 9 ILE HG12 1 1 8 2353 1 1 9 ILE HG13 H 4.634 -4.815 0.927 1.00 . A A . 9 ILE HG13 1 1 8 2354 1 1 9 ILE HG21 H 1.023 -4.392 1.348 1.00 . A A . 9 ILE HG21 1 1 8 2355 1 1 9 ILE HG22 H 2.375 -5.518 1.458 1.00 . A A . 9 ILE HG22 1 1 8 2356 1 1 9 ILE HG23 H 1.783 -5.004 -0.122 1.00 . A A . 9 ILE HG23 1 1 8 2357 1 1 9 ILE N N 3.339 -1.284 -0.126 1.00 . A A . 9 ILE N 1 1 8 2358 1 1 9 ILE O O 0.026 -1.995 0.608 1.00 . A A . 9 ILE O 1 1 8 2359 1 1 10 ARG C C -0.196 0.753 2.046 1.00 . A A . 10 ARG C 1 1 8 2360 1 1 10 ARG CA C 0.534 -0.360 2.786 1.00 . A A . 10 ARG CA 1 1 8 2361 1 1 10 ARG CB C 1.191 0.202 4.046 1.00 . A A . 10 ARG CB 1 1 8 2362 1 1 10 ARG CD C 1.721 -2.148 4.777 1.00 . A A . 10 ARG CD 1 1 8 2363 1 1 10 ARG CG C 2.229 -0.723 4.659 1.00 . A A . 10 ARG CG 1 1 8 2364 1 1 10 ARG CZ C 2.854 -4.216 5.515 1.00 . A A . 10 ARG CZ 1 1 8 2365 1 1 10 ARG H H 2.477 -0.833 2.125 1.00 . A A . 10 ARG H 1 1 8 2366 1 1 10 ARG HA H -0.174 -1.120 3.063 1.00 . A A . 10 ARG HA 1 1 8 2367 1 1 10 ARG HB2 H 1.675 1.135 3.799 1.00 . A A . 10 ARG HB2 1 1 8 2368 1 1 10 ARG HB3 H 0.426 0.389 4.784 1.00 . A A . 10 ARG HB3 1 1 8 2369 1 1 10 ARG HD2 H 0.699 -2.126 5.115 1.00 . A A . 10 ARG HD2 1 1 8 2370 1 1 10 ARG HD3 H 1.763 -2.607 3.800 1.00 . A A . 10 ARG HD3 1 1 8 2371 1 1 10 ARG HE H 2.854 -2.485 6.515 1.00 . A A . 10 ARG HE 1 1 8 2372 1 1 10 ARG HG2 H 3.102 -0.722 4.028 1.00 . A A . 10 ARG HG2 1 1 8 2373 1 1 10 ARG HG3 H 2.491 -0.358 5.641 1.00 . A A . 10 ARG HG3 1 1 8 2374 1 1 10 ARG HH11 H 1.837 -4.408 3.775 1.00 . A A . 10 ARG HH11 1 1 8 2375 1 1 10 ARG HH12 H 2.683 -5.827 4.295 1.00 . A A . 10 ARG HH12 1 1 8 2376 1 1 10 ARG HH21 H 3.938 -4.363 7.221 1.00 . A A . 10 ARG HH21 1 1 8 2377 1 1 10 ARG HH22 H 3.851 -5.811 6.269 1.00 . A A . 10 ARG HH22 1 1 8 2378 1 1 10 ARG N N 1.529 -0.979 1.932 1.00 . A A . 10 ARG N 1 1 8 2379 1 1 10 ARG NE N 2.529 -2.938 5.704 1.00 . A A . 10 ARG NE 1 1 8 2380 1 1 10 ARG NH1 N 2.417 -4.869 4.445 1.00 . A A . 10 ARG NH1 1 1 8 2381 1 1 10 ARG NH2 N 3.610 -4.845 6.405 1.00 . A A . 10 ARG NH2 1 1 8 2382 1 1 10 ARG O O -1.381 0.992 2.271 1.00 . A A . 10 ARG O 1 1 8 2383 1 1 11 LYS C C -1.042 1.936 -0.643 1.00 . A A . 11 LYS C 1 1 8 2384 1 1 11 LYS CA C -0.053 2.504 0.369 1.00 . A A . 11 LYS CA 1 1 8 2385 1 1 11 LYS CB C 1.059 3.282 -0.346 1.00 . A A . 11 LYS CB 1 1 8 2386 1 1 11 LYS CD C 0.022 5.549 -0.026 1.00 . A A . 11 LYS CD 1 1 8 2387 1 1 11 LYS CE C -0.454 6.824 -0.704 1.00 . A A . 11 LYS CE 1 1 8 2388 1 1 11 LYS CG C 0.585 4.554 -1.029 1.00 . A A . 11 LYS CG 1 1 8 2389 1 1 11 LYS H H 1.458 1.168 1.008 1.00 . A A . 11 LYS H 1 1 8 2390 1 1 11 LYS HA H -0.577 3.165 1.043 1.00 . A A . 11 LYS HA 1 1 8 2391 1 1 11 LYS HB2 H 1.821 3.547 0.375 1.00 . A A . 11 LYS HB2 1 1 8 2392 1 1 11 LYS HB3 H 1.499 2.641 -1.097 1.00 . A A . 11 LYS HB3 1 1 8 2393 1 1 11 LYS HD2 H -0.813 5.095 0.486 1.00 . A A . 11 LYS HD2 1 1 8 2394 1 1 11 LYS HD3 H 0.792 5.797 0.689 1.00 . A A . 11 LYS HD3 1 1 8 2395 1 1 11 LYS HE2 H -1.198 6.566 -1.442 1.00 . A A . 11 LYS HE2 1 1 8 2396 1 1 11 LYS HE3 H -0.895 7.468 0.041 1.00 . A A . 11 LYS HE3 1 1 8 2397 1 1 11 LYS HG2 H 1.420 5.008 -1.540 1.00 . A A . 11 LYS HG2 1 1 8 2398 1 1 11 LYS HG3 H -0.185 4.302 -1.744 1.00 . A A . 11 LYS HG3 1 1 8 2399 1 1 11 LYS HZ1 H 1.045 6.974 -2.147 1.00 . A A . 11 LYS HZ1 1 1 8 2400 1 1 11 LYS HZ2 H 1.413 7.754 -0.697 1.00 . A A . 11 LYS HZ2 1 1 8 2401 1 1 11 LYS HZ3 H 0.306 8.446 -1.770 1.00 . A A . 11 LYS HZ3 1 1 8 2402 1 1 11 LYS N N 0.519 1.419 1.153 1.00 . A A . 11 LYS N 1 1 8 2403 1 1 11 LYS NZ N 0.653 7.549 -1.375 1.00 . A A . 11 LYS NZ 1 1 8 2404 1 1 11 LYS O O -2.082 2.529 -0.932 1.00 . A A . 11 LYS O 1 1 8 2405 1 1 12 VAL C C -2.718 -0.620 -1.367 1.00 . A A . 12 VAL C 1 1 8 2406 1 1 12 VAL CA C -1.562 0.059 -2.096 1.00 . A A . 12 VAL CA 1 1 8 2407 1 1 12 VAL CB C -0.765 -0.998 -2.886 1.00 . A A . 12 VAL CB 1 1 8 2408 1 1 12 VAL CG1 C -1.703 -1.864 -3.712 1.00 . A A . 12 VAL CG1 1 1 8 2409 1 1 12 VAL CG2 C 0.267 -0.329 -3.783 1.00 . A A . 12 VAL CG2 1 1 8 2410 1 1 12 VAL H H 0.161 0.369 -0.919 1.00 . A A . 12 VAL H 1 1 8 2411 1 1 12 VAL HA H -1.962 0.778 -2.797 1.00 . A A . 12 VAL HA 1 1 8 2412 1 1 12 VAL HB H -0.242 -1.628 -2.177 1.00 . A A . 12 VAL HB 1 1 8 2413 1 1 12 VAL HG11 H -1.132 -2.597 -4.262 1.00 . A A . 12 VAL HG11 1 1 8 2414 1 1 12 VAL HG12 H -2.253 -1.240 -4.401 1.00 . A A . 12 VAL HG12 1 1 8 2415 1 1 12 VAL HG13 H -2.399 -2.364 -3.054 1.00 . A A . 12 VAL HG13 1 1 8 2416 1 1 12 VAL HG21 H 0.825 -1.086 -4.315 1.00 . A A . 12 VAL HG21 1 1 8 2417 1 1 12 VAL HG22 H 0.942 0.259 -3.180 1.00 . A A . 12 VAL HG22 1 1 8 2418 1 1 12 VAL HG23 H -0.235 0.314 -4.493 1.00 . A A . 12 VAL HG23 1 1 8 2419 1 1 12 VAL N N -0.707 0.766 -1.162 1.00 . A A . 12 VAL N 1 1 8 2420 1 1 12 VAL O O -3.797 -0.800 -1.923 1.00 . A A . 12 VAL O 1 1 8 2421 1 1 13 VAL C C -4.692 -0.705 0.884 1.00 . A A . 13 VAL C 1 1 8 2422 1 1 13 VAL CA C -3.516 -1.642 0.671 1.00 . A A . 13 VAL CA 1 1 8 2423 1 1 13 VAL CB C -2.933 -2.127 2.017 1.00 . A A . 13 VAL CB 1 1 8 2424 1 1 13 VAL CG1 C -3.444 -1.315 3.198 1.00 . A A . 13 VAL CG1 1 1 8 2425 1 1 13 VAL CG2 C -3.205 -3.603 2.200 1.00 . A A . 13 VAL CG2 1 1 8 2426 1 1 13 VAL H H -1.665 -0.718 0.326 1.00 . A A . 13 VAL H 1 1 8 2427 1 1 13 VAL HA H -3.847 -2.503 0.108 1.00 . A A . 13 VAL HA 1 1 8 2428 1 1 13 VAL HB H -1.862 -1.996 1.974 1.00 . A A . 13 VAL HB 1 1 8 2429 1 1 13 VAL HG11 H -3.004 -1.687 4.110 1.00 . A A . 13 VAL HG11 1 1 8 2430 1 1 13 VAL HG12 H -4.519 -1.401 3.256 1.00 . A A . 13 VAL HG12 1 1 8 2431 1 1 13 VAL HG13 H -3.170 -0.279 3.062 1.00 . A A . 13 VAL HG13 1 1 8 2432 1 1 13 VAL HG21 H -2.805 -3.930 3.146 1.00 . A A . 13 VAL HG21 1 1 8 2433 1 1 13 VAL HG22 H -2.730 -4.148 1.398 1.00 . A A . 13 VAL HG22 1 1 8 2434 1 1 13 VAL HG23 H -4.269 -3.779 2.176 1.00 . A A . 13 VAL HG23 1 1 8 2435 1 1 13 VAL N N -2.508 -0.955 -0.104 1.00 . A A . 13 VAL N 1 1 8 2436 1 1 13 VAL O O -5.824 -1.123 1.121 1.00 . A A . 13 VAL O 1 1 8 2437 1 1 14 LYS C C -6.313 1.567 -0.382 1.00 . A A . 14 LYS C 1 1 8 2438 1 1 14 LYS CA C -5.373 1.621 0.818 1.00 . A A . 14 LYS CA 1 1 8 2439 1 1 14 LYS CB C -4.654 2.963 0.875 1.00 . A A . 14 LYS CB 1 1 8 2440 1 1 14 LYS CD C -5.058 3.223 3.357 1.00 . A A . 14 LYS CD 1 1 8 2441 1 1 14 LYS CE C -6.224 4.164 3.108 1.00 . A A . 14 LYS CE 1 1 8 2442 1 1 14 LYS CG C -4.035 3.275 2.230 1.00 . A A . 14 LYS CG 1 1 8 2443 1 1 14 LYS H H -3.453 0.818 0.599 1.00 . A A . 14 LYS H 1 1 8 2444 1 1 14 LYS HA H -5.948 1.488 1.720 1.00 . A A . 14 LYS HA 1 1 8 2445 1 1 14 LYS HB2 H -3.852 2.937 0.147 1.00 . A A . 14 LYS HB2 1 1 8 2446 1 1 14 LYS HB3 H -5.345 3.752 0.619 1.00 . A A . 14 LYS HB3 1 1 8 2447 1 1 14 LYS HD2 H -5.434 2.217 3.444 1.00 . A A . 14 LYS HD2 1 1 8 2448 1 1 14 LYS HD3 H -4.572 3.505 4.281 1.00 . A A . 14 LYS HD3 1 1 8 2449 1 1 14 LYS HE2 H -5.844 5.170 3.015 1.00 . A A . 14 LYS HE2 1 1 8 2450 1 1 14 LYS HE3 H -6.707 3.876 2.188 1.00 . A A . 