NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
371092 | 1cb3 | 4483 | cing | 4-filtered-FRED | STAR | entry | full | 118 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1cb3 # This FRED archive file contains, for PDB entry <1cb3>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1cb3 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1cb3 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1299.52 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 $PROTEIN__LCA_ A . 1 1 stop_ save_ save_PROTEIN__LCA_ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "PROTEIN LCA " _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code XIDYWLAHKALAX _Entity.Number_of_monomers 13 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 ACE $ACE 1 1 2 ILE . 1 1 3 ASP . 1 1 4 TYR . 1 1 5 TRP . 1 1 6 LEU . 1 1 7 ALA . 1 1 8 HIS . 1 1 9 LYS . 1 1 10 ALA . 1 1 11 LEU . 1 1 12 ALA . 1 1 13 NH2 $NH2 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID ACE 1 1 1 1 ILE 2 2 1 1 ASP 3 3 1 1 TYR 4 4 1 1 TRP 5 5 1 1 LEU 6 6 1 1 ALA 7 7 1 1 HIS 8 8 1 1 LYS 9 9 1 1 ALA 10 10 1 1 LEU 11 11 1 1 ALA 12 12 1 1 NH2 13 13 1 1 stop_ save_ save_ACE _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ACE _Chem_comp.Type non-polymer save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_4_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 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 ILE H . 2 . HN 1 1 1 1 2 1 1 2 ILE HB . 2 . HB 1 1 2 1 1 1 1 2 ILE H . 2 . HN 1 1 2 1 2 1 1 2 ILE HG12 . 2 . HG12 1 1 3 1 1 1 1 2 ILE H . 2 . HN 1 1 3 1 2 1 1 2 ILE HG13 . 2 . HG11 1 1 4 1 1 1 1 2 ILE H . 2 . HN 1 1 4 1 2 1 1 2 ILE MG . 2 . HG2* 1 1 5 1 1 1 1 2 ILE H . 2 . HN 1 1 5 1 2 1 1 3 ASP H . 3 . HN 1 1 6 1 1 1 1 2 ILE HA . 2 . HA 1 1 6 1 2 1 1 2 ILE MD . 2 . HD* 1 1 7 1 1 1 1 2 ILE HA . 2 . HA 1 1 7 1 2 1 1 2 ILE HG12 . 2 . HG12 1 1 8 1 1 1 1 2 ILE HA . 2 . HA 1 1 8 1 2 1 1 2 ILE MG . 2 . HG2* 1 1 9 1 1 1 1 2 ILE HA . 2 . HA 1 1 9 1 2 1 1 3 ASP H . 3 . HN 1 1 10 1 1 1 1 2 ILE HA . 2 . HA 1 1 10 1 2 1 1 4 TYR H . 4 . HN 1 1 11 1 1 1 1 2 ILE HA . 2 . HA 1 1 11 1 2 1 1 5 TRP H . 5 . HN 1 1 12 1 1 1 1 2 ILE HA . 2 . HA 1 1 12 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 13 1 1 1 1 2 ILE HA . 2 . HA 1 1 13 1 2 1 1 5 TRP HE3 . 5 . HE3 1 1 14 1 1 1 1 2 ILE HA . 2 . HA 1 1 14 1 2 1 1 5 TRP HZ2 . 5 . HZ2 1 1 15 1 1 1 1 2 ILE HB . 2 . HB 1 1 15 1 2 1 1 2 ILE MD . 2 . HD* 1 1 16 1 1 1 1 2 ILE HB . 2 . HB 1 1 16 1 2 1 1 3 ASP H . 3 . HN 1 1 17 1 1 1 1 2 ILE HB . 2 . HB 1 1 17 1 2 1 1 4 TYR CZ . 4 . CZ 1 1 18 1 1 1 1 2 ILE MD . 2 . HD* 1 1 18 1 2 1 1 4 TYR CG . 4 . CG 1 1 19 1 1 1 1 2 ILE MD . 2 . HD* 1 1 19 1 2 1 1 4 TYR CZ . 4 . CZ 1 1 20 1 1 1 1 2 ILE MD . 2 . HD* 1 1 20 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 21 1 1 1 1 2 ILE MD . 2 . HD* 1 1 21 1 2 1 1 5 TRP HE1 . 5 . HE1 1 1 22 1 1 1 1 2 ILE MD . 2 . HD* 1 1 22 1 2 1 1 5 TRP HZ3 . 5 . HZ3 1 1 23 1 1 1 1 2 ILE HG12 . 2 . HG12 1 1 23 1 2 1 1 2 ILE MG . 2 . HG2* 1 1 24 1 1 1 1 2 ILE HG12 . 2 . HG12 1 1 24 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 25 1 1 1 1 2 ILE HG13 . 2 . HG11 1 1 25 1 2 1 1 2 ILE MG . 2 . HG2* 1 1 26 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 26 1 2 1 1 3 ASP H . 3 . HN 1 1 27 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 27 1 2 1 1 3 ASP HA . 3 . HA 1 1 28 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 28 1 2 1 1 4 TYR CG . 4 . CG 1 1 29 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 29 1 2 1 1 4 TYR CZ . 4 . CZ 1 1 30 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 30 1 2 1 1 4 TYR HA . 4 . HA 1 1 31 1 1 1 1 3 ASP H . 3 . HN 1 1 31 1 2 1 1 3 ASP HB2 . 3 . HB2 1 1 32 1 1 1 1 3 ASP H . 3 . HN 1 1 32 1 2 1 1 4 TYR H . 4 . HN 1 1 33 1 1 1 1 3 ASP HA . 3 . HA 1 1 33 1 2 1 1 4 TYR H . 4 . HN 1 1 34 1 1 1 1 3 ASP HA . 3 . HA 1 1 34 1 2 1 1 6 LEU HB2 . 6 . HB2 1 1 35 1 1 1 1 3 ASP HA . 3 . HA 1 1 35 1 2 1 1 6 LEU HB3 . 6 . HB1 1 1 36 1 1 1 1 3 ASP HA . 3 . HA 1 1 36 1 2 1 1 6 LEU MD2 . 6 . HD2* 1 1 37 1 1 1 1 3 ASP HB2 . 3 . HB2 1 1 37 1 2 1 1 4 TYR H . 4 . HN 1 1 38 1 1 1 1 4 TYR CG . 4 . CG 1 1 38 1 2 1 1 5 TRP H . 5 . HN 1 1 39 1 1 1 1 4 TYR CG . 4 . CG 1 1 39 1 2 1 1 5 TRP HA . 5 . HA 1 1 40 1 1 1 1 4 TYR CG . 4 . CG 1 1 40 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 41 1 1 1 1 4 TYR CG . 4 . CG 1 1 41 1 2 1 1 8 HIS HD2 . 8 . HD2 1 1 42 1 1 1 1 4 TYR CG . 4 . CG 1 1 42 1 2 1 1 8 HIS HE1 . 8 . HE1 1 1 43 1 1 1 1 4 TYR CZ . 4 . CZ 1 1 43 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 44 1 1 1 1 4 TYR CZ . 4 . CZ 1 1 44 1 2 1 1 5 TRP HH2 . 5 . HH2 1 1 45 1 1 1 1 4 TYR CZ . 4 . CZ 1 1 45 1 2 1 1 8 HIS HB2 . 8 . HB2 1 1 46 1 1 1 1 4 TYR CZ . 4 . CZ 1 1 46 1 2 1 1 8 HIS HB3 . 8 . HB1 1 1 47 1 1 1 1 4 TYR CZ . 4 . CZ 1 1 47 1 2 1 1 8 HIS HD2 . 8 . HD2 1 1 48 1 1 1 1 4 TYR CZ . 4 . CZ 1 1 48 1 2 1 1 8 HIS HE1 . 8 . HE1 1 1 49 1 1 1 1 4 TYR H . 4 . HN 1 1 49 1 2 1 1 4 TYR HB2 . 4 . HB2 1 1 50 1 1 1 1 4 TYR H . 4 . HN 1 1 50 1 2 1 1 4 TYR HB3 . 4 . HB1 1 1 51 1 1 1 1 4 TYR H . 4 . HN 1 1 51 1 2 1 1 5 TRP H . 5 . HN 1 1 52 1 1 1 1 4 TYR HA . 4 . HA 1 1 52 1 2 1 1 5 TRP H . 5 . HN 1 1 53 1 1 1 1 4 TYR HA . 4 . HA 1 1 53 1 2 1 1 6 LEU H . 6 . HN 1 1 54 1 1 1 1 4 TYR HA . 4 . HA 1 1 54 1 2 1 1 7 ALA H . 7 . HN 1 1 55 1 1 1 1 4 TYR HA . 4 . HA 1 1 55 1 2 1 1 7 ALA MB . 7 . HB* 1 1 56 1 1 1 1 4 TYR HA . 4 . HA 1 1 56 1 2 1 1 8 HIS HD2 . 8 . HD2 1 1 57 1 1 1 1 4 TYR HA . 4 . HA 1 1 57 1 2 1 1 8 HIS HE1 . 8 . HE1 1 1 58 1 1 1 1 4 TYR HB3 . 4 . HB1 1 1 58 1 2 1 1 5 TRP H . 5 . HN 1 1 59 1 1 1 1 5 TRP H . 5 . HN 1 1 59 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 60 1 1 1 1 5 TRP H . 5 . HN 1 1 60 1 2 1 1 6 LEU H . 6 . HN 1 1 61 1 1 1 1 5 TRP HA . 5 . HA 1 1 61 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 62 1 1 1 1 5 TRP HA . 5 . HA 1 1 62 1 2 1 1 6 LEU H . 6 . HN 1 1 63 1 1 1 1 5 TRP HA . 5 . HA 1 1 63 1 2 1 1 7 ALA H . 7 . HN 1 1 64 1 1 1 1 5 TRP HA . 5 . HA 1 1 64 1 2 1 1 8 HIS HB3 . 8 . HB1 1 1 65 1 1 1 1 5 TRP HB2 . 5 . HB2 1 1 65 1 2 1 1 6 LEU H . 6 . HN 1 1 66 1 1 1 1 5 TRP HE3 . 5 . HE3 1 1 66 1 2 1 1 9 LYS HA . 9 . HA 1 1 67 1 1 1 1 5 TRP HE3 . 5 . HE3 1 1 67 1 2 1 1 9 LYS QD . 9 . HD* 1 1 68 1 1 1 1 5 TRP HE3 . 5 . HE3 1 1 68 1 2 1 1 9 LYS QE . 9 . HE* 1 1 69 1 1 1 1 5 TRP HE3 . 5 . HE3 1 1 69 1 2 1 1 9 LYS QG . 9 . HG* 1 1 70 1 1 1 1 6 LEU H . 6 . HN 1 1 70 1 2 1 1 6 LEU HB2 . 6 . HB2 1 1 71 1 1 1 1 6 LEU H . 6 . HN 1 1 71 1 2 1 1 6 LEU HB3 . 6 . HB1 1 1 72 1 1 1 1 6 LEU H . 6 . HN 1 1 72 1 2 1 1 7 ALA H . 7 . HN 1 1 73 1 1 1 1 6 LEU HA . 6 . HA 1 1 73 1 2 1 1 6 LEU MD1 . 6 . HD1* 1 1 74 1 1 1 1 6 LEU HA . 6 . HA 1 1 74 1 2 1 1 6 LEU MD2 . 6 . HD2* 1 1 75 1 1 1 1 6 LEU HA . 6 . HA 1 1 75 1 2 1 1 7 ALA H . 7 . HN 1 1 76 1 1 1 1 6 LEU HB2 . 6 . HB2 1 1 76 1 2 1 1 7 ALA H . 7 . HN 1 1 77 1 1 1 1 6 LEU HB3 . 6 . HB1 1 1 77 1 2 1 1 7 ALA H . 7 . HN 1 1 78 1 1 1 1 7 ALA H . 7 . HN 1 1 78 1 2 1 1 7 ALA MB . 7 . HB* 1 1 79 1 1 1 1 7 ALA H . 7 . HN 1 1 79 1 2 1 1 8 HIS H . 8 . HN 1 1 80 1 1 1 1 7 ALA HA . 7 . HA 1 1 80 1 2 1 1 8 HIS H . 8 . HN 1 1 81 1 1 1 1 7 ALA HA . 7 . HA 1 1 81 1 2 1 1 8 HIS HD2 . 8 . HD2 1 1 82 1 1 1 1 7 ALA MB . 7 . HB* 1 1 82 1 2 1 1 8 HIS H . 8 . HN 1 1 83 1 1 1 1 7 ALA MB . 7 . HB* 1 1 83 1 2 1 1 8 HIS HD2 . 8 . HD2 1 1 84 1 1 1 1 7 ALA MB . 7 . HB* 1 1 84 1 2 1 1 8 HIS HE1 . 8 . HE1 1 1 85 1 1 1 1 8 HIS H . 8 . HN 1 1 85 1 2 1 1 8 HIS HB3 . 8 . HB1 1 1 86 1 1 1 1 8 HIS H . 8 . HN 1 1 86 1 2 1 1 8 HIS HD2 . 8 . HD2 1 1 87 1 1 1 1 8 HIS H . 8 . HN 1 1 87 1 2 1 1 9 LYS H . 9 . HN 1 1 88 1 1 1 1 8 HIS HA . 8 . HA 1 1 88 1 2 1 1 8 HIS HD2 . 8 . HD2 1 1 89 1 1 1 1 8 HIS HA . 8 . HA 1 1 89 1 2 1 1 9 LYS H . 9 . HN 1 1 90 1 1 1 1 8 HIS HA . 8 . HA 1 1 90 1 2 1 1 11 LEU HB3 . 11 . HB1 1 1 91 1 1 1 1 8 HIS HB2 . 8 . HB2 1 1 91 1 2 1 1 8 HIS HD2 . 8 . HD2 1 1 92 1 1 1 1 8 HIS HB2 . 8 . HB2 1 1 92 1 2 1 1 8 HIS HE1 . 8 . HE1 1 1 93 1 1 1 1 8 HIS HB2 . 8 . HB2 1 1 93 1 2 1 1 9 LYS H . 9 . HN 1 1 94 1 1 1 1 8 HIS HB3 . 8 . HB1 1 1 94 1 2 1 1 8 HIS HD2 . 8 . HD2 1 1 95 1 1 1 1 8 HIS HB3 . 8 . HB1 1 1 95 1 2 1 1 8 HIS HE1 . 8 . HE1 1 1 96 1 1 1 1 8 HIS HD2 . 8 . HD2 1 1 96 1 2 1 1 9 LYS QG . 9 . HG* 1 1 97 1 1 1 1 9 LYS H . 9 . HN 1 1 97 1 2 1 1 9 LYS HB3 . 9 . HB1 1 1 98 1 1 1 1 9 LYS H . 9 . HN 1 1 98 1 2 1 1 9 LYS QG . 9 . HG* 1 1 99 1 1 1 1 9 LYS H . 9 . HN 1 1 99 1 2 1 1 10 ALA H . 10 . HN 1 1 100 1 1 1 1 9 LYS HA . 9 . HA 1 1 100 1 2 1 1 9 LYS QD . 9 . HD* 1 1 101 1 1 1 1 9 LYS HA . 9 . HA 1 1 101 1 2 1 1 9 LYS QG . 9 . HG* 1 1 102 1 1 1 1 9 LYS HA . 9 . HA 1 1 102 1 2 1 1 10 ALA H . 10 . HN 1 1 103 1 1 1 1 9 LYS HB2 . 9 . HB2 1 1 103 1 2 1 1 10 ALA H . 10 . HN 1 1 104 1 1 1 1 9 LYS HB3 . 9 . HB1 1 1 104 1 2 1 1 10 ALA H . 10 . HN 1 1 105 1 1 1 1 9 LYS QD . 9 . HD* 1 1 105 1 2 1 1 9 LYS QE . 9 . HE* 1 1 106 1 1 1 1 9 LYS QE . 9 . HE* 1 1 106 1 2 1 1 9 LYS QG . 9 . HG* 1 1 107 1 1 1 1 10 ALA H . 10 . HN 1 1 107 1 2 1 1 10 ALA MB . 10 . HB* 1 1 108 1 1 1 1 10 ALA H . 10 . HN 1 1 108 1 2 1 1 11 LEU H . 11 . HN 1 1 109 1 1 1 1 10 ALA H . 10 . HN 1 1 109 1 2 1 1 11 LEU QB . 11 . HB* 1 1 110 1 1 1 1 10 ALA HA . 10 . HA 1 1 110 1 2 1 1 11 LEU H . 11 . HN 1 1 111 1 1 1 1 11 LEU H . 11 . HN 1 1 111 1 2 1 1 11 LEU QB . 11 . HB* 1 1 112 1 1 1 1 11 LEU HA . 11 . HA 1 1 112 1 2 1 1 11 LEU MD1 . 11 . HD1* 1 1 113 1 1 1 1 11 LEU HA . 11 . HA 1 1 113 1 2 1 1 11 LEU MD2 . 11 . HD2* 1 1 114 1 1 1 1 12 ALA H . 12 . HN 1 1 114 1 2 1 1 12 ALA MB . 12 . HB* 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.8 1.8 3.8 1 1 2 1 . . . . . 1.8 1.8 4.7 1 1 3 1 . . . . . 1.8 1.8 4.5 1 1 4 1 . . . . . 1.8 1.8 5.5 1 1 5 1 . . . . . 1.8 1.8 4.5 1 1 6 1 . . . . . 1.8 1.8 5.3 1 1 7 1 . . . . . 1.8 1.8 4.2 1 1 8 1 . . . . . 1.8 1.8 5.1 1 1 9 1 . . . . . 1.8 1.8 3.4 1 1 10 1 . . . . . 1.8 1.8 5.0 1 1 11 1 . . . . . 1.8 1.8 5.0 1 1 12 1 . . . . . 1.8 1.8 4.5 1 1 13 1 . . . . . 1.8 1.8 5.5 1 1 14 1 . . . . . 1.8 1.8 5.0 1 1 15 1 . . . . . 1.8 1.8 4.5 1 1 16 1 . . . . . 1.8 1.8 4.5 1 1 17 1 . . . . . 1.8 1.8 7.0 1 1 18 1 . . . . . 1.8 1.8 8.0 1 1 19 1 . . . . . 1.8 1.8 7.5 1 1 20 1 . . . . . 1.8 1.8 5.5 1 1 21 1 . . . . . 1.8 1.8 6.5 1 1 22 1 . . . . . 1.8 1.8 6.5 1 1 23 1 . . . . . 1.8 1.8 5.1 1 1 24 1 . . . . . 1.8 1.8 4.5 1 1 25 1 . . . . . 1.8 1.8 4.6 1 1 26 1 . . . . . 1.8 1.8 5.5 1 1 27 1 . . . . . 1.8 1.8 6.0 1 1 28 1 . . . . . 1.8 1.8 8.0 1 1 29 1 . . . . . 1.8 1.8 7.5 1 1 30 1 . . . . . 1.8 1.8 5.5 1 1 31 1 . . . . . 1.8 1.8 4.0 1 1 32 1 . . . . . 1.8 1.8 4.5 1 1 33 1 . . . . . 1.8 1.8 3.5 1 1 34 1 . . . . . 1.8 1.8 5.5 1 1 35 1 . . . . . 1.8 1.8 5.0 1 1 36 1 . . . . . 1.8 1.8 6.0 1 1 37 1 . . . . . 1.8 1.8 5.5 1 1 38 1 . . . . . 1.8 1.8 7.5 1 1 39 1 . . . . . 1.8 1.8 6.5 1 1 40 1 . . . . . 1.8 1.8 6.5 1 1 41 1 . . . . . 1.8 1.8 6.5 1 1 42 1 . . . . . 1.8 1.8 6.5 1 1 43 1 . . . . . 1.8 1.8 6.5 1 1 44 1 . . . . . 1.8 1.8 6.5 1 1 45 1 . . . . . 1.8 1.8 7.0 1 1 46 1 . . . . . 1.8 1.8 7.0 1 1 47 1 . . . . . 1.8 1.8 6.5 1 1 48 1 . . . . . 1.8 1.8 6.5 1 1 49 1 . . . . . 1.8 1.8 3.8 1 1 50 1 . . . . . 1.8 1.8 3.8 1 1 51 1 . . . . . 1.8 1.8 4.5 1 1 52 1 . . . . . 1.8 1.8 3.8 1 1 53 1 . . . . . 1.8 1.8 5.0 1 1 54 1 . . . . . 1.8 1.8 4.5 1 1 55 1 . . . . . 1.8 1.8 5.5 1 1 56 1 . . . . . 1.8 1.8 4.5 1 1 57 1 . . . . . 