14 LYS HE3 1 1 8 2451 1 1 14 LYS HG2 H -3.262 2.552 2.434 1.00 . A A . 14 LYS HG2 1 1 8 2452 1 1 14 LYS HG3 H -3.601 4.264 2.196 1.00 . A A . 14 LYS HG3 1 1 8 2453 1 1 14 LYS HZ1 H -8.016 4.759 4.004 1.00 . A A . 14 LYS HZ1 1 1 8 2454 1 1 14 LYS HZ2 H -6.780 4.422 5.105 1.00 . A A . 14 LYS HZ2 1 1 8 2455 1 1 14 LYS HZ3 H -7.588 3.156 4.330 1.00 . A A . 14 LYS HZ3 1 1 8 2456 1 1 14 LYS N N -4.389 0.573 0.750 1.00 . A A . 14 LYS N 1 1 8 2457 1 1 14 LYS NZ N -7.220 4.122 4.212 1.00 . A A . 14 LYS NZ 1 1 8 2458 1 1 14 LYS O O -7.499 1.862 -0.256 1.00 . A A . 14 LYS O 1 1 8 2459 1 1 15 LEU C C -7.165 -0.367 -2.825 1.00 . A A . 15 LEU C 1 1 8 2460 1 1 15 LEU CA C -6.625 1.056 -2.727 1.00 . A A . 15 LEU CA 1 1 8 2461 1 1 15 LEU CB C -5.837 1.465 -3.983 1.00 . A A . 15 LEU CB 1 1 8 2462 1 1 15 LEU CD1 C -5.041 -0.603 -5.194 1.00 . A A . 15 LEU CD1 1 1 8 2463 1 1 15 LEU CD2 C -3.588 1.430 -5.088 1.00 . A A . 15 LEU CD2 1 1 8 2464 1 1 15 LEU CG C -4.628 0.597 -4.354 1.00 . A A . 15 LEU CG 1 1 8 2465 1 1 15 LEU H H -4.826 0.995 -1.621 1.00 . A A . 15 LEU H 1 1 8 2466 1 1 15 LEU HA H -7.462 1.729 -2.607 1.00 . A A . 15 LEU HA 1 1 8 2467 1 1 15 LEU HB2 H -6.516 1.474 -4.821 1.00 . A A . 15 LEU HB2 1 1 8 2468 1 1 15 LEU HB3 H -5.481 2.470 -3.822 1.00 . A A . 15 LEU HB3 1 1 8 2469 1 1 15 LEU HD11 H -4.172 -1.204 -5.415 1.00 . A A . 15 LEU HD11 1 1 8 2470 1 1 15 LEU HD12 H -5.486 -0.261 -6.116 1.00 . A A . 15 LEU HD12 1 1 8 2471 1 1 15 LEU HD13 H -5.760 -1.196 -4.647 1.00 . A A . 15 LEU HD13 1 1 8 2472 1 1 15 LEU HD21 H -2.748 0.805 -5.352 1.00 . A A . 15 LEU HD21 1 1 8 2473 1 1 15 LEU HD22 H -3.252 2.232 -4.449 1.00 . A A . 15 LEU HD22 1 1 8 2474 1 1 15 LEU HD23 H -4.025 1.844 -5.985 1.00 . A A . 15 LEU HD23 1 1 8 2475 1 1 15 LEU HG H -4.174 0.224 -3.447 1.00 . A A . 15 LEU HG 1 1 8 2476 1 1 15 LEU N N -5.790 1.190 -1.548 1.00 . A A . 15 LEU N 1 1 8 2477 1 1 15 LEU O O -8.160 -0.627 -3.504 1.00 . A A . 15 LEU O 1 1 8 2478 1 1 16 PHE C C -8.131 -2.851 -1.196 1.00 . A A . 16 PHE C 1 1 8 2479 1 1 16 PHE CA C -6.918 -2.676 -2.103 1.00 . A A . 16 PHE CA 1 1 8 2480 1 1 16 PHE CB C -5.766 -3.550 -1.606 1.00 . A A . 16 PHE CB 1 1 8 2481 1 1 16 PHE CD1 C -5.492 -5.560 -3.075 1.00 . A A . 16 PHE CD1 1 1 8 2482 1 1 16 PHE CD2 C -6.563 -5.847 -0.965 1.00 . A A . 16 PHE CD2 1 1 8 2483 1 1 16 PHE CE1 C -5.648 -6.906 -3.340 1.00 . A A . 16 PHE CE1 1 1 8 2484 1 1 16 PHE CE2 C -6.722 -7.193 -1.226 1.00 . A A . 16 PHE CE2 1 1 8 2485 1 1 16 PHE CG C -5.946 -5.015 -1.887 1.00 . A A . 16 PHE CG 1 1 8 2486 1 1 16 PHE CZ C -6.263 -7.723 -2.415 1.00 . A A . 16 PHE CZ 1 1 8 2487 1 1 16 PHE H H -5.708 -1.010 -1.616 1.00 . A A . 16 PHE H 1 1 8 2488 1 1 16 PHE HA H -7.180 -2.967 -3.109 1.00 . A A . 16 PHE HA 1 1 8 2489 1 1 16 PHE HB2 H -4.852 -3.230 -2.082 1.00 . A A . 16 PHE HB2 1 1 8 2490 1 1 16 PHE HB3 H -5.668 -3.426 -0.537 1.00 . A A . 16 PHE HB3 1 1 8 2491 1 1 16 PHE HD1 H -5.008 -4.923 -3.798 1.00 . A A . 16 PHE HD1 1 1 8 2492 1 1 16 PHE HD2 H -6.923 -5.432 -0.035 1.00 . A A . 16 PHE HD2 1 1 8 2493 1 1 16 PHE HE1 H -5.290 -7.318 -4.272 1.00 . A A . 16 PHE HE1 1 1 8 2494 1 1 16 PHE HE2 H -7.203 -7.831 -0.501 1.00 . A A . 16 PHE HE2 1 1 8 2495 1 1 16 PHE HZ H -6.386 -8.776 -2.619 1.00 . A A . 16 PHE HZ 1 1 8 2496 1 1 16 PHE N N -6.507 -1.281 -2.125 1.00 . A A . 16 PHE N 1 1 8 2497 1 1 16 PHE O O -9.096 -3.528 -1.552 1.00 . A A . 16 PHE O 1 1 8 2498 1 1 17 ASN C C -10.147 -1.202 0.750 1.00 . A A . 17 ASN C 1 1 8 2499 1 1 17 ASN CA C -9.146 -2.325 0.959 1.00 . A A . 17 ASN CA 1 1 8 2500 1 1 17 ASN CB C -8.593 -2.256 2.391 1.00 . A A . 17 ASN CB 1 1 8 2501 1 1 17 ASN CG C -7.877 -3.522 2.828 1.00 . A A . 17 ASN CG 1 1 8 2502 1 1 17 ASN H H -7.271 -1.698 0.194 1.00 . A A . 17 ASN H 1 1 8 2503 1 1 17 ASN HA H -9.648 -3.273 0.820 1.00 . A A . 17 ASN HA 1 1 8 2504 1 1 17 ASN HB2 H -7.894 -1.437 2.455 1.00 . A A . 17 ASN HB2 1 1 8 2505 1 1 17 ASN HB3 H -9.410 -2.076 3.073 1.00 . A A . 17 ASN HB3 1 1 8 2506 1 1 17 ASN HD21 H -7.388 -3.945 0.956 1.00 . A A . 17 ASN HD21 1 1 8 2507 1 1 17 ASN HD22 H -6.848 -5.078 2.143 1.00 . A A . 17 ASN HD22 1 1 8 2508 1 1 17 ASN N N -8.068 -2.238 -0.020 1.00 . A A . 17 ASN N 1 1 8 2509 1 1 17 ASN ND2 N -7.314 -4.254 1.881 1.00 . A A . 17 ASN ND2 1 1 8 2510 1 1 17 ASN O O -11.034 -1.348 -0.116 1.00 . A A . 17 ASN O 1 1 8 2511 1 1 17 ASN OXT O -10.046 -0.172 1.453 1.00 . A A . 17 ASN OXT 1 1 8 2512 1 1 17 ASN OD1 O -7.835 -3.840 4.018 1.00 . A A . 17 ASN OD1 1 1 9 2513 1 1 1 LEU C C 13.627 -2.089 -0.058 1.00 . A A . 1 LEU C 1 1 9 2514 1 1 1 LEU CA C 15.063 -2.111 -0.563 1.00 . A A . 1 LEU CA 1 1 9 2515 1 1 1 LEU CB C 15.539 -0.686 -0.855 1.00 . A A . 1 LEU CB 1 1 9 2516 1 1 1 LEU CD1 C 17.362 0.892 -1.534 1.00 . A A . 1 LEU CD1 1 1 9 2517 1 1 1 LEU CD2 C 17.886 -1.034 -0.036 1.00 . A A . 1 LEU CD2 1 1 9 2518 1 1 1 LEU CG C 17.026 -0.549 -1.193 1.00 . A A . 1 LEU CG 1 1 9 2519 1 1 1 LEU H1 H 16.150 -2.971 -2.116 1.00 . A A . 1 LEU H1 1 1 9 2520 1 1 1 LEU H2 H 14.563 -2.567 -2.530 1.00 . A A . 1 LEU H2 1 1 9 2521 1 1 1 LEU H3 H 14.865 -3.921 -1.567 1.00 . A A . 1 LEU H3 1 1 9 2522 1 1 1 LEU HA H 15.690 -2.545 0.200 1.00 . A A . 1 LEU HA 1 1 9 2523 1 1 1 LEU HB2 H 14.965 -0.302 -1.684 1.00 . A A . 1 LEU HB2 1 1 9 2524 1 1 1 LEU HB3 H 15.334 -0.079 0.012 1.00 . A A . 1 LEU HB3 1 1 9 2525 1 1 1 LEU HD11 H 18.417 0.973 -1.755 1.00 . A A . 1 LEU HD11 1 1 9 2526 1 1 1 LEU HD12 H 17.120 1.526 -0.696 1.00 . A A . 1 LEU HD12 1 1 9 2527 1 1 1 LEU HD13 H 16.789 1.200 -2.395 1.00 . A A . 1 LEU HD13 1 1 9 2528 1 1 1 LEU HD21 H 17.648 -0.468 0.853 1.00 . A A . 1 LEU HD21 1 1 9 2529 1 1 1 LEU HD22 H 18.928 -0.895 -0.281 1.00 . A A . 1 LEU HD22 1 1 9 2530 1 1 1 LEU HD23 H 17.696 -2.082 0.142 1.00 . A A . 1 LEU HD23 1 1 9 2531 1 1 1 LEU HG H 17.250 -1.158 -2.058 1.00 . A A . 1 LEU HG 1 1 9 2532 1 1 1 LEU N N 15.170 -2.949 -1.777 1.00 . A A . 1 LEU N 1 1 9 2533 1 1 1 LEU O O 12.752 -1.461 -0.660 1.00 . A A . 1 LEU O 1 1 9 2534 1 1 2 MET C C 11.496 -1.577 2.110 1.00 . A A . 2 MET C 1 1 9 2535 1 1 2 MET CA C 12.042 -2.909 1.602 1.00 . A A . 2 MET CA 1 1 9 2536 1 1 2 MET CB C 12.008 -3.954 2.724 1.00 . A A . 2 MET CB 1 1 9 2537 1 1 2 MET CE C 13.590 -3.991 6.587 1.00 . A A . 2 MET CE 1 1 9 2538 1 1 2 MET CG C 12.761 -3.550 3.981 1.00 . A A . 2 MET CG 1 1 9 2539 1 1 2 MET H H 14.144 -3.179 1.539 1.00 . A A . 2 MET H 1 1 9 2540 1 1 2 MET HA H 11.411 -3.249 0.797 1.00 . A A . 2 MET HA 1 1 9 2541 1 1 2 MET HB2 H 10.979 -4.138 2.996 1.00 . A A . 2 MET HB2 1 1 9 2542 1 1 2 MET HB3 H 12.439 -4.873 2.354 1.00 . A A . 2 MET HB3 1 1 9 2543 1 1 2 MET HE1 H 13.599 -4.621 7.464 1.00 . A A . 2 MET HE1 1 1 9 2544 1 1 2 MET HE2 H 13.168 -3.030 6.838 1.00 . A A . 2 MET HE2 1 1 9 2545 1 1 2 MET HE3 H 14.601 -3.860 6.229 1.00 . A A . 2 MET HE3 1 1 9 2546 1 1 2 MET HG2 H 13.806 -3.442 3.737 1.00 . A A . 2 MET HG2 1 1 9 2547 1 1 2 MET HG3 H 12.374 -2.603 4.327 1.00 . A A . 2 MET HG3 1 1 9 2548 1 1 2 MET N N 13.391 -2.764 1.064 1.00 . A A . 2 MET N 1 1 9 2549 1 1 2 MET O O 10.285 -1.409 2.229 1.00 . A A . 