1.8 1.8 4.5 1 1 58 1 . . . . . 1.8 1.8 4.5 1 1 59 1 . . . . . 1.8 1.8 5.0 1 1 60 1 . . . . . 1.8 1.8 4.5 1 1 61 1 . . . . . 1.8 1.8 4.2 1 1 62 1 . . . . . 1.8 1.8 3.8 1 1 63 1 . . . . . 1.8 1.8 5.5 1 1 64 1 . . . . . 1.8 1.8 5.5 1 1 65 1 . . . . . 1.8 1.8 5.5 1 1 66 1 . . . . . 1.8 1.8 5.5 1 1 67 1 . . . . . 1.8 1.8 6.0 1 1 68 1 . . . . . 1.8 1.8 6.0 1 1 69 1 . . . . . 1.8 1.8 6.0 1 1 70 1 . . . . . 1.8 1.8 3.6 1 1 71 1 . . . . . 1.8 1.8 4.0 1 1 72 1 . . . . . 1.8 1.8 4.5 1 1 73 1 . . . . . 1.8 1.8 4.2 1 1 74 1 . . . . . 1.8 1.8 5.1 1 1 75 1 . . . . . 1.8 1.8 3.8 1 1 76 1 . . . . . 1.8 1.8 4.8 1 1 77 1 . . . . . 1.8 1.8 5.5 1 1 78 1 . . . . . 1.8 1.8 4.5 1 1 79 1 . . . . . 1.8 1.8 4.5 1 1 80 1 . . . . . 1.8 1.8 3.8 1 1 81 1 . . . . . 1.8 1.8 4.5 1 1 82 1 . . . . . 1.8 1.8 5.5 1 1 83 1 . . . . . 1.8 1.8 4.8 1 1 84 1 . . . . . 1.8 1.8 5.5 1 1 85 1 . . . . . 1.8 1.8 4.0 1 1 86 1 . . . . . 1.8 1.8 5.5 1 1 87 1 . . . . . 1.8 1.8 4.5 1 1 88 1 . . . . . 1.8 1.8 4.2 1 1 89 1 . . . . . 1.8 1.8 3.6 1 1 90 1 . . . . . 1.8 1.8 5.5 1 1 91 1 . . . . . 1.8 1.8 3.8 1 1 92 1 . . . . . 1.8 1.8 5.5 1 1 93 1 . . . . . 1.8 1.8 5.5 1 1 94 1 . . . . . 1.8 1.8 4.0 1 1 95 1 . . . . . 1.8 1.8 5.5 1 1 96 1 . . . . . 1.8 1.8 5.5 1 1 97 1 . . . . . 1.8 1.8 4.0 1 1 98 1 . . . . . 1.8 1.8 5.1 1 1 99 1 . . . . . 1.8 1.8 4.5 1 1 100 1 . . . . . 1.8 1.8 5.0 1 1 101 1 . . . . . 1.8 1.8 4.5 1 1 102 1 . . . . . 1.8 1.8 3.0 1 1 103 1 . . . . . 1.8 1.8 4.5 1 1 104 1 . . . . . 1.8 1.8 5.5 1 1 105 1 . . . . . 1.8 1.8 5.0 1 1 106 1 . . . . . 1.8 1.8 5.2 1 1 107 1 . . . . . 1.8 1.8 4.5 1 1 108 1 . . . . . 1.8 1.8 5.5 1 1 109 1 . . . . . 1.8 1.8 5.5 1 1 110 1 . . . . . 1.8 1.8 4.5 1 1 111 1 . . . . . 1.8 1.8 4.5 1 1 112 1 . . . . . 1.8 1.8 4.5 1 1 113 1 . . . . . 1.8 1.8 4.8 1 1 114 1 . . . . . 1.8 1.8 4.5 1 1 stop_ save_ save_CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 3 ASP C 1 1 4 TYR N 1 1 4 TYR CA 1 1 4 TYR C -75.0 -35.0 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 2 . 1 1 6 LEU C 1 1 7 ALA N 1 1 7 ALA CA 1 1 7 ALA C -89.99999 -40.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 3 . 1 1 9 LYS C 1 1 10 ALA N 1 1 10 ALA CA 1 1 10 ALA C -89.99999 -40.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 4 . 1 1 8 HIS N 1 1 8 HIS CA 1 1 8 HIS CB 1 1 8 HIS CG -25.0 265.0 . 8 . N . 8 . CA . 8 . CB . 8 . CG 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 2 ILE C C -2.025 -4.911 1.675 1.00 . A A . 1 ILE C 1 1 1 2 1 1 2 ILE CA C -0.837 -5.157 2.606 1.00 . A A . 1 ILE CA 1 1 1 3 1 1 2 ILE CB C 0.484 -4.668 1.987 1.00 . A A . 1 ILE CB 1 1 1 4 1 1 2 ILE CD1 C 1.917 -5.370 3.910 1.00 . A A . 1 ILE CD1 1 1 1 5 1 1 2 ILE CG1 C 1.401 -4.175 3.108 1.00 . A A . 1 ILE CG1 1 1 1 6 1 1 2 ILE CG2 C 0.242 -3.515 0.997 1.00 . A A . 1 ILE CG2 1 1 1 7 1 1 2 ILE H H 0.232 -7.023 2.739 1.00 . A A . 1 ILE H 1 1 1 8 1 1 2 ILE HA H -0.994 -4.672 3.550 1.00 . A A . 1 ILE HA 1 1 1 9 1 1 2 ILE HB H 0.958 -5.487 1.473 1.00 . A A . 1 ILE HB 1 1 1 10 1 1 2 ILE HD11 H 2.229 -6.150 3.233 1.00 . A A . 1 ILE HD11 1 1 1 11 1 1 2 ILE HD12 H 2.755 -5.061 4.517 1.00 . A A . 1 ILE HD12 1 1 1 12 1 1 2 ILE HD13 H 1.129 -5.742 4.549 1.00 . A A . 1 ILE HD13 1 1 1 13 1 1 2 ILE HG12 H 2.235 -3.638 2.680 1.00 . A A . 1 ILE HG12 1 1 1 14 1 1 2 ILE HG13 H 0.846 -3.517 3.762 1.00 . A A . 1 ILE HG13 1 1 1 15 1 1 2 ILE HG21 H -0.740 -3.094 1.160 1.00 . A A . 1 ILE HG21 1 1 1 16 1 1 2 ILE HG22 H 0.987 -2.749 1.146 1.00 . A A . 1 ILE HG22 1 1 1 17 1 1 2 ILE HG23 H 0.306 -3.886 -0.014 1.00 . A A . 1 ILE HG23 1 1 1 18 1 1 2 ILE N N -0.658 -6.620 2.810 1.00 . A A . 1 ILE N 1 1 1 19 1 1 2 ILE O O -3.114 -4.601 2.112 1.00 . A A . 1 ILE O 1 1 1 20 1 1 3 ASP C C -3.402 -3.361 -0.477 1.00 . A A . 2 ASP C 1 1 1 21 1 1 3 ASP CA C -2.903 -4.803 -0.584 1.00 . A A . 2 ASP CA 1 1 1 22 1 1 3 ASP CB C -4.006 -5.792 -0.202 1.00 . A A . 2 ASP CB 1 1 1 23 1 1 3 ASP CG C -4.787 -6.194 -1.455 1.00 . A A . 2 ASP CG 1 1 1 24 1 1 3 ASP H H -0.917 -5.288 0.083 1.00 . A A . 2 ASP H 1 1 1 25 1 1 3 ASP HA H -2.559 -5.001 -1.584 1.00 . A A . 2 ASP HA 1 1 1 26 1 1 3 ASP HB2 H -3.564 -6.670 0.246 1.00 . A A . 2 ASP HB2 1 1 1 27 1 1 3 ASP HB3 H -4.679 -5.328 0.504 1.00 . A A . 2 ASP HB3 1 1 1 28 1 1 3 ASP N N -1.809 -5.040 0.398 1.00 . A A . 2 ASP N 1 1 1 29 1 1 3 ASP O O -3.192 -2.555 -1.361 1.00 . A A . 2 ASP O 1 1 1 30 1 1 3 ASP OD1 O -4.955 -5.351 -2.320 1.00 . A A . 2 ASP OD1 1 1 1 31 1 1 3 ASP OD2 O -5.202 -7.338 -1.527 1.00 . A A . 2 ASP OD2 1 1 1 32 1 1 4 TYR C C -3.476 -0.656 1.118 1.00 . A A . 3 TYR C 1 1 1 33 1 1 4 TYR CA C -4.590 -1.651 0.746 1.00 . A A . 3 TYR CA 1 1 1 34 1 1 4 TYR CB C -5.669 -1.745 1.830 1.00 . A A . 3 TYR CB 1 1 1 35 1 1 4 TYR CD1 C -4.811 -3.335 3.585 1.00 . A A . 3 TYR CD1 1 1 1 36 1 1 4 TYR CD2 C -4.712 -0.952 4.014 1.00 . A A . 3 TYR CD2 1 1 1 37 1 1 4 TYR CE1 C -4.241 -3.582 4.837 1.00 . A A . 3 TYR CE1 1 1 1 38 1 1 4 TYR CE2 C -4.141 -1.198 5.263 1.00 . A A . 3 TYR CE2 1 1 1 39 1 1 4 TYR CG C -5.046 -2.019 3.175 1.00 . A A . 3 TYR CG 1 1 1 40 1 1 4 TYR CZ C -3.906 -2.512 5.676 1.00 . A A . 3 TYR CZ 1 1 1 41 1 1 4 TYR H H -4.231 -3.704 1.287 1.00 . A A . 3 TYR H 1 1 1 42 1 1 4 TYR HA H -5.045 -1.339 -0.175 1.00 . A A . 3 TYR HA 1 1 1 43 1 1 4 TYR HB2 H -6.212 -0.815 1.874 1.00 . A A . 3 TYR HB2 1 1 1 44 1 1 4 TYR HB3 H -6.352 -2.544 1.585 1.00 . A A . 3 TYR HB3 1 1 1 45 1 1 4 TYR HD1 H -5.070 -4.159 2.936 1.00 . A A . 3 TYR HD1 1 1 1 46 1 1 4 TYR HD2 H -4.894 0.062 3.695 1.00 . A A . 3 TYR HD2 1 1 1 47 1 1 4 TYR HE1 H -4.058 -4.597 5.158 1.00 . A A . 3 TYR HE1 1 1 1 48 1 1 4 TYR HE2 H -3.882 -0.374 5.912 1.00 . A A . 3 TYR HE2 1 1 1 49 1 1 4 TYR HH H -2.828 -1.986 7.162 1.00 . A A . 3 TYR HH 1 1 1 50 1 1 4 TYR N N -4.068 -3.036 0.591 1.00 . A A . 3 TYR N 1 1 1 51 1 1 4 TYR O O -3.324 0.344 0.457 1.00 . A A . 3 TYR O 1 1 1 52 1 1 4 TYR OH O -3.346 -2.756 6.914 1.00 . A A . 3 TYR OH 1 1 1 53 1 1 5 TRP C C -1.239 1.001 1.489 1.00 . A A . 4 TRP C 1 1 1 54 1 1 5 TRP CA C -1.602 0.010 2.598 1.00 . A A . 4 TRP CA 1 1 1 55 1 1 5 TRP CB C -0.392 -0.885 2.877 1.00 . A A . 4 TRP CB 1 1 1 56 1 1 5 TRP CD1 C -1.453 -2.642 4.362 1.00 . A A . 4 TRP CD1 1 1 1 57 1 1 5 TRP CD2 C 0.169 -1.496 5.401 1.00 . A A . 4 TRP CD2 1 1 1 58 1 1 5 TRP CE2 C -0.328 -2.431 6.337 1.00 . A A . 4 TRP CE2 1 1 1 59 1 1 5 TRP CE3 C 1.205 -0.645 5.804 1.00 . A A . 4 TRP CE3 1 1 1 60 1 1 5 TRP CG C -0.568 -1.645 4.155 1.00 . A A . 4 TRP CG 1 1 1 61 1 1 5 TRP CH2 C 1.221 -1.662 8.015 1.00 . A A . 4 TRP CH2 1 1 1 62 1 1 5 TRP CZ2 C 0.187 -2.519 7.627 1.00 . A A . 4 TRP CZ2 1 1 1 63 1 1 5 TRP CZ3 C 1.730 -0.726 7.104 1.00 . A A . 4 TRP CZ3 1 1 1 64 1 1 5 TRP H H -2.864 -1.740 2.665 1.00 . A A . 4 TRP H 1 1 1 65 1 1 5 TRP HA H -1.884 0.536 3.496 1.00 . A A . 4 TRP HA 1 1 1 66 1 1 5 TRP HB2 H -0.274 -1.577 2.067 1.00 . A A . 4 TRP HB2 1 1 1 67 1 1 5 TRP HB3 H 0.493 -0.270 2.948 1.00 . A A . 4 TRP HB3 1 1 1 68 1 1 5 TRP HD1 H -2.152 -3.025 3.637 1.00 . A A . 4 TRP HD1 1 1 1 69 1 1 5 TRP HE1 H -1.841 -3.829 6.056 1.00 . A A . 4 TRP HE1 1 1 1 70 1 1 5 TRP HE3 H 1.602 0.072 5.106 1.00 . A A . 4 TRP HE3 1 1 1 71 1 1 5 TRP HH2 H 1.626 -1.722 9.014 1.00 . A A . 4 TRP HH2 1 1 1 72 1 1 5 TRP HZ2 H -0.211 -3.243 8.322 1.00 . A A . 4 TRP HZ2 1 1 1 73 1 1 5 TRP HZ3 H 2.529 -0.065 7.403 1.00 . A A . 4 TRP HZ3 1 1 1 74 1 1 5 TRP N N -2.710 -0.924 2.162 1.00 . A A . 4 TRP N 1 1 1 75 1 1 5 TRP NE1 N -1.312 -3.109 5.654 1.00 . A A . 4 TRP NE1 1 1 1 76 1 1 5 TRP O O -1.250 2.201 1.678 1.00 . A A . 4 TRP O 1 1 1 77 1 1 6 LEU C C -1.400 2.641 -0.830 1.00 . A A . 5 LEU C 1 1 1 78 1 1 6 LEU CA C -0.557 1.355 -0.821 1.00 . A A . 5 LEU CA 1 1 1 79 1 1 6 LEU CB C -0.861 0.471 -2.038 1.00 . A A . 5 LEU CB 1 1 1 80 1 1 6 LEU CD1 C 0.127 1.993 -3.760 1.00 . A A . 5 LEU CD1 1 1 1 81 1 1 6 LEU CD2 C -1.710 0.413 -4.375 1.00 . A A . 5 LEU CD2 1 1 1 82 1 1 6 LEU CG C -1.159 1.322 -3.274 1.00 . A A . 5 LEU CG 1 1 1 83 1 1 6 LEU H H -0.929 -0.486 0.221 1.00 . A A . 5 LEU H 1 1 1 84 1 1 6 LEU HA H 0.494 1.593 -0.796 1.00 . A A . 5 LEU HA 1 1 1 85 1 1 6 LEU HB2 H -0.009 -0.161 -2.240 1.00 . A A . 5 LEU HB2 1 1 1 86 1 1 6 LEU HB3 H -1.718 -0.149 -1.819 1.00 . A A . 5 LEU HB3 1 1 1 87 1 1 6 LEU HD11 H 0.548 2.583 -2.961 1.00 . A A . 5 LEU HD11 1 1 1 88 1 1 6 LEU HD12 H 0.836 1.236 -4.061 1.00 . A A . 5 LEU HD12 1 1 1 89 1 1 6 LEU HD13 H -0.097 2.631 -4.602 1.00 . A A . 5 LEU HD13 1 1 1 90 1 1 6 LEU HD21 H -1.276 -0.573 -4.279 1.00 . A A . 5 LEU HD21 1 1 1 91 1 1 6 LEU HD22 H -2.784 0.342 -4.281 1.00 . A A . 5 LEU HD22 1 1 1 92 1 1 6 LEU HD23 H -1.460 0.823 -5.341 1.00 . A A . 5 LEU HD23 1 1 1 93 1 1 6 LEU HG H -1.891 2.077 -3.029 1.00 . A A . 5 LEU HG 1 1 1 94 1 1 6 LEU N N -0.923 0.488 0.334 1.00 . A A . 5 LEU N 1 1 1 95 1 1 6 LEU O O -0.873 3.735 -0.880 1.00 . A A . 5 LEU O 1 1 1 96 1 1 7 ALA C C -3.854 4.229 0.617 1.00 . A A . 6 ALA C 1 1 1 97 1 1 7 ALA CA C -3.564 3.737 -0.808 1.00 . A A . 6 ALA CA 1 1 1 98 1 1 7 ALA CB C -4.860 3.286 -1.484 1.00 . A A . 6 ALA CB 1 1 1 99 1 1 7 ALA H H -3.107 1.628 -0.758 1.00 . A A . 6 ALA H 1 1 1 100 1 1 7 ALA HA H -3.103 4.519 -1.387 1.00 . A A . 6 ALA HA 1 1 1 101 1 1 7 ALA HB1 H -5.048 2.250 -1.245 1.00 . A A . 6 ALA HB1 1 1 1 102 1 1 7 ALA HB2 H -5.681 3.893 -1.129 1.00 . A A . 6 ALA HB2 1 1 1 103 1 1 7 ALA HB3 H -4.766 3.399 -2.553 1.00 . A A . 6 ALA HB3 1 1 1 104 1 1 7 ALA N N -2.698 2.519 -0.791 1.00 . A A . 6 ALA N 1 1 1 105 1 1 7 ALA O O -4.648 5.125 0.820 1.00 . A A . 6 ALA O 1 1 1 106 1 1 8 HIS C C -2.190 4.512 3.682 1.00 . A A . 7 HIS C 1 1 1 107 1 1 8 HIS CA C -3.494 4.081 3.006 1.00 . A A . 7 HIS CA 1 1 1 108 1 1 8 HIS CB C -4.079 2.850 3.711 1.00 . A A . 7 HIS CB 1 1 1 109 1 1 8 HIS CD2 C -5.169 1.849 1.532 1.00 . A A . 7 HIS CD2 1 1 1 110 1 1 8 HIS CE1 C -7.090 1.293 2.355 1.00 . A A . 7 HIS CE1 1 1 1 111 1 1 8 HIS CG C -5.148 2.215 2.854 1.00 . A A . 7 HIS CG 1 1 1 112 1 1 8 HIS H H -2.600 2.916 1.427 1.00 . A A . 7 HIS H 1 1 1 113 1 1 8 HIS HA H -4.211 4.888 3.021 1.00 . A A . 7 HIS HA 1 1 1 114 1 1 8 HIS HB2 H -3.292 2.134 3.889 1.00 . A A . 7 HIS HB2 1 1 1 115 1 1 8 HIS HB3 H -4.510 3.150 4.655 1.00 . A A . 7 HIS HB3 1 1 1 116 1 1 8 HIS HD1 H -6.697 1.978 4.283 1.00 . A A . 7 HIS HD1 1 1 1 117 1 1 8 HIS HD2 H -4.360 1.981 0.841 1.00 . A A . 7 HIS HD2 1 1 1 118 1 1 8 HIS HE1 H -8.085 0.897 2.454 1.00 . A A . 7 HIS HE1 1 1 1 119 1 1 8 HIS HE2 H -6.679 0.920 0.355 1.00 . A A . 7 HIS HE2 1 1 1 120 1 1 8 HIS N N -3.231 3.645 1.605 1.00 . A A . 7 HIS N 1 1 1 121 1 1 8 HIS ND1 N -6.388 1.852 3.362 1.00 . A A . 7 HIS ND1 1 1 1 122 1 1 8 HIS NE2 N -6.390 1.271 1.224 1.00 . A A . 7 HIS NE2 1 1 1 123 1 1 8 HIS O O -2.015 5.661 4.037 1.00 . A A . 7 HIS O 1 1 1 124 1 1 9 LYS C C -0.234 4.517 5.918 1.00 . A A . 8 LYS C 1 1 1 125 1 1 9 LYS CA C 0.018 3.957 4.517 1.00 . A A . 8 LYS CA 1 1 1 126 1 1 9 LYS CB C 0.638 5.023 3.614 1.00 . A A . 8 LYS CB 1 1 1 127 1 1 9 LYS CD C 1.836 3.492 2.045 1.00 . A A . 8 LYS CD 1 1 1 128 1 1 9 LYS CE C 3.104 4.206 1.573 1.00 . A A . 8 LYS CE 1 1 1 129 1 1 9 LYS CG C 0.697 4.505 2.176 1.00 . A A . 8 LYS CG 1 1 1 130 1 1 9 LYS H H -1.436 2.679 3.569 1.00 . A A . 8 LYS H 1 1 1 131 1 1 9 LYS HA H 0.665 3.095 4.565 1.00 . A A . 8 LYS HA 1 1 1 132 1 1 9 LYS HB2 H 0.036 5.920 3.650 1.00 . A A . 