2 MET O 1 1 9 2550 1 1 2 MET SD S 12.601 -4.762 5.306 1.00 . A A . 2 MET SD 1 1 9 2551 1 1 3 GLY C C 10.939 1.327 1.980 1.00 . A A . 3 GLY C 1 1 9 2552 1 1 3 GLY CA C 11.977 0.676 2.873 1.00 . A A . 3 GLY CA 1 1 9 2553 1 1 3 GLY H H 13.345 -0.822 2.259 1.00 . A A . 3 GLY H 1 1 9 2554 1 1 3 GLY HA2 H 11.564 0.565 3.864 1.00 . A A . 3 GLY HA2 1 1 9 2555 1 1 3 GLY HA3 H 12.842 1.320 2.926 1.00 . A A . 3 GLY HA3 1 1 9 2556 1 1 3 GLY N N 12.392 -0.630 2.385 1.00 . A A . 3 GLY N 1 1 9 2557 1 1 3 GLY O O 9.969 1.910 2.464 1.00 . A A . 3 GLY O 1 1 9 2558 1 1 4 LEU C C 9.010 0.823 -0.441 1.00 . A A . 4 LEU C 1 1 9 2559 1 1 4 LEU CA C 10.192 1.757 -0.288 1.00 . A A . 4 LEU CA 1 1 9 2560 1 1 4 LEU CB C 10.838 1.885 -1.658 1.00 . A A . 4 LEU CB 1 1 9 2561 1 1 4 LEU CD1 C 13.026 1.390 -2.692 1.00 . A A . 4 LEU CD1 1 1 9 2562 1 1 4 LEU CD2 C 12.511 3.711 -1.890 1.00 . A A . 4 LEU CD2 1 1 9 2563 1 1 4 LEU CG C 12.311 2.225 -1.644 1.00 . A A . 4 LEU CG 1 1 9 2564 1 1 4 LEU H H 11.926 0.730 0.353 1.00 . A A . 4 LEU H 1 1 9 2565 1 1 4 LEU HA H 9.869 2.725 0.053 1.00 . A A . 4 LEU HA 1 1 9 2566 1 1 4 LEU HB2 H 10.709 0.950 -2.181 1.00 . A A . 4 LEU HB2 1 1 9 2567 1 1 4 LEU HB3 H 10.318 2.658 -2.205 1.00 . A A . 4 LEU HB3 1 1 9 2568 1 1 4 LEU HD11 H 12.739 1.725 -3.678 1.00 . A A . 4 LEU HD11 1 1 9 2569 1 1 4 LEU HD12 H 12.741 0.347 -2.571 1.00 . A A . 4 LEU HD12 1 1 9 2570 1 1 4 LEU HD13 H 14.094 1.490 -2.569 1.00 . A A . 4 LEU HD13 1 1 9 2571 1 1 4 LEU HD21 H 11.977 4.270 -1.137 1.00 . A A . 4 LEU HD21 1 1 9 2572 1 1 4 LEU HD22 H 12.131 3.968 -2.868 1.00 . A A . 4 LEU HD22 1 1 9 2573 1 1 4 LEU HD23 H 13.562 3.947 -1.838 1.00 . A A . 4 LEU HD23 1 1 9 2574 1 1 4 LEU HG H 12.718 1.982 -0.673 1.00 . A A . 4 LEU HG 1 1 9 2575 1 1 4 LEU N N 11.132 1.207 0.675 1.00 . A A . 4 LEU N 1 1 9 2576 1 1 4 LEU O O 7.857 1.202 -0.245 1.00 . A A . 4 LEU O 1 1 9 2577 1 1 5 PHE C C 7.331 -1.687 -0.135 1.00 . A A . 5 PHE C 1 1 9 2578 1 1 5 PHE CA C 8.379 -1.408 -1.206 1.00 . A A . 5 PHE CA 1 1 9 2579 1 1 5 PHE CB C 9.120 -2.685 -1.593 1.00 . A A . 5 PHE CB 1 1 9 2580 1 1 5 PHE CD1 C 8.014 -3.292 -3.763 1.00 . A A . 5 PHE CD1 1 1 9 2581 1 1 5 PHE CD2 C 7.858 -4.826 -1.943 1.00 . A A . 5 PHE CD2 1 1 9 2582 1 1 5 PHE CE1 C 7.276 -4.152 -4.554 1.00 . A A . 5 PHE CE1 1 1 9 2583 1 1 5 PHE CE2 C 7.121 -5.688 -2.731 1.00 . A A . 5 PHE CE2 1 1 9 2584 1 1 5 PHE CG C 8.313 -3.619 -2.449 1.00 . A A . 5 PHE CG 1 1 9 2585 1 1 5 PHE CZ C 6.829 -5.351 -4.037 1.00 . A A . 5 PHE CZ 1 1 9 2586 1 1 5 PHE H H 10.286 -0.676 -0.718 1.00 . A A . 5 PHE H 1 1 9 2587 1 1 5 PHE HA H 7.882 -1.021 -2.081 1.00 . A A . 5 PHE HA 1 1 9 2588 1 1 5 PHE HB2 H 10.022 -2.416 -2.136 1.00 . A A . 5 PHE HB2 1 1 9 2589 1 1 5 PHE HB3 H 9.393 -3.216 -0.692 1.00 . A A . 5 PHE HB3 1 1 9 2590 1 1 5 PHE HD1 H 8.363 -2.354 -4.167 1.00 . A A . 5 PHE HD1 1 1 9 2591 1 1 5 PHE HD2 H 8.086 -5.092 -0.922 1.00 . A A . 5 PHE HD2 1 1 9 2592 1 1 5 PHE HE1 H 7.051 -3.885 -5.576 1.00 . A A . 5 PHE HE1 1 1 9 2593 1 1 5 PHE HE2 H 6.770 -6.625 -2.323 1.00 . A A . 5 PHE HE2 1 1 9 2594 1 1 5 PHE HZ H 6.252 -6.024 -4.655 1.00 . A A . 5 PHE HZ 1 1 9 2595 1 1 5 PHE N N 9.342 -0.416 -0.771 1.00 . A A . 5 PHE N 1 1 9 2596 1 1 5 PHE O O 6.140 -1.680 -0.423 1.00 . A A . 5 PHE O 1 1 9 2597 1 1 6 ASN C C 5.883 -1.013 2.382 1.00 . A A . 6 ASN C 1 1 9 2598 1 1 6 ASN CA C 6.855 -2.163 2.215 1.00 . A A . 6 ASN CA 1 1 9 2599 1 1 6 ASN CB C 7.617 -2.349 3.525 1.00 . A A . 6 ASN CB 1 1 9 2600 1 1 6 ASN CG C 8.445 -3.618 3.559 1.00 . A A . 6 ASN CG 1 1 9 2601 1 1 6 ASN H H 8.741 -1.880 1.276 1.00 . A A . 6 ASN H 1 1 9 2602 1 1 6 ASN HA H 6.302 -3.064 1.993 1.00 . A A . 6 ASN HA 1 1 9 2603 1 1 6 ASN HB2 H 8.273 -1.505 3.669 1.00 . A A . 6 ASN HB2 1 1 9 2604 1 1 6 ASN HB3 H 6.905 -2.382 4.337 1.00 . A A . 6 ASN HB3 1 1 9 2605 1 1 6 ASN HD21 H 8.390 -3.629 5.547 1.00 . A A . 6 ASN HD21 1 1 9 2606 1 1 6 ASN HD22 H 9.266 -4.928 4.810 1.00 . A A . 6 ASN HD22 1 1 9 2607 1 1 6 ASN N N 7.772 -1.901 1.102 1.00 . A A . 6 ASN N 1 1 9 2608 1 1 6 ASN ND2 N 8.728 -4.110 4.758 1.00 . A A . 6 ASN ND2 1 1 9 2609 1 1 6 ASN O O 4.690 -1.211 2.623 1.00 . A A . 6 ASN O 1 1 9 2610 1 1 6 ASN OD1 O 8.843 -4.147 2.523 1.00 . A A . 6 ASN OD1 1 1 9 2611 1 1 7 ARG C C 4.607 1.458 1.209 1.00 . A A . 7 ARG C 1 1 9 2612 1 1 7 ARG CA C 5.608 1.391 2.361 1.00 . A A . 7 ARG CA 1 1 9 2613 1 1 7 ARG CB C 6.545 2.613 2.415 1.00 . A A . 7 ARG CB 1 1 9 2614 1 1 7 ARG CD C 5.954 4.105 0.490 1.00 . A A . 7 ARG CD 1 1 9 2615 1 1 7 ARG CG C 5.931 3.942 2.001 1.00 . A A . 7 ARG CG 1 1 9 2616 1 1 7 ARG CZ C 5.598 5.871 -1.199 1.00 . A A . 7 ARG CZ 1 1 9 2617 1 1 7 ARG H H 7.356 0.284 2.019 1.00 . A A . 7 ARG H 1 1 9 2618 1 1 7 ARG HA H 5.069 1.317 3.290 1.00 . A A . 7 ARG HA 1 1 9 2619 1 1 7 ARG HB2 H 6.906 2.721 3.425 1.00 . A A . 7 ARG HB2 1 1 9 2620 1 1 7 ARG HB3 H 7.390 2.422 1.768 1.00 . A A . 7 ARG HB3 1 1 9 2621 1 1 7 ARG HD2 H 6.935 3.835 0.130 1.00 . A A . 7 ARG HD2 1 1 9 2622 1 1 7 ARG HD3 H 5.220 3.434 0.066 1.00 . A A . 7 ARG HD3 1 1 9 2623 1 1 7 ARG HE H 5.476 6.132 0.782 1.00 . A A . 7 ARG HE 1 1 9 2624 1 1 7 ARG HG2 H 4.907 3.978 2.341 1.00 . A A . 7 ARG HG2 1 1 9 2625 1 1 7 ARG HG3 H 6.493 4.747 2.451 1.00 . A A . 7 ARG HG3 1 1 9 2626 1 1 7 ARG HH11 H 6.039 4.057 -1.982 1.00 . A A . 7 ARG HH11 1 1 9 2627 1 1 7 ARG HH12 H 5.784 5.319 -3.144 1.00 . A A . 7 ARG HH12 1 1 9 2628 1 1 7 ARG HH21 H 5.150 7.792 -0.741 1.00 . A A . 7 ARG HH21 1 1 9 2629 1 1 7 ARG HH22 H 5.289 7.446 -2.437 1.00 . A A . 7 ARG HH22 1 1 9 2630 1 1 7 ARG N N 6.405 0.196 2.236 1.00 . A A . 7 ARG N 1 1 9 2631 1 1 7 ARG NE N 5.648 5.471 0.071 1.00 . A A . 7 ARG NE 1 1 9 2632 1 1 7 ARG NH1 N 5.826 5.012 -2.186 1.00 . A A . 7 ARG NH1 1 1 9 2633 1 1 7 ARG NH2 N 5.322 7.136 -1.481 1.00 . A A . 7 ARG NH2 1 1 9 2634 1 1 7 ARG O O 3.471 1.909 1.374 1.00 . A A . 7 ARG O 1 1 9 2635 1 1 8 ILE C C 3.039 -0.071 -0.896 1.00 . A A . 8 ILE C 1 1 9 2636 1 1 8 ILE CA C 4.182 0.908 -1.128 1.00 . A A . 8 ILE CA 1 1 9 2637 1 1 8 ILE CB C 4.967 0.475 -2.386 1.00 . A A . 8 ILE CB 1 1 9 2638 1 1 8 ILE CD1 C 6.922 1.104 -3.893 1.00 . A A . 8 ILE CD1 1 1 9 2639 1 1 8 ILE CG1 C 6.062 1.493 -2.710 1.00 . A A . 8 ILE CG1 1 1 9 2640 1 1 8 ILE CG2 C 4.025 0.308 -3.571 1.00 . A A . 8 ILE CG2 1 1 9 2641 1 1 8 ILE H H 5.968 0.665 -0.021 1.00 . A A . 8 ILE H 1 1 9 2642 1 1 8 ILE HA H 3.771 1.891 -1.304 1.00 . A A . 8 ILE HA 1 1 9 2643 1 1 8 ILE HB H 5.424 -0.482 -2.185 1.00 . A A . 8 ILE HB 1 1 9 2644 1 1 8 ILE HD11 H 7.389 0.151 -3.700 1.00 . A A . 8 ILE HD11 1 1 9 2645 1 1 8 ILE HD12 H 7.684 1.854 -4.046 1.00 . A A . 8 ILE HD12 1 1 9 2646 1 1 8 ILE HD13 H 6.305 1.030 -4.776 1.00 . A A . 8 ILE HD13 1 1 9 2647 1 1 8 ILE HG12 H 5.606 2.445 -2.932 1.00 . A A . 8 ILE HG12 1 1 9 2648 1 1 8 ILE HG13 H 6.709 1.601 -1.851 1.00 . A A . 8 ILE HG13 1 1 9 2649 1 1 8 ILE HG21 H 4.585 -0.022 -4.434 1.00 . A A . 8 ILE HG21 1 1 9 2650 1 1 8 ILE HG22 H 3.551 1.253 -3.790 1.00 . A A . 8 ILE HG22 1 1 9 2651 1 1 8 ILE HG23 H 3.268 -0.425 -3.329 1.00 . A A . 8 ILE HG23 1 1 9 2652 1 1 8 ILE N N 5.039 0.980 0.047 1.00 . A A . 8 ILE N 1 1 9 2653 1 1 8 ILE O O 1.899 0.208 -1.261 1.00 . A A . 8 ILE O 1 1 9 2654 1 1 9 ILE C C 1.184 -1.640 0.761 1.00 . A A . 9 ILE C 1 1 9 2655 1 1 9 ILE CA C 2.345 -2.233 -0.015 1.00 . A A . 9 ILE CA 1 1 9 2656 1 1 9 ILE CB C 2.910 -3.428 0.795 1.00 . A A . 9 ILE CB 1 1 9 2657 1 1 9 ILE CD1 C 4.253 -4.290 -1.194 1.00 . A A . 9 ILE CD1 1 1 9 2658 1 1 9 ILE CG1 C 4.267 -3.883 0.257 1.00 . A A . 9 ILE CG1 1 1 9 2659 1 1 9 ILE CG2 C 1.923 -4.589 0.788 1.00 . A A . 9 ILE CG2 1 1 9 2660 1 1 9 ILE H H 4.270 -1.353 0.033 1.00 . A A . 9 ILE H 1 1 9 2661 1 1 9 ILE HA H 1.984 -2.595 -0.963 1.00 . A A . 9 ILE HA 1 1 9 2662 1 1 9 ILE HB H 3.032 -3.108 1.814 1.00 . A A . 9 ILE HB 1 1 9 2663 1 1 9 ILE HD11 H 5.261 -4.530 -1.504 1.00 . A A . 9 ILE HD11 1 1 9 2664 1 1 9 ILE HD12 H 3.877 -3.473 -1.789 1.00 . A A . 9 ILE HD12 1 1 9 2665 1 1 9 ILE HD13 H 3.620 -5.154 -1.319 1.00 . A A . 9 ILE HD13 1 1 9 2666 1 1 9 ILE HG12 H 4.975 -3.076 0.363 1.00 . A A . 9 ILE HG12 1 1 9 2667 1 1 9 ILE HG13 H 4.607 -4.729 0.834 1.00 . A A . 9 ILE HG13 1 1 9 2668 1 1 9 ILE HG21 H 1.762 -4.919 -0.227 1.00 . A A . 9 ILE HG21 1 1 9 2669 1 1 9 ILE HG22 H 0.985 -4.266 1.213 1.00 . A A . 9 ILE HG22 1 1 9 2670 1 1 9 ILE HG23 H 2.321 -5.403 1.373 1.00 . A A . 9 ILE HG23 1 1 9 2671 1 1 9 ILE N N 3.346 -1.205 -0.269 1.00 . A A . 9 ILE N 1 1 9 2672 1 1 9 ILE O O 0.023 -1.861 0.435 1.00 . A A . 9 ILE O 1 1 9 2673 1 1 10 ARG C C -0.225 0.863 1.870 1.00 . A A . 10 ARG C 1 1 9 2674 1 1 10 ARG CA C 0.506 -0.244 2.616 1.00 . A A . 10 ARG CA 1 1 9 2675 1 1 10 ARG CB C 1.136 0.319 3.890 1.00 . A A . 10 ARG CB 1 1 9 2676 1 1 10 ARG CD C 1.564 -2.041 4.633 1.00 . A A . 10 ARG CD 1 1 9 2677 1 1 10 ARG CG C 2.116 -0.630 4.558 1.00 . A A . 10 ARG CG 1 1 9 2678 1 1 10 ARG CZ C 1.730 -3.725 6.433 1.00 . A A . 10 ARG CZ 1 1 9 2679 1 1 10 ARG H H 2.461 -0.733 1.997 1.00 . A A . 10 ARG H 1 1 9 2680 1 1 10 ARG HA H -0.203 -1.008 2.881 1.00 . A A . 10 ARG HA 1 1 9 2681 1 1 10 ARG HB2 H 1.660 1.231 3.647 1.00 . A A . 10 ARG HB2 1 1 9 2682 1 1 10 ARG HB3 H 0.349 0.544 4.594 1.00 . A A . 10 ARG HB3 1 1 9 2683 1 1 10 ARG HD2 H 0.531 -1.992 4.919 1.00 . A A . 10 ARG HD2 1 1 9 2684 1 1 10 ARG HD3 H 1.643 -2.490 3.651 1.00 . A A . 10 ARG HD3 1 1 9 2685 1 1 10 ARG HE H 3.279 -2.777 5.596 1.00 . A A . 10 ARG HE 1 1 9 2686 1 1 10 ARG HG2 H 3.027 -0.645 3.983 1.00 . A A . 10 ARG HG2 1 1 9 2687 1 1 10 ARG HG3 H 2.322 -0.277 5.557 1.00 . A A . 10 ARG HG3 1 1 9 2688 1 1 10 ARG HH11 H -0.168 -3.316 5.846 1.00 . A A . 10 ARG HH11 1 1 9 2689 1 1 10 ARG HH12 H -0.022 -4.508 7.097 1.00 . A A . 10 ARG HH12 1 1 9 2690 1 1 10 ARG HH21 H 3.480 -4.337 7.255 1.00 . A A . 10 ARG HH21 1 1 9 2691 1 1 10 ARG HH22 H 2.053 -5.091 7.895 1.00 . A A . 10 ARG HH22 1 1 9 2692 1 1 10 ARG N N 1.515 -0.865 1.782 1.00 . A A . 10 ARG N 1 1 9 2693 1 1 10 ARG NE N 2.300 -2.867 5.588 1.00 . A A . 10 ARG NE 1 1 9 2694 1 1 10 ARG NH1 N 0.408 -3.859 6.458 1.00 . A A . 10 ARG NH1 1 1 9 2695 1 1 10 ARG NH2 N 2.482 -4.441 7.259 1.00 . A A . 10 ARG NH2 1 1 9 2696 1 1 10 ARG O O -1.415 1.080 2.085 1.00 . A A . 10 ARG O 1 1 9 2697 1 1 11 LYS C C -1.094 2.077 -0.797 1.00 . A A . 11 LYS C 1 1 9 2698 1 1 11 LYS CA C -0.117 2.641 0.226 1.00 . A A . 11 LYS CA 1 1 9 2699 1 1 11 LYS CB C 0.967 3.483 -0.462 1.00 . A A . 11 LYS CB 1 1 9 2700 1 1 11 LYS CD C 1.553 5.673 -1.576 1.00 . A A . 11 LYS CD 1 1 9 2701 1 1 11 LYS CE C 2.331 5.079 -2.739 1.00 . A A . 11 LYS CE 1 1 9 2702 1 1 11 LYS CG C 0.431 4.758 -1.100 1.00 . A A . 11 LYS CG 1 1 9 2703 1 1 11 LYS H H 1.414 1.291 0.808 1.00 . A A . 11 LYS H 1 1 9 2704 1 1 11 LYS HA H -0.661 3.264 0.921 1.00 . A A . 11 LYS HA 1 1 9 2705 1 1 11 LYS HB2 H 1.715 3.757 0.269 1.00 . A A . 11 LYS HB2 1 1 9 2706 1 1 11 LYS HB3 H 1.432 2.888 -1.233 1.00 . A A . 11 LYS HB3 1 1 9 2707 1 1 11 LYS HD2 H 1.124 6.612 -1.891 1.00 . A A . 11 LYS HD2 1 1 9 2708 1 1 11 LYS HD3 H 2.232 5.848 -0.753 1.00 . A A . 11 LYS HD3 1 1 9 2709 1 1 11 LYS HE2 H 3.173 5.718 -2.954 1.00 . A A . 11 LYS HE2 1 1 9 2710 1 1 11 LYS HE3 H 2.688 4.100 -2.454 1.00 . A A . 11 LYS HE3 1 1 9 2711 1 1 11 LYS HG2 H -0.183 4.493 -1.947 1.00 . A A . 11 LYS HG2 1 1 9 2712 1 1 11 LYS HG3 H -0.167 5.287 -0.372 1.00 . A A . 11 LYS HG3 1 1 9 2713 1 1 11 LYS HZ1 H 1.107 5.882 -4.227 1.00 . A A . 11 LYS HZ1 1 1 9 2714 1 1 11 LYS HZ2 H 0.711 4.294 -3.803 1.00 . A A . 11 LYS HZ2 1 1 9 2715 1 1 11 LYS HZ3 H 2.076 4.599 -4.755 1.00 . A A . 11 LYS HZ3 1 1 9 2716 1 1 11 LYS N N 0.480 1.546 0.979 1.00 . A A . 11 LYS N 1 1 9 2717 1 1 11 LYS NZ N 1.498 4.953 -3.965 1.00 . A A . 11 LYS NZ 1 1 9 2718 1 1 11 LYS O O -2.116 2.683 -1.113 1.00 . A A . 11 LYS O 1 1 9 2719 1 1 12 VAL C C -2.754 -0.537 -1.491 1.00 . A A . 12 VAL C 1 1 9 2720 1 1 12 VAL CA C -1.631 0.191 -2.226 1.00 . A A . 12 VAL CA 1 1 9 2721 1 1 12 VAL CB C -0.830 -0.824 -3.056 1.00 . A A . 12 VAL CB 1 1 9 2722 1 1 12 VAL CG1 C -1.767 -1.672 -3.901 1.00 . A A . 12 VAL CG1 1 1 9 2723 1 1 12 VAL CG2 C 0.180 -0.111 -3.942 1.00 . A A . 12 VAL CG2 1 1 9 2724 1 1 12 VAL H H 0.079 0.481 -1.026 1.00 . A A . 12 VAL H 1 1 9 2725 1 1 12 VAL HA H -2.062 0.920 -2.897 1.00 . A A . 12 VAL HA 1 1 9 2726 1 1 12 VAL HB H -0.291 -1.470 -2.372 1.00 . A A . 12 VAL HB 1 1 9 2727 1 1 12 VAL HG11 H -2.230 -1.051 -4.654 1.00 . A A . 12 VAL HG11 1 1 9 2728 1 1 12 VAL HG12 H -2.537 -2.091 -3.266 1.00 . A A . 12 VAL HG12 1 1 9 2729 1 1 12 VAL HG13 H -1.213 -2.467 -4.376 1.00 . A A . 12 VAL HG13 1 1 9 2730 1 1 12 VAL HG21 H 0.861 0.457 -3.326 1.00 . A A . 12 VAL HG21 1 1 9 2731 1 1 12 VAL HG22 H -0.338 0.555 -4.615 1.00 . A A . 12 VAL HG22 1 1 9 2732 1 1 12 VAL HG23 H 0.735 -0.840 -4.512 1.00 . A A . 12 VAL HG23 1 1 9 2733 1 1 12 VAL N N -0.774 0.893 -1.290 1.00 . A A . 12 VAL N 1 1 9 2734 1 1 12 VAL O O -3.853 -0.690 -2.014 1.00 . A A . 12 VAL O 1 1 9 2735 1 1 13 VAL C C -4.625 -0.788 0.835 1.00 . A A . 13 VAL C 1 1 9 2736 1 1 13 VAL CA C -3.456 -1.699 0.514 1.00 . A A . 13 VAL CA 1 1 9 2737 1 1 13 VAL CB C -2.809 -2.258 1.802 1.00 . A A . 13 VAL CB 1 1 9 2738 1 1 13 VAL CG1 C -3.215 -1.480 3.045 1.00 . A A . 13 VAL CG1 1 1 9 2739 1 1 13 VAL CG2 C -3.130 -3.727 1.943 1.00 . A A . 13 VAL CG2 1 1 9 2740 1 1 13 VAL H H -1.620 -0.754 0.136 1.00 . A A . 13 VAL H 1 1 9 2741 1 1 13 VAL HA H -3.806 -2.526 -0.085 1.00 . A A . 13 VAL HA 1 1 9 2742 1 1 13 VAL HB H -1.738 -2.168 1.696 1.00 . A A . 13 VAL HB 1 1 9 2743 1 1 13 VAL HG11 H -2.724 -1.902 3.909 1.00 . A A . 13 VAL HG11 1 1 9 2744 1 1 13 VAL HG12 H -4.286 -1.538 3.176 1.00 . A A . 13 VAL HG12 1 1 9 2745 1 1 13 VAL HG13 H -2.921 -0.447 2.932 1.00 . A A . 13 VAL HG13 1 1 9 2746 1 1 13 VAL HG21 H -2.689 -4.107 2.850 1.00 . A A . 13 VAL HG21 1 1 9 2747 1 1 13 VAL HG22 H -2.725 -4.253 1.094 1.00 . A A . 13 VAL HG22 1 1 9 2748 1 1 13 VAL HG23 H -4.200 -3.860 1.975 1.00 . A A . 13 VAL HG23 1 1 9 2749 1 1 13 VAL N N -2.485 -0.958 -0.265 1.00 . A A . 