8 LYS HB2 1 1 1 133 1 1 9 LYS HB3 H 1.636 5.245 3.956 1.00 . A A . 8 LYS HB3 1 1 1 134 1 1 9 LYS HD2 H 2.018 3.029 3.004 1.00 . A A . 8 LYS HD2 1 1 1 135 1 1 9 LYS HD3 H 1.563 2.734 1.326 1.00 . A A . 8 LYS HD3 1 1 1 136 1 1 9 LYS HE2 H 3.016 5.272 1.734 1.00 . A A . 8 LYS HE2 1 1 1 137 1 1 9 LYS HE3 H 3.969 3.817 2.086 1.00 . A A . 8 LYS HE3 1 1 1 138 1 1 9 LYS HG2 H -0.240 4.031 1.926 1.00 . A A . 8 LYS HG2 1 1 1 139 1 1 9 LYS HG3 H 0.874 5.331 1.503 1.00 . A A . 8 LYS HG3 1 1 1 140 1 1 9 LYS HZ1 H 2.246 3.706 -0.256 1.00 . A A . 8 LYS HZ1 1 1 1 141 1 1 9 LYS HZ2 H 3.600 4.724 -0.381 1.00 . A A . 8 LYS HZ2 1 1 1 142 1 1 9 LYS HZ3 H 3.803 3.074 -0.028 1.00 . A A . 8 LYS HZ3 1 1 1 143 1 1 9 LYS N N -1.274 3.600 3.863 1.00 . A A . 8 LYS N 1 1 1 144 1 1 9 LYS NZ N 3.195 3.905 0.117 1.00 . A A . 8 LYS NZ 1 1 1 145 1 1 9 LYS O O -1.241 5.145 6.176 1.00 . A A . 8 LYS O 1 1 1 146 1 1 10 ALA C C 0.389 6.344 8.192 1.00 . A A . 9 ALA C 1 1 1 147 1 1 10 ALA CA C 0.487 4.816 8.212 1.00 . A A . 9 ALA CA 1 1 1 148 1 1 10 ALA CB C 1.732 4.368 8.978 1.00 . A A . 9 ALA CB 1 1 1 149 1 1 10 ALA H H 1.482 3.787 6.602 1.00 . A A . 9 ALA H 1 1 1 150 1 1 10 ALA HA H -0.395 4.388 8.660 1.00 . A A . 9 ALA HA 1 1 1 151 1 1 10 ALA HB1 H 2.043 3.396 8.624 1.00 . A A . 9 ALA HB1 1 1 1 152 1 1 10 ALA HB2 H 2.528 5.080 8.820 1.00 . A A . 9 ALA HB2 1 1 1 153 1 1 10 ALA HB3 H 1.505 4.310 10.033 1.00 . A A . 9 ALA HB3 1 1 1 154 1 1 10 ALA N N 0.676 4.296 6.828 1.00 . A A . 9 ALA N 1 1 1 155 1 1 10 ALA O O -0.218 6.942 9.055 1.00 . A A . 9 ALA O 1 1 1 156 1 1 11 LEU C C 0.962 9.116 8.485 1.00 . A A . 10 LEU C 1 1 1 157 1 1 11 LEU CA C 0.947 8.461 7.099 1.00 . A A . 10 LEU CA 1 1 1 158 1 1 11 LEU CB C -0.349 8.777 6.338 1.00 . A A . 10 LEU CB 1 1 1 159 1 1 11 LEU CD1 C -2.179 10.193 7.278 1.00 . A A . 10 LEU CD1 1 1 1 160 1 1 11 LEU CD2 C -2.591 7.778 6.810 1.00 . A A . 10 LEU CD2 1 1 1 161 1 1 11 LEU CG C -1.554 8.798 7.286 1.00 . A A . 10 LEU CG 1 1 1 162 1 1 11 LEU H H 1.466 6.448 6.528 1.00 . A A . 10 LEU H 1 1 1 163 1 1 11 LEU HA H 1.792 8.807 6.525 1.00 . A A . 10 LEU HA 1 1 1 164 1 1 11 LEU HB2 H -0.255 9.742 5.863 1.00 . A A . 10 LEU HB2 1 1 1 165 1 1 11 LEU HB3 H -0.508 8.023 5.580 1.00 . A A . 10 LEU HB3 1 1 1 166 1 1 11 LEU HD11 H -1.492 10.893 6.827 1.00 . A A . 10 LEU HD11 1 1 1 167 1 1 11 LEU HD12 H -3.098 10.173 6.710 1.00 . A A . 10 LEU HD12 1 1 1 168 1 1 11 LEU HD13 H -2.390 10.499 8.292 1.00 . A A . 10 LEU HD13 1 1 1 169 1 1 11 LEU HD21 H -2.270 7.350 5.871 1.00 . A A . 10 LEU HD21 1 1 1 170 1 1 11 LEU HD22 H -2.690 6.994 7.546 1.00 . A A . 10 LEU HD22 1 1 1 171 1 1 11 LEU HD23 H -3.543 8.268 6.675 1.00 . A A . 10 LEU HD23 1 1 1 172 1 1 11 LEU HG H -1.241 8.553 8.287 1.00 . A A . 10 LEU HG 1 1 1 173 1 1 11 LEU N N 0.987 6.968 7.206 1.00 . A A . 10 LEU N 1 1 1 174 1 1 11 LEU O O 1.424 8.539 9.450 1.00 . A A . 10 LEU O 1 1 1 175 1 1 12 ALA C C 0.055 12.477 9.743 1.00 . A A . 11 ALA C 1 1 1 176 1 1 12 ALA CA C 0.453 11.009 9.915 1.00 . A A . 11 ALA CA 1 1 1 177 1 1 12 ALA CB C 1.888 10.901 10.435 1.00 . A A . 11 ALA CB 1 1 1 178 1 1 12 ALA H H 0.099 10.768 7.801 1.00 . A A . 11 ALA H 1 1 1 179 1 1 12 ALA HA H -0.222 10.512 10.593 1.00 . A A . 11 ALA HA 1 1 1 180 1 1 12 ALA HB1 H 2.578 10.984 9.608 1.00 . A A . 11 ALA HB1 1 1 1 181 1 1 12 ALA HB2 H 2.076 11.697 11.141 1.00 . A A . 11 ALA HB2 1 1 1 182 1 1 12 ALA HB3 H 2.024 9.948 10.923 1.00 . A A . 11 ALA HB3 1 1 1 183 1 1 12 ALA N N 0.464 10.318 8.591 1.00 . A A . 11 ALA N 1 1 1 184 1 1 12 ALA O O 0.637 13.356 10.347 1.00 . A A . 11 ALA O 1 1 1 185 1 1 13 NH2 HN1 H -1.394 12.076 8.446 1.00 . A A . 12 NH2 HN1 1 1 1 186 1 1 13 NH2 HN2 H -1.187 13.719 8.817 1.00 . A A . 12 NH2 HN2 1 1 1 187 1 1 13 NH2 N N -0.924 12.783 8.935 1.00 . A A . 12 NH2 N 1 1 2 188 1 1 2 ILE C C -2.026 -4.899 1.720 1.00 . A A . 1 ILE C 1 1 2 189 1 1 2 ILE CA C -0.845 -5.126 2.667 1.00 . A A . 1 ILE CA 1 1 2 190 1 1 2 ILE CB C 0.480 -4.649 2.050 1.00 . A A . 1 ILE CB 1 1 2 191 1 1 2 ILE CD1 C 2.622 -3.475 2.611 1.00 . A A . 1 ILE CD1 1 1 2 192 1 1 2 ILE CG1 C 1.406 -4.200 3.185 1.00 . A A . 1 ILE CG1 1 1 2 193 1 1 2 ILE CG2 C 0.239 -3.476 1.079 1.00 . A A . 1 ILE CG2 1 1 2 194 1 1 2 ILE H H 0.225 -6.989 2.840 1.00 . A A . 1 ILE H 1 1 2 195 1 1 2 ILE HA H -1.010 -4.619 3.598 1.00 . A A . 1 ILE HA 1 1 2 196 1 1 2 ILE HB H 0.937 -5.466 1.517 1.00 . A A . 1 ILE HB 1 1 2 197 1 1 2 ILE HD11 H 3.039 -4.056 1.803 1.00 . A A . 1 ILE HD11 1 1 2 198 1 1 2 ILE HD12 H 2.319 -2.506 2.240 1.00 . A A . 1 ILE HD12 1 1 2 199 1 1 2 ILE HD13 H 3.363 -3.347 3.385 1.00 . A A . 1 ILE HD13 1 1 2 200 1 1 2 ILE HG12 H 0.868 -3.531 3.844 1.00 . A A . 1 ILE HG12 1 1 2 201 1 1 2 ILE HG13 H 1.736 -5.065 3.743 1.00 . A A . 1 ILE HG13 1 1 2 202 1 1 2 ILE HG21 H -0.752 -3.075 1.233 1.00 . A A . 1 ILE HG21 1 1 2 203 1 1 2 ILE HG22 H 0.966 -2.698 1.252 1.00 . A A . 1 ILE HG22 1 1 2 204 1 1 2 ILE HG23 H 0.326 -3.825 0.062 1.00 . A A . 1 ILE HG23 1 1 2 205 1 1 2 ILE N N -0.666 -6.584 2.905 1.00 . A A . 1 ILE N 1 1 2 206 1 1 2 ILE O O -3.126 -4.613 2.144 1.00 . A A . 1 ILE O 1 1 2 207 1 1 3 ASP C C -3.387 -3.351 -0.451 1.00 . A A . 2 ASP C 1 1 2 208 1 1 3 ASP CA C -2.880 -4.790 -0.545 1.00 . A A . 2 ASP CA 1 1 2 209 1 1 3 ASP CB C -3.980 -5.779 -0.161 1.00 . A A . 2 ASP CB 1 1 2 210 1 1 3 ASP CG C -5.004 -5.871 -1.293 1.00 . A A . 2 ASP CG 1 1 2 211 1 1 3 ASP H H -0.892 -5.241 0.138 1.00 . A A . 2 ASP H 1 1 2 212 1 1 3 ASP HA H -2.531 -4.995 -1.543 1.00 . A A . 2 ASP HA 1 1 2 213 1 1 3 ASP HB2 H -3.545 -6.753 0.012 1.00 . A A . 2 ASP HB2 1 1 2 214 1 1 3 ASP HB3 H -4.471 -5.440 0.740 1.00 . A A . 2 ASP HB3 1 1 2 215 1 1 3 ASP N N -1.791 -5.015 0.444 1.00 . A A . 2 ASP N 1 1 2 216 1 1 3 ASP O O -3.193 -2.553 -1.346 1.00 . A A . 2 ASP O 1 1 2 217 1 1 3 ASP OD1 O -4.592 -5.850 -2.441 1.00 . A A . 2 ASP OD1 1 1 2 218 1 1 3 ASP OD2 O -6.183 -5.959 -0.993 1.00 . A A . 2 ASP OD2 1 1 2 219 1 1 4 TYR C C -3.468 -0.626 1.115 1.00 . A A . 3 TYR C 1 1 2 220 1 1 4 TYR CA C -4.576 -1.636 0.767 1.00 . A A . 3 TYR CA 1 1 2 221 1 1 4 TYR CB C -5.642 -1.729 1.867 1.00 . A A . 3 TYR CB 1 1 2 222 1 1 4 TYR CD1 C -4.731 -3.264 3.645 1.00 . A A . 3 TYR CD1 1 1 2 223 1 1 4 TYR CD2 C -4.687 -0.871 4.028 1.00 . A A . 3 TYR CD2 1 1 2 224 1 1 4 TYR CE1 C -4.145 -3.474 4.898 1.00 . A A . 3 TYR CE1 1 1 2 225 1 1 4 TYR CE2 C -4.104 -1.080 5.280 1.00 . A A . 3 TYR CE2 1 1 2 226 1 1 4 TYR CG C -5.001 -1.962 3.211 1.00 . A A . 3 TYR CG 1 1 2 227 1 1 4 TYR CZ C -3.832 -2.380 5.715 1.00 . A A . 3 TYR CZ 1 1 2 228 1 1 4 TYR H H -4.195 -3.682 1.326 1.00 . A A . 3 TYR H 1 1 2 229 1 1 4 TYR HA H -5.047 -1.338 -0.150 1.00 . A A . 3 TYR HA 1 1 2 230 1 1 4 TYR HB2 H -6.204 -0.809 1.897 1.00 . A A . 3 TYR HB2 1 1 2 231 1 1 4 TYR HB3 H -6.311 -2.548 1.645 1.00 . A A . 3 TYR HB3 1 1 2 232 1 1 4 TYR HD1 H -4.974 -4.106 3.013 1.00 . A A . 3 TYR HD1 1 1 2 233 1 1 4 TYR HD2 H -4.896 0.132 3.691 1.00 . A A . 3 TYR HD2 1 1 2 234 1 1 4 TYR HE1 H -3.935 -4.478 5.235 1.00 . A A . 3 TYR HE1 1 1 2 235 1 1 4 TYR HE2 H -3.861 -0.237 5.911 1.00 . A A . 3 TYR HE2 1 1 2 236 1 1 4 TYR HH H -3.852 -3.139 7.467 1.00 . A A . 3 TYR HH 1 1 2 237 1 1 4 TYR N N -4.044 -3.019 0.621 1.00 . A A . 3 TYR N 1 1 2 238 1 1 4 TYR O O -3.329 0.364 0.436 1.00 . A A . 3 TYR O 1 1 2 239 1 1 4 TYR OH O -3.258 -2.587 6.952 1.00 . A A . 3 TYR OH 1 1 2 240 1 1 5 TRP C C -1.243 1.057 1.445 1.00 . A A . 4 TRP C 1 1 2 241 1 1 5 TRP CA C -1.590 0.078 2.570 1.00 . A A . 4 TRP CA 1 1 2 242 1 1 5 TRP CB C -0.372 -0.806 2.848 1.00 . A A . 4 TRP CB 1 1 2 243 1 1 5 TRP CD1 C -1.412 -2.552 4.369 1.00 . A A . 4 TRP CD1 1 1 2 244 1 1 5 TRP CD2 C 0.231 -1.398 5.366 1.00 . A A . 4 TRP CD2 1 1 2 245 1 1 5 TRP CE2 C -0.250 -2.320 6.321 1.00 . A A . 4 TRP CE2 1 1 2 246 1 1 5 TRP CE3 C 1.275 -0.545 5.741 1.00 . A A . 4 TRP CE3 1 1 2 247 1 1 5 TRP CG C -0.528 -1.555 4.137 1.00 . A A . 4 TRP CG 1 1 2 248 1 1 5 TRP CH2 C 1.331 -1.536 7.962 1.00 . A A . 4 TRP CH2 1 1 2 249 1 1 5 TRP CZ2 C 0.288 -2.395 7.604 1.00 . A A . 4 TRP CZ2 1 1 2 250 1 1 5 TRP CZ3 C 1.825 -0.612 7.031 1.00 . A A . 4 TRP CZ3 1 1 2 251 1 1 5 TRP H H -2.838 -1.678 2.673 1.00 . A A . 4 TRP H 1 1 2 252 1 1 5 TRP HA H -1.866 0.613 3.464 1.00 . A A . 4 TRP HA 1 1 2 253 1 1 5 TRP HB2 H -0.256 -1.503 2.043 1.00 . A A . 4 TRP HB2 1 1 2 254 1 1 5 TRP HB3 H 0.509 -0.184 2.905 1.00 . A A . 4 TRP HB3 1 1 2 255 1 1 5 TRP HD1 H -2.126 -2.939 3.662 1.00 . A A . 4 TRP HD1 1 1 2 256 1 1 5 TRP HE1 H -1.772 -3.719 6.084 1.00 . A A . 4 TRP HE1 1 1 2 257 1 1 5 TRP HE3 H 1.659 0.163 5.027 1.00 . A A . 4 TRP HE3 1 1 2 258 1 1 5 TRP HH2 H 1.755 -1.585 8.954 1.00 . A A . 4 TRP HH2 1 1 2 259 1 1 5 TRP HZ2 H -0.098 -3.110 8.314 1.00 . A A . 4 TRP HZ2 1 1 2 260 1 1 5 TRP HZ3 H 2.630 0.052 7.308 1.00 . A A . 4 TRP HZ3 1 1 2 261 1 1 5 TRP N N -2.694 -0.871 2.157 1.00 . A A . 4 TRP N 1 1 2 262 1 1 5 TRP NE1 N -1.248 -3.004 5.665 1.00 . A A . 4 TRP NE1 1 1 2 263 1 1 5 TRP O O -1.267 2.259 1.615 1.00 . A A . 4 TRP O 1 1 2 264 1 1 6 LEU C C -1.429 2.657 -0.908 1.00 . A A . 5 LEU C 1 1 2 265 1 1 6 LEU CA C -0.569 1.384 -0.873 1.00 . A A . 5 LEU CA 1 1 2 266 1 1 6 LEU CB C -0.855 0.476 -2.074 1.00 . A A . 5 LEU CB 1 1 2 267 1 1 6 LEU CD1 C 0.147 1.977 -3.805 1.00 . A A . 5 LEU CD1 1 1 2 268 1 1 6 LEU CD2 C -1.667 0.370 -4.424 1.00 . A A . 5 LEU CD2 1 1 2 269 1 1 6 LEU CG C -1.141 1.303 -3.328 1.00 . A A . 5 LEU CG 1 1 2 270 1 1 6 LEU H H -0.915 -0.445 0.201 1.00 . A A . 5 LEU H 1 1 2 271 1 1 6 LEU HA H 0.479 1.638 -0.849 1.00 . A A . 5 LEU HA 1 1 2 272 1 1 6 LEU HB2 H 0.001 -0.157 -2.254 1.00 . A A . 5 LEU HB2 1 1 2 273 1 1 6 LEU HB3 H -1.712 -0.143 -1.855 1.00 . A A . 5 LEU HB3 1 1 2 274 1 1 6 LEU HD11 H 0.978 1.300 -3.673 1.00 . A A . 5 LEU HD11 1 1 2 275 1 1 6 LEU HD12 H 0.054 2.233 -4.850 1.00 . A A . 5 LEU HD12 1 1 2 276 1 1 6 LEU HD13 H 0.319 2.874 -3.228 1.00 . A A . 5 LEU HD13 1 1 2 277 1 1 6 LEU HD21 H -0.984 -0.457 -4.551 1.00 . A A . 5 LEU HD21 1 1 2 278 1 1 6 LEU HD22 H -2.638 -0.009 -4.137 1.00 . A A . 5 LEU HD22 1 1 2 279 1 1 6 LEU HD23 H -1.752 0.914 -5.352 1.00 . A A . 5 LEU HD23 1 1 2 280 1 1 6 LEU HG H -1.883 2.055 -3.107 1.00 . A A . 5 LEU HG 1 1 2 281 1 1 6 LEU N N -0.922 0.530 0.297 1.00 . A A . 5 LEU N 1 1 2 282 1 1 6 LEU O O -0.918 3.755 -1.005 1.00 . A A . 5 LEU O 1 1 2 283 1 1 7 ALA C C -3.875 4.266 0.527 1.00 . A A . 6 ALA C 1 1 2 284 1 1 7 ALA CA C -3.607 3.728 -0.884 1.00 . A A . 6 ALA CA 1 1 2 285 1 1 7 ALA CB C -4.910 3.237 -1.517 1.00 . A A . 6 ALA CB 1 1 2 286 1 1 7 ALA H H -3.121 1.626 -0.771 1.00 . A A . 6 ALA H 1 1 2 287 1 1 7 ALA HA H -3.167 4.493 -1.502 1.00 . A A . 6 ALA HA 1 1 2 288 1 1 7 ALA HB1 H -5.018 2.176 -1.343 1.00 . A A . 6 ALA HB1 1 1 2 289 1 1 7 ALA HB2 H -5.744 3.760 -1.073 1.00 . A A . 6 ALA HB2 1 1 2 290 1 1 7 ALA HB3 H -4.889 3.427 -2.580 1.00 . A A . 6 ALA HB3 1 1 2 291 1 1 7 ALA N N -2.725 2.520 -0.841 1.00 . A A . 6 ALA N 1 1 2 292 1 1 7 ALA O O -4.683 5.151 0.717 1.00 . A A . 6 ALA O 1 1 2 293 1 1 8 HIS C C -2.147 4.696 3.534 1.00 . A A . 7 HIS C 1 1 2 294 1 1 8 HIS CA C -3.457 4.209 2.909 1.00 . A A . 7 HIS CA 1 1 2 295 1 1 8 HIS CB C -3.995 2.990 3.669 1.00 . A A . 7 HIS CB 1 1 2 296 1 1 8 HIS CD2 C -5.118 1.897 1.549 1.00 . A A . 