13 VAL N 1 1 9 2750 1 1 13 VAL O O -5.741 -1.228 1.100 1.00 . A A . 13 VAL O 1 1 9 2751 1 1 14 LYS C C -6.322 1.529 -0.222 1.00 . A A . 14 LYS C 1 1 9 2752 1 1 14 LYS CA C -5.319 1.532 0.930 1.00 . A A . 14 LYS CA 1 1 9 2753 1 1 14 LYS CB C -4.600 2.872 1.018 1.00 . A A . 14 LYS CB 1 1 9 2754 1 1 14 LYS CD C -4.852 3.065 3.527 1.00 . A A . 14 LYS CD 1 1 9 2755 1 1 14 LYS CE C -5.885 4.178 3.463 1.00 . A A . 14 LYS CE 1 1 9 2756 1 1 14 LYS CG C -3.892 3.113 2.347 1.00 . A A . 14 LYS CG 1 1 9 2757 1 1 14 LYS H H -3.403 0.756 0.612 1.00 . A A . 14 LYS H 1 1 9 2758 1 1 14 LYS HA H -5.847 1.351 1.852 1.00 . A A . 14 LYS HA 1 1 9 2759 1 1 14 LYS HB2 H -3.845 2.891 0.240 1.00 . A A . 14 LYS HB2 1 1 9 2760 1 1 14 LYS HB3 H -5.307 3.670 0.851 1.00 . A A . 14 LYS HB3 1 1 9 2761 1 1 14 LYS HD2 H -5.362 2.115 3.523 1.00 . A A . 14 LYS HD2 1 1 9 2762 1 1 14 LYS HD3 H -4.285 3.165 4.440 1.00 . A A . 14 LYS HD3 1 1 9 2763 1 1 14 LYS HE2 H -6.390 4.126 2.512 1.00 . A A . 14 LYS HE2 1 1 9 2764 1 1 14 LYS HE3 H -6.601 4.034 4.258 1.00 . A A . 14 LYS HE3 1 1 9 2765 1 1 14 LYS HG2 H -3.141 2.353 2.483 1.00 . A A . 14 LYS HG2 1 1 9 2766 1 1 14 LYS HG3 H -3.420 4.083 2.319 1.00 . A A . 14 LYS HG3 1 1 9 2767 1 1 14 LYS HZ1 H -5.996 6.263 3.559 1.00 . A A . 14 LYS HZ1 1 1 9 2768 1 1 14 LYS HZ2 H -4.576 5.687 2.847 1.00 . A A . 14 LYS HZ2 1 1 9 2769 1 1 14 LYS HZ3 H -4.774 5.597 4.521 1.00 . A A . 14 LYS HZ3 1 1 9 2770 1 1 14 LYS N N -4.334 0.496 0.769 1.00 . A A . 14 LYS N 1 1 9 2771 1 1 14 LYS NZ N -5.265 5.523 3.608 1.00 . A A . 14 LYS NZ 1 1 9 2772 1 1 14 LYS O O -7.492 1.849 -0.021 1.00 . A A . 14 LYS O 1 1 9 2773 1 1 15 LEU C C -7.307 -0.348 -2.673 1.00 . A A . 15 LEU C 1 1 9 2774 1 1 15 LEU CA C -6.783 1.079 -2.559 1.00 . A A . 15 LEU CA 1 1 9 2775 1 1 15 LEU CB C -6.085 1.535 -3.850 1.00 . A A . 15 LEU CB 1 1 9 2776 1 1 15 LEU CD1 C -5.409 -0.503 -5.191 1.00 . A A . 15 LEU CD1 1 1 9 2777 1 1 15 LEU CD2 C -3.941 1.518 -5.148 1.00 . A A . 15 LEU CD2 1 1 9 2778 1 1 15 LEU CG C -4.918 0.671 -4.351 1.00 . A A . 15 LEU CG 1 1 9 2779 1 1 15 LEU H H -4.915 0.991 -1.567 1.00 . A A . 15 LEU H 1 1 9 2780 1 1 15 LEU HA H -7.620 1.735 -2.365 1.00 . A A . 15 LEU HA 1 1 9 2781 1 1 15 LEU HB2 H -6.824 1.589 -4.633 1.00 . A A . 15 LEU HB2 1 1 9 2782 1 1 15 LEU HB3 H -5.702 2.528 -3.673 1.00 . A A . 15 LEU HB3 1 1 9 2783 1 1 15 LEU HD11 H -5.921 -0.130 -6.065 1.00 . A A . 15 LEU HD11 1 1 9 2784 1 1 15 LEU HD12 H -6.089 -1.104 -4.604 1.00 . A A . 15 LEU HD12 1 1 9 2785 1 1 15 LEU HD13 H -4.567 -1.105 -5.496 1.00 . A A . 15 LEU HD13 1 1 9 2786 1 1 15 LEU HD21 H -4.454 1.965 -5.987 1.00 . A A . 15 LEU HD21 1 1 9 2787 1 1 15 LEU HD22 H -3.136 0.897 -5.509 1.00 . A A . 15 LEU HD22 1 1 9 2788 1 1 15 LEU HD23 H -3.539 2.297 -4.516 1.00 . A A . 15 LEU HD23 1 1 9 2789 1 1 15 LEU HG H -4.388 0.268 -3.499 1.00 . A A . 15 LEU HG 1 1 9 2790 1 1 15 LEU N N -5.874 1.184 -1.429 1.00 . A A . 15 LEU N 1 1 9 2791 1 1 15 LEU O O -8.313 -0.609 -3.331 1.00 . A A . 15 LEU O 1 1 9 2792 1 1 16 PHE C C -8.141 -2.927 -1.100 1.00 . A A . 16 PHE C 1 1 9 2793 1 1 16 PHE CA C -6.965 -2.673 -2.034 1.00 . A A . 16 PHE CA 1 1 9 2794 1 1 16 PHE CB C -5.758 -3.512 -1.604 1.00 . A A . 16 PHE CB 1 1 9 2795 1 1 16 PHE CD1 C -6.301 -5.874 -0.951 1.00 . A A . 16 PHE CD1 1 1 9 2796 1 1 16 PHE CD2 C -5.555 -5.453 -3.175 1.00 . A A . 16 PHE CD2 1 1 9 2797 1 1 16 PHE CE1 C -6.399 -7.223 -1.236 1.00 . A A . 16 PHE CE1 1 1 9 2798 1 1 16 PHE CE2 C -5.653 -6.798 -3.467 1.00 . A A . 16 PHE CE2 1 1 9 2799 1 1 16 PHE CG C -5.877 -4.975 -1.916 1.00 . A A . 16 PHE CG 1 1 9 2800 1 1 16 PHE CZ C -6.077 -7.684 -2.496 1.00 . A A . 16 PHE CZ 1 1 9 2801 1 1 16 PHE H H -5.813 -0.982 -1.516 1.00 . A A . 16 PHE H 1 1 9 2802 1 1 16 PHE HA H -7.246 -2.940 -3.040 1.00 . A A . 16 PHE HA 1 1 9 2803 1 1 16 PHE HB2 H -4.878 -3.138 -2.101 1.00 . A A . 16 PHE HB2 1 1 9 2804 1 1 16 PHE HB3 H -5.628 -3.411 -0.537 1.00 . A A . 16 PHE HB3 1 1 9 2805 1 1 16 PHE HD1 H -6.555 -5.513 0.035 1.00 . A A . 16 PHE HD1 1 1 9 2806 1 1 16 PHE HD2 H -5.224 -4.761 -3.934 1.00 . A A . 16 PHE HD2 1 1 9 2807 1 1 16 PHE HE1 H -6.730 -7.913 -0.475 1.00 . A A . 16 PHE HE1 1 1 9 2808 1 1 16 PHE HE2 H -5.400 -7.157 -4.452 1.00 . A A . 16 PHE HE2 1 1 9 2809 1 1 16 PHE HZ H -6.153 -8.738 -2.723 1.00 . A A . 16 PHE HZ 1 1 9 2810 1 1 16 PHE N N -6.607 -1.264 -2.018 1.00 . A A . 16 PHE N 1 1 9 2811 1 1 16 PHE O O -9.091 -3.622 -1.455 1.00 . A A . 16 PHE O 1 1 9 2812 1 1 17 ASN C C -10.266 -1.533 0.817 1.00 . A A . 17 ASN C 1 1 9 2813 1 1 17 ASN CA C -9.121 -2.503 1.092 1.00 . A A . 17 ASN CA 1 1 9 2814 1 1 17 ASN CB C -8.561 -2.264 2.502 1.00 . A A . 17 ASN CB 1 1 9 2815 1 1 17 ASN CG C -7.728 -3.422 3.033 1.00 . A A . 17 ASN CG 1 1 9 2816 1 1 17 ASN H H -7.285 -1.794 0.308 1.00 . A A . 17 ASN H 1 1 9 2817 1 1 17 ASN HA H -9.497 -3.514 1.029 1.00 . A A . 17 ASN HA 1 1 9 2818 1 1 17 ASN HB2 H -7.938 -1.383 2.484 1.00 . A A . 17 ASN HB2 1 1 9 2819 1 1 17 ASN HB3 H -9.384 -2.099 3.181 1.00 . A A . 17 ASN HB3 1 1 9 2820 1 1 17 ASN HD21 H -7.289 -4.009 1.188 1.00 . A A . 17 ASN HD21 1 1 9 2821 1 1 17 ASN HD22 H -6.608 -4.962 2.462 1.00 . A A . 17 ASN HD22 1 1 9 2822 1 1 17 ASN N N -8.069 -2.350 0.092 1.00 . A A . 17 ASN N 1 1 9 2823 1 1 17 ASN ND2 N -7.151 -4.210 2.138 1.00 . A A . 17 ASN ND2 1 1 9 2824 1 1 17 ASN O O -11.238 -1.926 0.134 1.00 . A A . 17 ASN O 1 1 9 2825 1 1 17 ASN OXT O -10.191 -0.375 1.274 1.00 . A A . 17 ASN OXT 1 1 9 2826 1 1 17 ASN OD1 O -7.610 -3.609 4.244 1.00 . A A . 17 ASN OD1 1 1 10 2827 1 1 1 LEU C C 14.898 -1.506 0.353 1.00 . A A . 1 LEU C 1 1 10 2828 1 1 1 LEU CA C 16.357 -1.280 0.727 1.00 . A A . 1 LEU CA 1 1 10 2829 1 1 1 LEU CB C 17.076 -2.628 0.839 1.00 . A A . 1 LEU CB 1 1 10 2830 1 1 1 LEU CD1 C 18.005 -2.730 -1.488 1.00 . A A . 1 LEU CD1 1 1 10 2831 1 1 1 LEU CD2 C 17.679 -4.836 -0.188 1.00 . A A . 1 LEU CD2 1 1 10 2832 1 1 1 LEU CG C 17.144 -3.440 -0.457 1.00 . A A . 1 LEU CG 1 1 10 2833 1 1 1 LEU H1 H 16.064 -1.085 2.782 1.00 . A A . 1 LEU H1 1 1 10 2834 1 1 1 LEU H2 H 15.940 0.366 1.932 1.00 . A A . 1 LEU H2 1 1 10 2835 1 1 1 LEU H3 H 17.458 -0.319 2.210 1.00 . A A . 1 LEU H3 1 1 10 2836 1 1 1 LEU HA H 16.825 -0.695 -0.051 1.00 . A A . 1 LEU HA 1 1 10 2837 1 1 1 LEU HB2 H 18.086 -2.446 1.178 1.00 . A A . 1 LEU HB2 1 1 10 2838 1 1 1 LEU HB3 H 16.568 -3.222 1.583 1.00 . A A . 1 LEU HB3 1 1 10 2839 1 1 1 LEU HD11 H 17.546 -1.791 -1.756 1.00 . A A . 1 LEU HD11 1 1 10 2840 1 1 1 LEU HD12 H 18.098 -3.351 -2.367 1.00 . A A . 1 LEU HD12 1 1 10 2841 1 1 1 LEU HD13 H 18.984 -2.547 -1.073 1.00 . A A . 1 LEU HD13 1 1 10 2842 1 1 1 LEU HD21 H 17.023 -5.348 0.499 1.00 . A A . 1 LEU HD21 1 1 10 2843 1 1 1 LEU HD22 H 18.667 -4.766 0.241 1.00 . A A . 1 LEU HD22 1 1 10 2844 1 1 1 LEU HD23 H 17.729 -5.387 -1.116 1.00 . A A . 1 LEU HD23 1 1 10 2845 1 1 1 LEU HG H 16.147 -3.535 -0.865 1.00 . A A . 1 LEU HG 1 1 10 2846 1 1 1 LEU N N 16.463 -0.530 2.000 1.00 . A A . 1 LEU N 1 1 10 2847 1 1 1 LEU O O 14.417 -0.975 -0.645 1.00 . A A . 