7 HIS CD2 1 1 2 297 1 1 8 HIS CE1 C -7.002 1.322 2.441 1.00 . A A . 7 HIS CE1 1 1 2 298 1 1 8 HIS CG C -5.069 2.302 2.860 1.00 . A A . 7 HIS CG 1 1 2 299 1 1 8 HIS H H -2.576 3.008 1.352 1.00 . A A . 7 HIS H 1 1 2 300 1 1 8 HIS HA H -4.192 4.999 2.914 1.00 . A A . 7 HIS HA 1 1 2 301 1 1 8 HIS HB2 H -3.186 2.298 3.851 1.00 . A A . 7 HIS HB2 1 1 2 302 1 1 8 HIS HB3 H -4.409 3.312 4.613 1.00 . A A . 7 HIS HB3 1 1 2 303 1 1 8 HIS HD1 H -6.573 2.069 4.339 1.00 . A A . 7 HIS HD1 1 1 2 304 1 1 8 HIS HD2 H -4.331 2.026 0.833 1.00 . A A . 7 HIS HD2 1 1 2 305 1 1 8 HIS HE1 H -7.986 0.908 2.577 1.00 . A A . 7 HIS HE1 1 1 2 306 1 1 8 HIS HE2 H -6.637 0.903 0.441 1.00 . A A . 7 HIS HE2 1 1 2 307 1 1 8 HIS N N -3.217 3.730 1.519 1.00 . A A . 7 HIS N 1 1 2 308 1 1 8 HIS ND1 N -6.287 1.924 3.413 1.00 . A A . 7 HIS ND1 1 1 2 309 1 1 8 HIS NE2 N -6.333 1.285 1.292 1.00 . A A . 7 HIS NE2 1 1 2 310 1 1 8 HIS O O -1.973 4.669 4.736 1.00 . A A . 7 HIS O 1 1 2 311 1 1 9 LYS C C 0.197 7.141 3.076 1.00 . A A . 8 LYS C 1 1 2 312 1 1 9 LYS CA C 0.076 5.627 3.274 1.00 . A A . 8 LYS CA 1 1 2 313 1 1 9 LYS CB C 1.146 4.894 2.465 1.00 . A A . 8 LYS CB 1 1 2 314 1 1 9 LYS CD C 2.042 2.801 3.497 1.00 . A A . 8 LYS CD 1 1 2 315 1 1 9 LYS CE C 3.415 3.207 2.953 1.00 . A A . 8 LYS CE 1 1 2 316 1 1 9 LYS CG C 0.946 3.383 2.603 1.00 . A A . 8 LYS CG 1 1 2 317 1 1 9 LYS H H -1.383 5.153 1.759 1.00 . A A . 8 LYS H 1 1 2 318 1 1 9 LYS HA H 0.164 5.374 4.317 1.00 . A A . 8 LYS HA 1 1 2 319 1 1 9 LYS HB2 H 1.068 5.175 1.424 1.00 . A A . 8 LYS HB2 1 1 2 320 1 1 9 LYS HB3 H 2.125 5.160 2.837 1.00 . A A . 8 LYS HB3 1 1 2 321 1 1 9 LYS HD2 H 1.926 3.179 4.502 1.00 . A A . 8 LYS HD2 1 1 2 322 1 1 9 LYS HD3 H 1.966 1.724 3.506 1.00 . A A . 8 LYS HD3 1 1 2 323 1 1 9 LYS HE2 H 4.018 2.330 2.764 1.00 . A A . 8 LYS HE2 1 1 2 324 1 1 9 LYS HE3 H 3.304 3.791 2.053 1.00 . A A . 8 LYS HE3 1 1 2 325 1 1 9 LYS HG2 H -0.021 3.189 3.045 1.00 . A A . 8 LYS HG2 1 1 2 326 1 1 9 LYS HG3 H 0.996 2.923 1.629 1.00 . A A . 8 LYS HG3 1 1 2 327 1 1 9 LYS HZ1 H 3.965 3.531 4.934 1.00 . A A . 8 LYS HZ1 1 1 2 328 1 1 9 LYS HZ2 H 5.020 4.224 3.802 1.00 . A A . 8 LYS HZ2 1 1 2 329 1 1 9 LYS HZ3 H 3.508 4.940 4.102 1.00 . A A . 8 LYS HZ3 1 1 2 330 1 1 9 LYS N N -1.222 5.139 2.726 1.00 . A A . 8 LYS N 1 1 2 331 1 1 9 LYS NZ N 4.022 4.038 4.029 1.00 . A A . 8 LYS NZ 1 1 2 332 1 1 9 LYS O O -0.783 7.859 3.096 1.00 . A A . 8 LYS O 1 1 2 333 1 1 10 ALA C C 0.514 9.634 1.719 1.00 . A A . 9 ALA C 1 1 2 334 1 1 10 ALA CA C 1.572 9.098 2.686 1.00 . A A . 9 ALA CA 1 1 2 335 1 1 10 ALA CB C 2.971 9.248 2.088 1.00 . A A . 9 ALA CB 1 1 2 336 1 1 10 ALA H H 2.170 7.035 2.871 1.00 . A A . 9 ALA H 1 1 2 337 1 1 10 ALA HA H 1.518 9.616 3.631 1.00 . A A . 9 ALA HA 1 1 2 338 1 1 10 ALA HB1 H 3.655 8.589 2.603 1.00 . A A . 9 ALA HB1 1 1 2 339 1 1 10 ALA HB2 H 2.944 8.989 1.040 1.00 . A A . 9 ALA HB2 1 1 2 340 1 1 10 ALA HB3 H 3.303 10.269 2.199 1.00 . A A . 9 ALA HB3 1 1 2 341 1 1 10 ALA N N 1.392 7.630 2.885 1.00 . A A . 9 ALA N 1 1 2 342 1 1 10 ALA O O 0.158 10.795 1.754 1.00 . A A . 9 ALA O 1 1 2 343 1 1 11 LEU C C -2.216 9.867 0.635 1.00 . A A . 10 LEU C 1 1 2 344 1 1 11 LEU CA C -1.027 9.259 -0.113 1.00 . A A . 10 LEU CA 1 1 2 345 1 1 11 LEU CB C -1.455 8.000 -0.867 1.00 . A A . 10 LEU CB 1 1 2 346 1 1 11 LEU CD1 C -2.976 9.372 -2.297 1.00 . A A . 10 LEU CD1 1 1 2 347 1 1 11 LEU CD2 C -0.609 8.987 -2.999 1.00 . A A . 10 LEU CD2 1 1 2 348 1 1 11 LEU CG C -1.823 8.366 -2.306 1.00 . A A . 10 LEU CG 1 1 2 349 1 1 11 LEU H H 0.308 7.864 0.843 1.00 . A A . 10 LEU H 1 1 2 350 1 1 11 LEU HA H -0.607 9.976 -0.801 1.00 . A A . 10 LEU HA 1 1 2 351 1 1 11 LEU HB2 H -0.640 7.290 -0.872 1.00 . A A . 10 LEU HB2 1 1 2 352 1 1 11 LEU HB3 H -2.312 7.561 -0.379 1.00 . A A . 10 LEU HB3 1 1 2 353 1 1 11 LEU HD11 H -3.735 9.043 -1.605 1.00 . A A . 10 LEU HD11 1 1 2 354 1 1 11 LEU HD12 H -2.605 10.340 -1.993 1.00 . A A . 10 LEU HD12 1 1 2 355 1 1 11 LEU HD13 H -3.397 9.444 -3.290 1.00 . A A . 10 LEU HD13 1 1 2 356 1 1 11 LEU HD21 H 0.293 8.679 -2.491 1.00 . A A . 10 LEU HD21 1 1 2 357 1 1 11 LEU HD22 H -0.574 8.657 -4.027 1.00 . A A . 10 LEU HD22 1 1 2 358 1 1 11 LEU HD23 H -0.690 10.063 -2.970 1.00 . A A . 10 LEU HD23 1 1 2 359 1 1 11 LEU HG H -2.128 7.475 -2.837 1.00 . A A . 10 LEU HG 1 1 2 360 1 1 11 LEU N N 0.008 8.797 0.855 1.00 . A A . 10 LEU N 1 1 2 361 1 1 11 LEU O O -2.889 10.749 0.139 1.00 . A A . 10 LEU O 1 1 2 362 1 1 12 ALA C C -3.125 10.968 3.636 1.00 . A A . 11 ALA C 1 1 2 363 1 1 12 ALA CA C -3.626 9.955 2.604 1.00 . A A . 11 ALA CA 1 1 2 364 1 1 12 ALA CB C -4.251 8.745 3.302 1.00 . A A . 11 ALA CB 1 1 2 365 1 1 12 ALA H H -1.925 8.691 2.208 1.00 . A A . 11 ALA H 1 1 2 366 1 1 12 ALA HA H -4.345 10.412 1.944 1.00 . A A . 11 ALA HA 1 1 2 367 1 1 12 ALA HB1 H -4.356 7.936 2.594 1.00 . A A . 11 ALA HB1 1 1 2 368 1 1 12 ALA HB2 H -3.615 8.431 4.115 1.00 . A A . 11 ALA HB2 1 1 2 369 1 1 12 ALA HB3 H -5.223 9.015 3.688 1.00 . A A . 11 ALA HB3 1 1 2 370 1 1 12 ALA N N -2.481 9.402 1.826 1.00 . A A . 11 ALA N 1 1 2 371 1 1 12 ALA O O -3.373 10.831 4.817 1.00 . A A . 11 ALA O 1 1 2 372 1 1 13 NH2 HN1 H -2.221 12.105 2.282 1.00 . A A . 12 NH2 HN1 1 1 2 373 1 1 13 NH2 HN2 H -2.095 12.649 3.885 1.00 . A A . 12 NH2 HN2 1 1 2 374 1 1 13 NH2 N N -2.422 11.992 3.234 1.00 . A A . 12 NH2 N 1 1 3 375 1 1 2 ILE C C -1.995 -4.844 1.624 1.00 . A A . 1 ILE C 1 1 3 376 1 1 2 ILE CA C -0.832 -5.112 2.582 1.00 . A A . 1 ILE CA 1 1 3 377 1 1 2 ILE CB C 0.501 -4.581 2.024 1.00 . A A . 1 ILE CB 1 1 3 378 1 1 2 ILE CD1 C 1.889 -5.337 3.963 1.00 . A A . 1 ILE CD1 1 1 3 379 1 1 2 ILE CG1 C 1.378 -4.120 3.190 1.00 . A A . 1 ILE CG1 1 1 3 380 1 1 2 ILE CG2 C 0.274 -3.394 1.071 1.00 . A A . 1 ILE CG2 1 1 3 381 1 1 2 ILE H H 0.248 -6.977 2.599 1.00 . A A . 1 ILE H 1 1 3 382 1 1 2 ILE HA H -1.024 -4.667 3.538 1.00 . A A . 1 ILE HA 1 1 3 383 1 1 2 ILE HB H 0.999 -5.372 1.495 1.00 . A A . 1 ILE HB 1 1 3 384 1 1 2 ILE HD11 H 2.296 -6.058 3.270 1.00 . A A . 1 ILE HD11 1 1 3 385 1 1 2 ILE HD12 H 2.660 -5.027 4.653 1.00 . A A . 1 ILE HD12 1 1 3 386 1 1 2 ILE HD13 H 1.073 -5.783 4.511 1.00 . A A . 1 ILE HD13 1 1 3 387 1 1 2 ILE HG12 H 2.219 -3.557 2.805 1.00 . A A . 1 ILE HG12 1 1 3 388 1 1 2 ILE HG13 H 0.797 -3.494 3.852 1.00 . A A . 1 ILE HG13 1 1 3 389 1 1 2 ILE HG21 H -0.724 -3.000 1.208 1.00 . A A . 1 ILE HG21 1 1 3 390 1 1 2 ILE HG22 H 0.994 -2.617 1.283 1.00 . A A . 1 ILE HG22 1 1 3 391 1 1 2 ILE HG23 H 0.391 -3.722 0.049 1.00 . A A . 1 ILE HG23 1 1 3 392 1 1 2 ILE N N -0.638 -6.579 2.736 1.00 . A A . 1 ILE N 1 1 3 393 1 1 2 ILE O O -3.103 -4.580 2.042 1.00 . A A . 1 ILE O 1 1 3 394 1 1 3 ASP C C -3.358 -3.230 -0.488 1.00 . A A . 2 ASP C 1 1 3 395 1 1 3 ASP CA C -2.800 -4.641 -0.662 1.00 . A A . 2 ASP CA 1 1 3 396 1 1 3 ASP CB C -3.878 -5.692 -0.399 1.00 . A A . 2 ASP CB 1 1 3 397 1 1 3 ASP CG C -4.098 -6.526 -1.663 1.00 . A A . 2 ASP CG 1 1 3 398 1 1 3 ASP H H -0.831 -5.120 0.052 1.00 . A A . 2 ASP H 1 1 3 399 1 1 3 ASP HA H -2.406 -4.752 -1.657 1.00 . A A . 2 ASP HA 1 1 3 400 1 1 3 ASP HB2 H -3.563 -6.336 0.408 1.00 . A A . 2 ASP HB2 1 1 3 401 1 1 3 ASP HB3 H -4.801 -5.201 -0.129 1.00 . A A . 2 ASP HB3 1 1 3 402 1 1 3 ASP N N -1.737 -4.905 0.347 1.00 . A A . 2 ASP N 1 1 3 403 1 1 3 ASP O O -3.166 -2.370 -1.324 1.00 . A A . 2 ASP O 1 1 3 404 1 1 3 ASP OD1 O -3.115 -6.946 -2.250 1.00 . A A . 2 ASP OD1 1 1 3 405 1 1 3 ASP OD2 O -5.247 -6.729 -2.023 1.00 . A A . 2 ASP OD2 1 1 3 406 1 1 4 TYR C C -3.528 -0.632 1.210 1.00 . A A . 3 TYR C 1 1 3 407 1 1 4 TYR CA C -4.617 -1.628 0.790 1.00 . A A . 3 TYR CA 1 1 3 408 1 1 4 TYR CB C -5.703 -1.790 1.858 1.00 . A A . 3 TYR CB 1 1 3 409 1 1 4 TYR CD1 C -4.767 -3.337 3.608 1.00 . A A . 3 TYR CD1 1 1 3 410 1 1 4 TYR CD2 C -4.840 -0.957 4.063 1.00 . A A . 3 TYR CD2 1 1 3 411 1 1 4 TYR CE1 C -4.201 -3.558 4.866 1.00 . A A . 3 TYR CE1 1 1 3 412 1 1 4 TYR CE2 C -4.277 -1.178 5.321 1.00 . A A . 3 TYR CE2 1 1 3 413 1 1 4 TYR CG C -5.085 -2.036 3.207 1.00 . A A . 3 TYR CG 1 1 3 414 1 1 4 TYR CZ C -3.957 -2.478 5.722 1.00 . A A . 3 TYR CZ 1 1 3 415 1 1 4 TYR H H -4.199 -3.689 1.244 1.00 . A A . 3 TYR H 1 1 3 416 1 1 4 TYR HA H -5.069 -1.289 -0.123 1.00 . A A . 3 TYR HA 1 1 3 417 1 1 4 TYR HB2 H -6.301 -0.892 1.898 1.00 . A A . 3 TYR HB2 1 1 3 418 1 1 4 TYR HB3 H -6.336 -2.627 1.598 1.00 . A A . 3 TYR HB3 1 1 3 419 1 1 4 TYR HD1 H -4.956 -4.169 2.945 1.00 . A A . 3 TYR HD1 1 1 3 420 1 1 4 TYR HD2 H -5.086 0.046 3.751 1.00 . A A . 3 TYR HD2 1 1 3 421 1 1 4 TYR HE1 H -3.953 -4.562 5.179 1.00 . A A . 3 TYR HE1 1 1 3 422 1 1 4 TYR HE2 H -4.088 -0.346 5.983 1.00 . A A . 3 TYR HE2 1 1 3 423 1 1 4 TYR HH H -3.594 -1.932 7.515 1.00 . A A . 3 TYR HH 1 1 3 424 1 1 4 TYR N N -4.051 -2.984 0.582 1.00 . A A . 3 TYR N 1 1 3 425 1 1 4 TYR O O -3.398 0.398 0.594 1.00 . A A . 3 TYR O 1 1 3 426 1 1 4 TYR OH O -3.404 -2.696 6.968 1.00 . A A . 3 TYR OH 1 1 3 427 1 1 5 TRP C C -1.261 0.949 1.542 1.00 . A A . 4 TRP C 1 1 3 428 1 1 5 TRP CA C -1.651 0.011 2.684 1.00 . A A . 4 TRP CA 1 1 3 429 1 1 5 TRP CB C -0.439 -0.866 3.015 1.00 . A A . 4 TRP CB 1 1 3 430 1 1 5 TRP CD1 C -1.518 -2.686 4.416 1.00 . A A . 4 TRP CD1 1 1 3 431 1 1 5 TRP CD2 C 0.052 -1.542 5.535 1.00 . A A . 4 TRP CD2 1 1 3 432 1 1 5 TRP CE2 C -0.453 -2.512 6.427 1.00 . A A . 4 TRP CE2 1 1 3 433 1 1 5 TRP CE3 C 1.061 -0.684 5.991 1.00 . A A . 4 TRP CE3 1 1 3 434 1 1 5 TRP CG C -0.647 -1.664 4.265 1.00 . A A . 4 TRP CG 1 1 3 435 1 1 5 TRP CH2 C 1.033 -1.768 8.171 1.00 . A A . 4 TRP CH2 1 1 3 436 1 1 5 TRP CZ2 C 0.026 -2.630 7.729 1.00 . A A . 4 TRP CZ2 1 1 3 437 1 1 5 TRP CZ3 C 1.551 -0.797 7.302 1.00 . A A . 4 TRP CZ3 1 1 3 438 1 1 5 TRP H H -2.870 -1.776 2.698 1.00 . A A . 4 TRP H 1 1 3 439 1 1 5 TRP HA H -1.959 0.570 3.553 1.00 . A A . 4 TRP HA 1 1 3 440 1 1 5 TRP HB2 H -0.259 -1.532 2.199 1.00 . A A . 4 TRP HB2 1 1 3 441 1 1 5 TRP HB3 H 0.426 -0.230 3.143 1.00 . A A . 4 TRP HB3 1 1 3 442 1 1 5 TRP HD1 H -2.188 -3.059 3.662 1.00 . A A . 4 TRP HD1 1 1 3 443 1 1 5 TRP HE1 H -1.930 -3.928 6.063 1.00 . A A . 4 TRP HE1 1 1 3 444 1 1 5 TRP HE3 H 1.464 0.060 5.325 1.00 . A A . 4 TRP HE3 1 1 3 445 1 1 5 TRP HH2 H 1.414 -1.851 9.178 1.00 . A A . 4 TRP HH2 1 1 3 446 1 1 5 TRP HZ2 H -0.377 -3.383 8.388 1.00 . A A . 4 TRP HZ2 1 1 3 447 1 1 5 TRP HZ3 H 2.330 -0.131 7.643 1.00 . A A . 4 TRP HZ3 1 1 3 448 1 1 5 TRP N N -2.744 -0.933 2.233 1.00 . A A . 4 TRP N 1 1 3 449 1 1 5 TRP NE1 N -1.404 -3.187 5.698 1.00 . A A . 4 TRP NE1 1 1 3 450 1 1 5 TRP O O -1.214 2.154 1.686 1.00 . A A . 4 TRP O 1 1 3 451 1 1 6 LEU C C -1.433 2.478 -0.852 1.00 . A A . 5 LEU C 1 1 3 452 1 1 6 LEU CA C -0.622 1.175 -0.794 1.00 . A A . 5 LEU CA 1 1 3 453 1 1 6 LEU CB C -0.974 0.251 -1.971 1.00 . A A . 5 LEU CB 1 1 3 454 1 1 6 LEU CD1 C 0.136 2.129 -3.248 1.00 . A A . 5 LEU CD1 1 1 3 455 1 1 6 LEU CD2 C 1.134 -0.167 -3.239 1.00 . A A . 5 LEU CD2 1 1 3 456 1 1 6 LEU CG C -0.173 0.627 -3.227 1.00 . A A . 5 LEU CG 1 1 3 457 1 1 6 LEU H H -1.059 -0.599 0.328 1.00 . A A . 5 LEU H 1 1 3 458 1 1 6 LEU HA H 0.436 1.384 -0.795 1.00 . A A . 5 LEU HA 1 1 3 459 1 1 6 LEU HB2 H -0.740 -0.767 -1.698 1.00 . A A . 5 LEU HB2 1 1 3 460 1 1 6 LEU HB3 H -2.030 0.322 -2.183 1.00 . A A . 5 LEU HB3 1 1 3 461 1 1 6 LEU HD11 H -0.785 2.687 -3.168 1.00 . A A . 5 LEU HD11 1 1 3 462 1 1 6 LEU HD12 H 0.779 2.374 -2.415 1.00 . A A . 5 LEU HD12 1 1 3 463 1 1 6 LEU HD13 H 0.633 2.381 -4.172 1.00 . A A . 5 LEU HD13 1 1 3 464 1 1 6 LEU HD21 H 1.454 -0.348 -2.222 1.00 . A A . 5 LEU HD21 1 1 3 465 1 1 6 LEU HD22 H 0.976 -1.111 -3.739 1.00 . A A . 5 LEU HD22 1 1 3 466 1 1 6 LEU HD23 H 1.893 0.395 -3.761 1.00 . A A . 5 LEU HD23 1 1 3 467 1 1 6 LEU HG H -0.751 0.373 -4.104 1.00 . A A . 5 LEU HG 1 1 3 468 1 1 6 LEU N N -0.997 0.376 0.402 1.00 . A A . 5 LEU N 1 1 3 469 1 1 6 LEU O O -0.885 3.554 -0.985 1.00 . A A . 5 LEU O 1 1 3 470 1 1 7 ALA C C -3.816 4.196 0.579 1.00 . A A . 6 ALA C 1 1 3 471 1 1 7 ALA CA C -3.581 3.617 -0.820 1.00 . A A . 6 ALA CA 1 1 3 472 1 1 7 ALA CB C -4.907 3.143 -1.416 1.00 . A A . 6 ALA CB 1 1 3 473 1 1 7 ALA H H -3.155 1.508 -0.661 1.00 . A A . 6 ALA H 1 1 3 474 1 1 7 ALA HA H -3.133 4.356 -1.466 1.00 . A A . 6 ALA HA 1 1 3 475 1 1 7 ALA HB1 H -5.335 2.382 -0.778 1.00 . A A . 6 ALA HB1 1 1 3 476 1 1 7 ALA HB2 H -5.590 3.977 -1.487 1.00 . A A . 6 ALA HB2 1 1 3 477 1 1 7 ALA HB3 H -4.736 2.733 -2.400 1.00 . A A . 6 ALA HB3 1 1 3 478 1 1 7 ALA N N -2.733 2.387 -0.762 1.00 . A A . 6 ALA N 1 1 3 479 1 1 7 ALA O O -4.534 5.161 0.745 1.00 . A A . 6 ALA O 1 1 3 480 1 1 8 HIS C C -2.160 4.577 3.600 1.00 . A A . 7 HIS C 1 1 3 481 1 1 8 HIS CA C -3.477 4.110 2.972 1.00 . A A . 7 HIS CA 1 1 3 482 1 1 8 HIS CB C -4.053 2.916 3.747 1.00 . A A . 7 HIS CB 1 1 3 483 1 1 8 HIS CD2 C -5.226 1.862 1.627 1.00 . A A . 7 HIS CD2 1 1 3 484 1 1 8 HIS CE1 C -7.076 1.245 2.552 1.00 . A A . 7 HIS CE1 1 1 3 485 1 1 8 HIS CG C -5.143 2.239 2.947 1.00 . A A . 7 HIS CG 1 1 3 486 1 1 8 HIS H H -2.687 2.809 1.445 1.00 . A A . 7 HIS H 1 1 3 487 1 1 8 HIS HA H -4.193 4.917 2.958 1.00 . A A . 7 HIS HA 1 1 3 488 1 1 8 HIS HB2 H -3.263 2.206 3.944 1.00 . A A . 7 HIS HB2 1 1 3 489 1 1 8 HIS HB3 H -4.461 3.264 4.684 1.00 . A A . 7 HIS HB3 1 1 3 490 1 1 8 HIS HD1 H -6.609 1.954 4.456 1.00 . A A . 7 HIS HD1 1 1 3 491 1 1 8 HIS HD2 H -4.464 2.015 0.892 1.00 . A A . 7 HIS HD2 1 1 3 492 1 1 8 HIS HE1 H -8.051 0.818 2.702 1.00 . A A . 7 HIS HE1 1 1 3 493 1 1 8 HIS HE2 H -6.762 0.876 0.538 1.00 . A A . 7 HIS HE2 1 1 3 494 1 1 8 HIS N N -3.246 3.601 1.591 1.00 . A A . 7 HIS N 1 1 3 495 1 1 8 HIS ND1 N -6.343 1.834 3.520 1.00 . A A . 7 HIS ND1 1 1 3 496 1 1 8 HIS NE2 N -6.439 1.241 1.388 1.00 . A A . 7 HIS NE2 1 1 3 497 1 1 8 HIS O O -2.070 5.664 4.137 1.00 . A A . 7 HIS O 1 1 3 498 1 1 9 LYS C C -0.062 4.821 5.500 1.00 . A A . 8 LYS C 1 1 3 499 1 1 9 LYS CA C 0.165 4.166 4.138 1.00 . A A . 8 LYS CA 1 1 3 500 1 1 9 LYS CB C 0.765 5.165 3.146 1.00 . A A . 8 LYS CB 1 1 3 501 1 1 9 LYS CD C 2.334 3.995 1.594 1.00 . A A . 8 LYS CD 1 1 3 502 1 1 9 LYS CE C 2.507 2.679 2.356 1.00 . A A . 8 LYS CE 1 1 3 503 1 1 9 LYS CG C 0.903 4.504 1.773 1.00 . A A . 8 LYS CG 1 1 3 504 1 1 9 LYS H H -1.226 2.899 3.108 1.00 . A A . 8 LYS H 1 1 3 505 1 1 9 LYS HA H 0.813 3.310 4.235 1.00 . A A . 8 LYS HA 1 1 3 506 1 1 9 LYS HB2 H 0.118 6.027 3.068 1.00 . A A . 8 LYS HB2 1 1 3 507 1 1 9 LYS HB3 H 1.740 5.474 3.491 1.00 . A A . 8 LYS HB3 1 1 3 508 1 1 9 LYS HD2 H 2.529 3.831 0.544 1.00 . A A . 8 LYS HD2 1 1 3 509 1 1 9 LYS HD3 H 3.028 4.725 1.979 1.00 . A A . 8 LYS HD3 1 1 3 510 1 1 9 LYS HE2 H 2.577 2.868 3.419 1.00 . A A . 8 LYS HE2 1 1 3 511 1 1 9 LYS HE3 H 1.686 2.010 2.145 1.00 . A A . 8 LYS HE3 1 1 3 512 1 1 9 LYS HG2 H 0.213 3.677 1.702 1.00 . A A . 8 LYS HG2 1 1 3 513 1 1 9 LYS HG3 H 0.681 5.226 1.002 1.00 . A A . 8 LYS HG3 1 1 3 514 1 1 9 LYS HZ1 H 3.784 2.138 0.804 1.00 . A A . 8 LYS HZ1 1 1 3 515 1 1 9 LYS HZ2 H 4.583 2.651 2.213 1.00 . A A . 8 LYS HZ2 1 1 3 516 1 1 9 LYS HZ3 H 3.863 1.113 2.153 1.00 . A A . 8 LYS HZ3 1 1 3 517 1 1 9 LYS N N -1.137 3.767 3.541 1.00 . A A . 8 LYS N 1 1 3 518 1 1 9 LYS NZ N 3.780 2.101 1.843 1.00 . A A . 8 LYS NZ 1 1 3 519 1 1 9 LYS O O -0.915 4.413 6.264 1.00 . A A . 8 LYS O 1 1 3 520 1 1 10 ALA C C -0.948 6.825 7.376 1.00 . A A . 9 ALA C 1 1 3 521 1 1 10 ALA CA C 0.531 6.521 7.118 1.00 . A A . 9 ALA CA 1 1 3 522 1 1 10 ALA CB C 1.329 7.817 6.985 1.00 . A A . 9 ALA CB 1 1 3 523 1 1 10 ALA H H 1.371 6.135 5.173 1.00 . A A . 9 ALA H 1 1 3 524 1 1 10 ALA HA H 0.937 5.917 7.915 1.00 . A A . 9 ALA HA 1 1 3 525 1 1 10 ALA HB1 H 2.021 7.731 6.161 1.00 . A A . 9 ALA HB1 1 1 3 526 1 1 10 ALA HB2 H 0.653 8.639 6.804 1.00 . A A . 9 ALA HB2 1 1 3 527 1 1 10 ALA HB3 H 1.878 7.998 7.898 1.00 . A A . 9 ALA HB3 1 1 3 528 1 1 10 ALA N N 0.695 5.830 5.807 1.00 . A A . 9 ALA N 1 1 3 529 1 1 10 ALA O O -1.400 6.837 8.504 1.00 . A A . 9 ALA O 1 1 3 530 1 1 11 LEU C C -3.328 8.565 7.469 1.00 . A A . 10 LEU C 1 1 3 531 1 1 11 LEU CA C -3.152 7.373 6.524 1.00 . A A . 10 LEU CA 1 1 3 532 1 1 11 LEU CB C -3.748 6.107 7.140 1.00 . A A . 10 LEU CB 1 1 3 533 1 1 11 LEU CD1 C -6.053 5.179 7.393 1.00 . A A . 10 LEU CD1 1 1 3 534 1 1 11 LEU CD2 C -5.125 6.711 9.134 1.00 . A A . 10 LEU CD2 1 1 3 535 1 1 11 LEU CG C -5.164 6.399 7.636 1.00 . A A . 10 LEU CG 1 1 3 536 1 1 11 LEU H H -1.316 7.054 5.439 1.00 . A A . 10 LEU H 1 1 3 537 1 1 11 LEU HA H -3.617 7.574 5.573 1.00 . A A . 10 LEU HA 1 1 3 538 1 1 11 LEU HB2 H -3.781 5.325 6.394 1.00 . A A . 10 LEU HB2 1 1 3 539 1 1 11 LEU HB3 H -3.137 5.787 7.970 1.00 . A A . 10 LEU HB3 1 1 3 540 1 1 11 LEU HD11 H -5.763 4.699 6.470 1.00 . A A . 10 LEU HD11 1 1 3 541 1 1 11 LEU HD12 H -5.941 4.482 8.211 1.00 . A A . 10 LEU HD12 1 1 3 542 1 1 11 LEU HD13 H -7.085 5.492 7.327 1.00 . A A . 10 LEU HD13 1 1 3 543 1 1 11 LEU HD21 H -4.098 6.774 9.462 1.00 . A A . 10 LEU HD21 1 1 3 544 1 1 11 LEU HD22 H -5.621 7.651 9.319 1.00 . A A . 10 LEU HD22 1 1 3 545 1 1 11 LEU HD23 H -5.628 5.924 9.678 1.00 . A A . 10 LEU HD23 1 1 3 546 1 1 11 LEU HG H -5.565 7.249 7.100 1.00 . A A . 10 LEU HG 1 1 3 547 1 1 11 LEU N N -1.702 7.070 6.340 1.00 . A A . 10 LEU N 1 1 3 548 1 1 11 LEU O O -3.044 8.484 8.648 1.00 . A A . 10 LEU O 1 1 3 549 1 1 12 ALA C C -5.476 11.048 8.156 1.00 . A A . 11 ALA C 1 1 3 550 1 1 12 ALA CA C -3.991 10.868 7.831 1.00 . A A . 11 ALA CA 1 1 3 551 1 1 12 ALA CB C -3.475 12.046 7.004 1.00 . A A . 11 ALA CB 1 1 3 552 1 1 12 ALA H H -4.019 9.718 6.008 1.00 . A A . 11 ALA H 1 1 3 553 1 1 12 ALA HA H -3.414 10.773 8.737 1.00 . A A . 11 ALA HA 1 1 3 554 1 1 12 ALA HB1 H -3.624 11.842 5.954 1.00 . A A . 11 ALA HB1 1 1 3 555 1 1 12 ALA HB2 H -4.016 12.941 7.277 1.00 . A A . 11 ALA HB2 1 1 3 556 1 1 12 ALA HB3 H -2.422 12.189 7.199 1.00 . A A . 11 ALA HB3 1 1 3 557 1 1 12 ALA N N -3.796 9.672 6.961 1.00 . A A . 11 ALA N 1 1 3 558 1 1 12 ALA O O -6.272 10.154 7.951 1.00 . A A . 11 ALA O 1 1 3 559 1 1 13 NH2 HN1 H -5.245 12.903 8.827 1.00 . A A . 12 NH2 HN1 1 1 3 560 1 1 13 NH2 HN2 H -6.833 12.307 8.873 1.00 . A A . 12 NH2 HN2 1 1 3 561 1 1 13 NH2 N N -5.885 12.181 8.660 1.00 . A A . 12 NH2 N 1 1 4 562 1 1 2 ILE C C -2.004 -5.039 1.603 1.00 . A A . 1 ILE C 1 1 4 563 1 1 2 ILE CA C -0.868 -5.270 2.600 1.00 . A A . 1 ILE CA 1 1 4 564 1 1 2 ILE CB C 0.470 -4.713 2.084 1.00 . A A . 1 ILE CB 1 1 4 565 1 1 2 ILE CD1 C 2.506 -3.455 2.831 1.00 . A A . 1 ILE CD1 1 1 4 566 1 1 2 ILE CG1 C 1.302 -4.270 3.294 1.00 . A A . 1 ILE CG1 1 1 4 567 1 1 2 ILE CG2 C 0.236 -3.513 1.144 1.00 . A A . 1 ILE CG2 1 1 4 568 1 1 2 ILE H H 0.266 -7.093 2.772 1.00 . A A . 1 ILE H 1 1 4 569 1 1 2 ILE HA H -1.103 -4.817 3.545 1.00 . A A . 1 ILE HA 1 1 4 570 1 1 2 ILE HB H 0.998 -5.489 1.551 1.00 . A A . 1 ILE HB 1 1 4 571 1 1 2 ILE HD11 H 3.022 -3.988 2.047 1.00 . A A . 1 ILE HD11 1 1 4 572 1 1 2 ILE HD12 H 2.169 -2.499 2.456 1.00 . A A . 1 ILE HD12 1 1 4 573 1 1 2 ILE HD13 H 3.176 -3.298 3.664 1.00 . A A . 1 ILE HD13 1 1 4 574 1 1 2 ILE HG12 H 0.689 -3.664 3.948 1.00 . A A . 1 ILE HG12 1 1 4 575 1 1 2 ILE HG13 H 1.646 -5.143 3.831 1.00 . A A . 1 ILE HG13 1 1 4 576 1 1 2 ILE HG21 H -0.776 -3.152 1.259 1.00 . A A . 1 ILE HG21 1 1 4 577 1 1 2 ILE HG22 H 0.923 -2.718 1.380 1.00 . A A . 1 ILE HG22 1 1 4 578 1 1 2 ILE HG23 H 0.387 -3.825 0.120 1.00 . A A . 1 ILE HG23 1 1 4 579 1 1 2 ILE N N -0.644 -6.730 2.776 1.00 . A A . 1 ILE N 1 1 4 580 1 1 2 ILE O O -3.134 -4.804 1.978 1.00 . A A . 1 ILE O 1 1 4 581 1 1 3 ASP C C -3.303 -3.449 -0.577 1.00 . A A . 2 ASP C 1 1 4 582 1 1 3 ASP CA C -2.745 -4.867 -0.695 1.00 . A A . 2 ASP CA 1 1 4 583 1 1 3 ASP CB C -3.833 -5.903 -0.405 1.00 . A A . 2 ASP CB 1 1 4 584 1 1 3 ASP CG C -4.016 -6.808 -1.625 1.00 . A A . 2 ASP CG 1 1 4 585 1 1 3 ASP H H -0.780 -5.285 0.072 1.00 . A A . 2 ASP H 1 1 4 586 1 1 3 ASP HA H -2.340 -5.023 -1.680 1.00 . A A . 2 ASP HA 1 1 4 587 1 1 3 ASP HB2 H -3.542 -6.499 0.448 1.00 . A A . 2 ASP HB2 1 1 4 588 1 1 3 ASP HB3 H -4.762 -5.398 -0.190 1.00 . A A . 2 ASP HB3 1 1 4 589 1 1 3 ASP N N -1.701 -5.097 0.339 1.00 . A A . 2 ASP N 1 1 4 590 1 1 3 ASP O O -3.082 -2.612 -1.428 1.00 . A A . 2 ASP O 1 1 4 591 1 1 3 ASP OD1 O -3.112 -6.858 -2.441 1.00 . A A . 2 ASP OD1 1 1 4 592 1 1 3 ASP OD2 O -5.058 -7.435 -1.720 1.00 . A A . 2 ASP OD2 1 1 4 593 1 1 4 TYR C C -3.551 -0.789 1.065 1.00 . A A . 3 TYR C 1 1 4 594 1 1 4 TYR CA C -4.610 -1.812 0.621 1.00 . A A . 3 TYR CA 1 1 4 595 1 1 4 TYR CB C -5.744 -1.953 1.647 1.00 . A A . 3 TYR CB 1 1 4 596 1 1 4 TYR CD1 C -4.997 -3.667 3.337 1.00 . A A . 3 TYR CD1 1 1 4 597 1 1 4 TYR CD2 C -4.914 -1.318 3.937 1.00 . A A . 3 TYR CD2 1 1 4 598 1 1 4 TYR CE1 C -4.503 -4.003 4.602 1.00 . A A . 3 TYR CE1 1 1 4 599 1 1 4 TYR CE2 C -4.423 -1.656 5.200 1.00 . A A . 3 TYR CE2 1 1 4 600 1 1 4 TYR CG C -5.200 -2.323 3.005 1.00 . A A . 3 TYR CG 1 1 4 601 1 1 4 TYR CZ C -4.217 -2.998 5.532 1.00 . A A . 3 TYR CZ 1 1 4 602 1 1 4 TYR H H -4.206 -3.867 1.137 1.00 . A A . 3 TYR H 1 1 4 603 1 1 4 TYR HA H -5.026 -1.495 -0.316 1.00 . A A . 3 TYR HA 1 1 4 604 1 1 4 TYR HB2 H -6.275 -1.016 1.721 1.00 . A A . 3 TYR HB2 1 1 4 605 1 1 4 TYR HB3 H -6.427 -2.721 1.315 1.00 . A A . 3 TYR HB3 1 1 4 606 1 1 4 TYR HD1 H -5.218 -4.441 2.618 1.00 . A A . 3 TYR HD1 1 1 4 607 1 1 4 TYR HD2 H -5.069 -0.283 3.679 1.00 . A A . 3 TYR HD2 1 1 4 608 1 1 4 TYR HE1 H -4.344 -5.040 4.860 1.00 . A A . 3 TYR HE1 1 1 4 609 1 1 4 TYR HE2 H -4.201 -0.882 5.919 1.00 . A A . 3 TYR HE2 1 1 4 610 1 1 4 TYR HH H -4.406 -3.858 7.227 1.00 . A A . 3 TYR HH 1 1 4 611 1 1 4 TYR N N -4.032 -3.175 0.466 1.00 . A A . 3 TYR N 1 1 4 612 1 1 4 TYR O O -3.370 0.205 0.400 1.00 . A A . 3 TYR O 1 1 4 613 1 1 4 TYR OH O -3.736 -3.332 6.782 1.00 . A A . 3 TYR OH 1 1 4 614 1 1 5 TRP C C -1.416 0.955 1.628 1.00 . A A . 4 TRP C 1 1 4 615 1 1 5 TRP CA C -1.812 -0.077 2.685 1.00 . A A . 4 TRP CA 1 1 4 616 1 1 5 TRP CB C -0.596 -0.948 3.004 1.00 . A A . 4 TRP CB 1 1 4 617 1 1 5 TRP CD1 C -1.683 -2.797 4.359 1.00 . A A . 4 TRP CD1 1 1 4 618 1 1 5 TRP CD2 C -0.177 -1.625 5.538 1.00 . A A . 4 TRP CD2 1 1 4 619 1 1 5 TRP CE2 C -0.692 -2.609 6.408 1.00 . A A . 4 TRP CE2 1 1 4 620 1 1 5 TRP CE3 C 0.794 -0.747 6.032 1.00 . A A . 4 TRP CE3 1 1 4 621 1 1 5 TRP CG C -0.824 -1.759 4.242 1.00 . A A . 4 TRP CG 1 1 4 622 1 1 5 TRP CH2 C 0.712 -1.836 8.208 1.00 . A A . 4 TRP CH2 1 1 4 623 1 1 5 TRP CZ2 C -0.257 -2.719 7.727 1.00 . A A . 4 TRP CZ2 1 1 4 624 1 1 5 TRP CZ3 C 1.239 -0.850 7.361 1.00 . A A . 4 TRP CZ3 1 1 4 625 1 1 5 TRP H H -3.039 -1.846 2.665 1.00 . A A . 4 TRP H 1 1 4 626 1 1 5 TRP HA H -2.154 0.413 3.582 1.00 . A A . 