1 LEU O 1 1 10 2848 1 1 2 MET C C 11.852 -1.656 1.570 1.00 . A A . 2 MET C 1 1 10 2849 1 1 2 MET CA C 12.806 -2.620 0.879 1.00 . A A . 2 MET CA 1 1 10 2850 1 1 2 MET CB C 12.503 -4.057 1.311 1.00 . A A . 2 MET CB 1 1 10 2851 1 1 2 MET CE C 13.941 -7.716 -0.082 1.00 . A A . 2 MET CE 1 1 10 2852 1 1 2 MET CG C 13.269 -5.103 0.518 1.00 . A A . 2 MET CG 1 1 10 2853 1 1 2 MET H H 14.615 -2.637 1.977 1.00 . A A . 2 MET H 1 1 10 2854 1 1 2 MET HA H 12.662 -2.541 -0.188 1.00 . A A . 2 MET HA 1 1 10 2855 1 1 2 MET HB2 H 12.760 -4.169 2.354 1.00 . A A . 2 MET HB2 1 1 10 2856 1 1 2 MET HB3 H 11.447 -4.245 1.186 1.00 . A A . 2 MET HB3 1 1 10 2857 1 1 2 MET HE1 H 13.601 -7.526 -1.089 1.00 . A A . 2 MET HE1 1 1 10 2858 1 1 2 MET HE2 H 13.854 -8.771 0.134 1.00 . A A . 2 MET HE2 1 1 10 2859 1 1 2 MET HE3 H 14.972 -7.413 0.014 1.00 . A A . 2 MET HE3 1 1 10 2860 1 1 2 MET HG2 H 12.991 -5.022 -0.522 1.00 . A A . 2 MET HG2 1 1 10 2861 1 1 2 MET HG3 H 14.326 -4.907 0.622 1.00 . A A . 2 MET HG3 1 1 10 2862 1 1 2 MET N N 14.194 -2.282 1.164 1.00 . A A . 2 MET N 1 1 10 2863 1 1 2 MET O O 10.637 -1.830 1.506 1.00 . A A . 2 MET O 1 1 10 2864 1 1 2 MET SD S 12.937 -6.784 1.073 1.00 . A A . 2 MET SD 1 1 10 2865 1 1 3 GLY C C 10.619 1.049 1.996 1.00 . A A . 3 GLY C 1 1 10 2866 1 1 3 GLY CA C 11.593 0.342 2.915 1.00 . A A . 3 GLY CA 1 1 10 2867 1 1 3 GLY H H 13.382 -0.527 2.194 1.00 . A A . 3 GLY H 1 1 10 2868 1 1 3 GLY HA2 H 11.039 -0.163 3.691 1.00 . A A . 3 GLY HA2 1 1 10 2869 1 1 3 GLY HA3 H 12.242 1.077 3.369 1.00 . A A . 3 GLY HA3 1 1 10 2870 1 1 3 GLY N N 12.408 -0.630 2.208 1.00 . A A . 3 GLY N 1 1 10 2871 1 1 3 GLY O O 9.512 1.402 2.406 1.00 . A A . 3 GLY O 1 1 10 2872 1 1 4 LEU C C 8.990 0.934 -0.506 1.00 . A A . 4 LEU C 1 1 10 2873 1 1 4 LEU CA C 10.171 1.846 -0.261 1.00 . A A . 4 LEU CA 1 1 10 2874 1 1 4 LEU CB C 10.902 1.993 -1.592 1.00 . A A . 4 LEU CB 1 1 10 2875 1 1 4 LEU CD1 C 13.159 1.568 -2.502 1.00 . A A . 4 LEU CD1 1 1 10 2876 1 1 4 LEU CD2 C 12.511 3.880 -1.785 1.00 . A A . 4 LEU CD2 1 1 10 2877 1 1 4 LEU CG C 12.359 2.394 -1.509 1.00 . A A . 4 LEU CG 1 1 10 2878 1 1 4 LEU H H 11.950 0.994 0.512 1.00 . A A . 4 LEU H 1 1 10 2879 1 1 4 LEU HA H 9.841 2.811 0.083 1.00 . A A . 4 LEU HA 1 1 10 2880 1 1 4 LEU HB2 H 10.842 1.049 -2.111 1.00 . A A . 4 LEU HB2 1 1 10 2881 1 1 4 LEU HB3 H 10.382 2.736 -2.178 1.00 . A A . 4 LEU HB3 1 1 10 2882 1 1 4 LEU HD11 H 12.945 1.902 -3.505 1.00 . A A . 4 LEU HD11 1 1 10 2883 1 1 4 LEU HD12 H 12.875 0.522 -2.406 1.00 . A A . 4 LEU HD12 1 1 10 2884 1 1 4 LEU HD13 H 14.214 1.677 -2.300 1.00 . A A . 4 LEU HD13 1 1 10 2885 1 1 4 LEU HD21 H 11.909 4.437 -1.080 1.00 . A A . 4 LEU HD21 1 1 10 2886 1 1 4 LEU HD22 H 12.179 4.095 -2.790 1.00 . A A . 4 LEU HD22 1 1 10 2887 1 1 4 LEU HD23 H 13.546 4.164 -1.679 1.00 . A A . 4 LEU HD23 1 1 10 2888 1 1 4 LEU HG H 12.730 2.195 -0.518 1.00 . A A . 4 LEU HG 1 1 10 2889 1 1 4 LEU N N 11.035 1.249 0.752 1.00 . A A . 4 LEU N 1 1 10 2890 1 1 4 LEU O O 7.831 1.300 -0.308 1.00 . A A . 4 LEU O 1 1 10 2891 1 1 5 PHE C C 7.403 -1.649 -0.268 1.00 . A A . 5 PHE C 1 1 10 2892 1 1 5 PHE CA C 8.375 -1.262 -1.375 1.00 . A A . 5 PHE CA 1 1 10 2893 1 1 5 PHE CB C 9.133 -2.486 -1.880 1.00 . A A . 5 PHE CB 1 1 10 2894 1 1 5 PHE CD1 C 7.770 -4.541 -2.346 1.00 . A A . 5 PHE CD1 1 1 10 2895 1 1 5 PHE CD2 C 8.128 -2.993 -4.123 1.00 . A A . 5 PHE CD2 1 1 10 2896 1 1 5 PHE CE1 C 7.029 -5.343 -3.191 1.00 . A A . 5 PHE CE1 1 1 10 2897 1 1 5 PHE CE2 C 7.388 -3.792 -4.971 1.00 . A A . 5 PHE CE2 1 1 10 2898 1 1 5 PHE CG C 8.329 -3.358 -2.802 1.00 . A A . 5 PHE CG 1 1 10 2899 1 1 5 PHE CZ C 6.838 -4.967 -4.505 1.00 . A A . 5 PHE CZ 1 1 10 2900 1 1 5 PHE H H 10.278 -0.527 -0.890 1.00 . A A . 5 PHE H 1 1 10 2901 1 1 5 PHE HA H 7.821 -0.829 -2.193 1.00 . A A . 5 PHE HA 1 1 10 2902 1 1 5 PHE HB2 H 10.023 -2.155 -2.411 1.00 . A A . 5 PHE HB2 1 1 10 2903 1 1 5 PHE HB3 H 9.427 -3.087 -1.032 1.00 . A A . 5 PHE HB3 1 1 10 2904 1 1 5 PHE HD1 H 7.919 -4.836 -1.319 1.00 . A A . 5 PHE HD1 1 1 10 2905 1 1 5 PHE HD2 H 8.560 -2.072 -4.489 1.00 . A A . 5 PHE HD2 1 1 10 2906 1 1 5 PHE HE1 H 6.599 -6.263 -2.825 1.00 . A A . 5 PHE HE1 1 1 10 2907 1 1 5 PHE HE2 H 7.239 -3.496 -5.999 1.00 . A A . 5 PHE HE2 1 1 10 2908 1 1 5 PHE HZ H 6.258 -5.593 -5.167 1.00 . A A . 5 PHE HZ 1 1 10 2909 1 1 5 PHE N N 9.331 -0.281 -0.910 1.00 . A A . 5 PHE N 1 1 10 2910 1 1 5 PHE O O 6.201 -1.722 -0.497 1.00 . A A . 5 PHE O 1 1 10 2911 1 1 6 ASN C C 6.063 -1.153 2.348 1.00 . A A . 6 ASN C 1 1 10 2912 1 1 6 ASN CA C 7.086 -2.234 2.078 1.00 . A A . 6 ASN CA 1 1 10 2913 1 1 6 ASN CB C 7.922 -2.442 3.337 1.00 . A A . 6 ASN CB 1 1 10 2914 1 1 6 ASN CG C 8.834 -3.655 3.254 1.00 . A A . 6 ASN CG 1 1 10 2915 1 1 6 ASN H H 8.899 -1.802 1.057 1.00 . A A . 6 ASN H 1 1 10 2916 1 1 6 ASN HA H 6.571 -3.153 1.841 1.00 . A A . 6 ASN HA 1 1 10 2917 1 1 6 ASN HB2 H 8.528 -1.563 3.500 1.00 . A A . 6 ASN HB2 1 1 10 2918 1 1 6 ASN HB3 H 7.257 -2.570 4.177 1.00 . A A . 6 ASN HB3 1 1 10 2919 1 1 6 ASN HD21 H 7.545 -4.594 2.069 1.00 . A A . 6 ASN HD21 1 1 10 2920 1 1 6 ASN HD22 H 8.988 -5.463 2.448 1.00 . A A . 6 ASN HD22 1 1 10 2921 1 1 6 ASN N N 7.924 -1.877 0.935 1.00 . A A . 6 ASN N 1 1 10 2922 1 1 6 ASN ND2 N 8.412 -4.671 2.519 1.00 . A A . 6 ASN ND2 1 1 10 2923 1 1 6 ASN O O 4.899 -1.439 2.629 1.00 . A A . 6 ASN O 1 1 10 2924 1 1 6 ASN OD1 O 9.909 -3.679 3.854 1.00 . A A . 6 ASN OD1 1 1 10 2925 1 1 7 ARG C C 4.584 1.284 1.342 1.00 . A A . 7 ARG C 1 1 10 2926 1 1 7 ARG CA C 5.616 1.213 2.467 1.00 . A A . 7 ARG CA 1 1 10 2927 1 1 7 ARG CB C 6.444 2.502 2.606 1.00 . A A . 7 ARG CB 1 1 10 2928 1 1 7 ARG CD C 5.810 4.071 0.774 1.00 . A A . 7 ARG CD 1 1 10 2929 1 1 7 ARG CG C 5.710 3.788 2.260 1.00 . A A . 7 ARG CG 1 1 10 2930 1 1 7 ARG CZ C 5.707 6.174 -0.512 1.00 . A A . 7 ARG CZ 1 1 10 2931 1 1 7 ARG H H 7.437 0.260 2.018 1.00 . A A . 7 ARG H 1 1 10 2932 1 1 7 ARG HA H 5.103 1.030 3.394 1.00 . A A . 7 ARG HA 1 1 10 2933 1 1 7 ARG HB2 H 6.785 2.580 3.626 1.00 . A A . 7 ARG HB2 1 1 10 2934 1 1 7 ARG HB3 H 7.307 2.424 1.959 1.00 . A A . 7 ARG HB3 1 1 10 2935 1 1 7 ARG HD2 H 6.853 4.087 0.497 1.00 . A A . 7 ARG HD2 1 1 10 2936 1 1 7 ARG HD3 H 5.315 3.269 0.245 1.00 . A A . 7 ARG HD3 1 1 10 2937 1 1 7 ARG HE H 4.343 5.580 0.834 1.00 . A A . 7 ARG HE 1 1 10 2938 1 1 7 ARG HG2 H 4.670 3.686 2.533 1.00 . A A . 7 ARG HG2 1 1 10 2939 1 1 7 ARG HG3 H 6.153 4.604 2.808 1.00 . A A . 7 ARG HG3 1 1 10 2940 1 1 7 ARG HH11 H 7.396 5.091 -0.814 1.00 . A A . 7 ARG HH11 1 1 10 2941 1 1 7 ARG HH12 H 7.265 6.539 -1.760 1.00 . A A . 7 ARG HH12 1 1 10 2942 1 1 7 ARG HH21 H 4.171 7.497 -0.412 1.00 . A A . 7 ARG HH21 1 1 10 2943 1 1 7 ARG HH22 H 5.436 7.906 -1.527 1.00 . A A . 7 ARG HH22 1 1 10 2944 1 1 7 ARG N N 6.499 0.092 2.251 1.00 . A A . 7 ARG N 1 1 10 2945 1 1 7 ARG NE N 5.196 5.343 0.396 1.00 . A A . 7 ARG NE 1 1 10 2946 1 1 7 ARG NH1 N 6.884 5.913 -1.074 1.00 . A A . 7 ARG NH1 1 1 10 2947 1 1 7 ARG NH2 N 5.054 7.281 -0.843 1.00 . A A . 