4 TRP HA 1 1 4 627 1 1 5 TRP HB2 H -0.411 -1.605 2.178 1.00 . A A . 4 TRP HB2 1 1 4 628 1 1 5 TRP HB3 H 0.265 -0.312 3.150 1.00 . A A . 4 TRP HB3 1 1 4 629 1 1 5 TRP HD1 H -2.319 -3.180 3.578 1.00 . A A . 4 TRP HD1 1 1 4 630 1 1 5 TRP HE1 H -2.123 -4.057 5.987 1.00 . A A . 4 TRP HE1 1 1 4 631 1 1 5 TRP HE3 H 1.203 0.008 5.384 1.00 . A A . 4 TRP HE3 1 1 4 632 1 1 5 TRP HH2 H 1.053 -1.913 9.228 1.00 . A A . 4 TRP HH2 1 1 4 633 1 1 5 TRP HZ2 H -0.668 -3.482 8.372 1.00 . A A . 4 TRP HZ2 1 1 4 634 1 1 5 TRP HZ3 H 1.988 -0.167 7.732 1.00 . A A . 4 TRP HZ3 1 1 4 635 1 1 5 TRP N N -2.864 -1.031 2.169 1.00 . A A . 4 TRP N 1 1 4 636 1 1 5 TRP NE1 N -1.600 -3.303 5.642 1.00 . A A . 4 TRP NE1 1 1 4 637 1 1 5 TRP O O -1.503 2.148 1.840 1.00 . A A . 4 TRP O 1 1 4 638 1 1 6 LEU C C -1.420 2.669 -0.644 1.00 . A A . 5 LEU C 1 1 4 639 1 1 6 LEU CA C -0.570 1.387 -0.618 1.00 . A A . 5 LEU CA 1 1 4 640 1 1 6 LEU CB C -0.801 0.530 -1.870 1.00 . A A . 5 LEU CB 1 1 4 641 1 1 6 LEU CD1 C 0.204 2.135 -3.502 1.00 . A A . 5 LEU CD1 1 1 4 642 1 1 6 LEU CD2 C -1.543 0.509 -4.244 1.00 . A A . 5 LEU CD2 1 1 4 643 1 1 6 LEU CG C -1.076 1.404 -3.094 1.00 . A A . 5 LEU CG 1 1 4 644 1 1 6 LEU H H -0.930 -0.487 0.368 1.00 . A A . 5 LEU H 1 1 4 645 1 1 6 LEU HA H 0.477 1.632 -0.532 1.00 . A A . 5 LEU HA 1 1 4 646 1 1 6 LEU HB2 H 0.077 -0.074 -2.054 1.00 . A A . 5 LEU HB2 1 1 4 647 1 1 6 LEU HB3 H -1.646 -0.120 -1.701 1.00 . A A . 5 LEU HB3 1 1 4 648 1 1 6 LEU HD11 H 0.854 2.230 -2.644 1.00 . A A . 5 LEU HD11 1 1 4 649 1 1 6 LEU HD12 H 0.708 1.575 -4.275 1.00 . A A . 5 LEU HD12 1 1 4 650 1 1 6 LEU HD13 H -0.046 3.118 -3.874 1.00 . A A . 5 LEU HD13 1 1 4 651 1 1 6 LEU HD21 H -1.975 -0.396 -3.841 1.00 . A A . 5 LEU HD21 1 1 4 652 1 1 6 LEU HD22 H -2.284 1.031 -4.829 1.00 . A A . 5 LEU HD22 1 1 4 653 1 1 6 LEU HD23 H -0.700 0.257 -4.870 1.00 . A A . 5 LEU HD23 1 1 4 654 1 1 6 LEU HG H -1.846 2.124 -2.860 1.00 . A A . 5 LEU HG 1 1 4 655 1 1 6 LEU N N -0.984 0.484 0.494 1.00 . A A . 5 LEU N 1 1 4 656 1 1 6 LEU O O -0.899 3.764 -0.712 1.00 . A A . 5 LEU O 1 1 4 657 1 1 7 ALA C C -3.901 4.289 0.754 1.00 . A A . 6 ALA C 1 1 4 658 1 1 7 ALA CA C -3.589 3.760 -0.653 1.00 . A A . 6 ALA CA 1 1 4 659 1 1 7 ALA CB C -4.872 3.295 -1.341 1.00 . A A . 6 ALA CB 1 1 4 660 1 1 7 ALA H H -3.124 1.651 -0.568 1.00 . A A . 6 ALA H 1 1 4 661 1 1 7 ALA HA H -3.120 4.530 -1.245 1.00 . A A . 6 ALA HA 1 1 4 662 1 1 7 ALA HB1 H -5.168 2.336 -0.943 1.00 . A A . 6 ALA HB1 1 1 4 663 1 1 7 ALA HB2 H -5.657 4.017 -1.163 1.00 . A A . 6 ALA HB2 1 1 4 664 1 1 7 ALA HB3 H -4.699 3.207 -2.404 1.00 . A A . 6 ALA HB3 1 1 4 665 1 1 7 ALA N N -2.719 2.543 -0.610 1.00 . A A . 6 ALA N 1 1 4 666 1 1 7 ALA O O -4.883 4.976 0.956 1.00 . A A . 6 ALA O 1 1 4 667 1 1 8 HIS C C -2.130 5.165 3.693 1.00 . A A . 7 HIS C 1 1 4 668 1 1 8 HIS CA C -3.374 4.486 3.111 1.00 . A A . 7 HIS CA 1 1 4 669 1 1 8 HIS CB C -3.754 3.247 3.932 1.00 . A A . 7 HIS CB 1 1 4 670 1 1 8 HIS CD2 C -4.628 1.846 1.897 1.00 . A A . 7 HIS CD2 1 1 4 671 1 1 8 HIS CE1 C -6.537 1.228 2.708 1.00 . A A . 7 HIS CE1 1 1 4 672 1 1 8 HIS CG C -4.712 2.389 3.150 1.00 . A A . 7 HIS CG 1 1 4 673 1 1 8 HIS H H -2.300 3.427 1.561 1.00 . A A . 7 HIS H 1 1 4 674 1 1 8 HIS HA H -4.202 5.178 3.091 1.00 . A A . 7 HIS HA 1 1 4 675 1 1 8 HIS HB2 H -2.863 2.678 4.154 1.00 . A A . 7 HIS HB2 1 1 4 676 1 1 8 HIS HB3 H -4.221 3.557 4.854 1.00 . A A . 7 HIS HB3 1 1 4 677 1 1 8 HIS HD1 H -6.309 2.206 4.535 1.00 . A A . 7 HIS HD1 1 1 4 678 1 1 8 HIS HD2 H -3.796 1.971 1.228 1.00 . A A . 7 HIS HD2 1 1 4 679 1 1 8 HIS HE1 H -7.503 0.761 2.819 1.00 . A A . 7 HIS HE1 1 1 4 680 1 1 8 HIS HE2 H -5.983 0.624 0.801 1.00 . A A . 7 HIS HE2 1 1 4 681 1 1 8 HIS N N -3.090 3.983 1.731 1.00 . A A . 7 HIS N 1 1 4 682 1 1 8 HIS ND1 N -5.941 1.984 3.654 1.00 . A A . 7 HIS ND1 1 1 4 683 1 1 8 HIS NE2 N -5.776 1.117 1.622 1.00 . A A . 7 HIS NE2 1 1 4 684 1 1 8 HIS O O -1.447 5.908 3.017 1.00 . A A . 7 HIS O 1 1 4 685 1 1 9 LYS C C -0.862 7.067 5.691 1.00 . A A . 8 LYS C 1 1 4 686 1 1 9 LYS CA C -0.645 5.559 5.572 1.00 . A A . 8 LYS CA 1 1 4 687 1 1 9 LYS CB C 0.526 5.254 4.633 1.00 . A A . 8 LYS CB 1 1 4 688 1 1 9 LYS CD C 1.854 3.224 4.031 1.00 . A A . 8 LYS CD 1 1 4 689 1 1 9 LYS CE C 2.005 2.530 2.676 1.00 . A A . 8 LYS CE 1 1 4 690 1 1 9 LYS CG C 0.443 3.803 4.155 1.00 . A A . 8 LYS CG 1 1 4 691 1 1 9 LYS H H -2.397 4.331 5.474 1.00 . A A . 8 LYS H 1 1 4 692 1 1 9 LYS HA H -0.458 5.129 6.544 1.00 . A A . 8 LYS HA 1 1 4 693 1 1 9 LYS HB2 H 0.489 5.918 3.782 1.00 . A A . 8 LYS HB2 1 1 4 694 1 1 9 LYS HB3 H 1.456 5.401 5.162 1.00 . A A . 8 LYS HB3 1 1 4 695 1 1 9 LYS HD2 H 2.577 4.022 4.111 1.00 . A A . 8 LYS HD2 1 1 4 696 1 1 9 LYS HD3 H 2.020 2.507 4.822 1.00 . A A . 8 LYS HD3 1 1 4 697 1 1 9 LYS HE2 H 1.398 1.636 2.644 1.00 . A A . 8 LYS HE2 1 1 4 698 1 1 9 LYS HE3 H 1.733 3.201 1.876 1.00 . A A . 8 LYS HE3 1 1 4 699 1 1 9 LYS HG2 H -0.125 3.222 4.868 1.00 . A A . 8 LYS HG2 1 1 4 700 1 1 9 LYS HG3 H -0.044 3.768 3.192 1.00 . A A . 8 LYS HG3 1 1 4 701 1 1 9 LYS HZ1 H 3.735 1.649 3.427 1.00 . A A . 8 LYS HZ1 1 1 4 702 1 1 9 LYS HZ2 H 3.612 1.600 1.736 1.00 . A A . 8 LYS HZ2 1 1 4 703 1 1 9 LYS HZ3 H 4.013 3.056 2.515 1.00 . A A . 8 LYS HZ3 1 1 4 704 1 1 9 LYS N N -1.834 4.924 4.944 1.00 . A A . 8 LYS N 1 1 4 705 1 1 9 LYS NZ N 3.451 2.183 2.581 1.00 . A A . 8 LYS NZ 1 1 4 706 1 1 9 LYS O O -1.956 7.531 5.944 1.00 . A A . 8 LYS O 1 1 4 707 1 1 10 ALA C C -1.052 9.811 4.654 1.00 . A A . 9 ALA C 1 1 4 708 1 1 10 ALA CA C 0.036 9.314 5.610 1.00 . A A . 9 ALA CA 1 1 4 709 1 1 10 ALA CB C 1.402 9.865 5.201 1.00 . A A . 9 ALA CB 1 1 4 710 1 1 10 ALA H H 1.040 7.429 5.307 1.00 . A A . 9 ALA H 1 1 4 711 1 1 10 ALA HA H -0.190 9.604 6.623 1.00 . A A . 9 ALA HA 1 1 4 712 1 1 10 ALA HB1 H 2.161 9.478 5.865 1.00 . A A . 9 ALA HB1 1 1 4 713 1 1 10 ALA HB2 H 1.624 9.564 4.188 1.00 . A A . 9 ALA HB2 1 1 4 714 1 1 10 ALA HB3 H 1.388 10.944 5.262 1.00 . A A . 9 ALA HB3 1 1 4 715 1 1 10 ALA N N 0.172 7.831 5.510 1.00 . A A . 9 ALA N 1 1 4 716 1 1 10 ALA O O -1.859 9.046 4.166 1.00 . A A . 9 ALA O 1 1 4 717 1 1 11 LEU C C -3.514 11.247 3.946 1.00 . A A . 10 LEU C 1 1 4 718 1 1 11 LEU CA C -2.114 11.633 3.460 1.00 . A A . 10 LEU CA 1 1 4 719 1 1 11 LEU CB C -1.819 10.985 2.108 1.00 . A A . 10 LEU CB 1 1 4 720 1 1 11 LEU CD1 C -1.954 12.335 0.010 1.00 . A A . 10 LEU CD1 1 1 4 721 1 1 11 LEU CD2 C -3.510 10.412 0.360 1.00 . A A . 10 LEU CD2 1 1 4 722 1 1 11 LEU CG C -2.762 11.557 1.049 1.00 . A A . 10 LEU CG 1 1 4 723 1 1 11 LEU H H -0.419 11.688 4.789 1.00 . A A . 10 LEU H 1 1 4 724 1 1 11 LEU HA H -2.023 12.705 3.383 1.00 . A A . 10 LEU HA 1 1 4 725 1 1 11 LEU HB2 H -0.795 11.190 1.826 1.00 . A A . 10 LEU HB2 1 1 4 726 1 1 11 LEU HB3 H -1.966 9.918 2.180 1.00 . A A . 10 LEU HB3 1 1 4 727 1 1 11 LEU HD11 H -0.904 12.280 0.256 1.00 . A A . 10 LEU HD11 1 1 4 728 1 1 11 LEU HD12 H -2.118 11.907 -0.968 1.00 . A A . 10 LEU HD12 1 1 4 729 1 1 11 LEU HD13 H -2.269 13.368 0.008 1.00 . A A . 10 LEU HD13 1 1 4 730 1 1 11 LEU HD21 H -3.887 9.728 1.107 1.00 . A A . 10 LEU HD21 1 1 4 731 1 1 11 LEU HD22 H -4.334 10.812 -0.210 1.00 . A A . 10 LEU HD22 1 1 4 732 1 1 11 LEU HD23 H -2.835 9.888 -0.300 1.00 . A A . 10 LEU HD23 1 1 4 733 1 1 11 LEU HG H -3.474 12.220 1.522 1.00 . A A . 10 LEU HG 1 1 4 734 1 1 11 LEU N N -1.079 11.087 4.384 1.00 . A A . 10 LEU N 1 1 4 735 1 1 11 LEU O O -3.955 10.128 3.774 1.00 . A A . 10 LEU O 1 1 4 736 1 1 12 ALA C C -5.604 10.475 5.717 1.00 . A A . 11 ALA C 1 1 4 737 1 1 12 ALA CA C -5.587 11.852 5.047 1.00 . A A . 11 ALA CA 1 1 4 738 1 1 12 ALA CB C -6.467 11.850 3.797 1.00 . A A . 11 ALA CB 1 1 4 739 1 1 12 ALA H H -3.843 13.062 4.680 1.00 . A A . 11 ALA H 1 1 4 740 1 1 12 ALA HA H -5.923 12.611 5.734 1.00 . A A . 11 ALA HA 1 1 4 741 1 1 12 ALA HB1 H -5.849 11.974 2.920 1.00 . A A . 11 ALA HB1 1 1 4 742 1 1 12 ALA HB2 H -6.999 10.912 3.732 1.00 . A A . 11 ALA HB2 1 1 4 743 1 1 12 ALA HB3 H -7.177 12.662 3.856 1.00 . A A . 11 ALA HB3 1 1 4 744 1 1 12 ALA N N -4.216 12.166 4.552 1.00 . A A . 11 ALA N 1 1 4 745 1 1 12 ALA O O -6.302 9.579 5.285 1.00 . A A . 11 ALA O 1 1 4 746 1 1 13 NH2 HN1 H -4.296 10.990 7.119 1.00 . A A . 12 NH2 HN1 1 1 4 747 1 1 13 NH2 HN2 H -4.862 9.391 7.206 1.00 . A A . 12 NH2 HN2 1 1 4 748 1 1 13 NH2 N N -4.858 10.268 6.768 1.00 . A A . 12 NH2 N 1 1 5 749 1 1 2 ILE C C -1.992 -5.038 1.582 1.00 . A A . 1 ILE C 1 1 5 750 1 1 2 ILE CA C -0.856 -5.262 2.581 1.00 . A A . 1 ILE CA 1 1 5 751 1 1 2 ILE CB C 0.477 -4.677 2.083 1.00 . A A . 1 ILE CB 1 1 5 752 1 1 2 ILE CD1 C 2.469 -3.362 2.863 1.00 . A A . 1 ILE CD1 1 1 5 753 1 1 2 ILE CG1 C 1.277 -4.208 3.305 1.00 . A A . 1 ILE CG1 1 1 5 754 1 1 2 ILE CG2 C 0.232 -3.489 1.128 1.00 . A A . 1 ILE CG2 1 1 5 755 1 1 2 ILE H H 0.309 -7.067 2.737 1.00 . A A . 1 ILE H 1 1 5 756 1 1 2 ILE HA H -1.104 -4.827 3.531 1.00 . A A . 1 ILE HA 1 1 5 757 1 1 2 ILE HB H 1.031 -5.444 1.565 1.00 . A A . 1 ILE HB 1 1 5 758 1 1 2 ILE HD11 H 2.558 -3.403 1.788 1.00 . A A . 1 ILE HD11 1 1 5 759 1 1 2 ILE HD12 H 2.314 -2.338 3.173 1.00 . A A . 1 ILE HD12 1 1 5 760 1 1 2 ILE HD13 H 3.370 -3.744 3.317 1.00 . A A . 1 ILE HD13 1 1 5 761 1 1 2 ILE HG12 H 0.637 -3.618 3.946 1.00 . A A . 1 ILE HG12 1 1 5 762 1 1 2 ILE HG13 H 1.635 -5.070 3.850 1.00 . A A . 1 ILE HG13 1 1 5 763 1 1 2 ILE HG21 H -0.784 -3.139 1.236 1.00 . A A . 1 ILE HG21 1 1 5 764 1 1 2 ILE HG22 H 0.911 -2.684 1.357 1.00 . A A . 1 ILE HG22 1 1 5 765 1 1 2 ILE HG23 H 0.390 -3.810 0.109 1.00 . A A . 1 ILE HG23 1 1 5 766 1 1 2 ILE N N -0.607 -6.720 2.737 1.00 . A A . 1 ILE N 1 1 5 767 1 1 2 ILE O O -3.125 -4.811 1.956 1.00 . A A . 1 ILE O 1 1 5 768 1 1 3 ASP C C -3.307 -3.461 -0.593 1.00 . A A . 2 ASP C 1 1 5 769 1 1 3 ASP CA C -2.731 -4.872 -0.719 1.00 . A A . 2 ASP CA 1 1 5 770 1 1 3 ASP CB C -3.805 -5.925 -0.442 1.00 . A A . 2 ASP CB 1 1 5 771 1 1 3 ASP CG C -4.672 -6.111 -1.689 1.00 . A A . 2 ASP CG 1 1 5 772 1 1 3 ASP H H -0.765 -5.275 0.052 1.00 . A A . 2 ASP H 1 1 5 773 1 1 3 ASP HA H -2.319 -5.015 -1.704 1.00 . A A . 2 ASP HA 1 1 5 774 1 1 3 ASP HB2 H -3.331 -6.863 -0.189 1.00 . A A . 2 ASP HB2 1 1 5 775 1 1 3 ASP HB3 H -4.425 -5.601 0.380 1.00 . A A . 2 ASP HB3 1 1 5 776 1 1 3 ASP N N -1.687 -5.093 0.318 1.00 . A A . 2 ASP N 1 1 5 777 1 1 3 ASP O O -3.090 -2.616 -1.440 1.00 . A A . 2 ASP O 1 1 5 778 1 1 3 ASP OD1 O -5.260 -5.135 -2.128 1.00 . A A . 2 ASP OD1 1 1 5 779 1 1 3 ASP OD2 O -4.733 -7.223 -2.183 1.00 . A A . 2 ASP OD2 1 1 5 780 1 1 4 TYR C C -3.582 -0.816 1.060 1.00 . A A . 3 TYR C 1 1 5 781 1 1 4 TYR CA C -4.633 -1.842 0.607 1.00 . A A . 3 TYR CA 1 1 5 782 1 1 4 TYR CB C -5.776 -1.993 1.623 1.00 . A A . 3 TYR CB 1 1 5 783 1 1 4 TYR CD1 C -5.057 -3.750 3.283 1.00 . A A . 3 TYR CD1 1 1 5 784 1 1 4 TYR CD2 C -4.967 -1.416 3.936 1.00 . A A . 3 TYR CD2 1 1 5 785 1 1 4 TYR CE1 C -4.584 -4.119 4.547 1.00 . A A . 3 TYR CE1 1 1 5 786 1 1 4 TYR CE2 C -4.491 -1.786 5.197 1.00 . A A . 3 TYR CE2 1 1 5 787 1 1 4 TYR CG C -5.248 -2.399 2.978 1.00 . A A . 3 TYR CG 1 1 5 788 1 1 4 TYR CZ C -4.302 -3.137 5.503 1.00 . A A . 3 TYR CZ 1 1 5 789 1 1 4 TYR H H -4.211 -3.895 1.114 1.00 . A A . 3 TYR H 1 1 5 790 1 1 4 TYR HA H -5.044 -1.522 -0.333 1.00 . A A . 3 TYR HA 1 1 5 791 1 1 4 TYR HB2 H -6.297 -1.053 1.715 1.00 . A A . 3 TYR HB2 1 1 5 792 1 1 4 TYR HB3 H -6.465 -2.746 1.270 1.00 . A A . 3 TYR HB3 1 1 5 793 1 1 4 TYR HD1 H -5.275 -4.508 2.545 1.00 . A A . 3 TYR HD1 1 1 5 794 1 1 4 TYR HD2 H -5.112 -0.374 3.700 1.00 . A A . 3 TYR HD2 1 1 5 795 1 1 4 TYR HE1 H -4.436 -5.162 4.785 1.00 . A A . 3 TYR HE1 1 1 5 796 1 1 4 TYR HE2 H -4.272 -1.029 5.936 1.00 . A A . 3 TYR HE2 1 1 5 797 1 1 4 TYR HH H -3.867 -2.727 7.317 1.00 . A A . 3 TYR HH 1 1 5 798 1 1 4 TYR N N -4.043 -3.199 0.447 1.00 . A A . 3 TYR N 1 1 5 799 1 1 4 TYR O O -3.399 0.178 0.396 1.00 . A A . 3 TYR O 1 1 5 800 1 1 4 TYR OH O -3.838 -3.502 6.751 1.00 . A A . 3 TYR OH 1 1 5 801 1 1 5 TRP C C -1.436 0.918 1.630 1.00 . A A . 4 TRP C 1 1 5 802 1 1 5 TRP CA C -1.857 -0.100 2.693 1.00 . A A . 4 TRP CA 1 1 5 803 1 1 5 TRP CB C -0.648 -0.969 3.042 1.00 . A A . 4 TRP CB 1 1 5 804 1 1 5 TRP CD1 C -1.750 -2.832 4.364 1.00 . A A . 4 TRP CD1 1 1 5 805 1 1 5 TRP CD2 C -0.287 -1.647 5.584 1.00 . A A . 4 TRP CD2 1 1 5 806 1 1 5 TRP CE2 C -0.814 -2.640 6.439 1.00 . A A . 4 TRP CE2 1 1 5 807 1 1 5 TRP CE3 C 0.660 -0.759 6.108 1.00 . A A . 4 TRP CE3 1 1 5 808 1 1 5 TRP CG C -0.900 -1.785 4.272 1.00 . A A . 4 TRP CG 1 1 5 809 1 1 5 TRP CH2 C 0.534 -1.858 8.276 1.00 . A A . 4 TRP CH2 1 1 5 810 1 1 5 TRP CZ2 C -0.411 -2.752 7.766 1.00 . A A . 4 TRP CZ2 1 1 5 811 1 1 5 TRP CZ3 C 1.071 -0.862 7.448 1.00 . A A . 4 TRP CZ3 1 1 5 812 1 1 5 TRP H H -3.080 -1.874 2.662 1.00 . A A . 4 TRP H 1 1 5 813 1 1 5 TRP HA H -2.212 0.402 3.578 1.00 . A A . 4 TRP HA 1 1 5 814 1 1 5 TRP HB2 H -0.440 -1.624 2.218 1.00 . A A . 4 TRP HB2 1 1 5 815 1 1 5 TRP HB3 H 0.207 -0.331 3.209 1.00 . A A . 4 TRP HB3 1 1 5 816 1 1 5 TRP HD1 H -2.362 -3.221 3.566 1.00 . A A . 4 TRP HD1 1 1 5 817 1 1 5 TRP HE1 H -2.213 -4.105 5.975 1.00 . A A . 4 TRP HE1 1 1 5 818 1 1 5 TRP HE3 H 1.078 0.003 5.473 1.00 . A A . 4 TRP HE3 1 1 5 819 1 1 5 TRP HH2 H 0.850 -1.935 9.306 1.00 . A A . 4 TRP HH2 1 1 5 820 1 1 5 TRP HZ2 H -0.830 -3.521 8.397 1.00 . A A . 4 TRP HZ2 1 1 5 821 1 1 5 TRP HZ3 H 1.801 -0.172 7.841 1.00 . A A . 4 TRP HZ3 1 1 5 822 1 1 5 TRP N N -2.903 -1.057 2.169 1.00 . A A . 4 TRP N 1 1 5 823 1 1 5 TRP NE1 N -1.692 -3.343 5.647 1.00 . A A . 4 TRP NE1 1 1 5 824 1 1 5 TRP O O -1.497 2.115 1.832 1.00 . A A . 4 TRP O 1 1 5 825 1 1 6 LEU C C -1.439 2.585 -0.684 1.00 . A A . 5 LEU C 1 1 5 826 1 1 6 LEU CA C -0.568 1.321 -0.607 1.00 . A A . 5 LEU CA 1 1 5 827 1 1 6 LEU CB C -0.747 0.449 -1.851 1.00 . A A . 5 LEU CB 1 1 5 828 1 1 6 LEU CD1 C 0.706 1.718 -3.436 1.00 . A A . 5 LEU CD1 1 1 5 829 1 1 6 LEU CD2 C -1.295 0.477 -4.275 1.00 . A A . 5 LEU CD2 1 1 5 830 1 1 6 LEU CG C -0.730 1.304 -3.116 1.00 . A A . 5 LEU CG 1 1 5 831 1 1 6 LEU H H -0.971 -0.542 0.381 1.00 . A A . 5 LEU H 1 1 5 832 1 1 6 LEU HA H 0.470 1.585 -0.492 1.00 . A A . 5 LEU HA 1 1 5 833 1 1 6 LEU HB2 H 0.056 -0.272 -1.899 1.00 . A A . 5 LEU HB2 1 1 5 834 1 1 6 LEU HB3 H -1.690 -0.073 -1.788 1.00 . A A . 5 LEU HB3 1 1 5 835 1 1 6 LEU HD11 H 1.372 1.326 -2.680 1.00 . A A . 5 LEU HD11 1 1 5 836 1 1 6 LEU HD12 H 0.988 1.326 -4.403 1.00 . A A . 5 LEU HD12 1 1 5 837 1 1 6 LEU HD13 H 0.775 2.796 -3.452 1.00 . A A . 5 LEU HD13 1 1 5 838 1 1 6 LEU HD21 H -1.779 -0.407 -3.882 1.00 . A A . 5 LEU HD21 1 1 5 839 1 1 6 LEU HD22 H -2.015 1.067 -4.821 1.00 . A A . 5 LEU HD22 1 1 5 840 1 1 6 LEU HD23 H -0.493 0.184 -4.934 1.00 . A A . 5 LEU HD23 1 1 5 841 1 1 6 LEU HG H -1.338 2.184 -2.970 1.00 . A A . 5 LEU HG 1 1 5 842 1 1 6 LEU N N -1.006 0.431 0.502 1.00 . A A . 5 LEU N 1 1 5 843 1 1 6 LEU O O -0.940 3.679 -0.858 1.00 . A A . 5 LEU O 1 1 5 844 1 1 7 ALA C C -3.862 4.271 0.729 1.00 . A A . 6 ALA C 1 1 5 845 1 1 7 ALA CA C -3.621 3.649 -0.654 1.00 . A A . 6 ALA CA 1 1 5 846 1 1 7 ALA CB C -4.932 3.123 -1.235 1.00 . A A . 6 ALA CB 1 1 5 847 1 1 7 ALA H H -3.122 1.558 -0.441 1.00 . A A . 6 ALA H 1 1 5 848 1 1 7 ALA HA H -3.196 4.380 -1.323 1.00 . A A . 6 ALA HA 1 1 5 849 1 1 7 ALA HB1 H -4.881 2.048 -1.326 1.00 . A A . 6 ALA HB1 1 1 5 850 1 1 7 ALA HB2 H -5.748 3.390 -0.579 1.00 . A A . 6 ALA HB2 1 1 5 851 1 1 7 ALA HB3 H -5.096 3.560 -2.210 1.00 . A A . 6 ALA HB3 1 1 5 852 1 1 7 ALA N N -2.732 2.448 -0.571 1.00 . A A . 6 ALA N 1 1 5 853 1 1 7 ALA O O -4.830 4.976 0.934 1.00 . A A . 6 ALA O 1 1 5 854 1 1 8 HIS C C -1.907 5.224 3.552 1.00 . A A . 7 HIS C 1 1 5 855 1 1 8 HIS CA C -3.214 4.613 3.040 1.00 . A A . 7 HIS CA 1 1 5 856 1 1 8 HIS CB C -3.657 3.451 3.947 1.00 . A A . 7 HIS CB 1 1 5 857 1 1 8 HIS CD2 C -4.412 1.852 2.015 1.00 . A A . 7 HIS CD2 1 1 5 858 1 1 8 HIS CE1 C -6.379 1.331 2.747 1.00 . A A . 7 HIS CE1 1 1 5 859 1 1 8 HIS CG C -4.574 2.522 3.195 1.00 . A A . 7 HIS CG 1 1 5 860 1 1 8 HIS H H -2.226 3.452 1.508 1.00 . A A . 7 HIS H 1 1 5 861 1 1 8 HIS HA H -3.988 5.364 3.005 1.00 . A A . 7 HIS HA 1 1 5 862 1 1 8 HIS HB2 H -2.786 2.903 4.277 1.00 . A A . 7 HIS HB2 1 1 5 863 1 1 8 HIS HB3 H -4.177 3.845 4.809 1.00 . A A . 7 HIS HB3 1 1 5 864 1 1 8 HIS HD1 H -6.266 2.493 4.476 1.00 . A A . 7 HIS HD1 1 1 5 865 1 1 8 HIS HD2 H -3.536 1.907 1.395 1.00 . A A . 7 HIS HD2 1 1 5 866 1 1 8 HIS HE1 H -7.356 0.884 2.835 1.00 . A A . 7 HIS HE1 1 1 5 867 1 1 8 HIS HE2 H -5.703 0.536 0.953 1.00 . A A . 7 HIS HE2 1 1 5 868 1 1 8 HIS N N -3.003 4.024 1.682 1.00 . A A . 7 HIS N 1 1 5 869 1 1 8 HIS ND1 N -5.841 2.179 3.651 1.00 . A A . 7 HIS ND1 1 1 5 870 1 1 8 HIS NE2 N -5.546 1.105 1.734 1.00 . A A . 7 HIS NE2 1 1 5 871 1 1 8 HIS O O -1.778 6.426 3.670 1.00 . A A . 7 HIS O 1 1 5 872 1 1 9 LYS C C 0.126 5.907 5.507 1.00 . A A . 8 LYS C 1 1 5 873 1 1 9 LYS CA C 0.361 4.938 4.350 1.00 . A A . 8 LYS CA 1 1 5 874 1 1 9 LYS CB C 0.970 5.670 3.155 1.00 . A A . 8 LYS CB 1 1 5 875 1 1 9 LYS CD C 2.908 4.348 2.293 1.00 . A A . 8 LYS CD 1 1 5 876 1 1 9 LYS CE C 3.397 3.465 1.142 1.00 . A A . 8 LYS CE 1 1 5 877 1 1 9 LYS CG C 1.419 4.651 2.107 1.00 . A A . 8 LYS CG 1 1 5 878 1 1 9 LYS H H -1.054 3.443 3.749 1.00 . A A . 8 LYS H 1 1 5 879 1 1 9 LYS HA H 1.007 4.133 4.656 1.00 . A A . 8 LYS HA 1 1 5 880 1 1 9 LYS HB2 H 0.233 6.331 2.723 1.00 . A A . 8 LYS HB2 1 1 5 881 1 1 9 LYS HB3 H 1.821 6.244 3.482 1.00 . A A . 8 LYS HB3 1 1 5 882 1 1 9 LYS HD2 H 3.465 5.273 2.299 1.00 . A A . 8 LYS HD2 1 1 5 883 1 1 9 LYS HD3 H 3.056 3.832 3.229 1.00 . A A . 8 LYS HD3 1 1 5 884 1 1 9 LYS HE2 H 4.355 3.027 1.388 1.00 . A A . 8 LYS HE2 1 1 5 885 1 1 9 LYS HE3 H 2.675 2.694 0.926 1.00 . A A . 8 LYS HE3 1 1 5 886 1 1 9 LYS HG2 H 0.849 3.741 2.222 1.00 . A A . 8 LYS HG2 1 1 5 887 1 1 9 LYS HG3 H 1.257 5.055 1.119 1.00 . A A . 8 LYS HG3 1 1 5 888 1 1 9 LYS HZ1 H 2.806 5.133 0.048 1.00 . A A . 8 LYS HZ1 1 1 5 889 1 1 9 LYS HZ2 H 4.473 4.815 -0.020 1.00 . A A . 8 LYS HZ2 1 1 5 890 1 1 9 LYS HZ3 H 3.390 3.852 -0.902 1.00 . A A . 8 LYS HZ3 1 1 5 891 1 1 9 LYS N N -0.934 4.406 3.852 1.00 . A A . 8 LYS N 1 1 5 892 1 1 9 LYS NZ N 3.527 4.386 -0.020 1.00 . A A . 8 LYS NZ 1 1 5 893 1 1 9 LYS O O -0.996 6.217 5.857 1.00 . A A . 8 LYS O 1 1 5 894 1 1 10 ALA C C 0.893 8.772 6.707 1.00 . A A . 9 ALA C 1 1 5 895 1 1 10 ALA CA C 1.029 7.342 7.236 1.00 . A A . 9 ALA CA 1 1 5 896 1 1 10 ALA CB C 2.312 7.191 8.054 1.00 . A A . 9 ALA CB 1 1 5 897 1 1 10 ALA H H 2.069 6.121 5.796 1.00 . A A . 9 ALA H 1 1 5 898 1 1 10 ALA HA H 0.174 7.079 7.839 1.00 . A A . 9 ALA HA 1 1 5 899 1 1 10 ALA HB1 H 3.164 7.188 7.391 1.00 . A A . 9 ALA HB1 1 1 5 900 1 1 10 ALA HB2 H 2.396 8.015 8.747 1.00 . A A . 9 ALA HB2 1 1 5 901 1 1 10 ALA HB3 H 2.280 6.261 8.603 1.00 . A A . 9 ALA HB3 1 1 5 902 1 1 10 ALA N N 1.178 6.387 6.101 1.00 . A A . 9 ALA N 1 1 5 903 1 1 10 ALA O O 1.071 9.733 7.430 1.00 . A A . 9 ALA O 1 1 5 904 1 1 11 LEU C C -0.645 11.067 5.623 1.00 . A A . 10 LEU C 1 1 5 905 1 1 11 LEU CA C 0.434 10.286 4.868 1.00 . A A . 10 LEU CA 1 1 5 906 1 1 11 LEU CB C 0.011 10.055 3.416 1.00 . A A . 10 LEU CB 1 1 5 907 1 1 11 LEU CD1 C 0.241 12.540 3.227 1.00 . A A . 10 LEU CD1 1 1 5 908 1 1 11 LEU CD2 C 2.025 11.047 2.318 1.00 . A A . 10 LEU CD2 1 1 5 909 1 1 11 LEU CG C 0.520 11.202 2.539 1.00 . A A . 10 LEU CG 1 1 5 910 1 1 11 LEU H H 0.443 8.132 4.882 1.00 . A A . 10 LEU H 1 1 5 911 1 1 11 LEU HA H 1.375 10.813 4.899 1.00 . A A . 10 LEU HA 1 1 5 912 1 1 11 LEU HB2 H 0.428 9.122 3.065 1.00 . A A . 10 LEU HB2 1 1 5 913 1 1 11 LEU HB3 H -1.065 10.012 3.358 1.00 . A A . 10 LEU HB3 1 1 5 914 1 1 11 LEU HD11 H -0.703 12.487 3.750 1.00 . A A . 10 LEU HD11 1 1 5 915 1 1 11 LEU HD12 H 1.032 12.754 3.931 1.00 . A A . 10 LEU HD12 1 1 5 916 1 1 11 LEU HD13 H 0.198 13.324 2.486 1.00 . A A . 10 LEU HD13 1 1 5 917 1 1 11 LEU HD21 H 2.256 10.008 2.130 1.00 . A A . 10 LEU HD21 1 1 5 918 1 1 11 LEU HD22 H 2.328 11.643 1.470 1.00 . A A . 10 LEU HD22 1 1 5 919 1 1 11 LEU HD23 H 2.555 11.379 3.200 1.00 . A A . 10 LEU HD23 1 1 5 920 1 1 11 LEU HG H 0.011 11.177 1.585 1.00 . A A . 10 LEU HG 1 1 5 921 1 1 11 LEU N N 0.581 8.920 5.447 1.00 . A A . 10 LEU N 1 1 5 922 1 1 11 LEU O O -1.766 10.622 5.757 1.00 . A A . 10 LEU O 1 1 5 923 1 1 12 ALA C C -0.718 14.379 7.280 1.00 . A A . 11 ALA C 1 1 5 924 1 1 12 ALA CA C -1.322 13.036 6.863 1.00 . A A . 11 ALA CA 1 1 5 925 1 1 12 ALA CB C -1.669 12.198 8.094 1.00 . A A . 11 ALA CB 1 1 5 926 1 1 12 ALA H H 0.598 12.570 5.999 1.00 . A A . 11 ALA H 1 1 5 927 1 1 12 ALA HA H -2.202 13.189 6.261 1.00 . A A . 11 ALA HA 1 1 5 928 1 1 12 ALA HB1 H -1.063 11.305 8.104 1.00 . A A . 11 ALA HB1 1 1 5 929 1 1 12 ALA HB2 H -1.477 12.774 8.988 1.00 . A A . 11 ALA HB2 1 1 5 930 1 1 12 ALA HB3 H -2.713 11.924 8.060 1.00 . A A . 11 ALA HB3 1 1 5 931 1 1 12 ALA N N -0.313 12.229 6.117 1.00 . A A . 11 ALA N 1 1 5 932 1 1 12 ALA O O 0.484 14.511 7.408 1.00 . A A . 11 ALA O 1 1 5 933 1 1 13 NH2 HN1 H -2.478 15.291 7.397 1.00 . A A . 12 NH2 HN1 1 1 5 934 1 1 13 NH2 HN2 H -1.134 16.259 7.765 1.00 . A A . 12 NH2 HN2 1 1 5 935 1 1 13 NH2 N N -1.509 15.394 7.500 1.00 . A A . 12 NH2 N 1 1 6 936 1 1 2 ILE C C -2.031 -4.918 1.698 1.00 . A A . 1 ILE C 1 1 6 937 1 1 2 ILE CA C -0.849 -5.156 2.639 1.00 . A A . 1 ILE CA 1 1 6 938 1 1 2 ILE CB C 0.475 -4.679 2.021 1.00 . A A . 1 ILE CB 1 1 6 939 1 1 2 ILE CD1 C 2.626 -3.521 2.581 1.00 . A A . 1 ILE CD1 1 1 6 940 1 1 2 ILE CG1 C 1.407 -4.239 3.155 1.00 . A A . 1 ILE CG1 1 1 6 941 1 1 2 ILE CG2 C 0.236 -3.499 1.058 1.00 . A A . 1 ILE CG2 1 1 6 942 1 1 2 ILE H H 0.217 -7.021 2.802 1.00 . A A . 1 ILE H 1 1 6 943 1 1 2 ILE HA H -1.008 -4.653 3.574 1.00 . A A . 1 ILE HA 1 1 6 944 1 1 2 ILE HB H 0.928 -5.493 1.481 1.00 . A A . 1 ILE HB 1 1 6 945 1 1 2 ILE HD11 H 3.003 -4.074 1.734 1.00 . A A . 1 ILE HD11 1 1 6 946 1 1 2 ILE HD12 H 2.339 -2.528 2.263 1.00 . A A . 1 ILE HD12 1 1 6 947 1 1 2 ILE HD13 H 3.391 -3.450 3.338 1.00 . A A . 1 ILE HD13 1 1 6 948 1 1 2 ILE HG12 H 0.874 -3.569 3.817 1.00 . A A . 1 ILE HG12 1 1 6 949 1 1 2 ILE HG13 H 1.733 -5.109 3.709 1.00 . A A . 1 ILE HG13 1 1 6 950 1 1 2 ILE HG21 H -0.755 -3.096 1.217 1.00 . A A . 1 ILE HG21 1 1 6 951 1 1 2 ILE HG22 H 0.965 -2.725 1.235 1.00 . A A . 1 ILE HG22 1 1 6 952 1 1 2 ILE HG23 H 0.318 -3.842 0.039 1.00 . A A . 1 ILE HG23 1 1 6 953 1 1 2 ILE N N -0.672 -6.616 2.867 1.00 . A A . 1 ILE N 1 1 6 954 1 1 2 ILE O O -3.130 -4.633 2.128 1.00 . A A . 1 ILE O 1 1 6 955 1 1 3 ASP C C -3.398 -3.353 -0.458 1.00 . A A . 2 ASP C 1 1 6 956 1 1 3 ASP CA C -2.894 -4.793 -0.564 1.00 . A A . 