7 ARG NH2 1 1 10 2948 1 1 7 ARG O O 3.431 1.662 1.559 1.00 . A A . 7 ARG O 1 1 10 2949 1 1 8 ILE C C 3.003 -0.207 -0.772 1.00 . A A . 8 ILE C 1 1 10 2950 1 1 8 ILE CA C 4.104 0.826 -1.002 1.00 . A A . 8 ILE CA 1 1 10 2951 1 1 8 ILE CB C 4.866 0.486 -2.308 1.00 . A A . 8 ILE CB 1 1 10 2952 1 1 8 ILE CD1 C 5.228 2.950 -2.887 1.00 . A A . 8 ILE CD1 1 1 10 2953 1 1 8 ILE CG1 C 5.866 1.595 -2.658 1.00 . A A . 8 ILE CG1 1 1 10 2954 1 1 8 ILE CG2 C 3.899 0.259 -3.465 1.00 . A A . 8 ILE CG2 1 1 10 2955 1 1 8 ILE H H 5.938 0.617 0.031 1.00 . A A . 8 ILE H 1 1 10 2956 1 1 8 ILE HA H 3.650 1.800 -1.117 1.00 . A A . 8 ILE HA 1 1 10 2957 1 1 8 ILE HB H 5.407 -0.433 -2.145 1.00 . A A . 8 ILE HB 1 1 10 2958 1 1 8 ILE HD11 H 5.987 3.660 -3.178 1.00 . A A . 8 ILE HD11 1 1 10 2959 1 1 8 ILE HD12 H 4.754 3.284 -1.976 1.00 . A A . 8 ILE HD12 1 1 10 2960 1 1 8 ILE HD13 H 4.488 2.872 -3.670 1.00 . A A . 8 ILE HD13 1 1 10 2961 1 1 8 ILE HG12 H 6.575 1.698 -1.850 1.00 . A A . 8 ILE HG12 1 1 10 2962 1 1 8 ILE HG13 H 6.394 1.320 -3.559 1.00 . A A . 8 ILE HG13 1 1 10 2963 1 1 8 ILE HG21 H 3.204 -0.529 -3.206 1.00 . A A . 8 ILE HG21 1 1 10 2964 1 1 8 ILE HG22 H 4.453 -0.026 -4.348 1.00 . A A . 8 ILE HG22 1 1 10 2965 1 1 8 ILE HG23 H 3.351 1.169 -3.663 1.00 . A A . 8 ILE HG23 1 1 10 2966 1 1 8 ILE N N 4.999 0.883 0.145 1.00 . A A . 8 ILE N 1 1 10 2967 1 1 8 ILE O O 1.868 -0.013 -1.196 1.00 . A A . 8 ILE O 1 1 10 2968 1 1 9 ILE C C 1.186 -1.815 0.971 1.00 . A A . 9 ILE C 1 1 10 2969 1 1 9 ILE CA C 2.366 -2.353 0.179 1.00 . A A . 9 ILE CA 1 1 10 2970 1 1 9 ILE CB C 2.988 -3.540 0.955 1.00 . A A . 9 ILE CB 1 1 10 2971 1 1 9 ILE CD1 C 4.293 -4.340 -1.085 1.00 . A A . 9 ILE CD1 1 1 10 2972 1 1 9 ILE CG1 C 4.343 -3.938 0.368 1.00 . A A . 9 ILE CG1 1 1 10 2973 1 1 9 ILE CG2 C 2.042 -4.734 0.958 1.00 . A A . 9 ILE CG2 1 1 10 2974 1 1 9 ILE H H 4.223 -1.351 0.337 1.00 . A A . 9 ILE H 1 1 10 2975 1 1 9 ILE HA H 2.017 -2.708 -0.778 1.00 . A A . 9 ILE HA 1 1 10 2976 1 1 9 ILE HB H 3.130 -3.231 1.975 1.00 . A A . 9 ILE HB 1 1 10 2977 1 1 9 ILE HD11 H 5.296 -4.551 -1.433 1.00 . A A . 9 ILE HD11 1 1 10 2978 1 1 9 ILE HD12 H 3.872 -3.533 -1.664 1.00 . A A . 9 ILE HD12 1 1 10 2979 1 1 9 ILE HD13 H 3.681 -5.220 -1.193 1.00 . A A . 9 ILE HD13 1 1 10 2980 1 1 9 ILE HG12 H 5.022 -3.103 0.453 1.00 . A A . 9 ILE HG12 1 1 10 2981 1 1 9 ILE HG13 H 4.738 -4.772 0.929 1.00 . A A . 9 ILE HG13 1 1 10 2982 1 1 9 ILE HG21 H 1.841 -5.036 -0.059 1.00 . A A . 9 ILE HG21 1 1 10 2983 1 1 9 ILE HG22 H 1.117 -4.458 1.442 1.00 . A A . 9 ILE HG22 1 1 10 2984 1 1 9 ILE HG23 H 2.498 -5.553 1.493 1.00 . A A . 9 ILE HG23 1 1 10 2985 1 1 9 ILE N N 3.327 -1.282 -0.055 1.00 . A A . 9 ILE N 1 1 10 2986 1 1 9 ILE O O 0.044 -2.226 0.774 1.00 . A A . 9 ILE O 1 1 10 2987 1 1 10 ARG C C -0.238 0.863 1.956 1.00 . A A . 10 ARG C 1 1 10 2988 1 1 10 ARG CA C 0.445 -0.279 2.692 1.00 . A A . 10 ARG CA 1 1 10 2989 1 1 10 ARG CB C 1.043 0.230 4.006 1.00 . A A . 10 ARG CB 1 1 10 2990 1 1 10 ARG CD C 1.913 -1.972 4.761 1.00 . A A . 10 ARG CD 1 1 10 2991 1 1 10 ARG CG C 2.266 -0.535 4.464 1.00 . A A . 10 ARG CG 1 1 10 2992 1 1 10 ARG CZ C 3.134 -4.113 4.868 1.00 . A A . 10 ARG CZ 1 1 10 2993 1 1 10 ARG H H 2.397 -0.547 1.926 1.00 . A A . 10 ARG H 1 1 10 2994 1 1 10 ARG HA H -0.283 -1.045 2.903 1.00 . A A . 10 ARG HA 1 1 10 2995 1 1 10 ARG HB2 H 1.307 1.270 3.901 1.00 . A A . 10 ARG HB2 1 1 10 2996 1 1 10 ARG HB3 H 0.295 0.128 4.773 1.00 . A A . 10 ARG HB3 1 1 10 2997 1 1 10 ARG HD2 H 1.271 -2.000 5.627 1.00 . A A . 10 ARG HD2 1 1 10 2998 1 1 10 ARG HD3 H 1.385 -2.360 3.907 1.00 . A A . 10 ARG HD3 1 1 10 2999 1 1 10 ARG HE H 3.908 -2.324 5.319 1.00 . A A . 10 ARG HE 1 1 10 3000 1 1 10 ARG HG2 H 3.008 -0.510 3.682 1.00 . A A . 10 ARG HG2 1 1 10 3001 1 1 10 ARG HG3 H 2.660 -0.074 5.357 1.00 . A A . 10 ARG HG3 1 1 10 3002 1 1 10 ARG HH11 H 1.200 -4.286 4.288 1.00 . A A . 10 ARG HH11 1 1 10 3003 1 1 10 ARG HH12 H 2.087 -5.772 4.357 1.00 . A A . 10 ARG HH12 1 1 10 3004 1 1 10 ARG HH21 H 5.074 -4.274 5.424 1.00 . A A . 10 ARG HH21 1 1 10 3005 1 1 10 ARG HH22 H 4.292 -5.768 5.009 1.00 . A A . 10 ARG HH22 1 1 10 3006 1 1 10 ARG N N 1.472 -0.863 1.848 1.00 . A A . 10 ARG N 1 1 10 3007 1 1 10 ARG NE N 3.094 -2.791 5.017 1.00 . A A . 10 ARG NE 1 1 10 3008 1 1 10 ARG NH1 N 2.054 -4.776 4.474 1.00 . A A . 10 ARG NH1 1 1 10 3009 1 1 10 ARG NH2 N 4.256 -4.772 5.120 1.00 . A A . 10 ARG NH2 1 1 10 3010 1 1 10 ARG O O -1.406 1.170 2.195 1.00 . A A . 10 ARG O 1 1 10 3011 1 1 11 LYS C C -1.029 1.995 -0.772 1.00 . A A . 11 LYS C 1 1 10 3012 1 1 11 LYS CA C -0.027 2.559 0.228 1.00 . A A . 11 LYS CA 1 1 10 3013 1 1 11 LYS CB C 1.121 3.271 -0.495 1.00 . A A . 11 LYS CB 1 1 10 3014 1 1 11 LYS CD C 1.889 5.150 -1.969 1.00 . A A . 11 LYS CD 1 1 10 3015 1 1 11 LYS CE C 1.469 6.317 -2.848 1.00 . A A . 11 LYS CE 1 1 10 3016 1 1 11 LYS CG C 0.689 4.455 -1.345 1.00 . A A . 11 LYS CG 1 1 10 3017 1 1 11 LYS H H 1.433 1.196 0.921 1.00 . A A . 11 LYS H 1 1 10 3018 1 1 11 LYS HA H -0.531 3.259 0.878 1.00 . A A . 11 LYS HA 1 1 10 3019 1 1 11 LYS HB2 H 1.827 3.625 0.240 1.00 . A A . 11 LYS HB2 1 1 10 3020 1 1 11 LYS HB3 H 1.617 2.558 -1.139 1.00 . A A . 11 LYS HB3 1 1 10 3021 1 1 11 LYS HD2 H 2.529 5.518 -1.181 1.00 . A A . 11 LYS HD2 1 1 10 3022 1 1 11 LYS HD3 H 2.432 4.436 -2.571 1.00 . A A . 11 LYS HD3 1 1 10 3023 1 1 11 LYS HE2 H 0.852 6.985 -2.265 1.00 . A A . 11 LYS HE2 1 1 10 3024 1 1 11 LYS HE3 H 2.354 6.841 -3.177 1.00 . A A . 11 LYS HE3 1 1 10 3025 1 1 11 LYS HG2 H 0.037 4.105 -2.132 1.00 . A A . 11 LYS HG2 1 1 10 3026 1 1 11 LYS HG3 H 0.158 5.160 -0.722 1.00 . A A . 11 LYS HG3 1 1 10 3027 1 1 11 LYS HZ1 H 1.275 5.222 -4.616 1.00 . A A . 11 LYS HZ1 1 1 10 3028 1 1 11 LYS HZ2 H 0.433 6.689 -4.620 1.00 . A A . 11 LYS HZ2 1 1 10 3029 1 1 11 LYS HZ3 H -0.167 5.376 -3.743 1.00 . A A . 11 LYS HZ3 1 1 10 3030 1 1 11 LYS N N 0.501 1.479 1.047 1.00 . A A . 11 LYS N 1 1 10 3031 1 1 11 LYS NZ N 0.699 5.870 -4.039 1.00 . A A . 11 LYS NZ 1 1 10 3032 1 1 11 LYS O O -2.039 2.624 -1.094 1.00 . A A . 11 LYS O 1 1 10 3033 1 1 12 VAL C C -2.764 -0.595 -1.410 1.00 . A A . 12 VAL C 1 1 10 3034 1 1 12 VAL CA C -1.628 0.095 -2.161 1.00 . A A . 12 VAL CA 1 1 10 3035 1 1 12 VAL CB C -0.862 -0.953 -2.991 1.00 . A A . 12 VAL CB 1 1 10 3036 1 1 12 VAL CG1 C -1.825 -1.756 -3.852 1.00 . A A . 12 VAL CG1 1 1 10 3037 1 1 12 VAL CG2 C 0.188 -0.281 -3.860 1.00 . A A . 12 VAL CG2 1 1 10 3038 1 1 12 VAL H H 0.101 0.361 -0.979 1.00 . A A . 12 VAL H 1 1 10 3039 1 1 12 VAL HA H -2.047 0.824 -2.838 1.00 . A A . 12 VAL HA 1 1 10 3040 1 1 12 VAL HB H -0.360 -1.627 -2.309 1.00 . A A . 12 VAL HB 1 1 10 3041 1 1 12 VAL HG11 H -1.293 -2.557 -4.342 1.00 . A A . 12 VAL HG11 1 1 10 3042 1 1 12 VAL HG12 H -2.267 -1.105 -4.593 1.00 . A A . 12 VAL HG12 1 1 10 3043 1 1 12 VAL HG13 H -2.606 -2.165 -3.226 1.00 . A A . 12 VAL HG13 1 1 10 3044 1 1 12 VAL HG21 H 0.882 0.261 -3.234 1.00 . A A . 12 VAL HG21 1 1 10 3045 1 1 12 VAL HG22 H -0.295 0.405 -4.540 1.00 . A A . 12 VAL HG22 1 1 10 3046 1 1 12 VAL HG23 H 0.723 -1.031 -4.424 1.00 . A A . 12 VAL HG23 1 1 10 3047 1 1 12 VAL N N -0.745 0.790 -1.243 1.00 . A A . 12 VAL N 1 1 10 3048 1 1 12 VAL O O -3.853 -0.774 -1.947 1.00 . A A . 12 VAL O 1 1 10 3049 1 1 13 VAL C C -4.702 -0.741 0.863 1.00 . A A . 13 VAL C 1 1 10 3050 1 1 13 VAL CA C -3.516 -1.657 0.629 1.00 . A A . 13 VAL CA 1 1 10 3051 1 1 13 VAL CB C -2.912 -2.139 1.965 1.00 . A A . 13 VAL CB 1 1 10 3052 1 1 13 VAL CG1 C -3.368 -1.298 3.152 1.00 . A A . 13 VAL CG1 1 1 10 3053 1 1 13 VAL CG2 C -3.221 -3.602 2.172 1.00 . A A . 13 VAL CG2 1 1 10 3054 1 1 13 VAL H H -1.678 -0.713 0.261 1.00 . A A . 13 VAL H 1 1 10 3055 1 1 13 VAL HA H -3.840 -2.518 0.065 1.00 . A A . 13 VAL HA 1 1 10 3056 1 1 13 VAL HB H -1.842 -2.038 1.889 1.00 . A A . 13 VAL HB 1 1 10 3057 1 1 13 VAL HG11 H -3.053 -0.275 3.008 1.00 . A A . 13 VAL HG11 1 1 10 3058 1 1 13 VAL HG12 H -2.931 -1.687 4.059 1.00 . A A . 13 VAL HG12 1 1 10 3059 1 1 13 VAL HG13 H -4.446 -1.336 3.227 1.00 . A A . 13 VAL HG13 1 1 10 3060 1 1 13 VAL HG21 H -2.797 -3.931 3.107 1.00 . A A . 13 VAL HG21 1 1 10 3061 1 1 13 VAL HG22 H -2.789 -4.167 1.360 1.00 . A A . 13 VAL HG22 1 1 10 3062 1 1 13 VAL HG23 H -4.289 -3.746 2.186 1.00 . A A . 13 VAL HG23 1 1 10 3063 1 1 13 VAL N N -2.525 -0.950 -0.156 1.00 . A A . 13 VAL N 1 1 10 3064 1 1 13 VAL O O -5.833 -1.177 1.075 1.00 . A A . 13 VAL O 1 1 10 3065 1 1 14 LYS C C -6.368 1.533 -0.300 1.00 . A A . 14 LYS C 1 1 10 3066 1 1 14 LYS CA C -5.396 1.584 0.874 1.00 . A A . 14 LYS CA 1 1 10 3067 1 1 14 LYS CB C -4.683 2.929 0.934 1.00 . A A . 14 LYS CB 1 1 10 3068 1 1 14 LYS CD C -4.992 3.187 3.434 1.00 . A A . 14 LYS CD 1 1 10 3069 1 1 14 LYS CE C -6.053 4.270 3.305 1.00 . A A . 14 LYS CE 1 1 10 3070 1 1 14 LYS CG C -4.008 3.213 2.271 1.00 . A A . 14 LYS CG 1 1 10 3071 1 1 14 LYS H H -3.473 0.796 0.631 1.00 . A A . 14 LYS H 1 1 10 3072 1 1 14 LYS HA H -5.947 1.432 1.787 1.00 . A A . 14 LYS HA 1 1 10 3073 1 1 14 LYS HB2 H -3.910 2.927 0.174 1.00 . A A . 14 LYS HB2 1 1 10 3074 1 1 14 LYS HB3 H -5.389 3.719 0.726 1.00 . A A . 14 LYS HB3 1 1 10 3075 1 1 14 LYS HD2 H -5.478 2.225 3.461 1.00 . A A . 14 LYS HD2 1 1 10 3076 1 1 14 LYS HD3 H -4.446 3.340 4.353 1.00 . A A . 14 LYS HD3 1 1 10 3077 1 1 14 LYS HE2 H -6.550 4.154 2.356 1.00 . A A . 14 LYS HE2 1 1 10 3078 1 1 14 LYS HE3 H -6.770 4.149 4.103 1.00 . A A . 14 LYS HE3 1 1 10 3079 1 1 14 LYS HG2 H -3.253 2.464 2.442 1.00 . A A . 14 LYS HG2 1 1 10 3080 1 1 14 LYS HG3 H -3.545 4.188 2.226 1.00 . A A . 14 LYS HG3 1 1 10 3081 1 1 14 LYS HZ1 H -4.954 5.755 4.276 1.00 . A A . 14 LYS HZ1 1 1 10 3082 1 1 14 LYS HZ2 H -6.226 6.348 3.332 1.00 . A A . 14 LYS HZ2 1 1 10 3083 1 1 14 LYS HZ3 H -4.813 5.791 2.588 1.00 . A A . 14 LYS HZ3 1 1 10 3084 1 1 14 LYS N N -4.408 0.542 0.772 1.00 . A A . 14 LYS N 1 1 10 3085 1 1 14 LYS NZ N -5.470 5.636 3.381 1.00 . A A . 14 LYS NZ 1 1 10 3086 1 1 14 LYS O O -7.558 1.776 -0.128 1.00 . A A . 14 LYS O 1 1 10 3087 1 1 15 LEU C C -7.277 -0.354 -2.732 1.00 . A A . 15 LEU C 1 1 10 3088 1 1 15 LEU CA C -6.750 1.072 -2.642 1.00 . A A . 15 LEU CA 1 1 10 3089 1 1 15 LEU CB C -6.016 1.495 -3.926 1.00 . A A . 15 LEU CB 1 1 10 3090 1 1 15 LEU CD1 C -5.295 -0.548 -5.223 1.00 . A A . 15 LEU CD1 1 1 10 3091 1 1 15 LEU CD2 C -3.811 1.461 -5.119 1.00 . A A . 15 LEU CD2 1 1 10 3092 1 1 15 LEU CG C -4.832 0.624 -4.367 1.00 . A A . 15 LEU CG 1 1 10 3093 1 1 15 LEU H H -4.911 1.034 -1.600 1.00 . A A . 15 LEU H 1 1 10 3094 1 1 15 LEU HA H -7.589 1.736 -2.485 1.00 . A A . 15 LEU HA 1 1 10 3095 1 1 15 LEU HB2 H -6.734 1.519 -4.732 1.00 . A A . 15 LEU HB2 1 1 10 3096 1 1 15 LEU HB3 H -5.646 2.497 -3.770 1.00 . A A . 15 LEU HB3 1 1 10 3097 1 1 15 LEU HD11 H -4.440 -1.139 -5.518 1.00 . A A . 15 LEU HD11 1 1 10 3098 1 1 15 LEU HD12 H -5.796 -0.175 -6.103 1.00 . A A . 15 LEU HD12 1 1 10 3099 1 1 15 LEU HD13 H -5.977 -1.162 -4.653 1.00 . A A . 15 LEU HD13 1 1 10 3100 1 1 15 LEU HD21 H -3.430 2.235 -4.470 1.00 . A A . 15 LEU HD21 1 1 10 3101 1 1 15 LEU HD22 H -4.281 1.912 -5.981 1.00 . A A . 15 LEU HD22 1 1 10 3102 1 1 15 LEU HD23 H -2.997 0.830 -5.443 1.00 . A A . 15 LEU HD23 1 1 10 3103 1 1 15 LEU HG H -4.348 0.219 -3.488 1.00 . A A . 15 LEU HG 1 1 10 3104 1 1 15 LEU N N -5.876 1.199 -1.490 1.00 . A A . 15 LEU N 1 1 10 3105 1 1 15 LEU O O -8.294 -0.617 -3.374 1.00 . A A . 15 LEU O 1 1 10 3106 1 1 16 PHE C C -8.194 -2.868 -1.166 1.00 . A A . 16 PHE C 1 1 10 3107 1 1 16 PHE CA C -6.964 -2.668 -2.037 1.00 . A A . 16 PHE CA 1 1 10 3108 1 1 16 PHE CB C -5.808 -3.507 -1.495 1.00 . A A . 16 PHE CB 1 1 10 3109 1 1 16 PHE CD1 C -6.615 -5.558 -2.704 1.00 . A A . 16 PHE CD1 1 1 10 3110 1 1 16 PHE CD2 C -5.633 -5.823 -0.548 1.00 . A A . 16 PHE CD2 1 1 10 3111 1 1 16 PHE CE1 C -6.811 -6.923 -2.787 1.00 . A A . 16 PHE CE1 1 1 10 3112 1 1 16 PHE CE2 C -5.826 -7.190 -0.626 1.00 . A A . 16 PHE CE2 1 1 10 3113 1 1 16 PHE CG C -6.026 -4.993 -1.584 1.00 . A A . 16 PHE CG 1 1 10 3114 1 1 16 PHE CZ C -6.415 -7.740 -1.747 1.00 . A A . 16 PHE CZ 1 1 10 3115 1 1 16 PHE H H -5.768 -0.986 -1.585 1.00 . A A . 16 PHE H 1 1 10 3116 1 1 16 PHE HA H -7.188 -2.978 -3.046 1.00 . A A . 16 PHE HA 1 1 10 3117 1 1 16 PHE HB2 H -4.914 -3.265 -2.040 1.00 . A A . 16 PHE HB2 1 1 10 3118 1 1 16 PHE HB3 H -5.661 -3.259 -0.454 1.00 . A A . 16 PHE HB3 1 1 10 3119 1 1 16 PHE HD1 H -6.926 -4.922 -3.518 1.00 . A A . 16 PHE HD1 1 1 10 3120 1 1 16 PHE HD2 H -5.171 -5.394 0.330 1.00 . A A . 16 PHE HD2 1 1 10 3121 1 1 16 PHE HE1 H -7.272 -7.351 -3.666 1.00 . A A . 16 PHE HE1 1 1 10 3122 1 1 16 PHE HE2 H -5.515 -7.825 0.190 1.00 . A A . 16 PHE HE2 1 1 10 3123 1 1 16 PHE HZ H -6.567 -8.807 -1.809 1.00 . A A . 16 PHE HZ 1 1 10 3124 1 1 16 PHE N N -6.580 -1.266 -2.065 1.00 . A A . 16 PHE N 1 1 10 3125 1 1 16 PHE O O -9.134 -3.566 -1.542 1.00 . A A . 16 PHE O 1 1 10 3126 1 1 17 ASN C C -10.378 -1.385 0.565 1.00 . A A . 17 ASN C 1 1 10 3127 1 1 17 ASN CA C -9.283 -2.367 0.945 1.00 . A A . 17 ASN CA 1 1 10 3128 1 1 17 ASN CB C -8.832 -2.108 2.390 1.00 . A A . 17 ASN CB 1 1 10 3129 1 1 17 ASN CG C -8.010 -3.240 2.979 1.00 . A A . 17 ASN CG 1 1 10 3130 1 1 17 ASN H H -7.379 -1.722 0.255 1.00 . A A . 17 ASN H 1 1 10 3131 1 1 17 ASN HA H -9.679 -3.369 0.876 1.00 . A A . 17 ASN HA 1 1 10 3132 1 1 17 ASN HB2 H -8.233 -1.212 2.415 1.00 . A A . 17 ASN HB2 1 1 10 3133 1 1 17 ASN HB3 H -9.707 -1.966 3.008 1.00 . A A . 17 ASN HB3 1 1 10 3134 1 1 17 ASN HD21 H -7.195 -3.631 1.216 1.00 . A A . 17 ASN HD21 1 1 10 3135 1 1 17 ASN HD22 H -6.678 -4.639 2.522 1.00 . A A . 17 ASN HD22 1 1 10 3136 1 1 17 ASN N N -8.168 -2.263 0.011 1.00 . A A . 17 ASN N 1 1 10 3137 1 1 17 ASN ND2 N -7.214 -3.901 2.156 1.00 . A A . 17 ASN ND2 1 1 10 3138 1 1 17 ASN O O -11.311 -1.785 -0.161 1.00 . A A . 17 ASN O 1 1 10 3139 1 1 17 ASN OXT O -10.306 -0.212 0.989 1.00 . A A . 17 ASN OXT 1 1 10 3140 1 1 17 ASN OD1 O -8.079 -3.511 4.178 1.00 . A A . 17 ASN OD1 1 1 stop_ save_
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