2 ASP CA 1 1 6 957 1 1 3 ASP CB C -3.996 -5.783 -0.186 1.00 . A A . 2 ASP CB 1 1 6 958 1 1 3 ASP CG C -4.941 -5.973 -1.373 1.00 . A A . 2 ASP CG 1 1 6 959 1 1 3 ASP H H -0.905 -5.254 0.109 1.00 . A A . 2 ASP H 1 1 6 960 1 1 3 ASP HA H -2.547 -4.990 -1.565 1.00 . A A . 2 ASP HA 1 1 6 961 1 1 3 ASP HB2 H -3.552 -6.732 0.079 1.00 . A A . 2 ASP HB2 1 1 6 962 1 1 3 ASP HB3 H -4.552 -5.399 0.657 1.00 . A A . 2 ASP HB3 1 1 6 963 1 1 3 ASP N N -1.803 -5.027 0.420 1.00 . A A . 2 ASP N 1 1 6 964 1 1 3 ASP O O -3.209 -2.550 -1.350 1.00 . A A . 2 ASP O 1 1 6 965 1 1 3 ASP OD1 O -4.571 -5.583 -2.468 1.00 . A A . 2 ASP OD1 1 1 6 966 1 1 3 ASP OD2 O -6.019 -6.507 -1.167 1.00 . A A . 2 ASP OD2 1 1 6 967 1 1 4 TYR C C -3.461 -0.637 1.127 1.00 . A A . 3 TYR C 1 1 6 968 1 1 4 TYR CA C -4.575 -1.643 0.779 1.00 . A A . 3 TYR CA 1 1 6 969 1 1 4 TYR CB C -5.635 -1.741 1.884 1.00 . A A . 3 TYR CB 1 1 6 970 1 1 4 TYR CD1 C -4.718 -3.286 3.649 1.00 . A A . 3 TYR CD1 1 1 6 971 1 1 4 TYR CD2 C -4.670 -0.894 4.045 1.00 . A A . 3 TYR CD2 1 1 6 972 1 1 4 TYR CE1 C -4.128 -3.502 4.899 1.00 . A A . 3 TYR CE1 1 1 6 973 1 1 4 TYR CE2 C -4.079 -1.110 5.293 1.00 . A A . 3 TYR CE2 1 1 6 974 1 1 4 TYR CG C -4.989 -1.981 3.224 1.00 . A A . 3 TYR CG 1 1 6 975 1 1 4 TYR CZ C -3.809 -2.414 5.719 1.00 . A A . 3 TYR CZ 1 1 6 976 1 1 4 TYR H H -4.194 -3.691 1.322 1.00 . A A . 3 TYR H 1 1 6 977 1 1 4 TYR HA H -5.049 -1.337 -0.134 1.00 . A A . 3 TYR HA 1 1 6 978 1 1 4 TYR HB2 H -6.197 -0.822 1.921 1.00 . A A . 3 TYR HB2 1 1 6 979 1 1 4 TYR HB3 H -6.304 -2.559 1.660 1.00 . A A . 3 TYR HB3 1 1 6 980 1 1 4 TYR HD1 H -4.964 -4.124 3.015 1.00 . A A . 3 TYR HD1 1 1 6 981 1 1 4 TYR HD2 H -4.880 0.111 3.714 1.00 . A A . 3 TYR HD2 1 1 6 982 1 1 4 TYR HE1 H -3.918 -4.509 5.231 1.00 . A A . 3 TYR HE1 1 1 6 983 1 1 4 TYR HE2 H -3.834 -0.271 5.927 1.00 . A A . 3 TYR HE2 1 1 6 984 1 1 4 TYR HH H -3.031 -1.771 7.340 1.00 . A A . 3 TYR HH 1 1 6 985 1 1 4 TYR N N -4.047 -3.025 0.621 1.00 . A A . 3 TYR N 1 1 6 986 1 1 4 TYR O O -3.317 0.352 0.447 1.00 . A A . 3 TYR O 1 1 6 987 1 1 4 TYR OH O -3.230 -2.627 6.954 1.00 . A A . 3 TYR OH 1 1 6 988 1 1 5 TRP C C -1.231 1.038 1.455 1.00 . A A . 4 TRP C 1 1 6 989 1 1 5 TRP CA C -1.576 0.056 2.578 1.00 . A A . 4 TRP CA 1 1 6 990 1 1 5 TRP CB C -0.361 -0.836 2.844 1.00 . A A . 4 TRP CB 1 1 6 991 1 1 5 TRP CD1 C -1.398 -2.588 4.358 1.00 . A A . 4 TRP CD1 1 1 6 992 1 1 5 TRP CD2 C 0.253 -1.446 5.355 1.00 . A A . 4 TRP CD2 1 1 6 993 1 1 5 TRP CE2 C -0.225 -2.374 6.306 1.00 . A A . 4 TRP CE2 1 1 6 994 1 1 5 TRP CE3 C 1.303 -0.598 5.729 1.00 . A A . 4 TRP CE3 1 1 6 995 1 1 5 TRP CG C -0.513 -1.593 4.128 1.00 . A A . 4 TRP CG 1 1 6 996 1 1 5 TRP CH2 C 1.367 -1.605 7.945 1.00 . A A . 4 TRP CH2 1 1 6 997 1 1 5 TRP CZ2 C 0.321 -2.459 7.586 1.00 . A A . 4 TRP CZ2 1 1 6 998 1 1 5 TRP CZ3 C 1.859 -0.677 7.016 1.00 . A A . 4 TRP CZ3 1 1 6 999 1 1 5 TRP H H -2.831 -1.695 2.681 1.00 . A A . 4 TRP H 1 1 6 1000 1 1 5 TRP HA H -1.845 0.586 3.476 1.00 . A A . 4 TRP HA 1 1 6 1001 1 1 5 TRP HB2 H -0.251 -1.527 2.033 1.00 . A A . 4 TRP HB2 1 1 6 1002 1 1 5 TRP HB3 H 0.524 -0.217 2.900 1.00 . A A . 4 TRP HB3 1 1 6 1003 1 1 5 TRP HD1 H -2.117 -2.969 3.653 1.00 . A A . 4 TRP HD1 1 1 6 1004 1 1 5 TRP HE1 H -1.752 -3.766 6.068 1.00 . A A . 4 TRP HE1 1 1 6 1005 1 1 5 TRP HE3 H 1.686 0.112 5.018 1.00 . A A . 4 TRP HE3 1 1 6 1006 1 1 5 TRP HH2 H 1.797 -1.663 8.933 1.00 . A A . 4 TRP HH2 1 1 6 1007 1 1 5 TRP HZ2 H -0.064 -3.178 8.293 1.00 . A A . 4 TRP HZ2 1 1 6 1008 1 1 5 TRP HZ3 H 2.668 -0.017 7.293 1.00 . A A . 4 TRP HZ3 1 1 6 1009 1 1 5 TRP N N -2.685 -0.886 2.166 1.00 . A A . 4 TRP N 1 1 6 1010 1 1 5 TRP NE1 N -1.228 -3.050 5.650 1.00 . A A . 4 TRP NE1 1 1 6 1011 1 1 5 TRP O O -1.257 2.241 1.629 1.00 . A A . 4 TRP O 1 1 6 1012 1 1 6 LEU C C -1.420 2.642 -0.897 1.00 . A A . 5 LEU C 1 1 6 1013 1 1 6 LEU CA C -0.553 1.375 -0.859 1.00 . A A . 5 LEU CA 1 1 6 1014 1 1 6 LEU CB C -0.829 0.469 -2.065 1.00 . A A . 5 LEU CB 1 1 6 1015 1 1 6 LEU CD1 C 0.216 1.952 -3.786 1.00 . A A . 5 LEU CD1 1 1 6 1016 1 1 6 LEU CD2 C -1.617 0.375 -4.423 1.00 . A A . 5 LEU CD2 1 1 6 1017 1 1 6 LEU CG C -1.088 1.299 -3.323 1.00 . A A . 5 LEU CG 1 1 6 1018 1 1 6 LEU H H -0.897 -0.458 0.206 1.00 . A A . 5 LEU H 1 1 6 1019 1 1 6 LEU HA H 0.493 1.635 -0.831 1.00 . A A . 5 LEU HA 1 1 6 1020 1 1 6 LEU HB2 H 0.025 -0.170 -2.232 1.00 . A A . 5 LEU HB2 1 1 6 1021 1 1 6 LEU HB3 H -1.695 -0.141 -1.858 1.00 . A A . 5 LEU HB3 1 1 6 1022 1 1 6 LEU HD11 H 1.001 1.211 -3.810 1.00 . A A . 5 LEU HD11 1 1 6 1023 1 1 6 LEU HD12 H 0.082 2.365 -4.775 1.00 . A A . 5 LEU HD12 1 1 6 1024 1 1 6 LEU HD13 H 0.487 2.741 -3.100 1.00 . A A . 5 LEU HD13 1 1 6 1025 1 1 6 LEU HD21 H -1.536 -0.652 -4.097 1.00 . A A . 5 LEU HD21 1 1 6 1026 1 1 6 LEU HD22 H -2.652 0.609 -4.623 1.00 . A A . 5 LEU HD22 1 1 6 1027 1 1 6 LEU HD23 H -1.035 0.513 -5.322 1.00 . A A . 5 LEU HD23 1 1 6 1028 1 1 6 LEU HG H -1.820 2.064 -3.111 1.00 . A A . 5 LEU HG 1 1 6 1029 1 1 6 LEU N N -0.907 0.517 0.307 1.00 . A A . 5 LEU N 1 1 6 1030 1 1 6 LEU O O -0.917 3.743 -1.001 1.00 . A A . 5 LEU O 1 1 6 1031 1 1 7 ALA C C -3.867 4.244 0.540 1.00 . A A . 6 ALA C 1 1 6 1032 1 1 7 ALA CA C -3.604 3.701 -0.869 1.00 . A A . 6 ALA CA 1 1 6 1033 1 1 7 ALA CB C -4.907 3.200 -1.493 1.00 . A A . 6 ALA CB 1 1 6 1034 1 1 7 ALA H H -3.106 1.604 -0.749 1.00 . A A . 6 ALA H 1 1 6 1035 1 1 7 ALA HA H -3.171 4.467 -1.493 1.00 . A A . 6 ALA HA 1 1 6 1036 1 1 7 ALA HB1 H -4.687 2.665 -2.405 1.00 . A A . 6 ALA HB1 1 1 6 1037 1 1 7 ALA HB2 H -5.407 2.539 -0.800 1.00 . A A . 6 ALA HB2 1 1 6 1038 1 1 7 ALA HB3 H -5.548 4.041 -1.713 1.00 . A A . 6 ALA HB3 1 1 6 1039 1 1 7 ALA N N -2.716 2.500 -0.824 1.00 . A A . 6 ALA N 1 1 6 1040 1 1 7 ALA O O -4.680 5.128 0.730 1.00 . A A . 6 ALA O 1 1 6 1041 1 1 8 HIS C C -2.131 4.703 3.535 1.00 . A A . 7 HIS C 1 1 6 1042 1 1 8 HIS CA C -3.440 4.199 2.921 1.00 . A A . 7 HIS CA 1 1 6 1043 1 1 8 HIS CB C -3.962 2.977 3.687 1.00 . A A . 7 HIS CB 1 1 6 1044 1 1 8 HIS CD2 C -5.104 1.882 1.579 1.00 . A A . 7 HIS CD2 1 1 6 1045 1 1 8 HIS CE1 C -6.980 1.308 2.489 1.00 . A A . 7 HIS CE1 1 1 6 1046 1 1 8 HIS CG C -5.042 2.286 2.891 1.00 . A A . 7 HIS CG 1 1 6 1047 1 1 8 HIS H H -2.561 2.996 1.364 1.00 . A A . 7 HIS H 1 1 6 1048 1 1 8 HIS HA H -4.183 4.980 2.926 1.00 . A A . 7 HIS HA 1 1 6 1049 1 1 8 HIS HB2 H -3.147 2.288 3.858 1.00 . A A . 7 HIS HB2 1 1 6 1050 1 1 8 HIS HB3 H -4.365 3.295 4.637 1.00 . A A . 7 HIS HB3 1 1 6 1051 1 1 8 HIS HD1 H -6.532 2.053 4.383 1.00 . A A . 7 HIS HD1 1 1 6 1052 1 1 8 HIS HD2 H -4.324 2.011 0.856 1.00 . A A . 7 HIS HD2 1 1 6 1053 1 1 8 HIS HE1 H -7.962 0.895 2.634 1.00 . A A . 7 HIS HE1 1 1 6 1054 1 1 8 HIS HE2 H -6.636 0.891 0.486 1.00 . A A . 7 HIS HE2 1 1 6 1055 1 1 8 HIS N N -3.204 3.716 1.531 1.00 . A A . 7 HIS N 1 1 6 1056 1 1 8 HIS ND1 N -6.255 1.909 3.454 1.00 . A A . 7 HIS ND1 1 1 6 1057 1 1 8 HIS NE2 N -6.323 1.271 1.333 1.00 . A A . 7 HIS NE2 1 1 6 1058 1 1 8 HIS O O -2.073 5.051 4.697 1.00 . A A . 7 HIS O 1 1 6 1059 1 1 9 LYS C C 0.507 6.648 2.795 1.00 . A A . 8 LYS C 1 1 6 1060 1 1 9 LYS CA C 0.223 5.230 3.299 1.00 . A A . 8 LYS CA 1 1 6 1061 1 1 9 LYS CB C 1.264 4.249 2.758 1.00 . A A . 8 LYS CB 1 1 6 1062 1 1 9 LYS CD C 1.836 2.589 4.536 1.00 . A A . 8 LYS CD 1 1 6 1063 1 1 9 LYS CE C 3.148 1.922 4.117 1.00 . A A . 8 LYS CE 1 1 6 1064 1 1 9 LYS CG C 0.975 2.846 3.298 1.00 . A A . 8 LYS CG 1 1 6 1065 1 1 9 LYS H H -1.150 4.461 1.826 1.00 . A A . 8 LYS H 1 1 6 1066 1 1 9 LYS HA H 0.219 5.206 4.378 1.00 . A A . 8 LYS HA 1 1 6 1067 1 1 9 LYS HB2 H 1.219 4.236 1.678 1.00 . A A . 8 LYS HB2 1 1 6 1068 1 1 9 LYS HB3 H 2.249 4.558 3.074 1.00 . A A . 8 LYS HB3 1 1 6 1069 1 1 9 LYS HD2 H 2.048 3.528 5.028 1.00 . A A . 8 LYS HD2 1 1 6 1070 1 1 9 LYS HD3 H 1.304 1.938 5.215 1.00 . A A . 8 LYS HD3 1 1 6 1071 1 1 9 LYS HE2 H 3.588 1.402 4.957 1.00 . A A . 8 LYS HE2 1 1 6 1072 1 1 9 LYS HE3 H 2.980 1.242 3.297 1.00 . A A . 8 LYS HE3 1 1 6 1073 1 1 9 LYS HG2 H -0.070 2.772 3.563 1.00 . A A . 8 LYS HG2 1 1 6 1074 1 1 9 LYS HG3 H 1.209 2.114 2.541 1.00 . A A . 8 LYS HG3 1 1 6 1075 1 1 9 LYS HZ1 H 3.894 3.855 4.316 1.00 . A A . 8 LYS HZ1 1 1 6 1076 1 1 9 LYS HZ2 H 5.020 2.737 3.709 1.00 . A A . 8 LYS HZ2 1 1 6 1077 1 1 9 LYS HZ3 H 3.776 3.322 2.710 1.00 . A A . 8 LYS HZ3 1 1 6 1078 1 1 9 LYS N N -1.081 4.746 2.761 1.00 . A A . 8 LYS N 1 1 6 1079 1 1 9 LYS NZ N 4.026 3.044 3.680 1.00 . A A . 8 LYS NZ 1 1 6 1080 1 1 9 LYS O O -0.395 7.389 2.460 1.00 . A A . 8 LYS O 1 1 6 1081 1 1 10 ALA C C 1.355 8.694 0.945 1.00 . A A . 9 ALA C 1 1 6 1082 1 1 10 ALA CA C 2.091 8.399 2.255 1.00 . A A . 9 ALA CA 1 1 6 1083 1 1 10 ALA CB C 3.603 8.377 2.027 1.00 . A A . 9 ALA CB 1 1 6 1084 1 1 10 ALA H H 2.467 6.416 3.013 1.00 . A A . 9 ALA H 1 1 6 1085 1 1 10 ALA HA H 1.842 9.136 3.003 1.00 . A A . 9 ALA HA 1 1 6 1086 1 1 10 ALA HB1 H 3.876 7.471 1.507 1.00 . A A . 9 ALA HB1 1 1 6 1087 1 1 10 ALA HB2 H 3.891 9.233 1.435 1.00 . A A . 9 ALA HB2 1 1 6 1088 1 1 10 ALA HB3 H 4.111 8.412 2.980 1.00 . A A . 9 ALA HB3 1 1 6 1089 1 1 10 ALA N N 1.753 7.030 2.739 1.00 . A A . 9 ALA N 1 1 6 1090 1 1 10 ALA O O 1.819 8.361 -0.127 1.00 . A A . 9 ALA O 1 1 6 1091 1 1 11 LEU C C -1.686 10.614 0.093 1.00 . A A . 10 LEU C 1 1 6 1092 1 1 11 LEU CA C -0.553 9.633 -0.218 1.00 . A A . 10 LEU CA 1 1 6 1093 1 1 11 LEU CB C -1.118 8.291 -0.686 1.00 . A A . 10 LEU CB 1 1 6 1094 1 1 11 LEU CD1 C 0.095 6.705 -2.186 1.00 . A A . 10 LEU CD1 1 1 6 1095 1 1 11 LEU CD2 C -1.908 7.935 -3.028 1.00 . A A . 10 LEU CD2 1 1 6 1096 1 1 11 LEU CG C -0.676 8.024 -2.125 1.00 . A A . 10 LEU CG 1 1 6 1097 1 1 11 LEU H H -0.146 9.578 1.898 1.00 . A A . 10 LEU H 1 1 6 1098 1 1 11 LEU HA H 0.103 10.040 -0.971 1.00 . A A . 10 LEU HA 1 1 6 1099 1 1 11 LEU HB2 H -0.753 7.504 -0.044 1.00 . A A . 10 LEU HB2 1 1 6 1100 1 1 11 LEU HB3 H -2.196 8.321 -0.643 1.00 . A A . 10 LEU HB3 1 1 6 1101 1 1 11 LEU HD11 H -0.184 6.086 -1.347 1.00 . A A . 10 LEU HD11 1 1 6 1102 1 1 11 LEU HD12 H -0.140 6.192 -3.107 1.00 . A A . 10 LEU HD12 1 1 6 1103 1 1 11 LEU HD13 H 1.156 6.906 -2.148 1.00 . A A . 10 LEU HD13 1 1 6 1104 1 1 11 LEU HD21 H -2.796 7.861 -2.418 1.00 . A A . 10 LEU HD21 1 1 6 1105 1 1 11 LEU HD22 H -1.968 8.820 -3.645 1.00 . A A . 10 LEU HD22 1 1 6 1106 1 1 11 LEU HD23 H -1.831 7.061 -3.658 1.00 . A A . 10 LEU HD23 1 1 6 1107 1 1 11 LEU HG H -0.038 8.830 -2.461 1.00 . A A . 10 LEU HG 1 1 6 1108 1 1 11 LEU N N 0.211 9.317 1.023 1.00 . A A . 10 LEU N 1 1 6 1109 1 1 11 LEU O O -2.666 10.267 0.722 1.00 . A A . 10 LEU O 1 1 6 1110 1 1 12 ALA C C -3.667 12.825 -1.199 1.00 . A A . 11 ALA C 1 1 6 1111 1 1 12 ALA CA C -2.630 12.839 -0.071 1.00 . A A . 11 ALA CA 1 1 6 1112 1 1 12 ALA CB C -1.910 14.187 -0.024 1.00 . A A . 11 ALA CB 1 1 6 1113 1 1 12 ALA H H -0.762 12.098 -0.848 1.00 . A A . 11 ALA H 1 1 6 1114 1 1 12 ALA HA H -3.102 12.640 0.878 1.00 . A A . 11 ALA HA 1 1 6 1115 1 1 12 ALA HB1 H -1.341 14.323 -0.932 1.00 . A A . 11 ALA HB1 1 1 6 1116 1 1 12 ALA HB2 H -2.636 14.981 0.069 1.00 . A A . 11 ALA HB2 1 1 6 1117 1 1 12 ALA HB3 H -1.243 14.208 0.826 1.00 . A A . 11 ALA HB3 1 1 6 1118 1 1 12 ALA N N -1.560 11.838 -0.342 1.00 . A A . 11 ALA N 1 1 6 1119 1 1 12 ALA O O -3.372 12.438 -2.313 1.00 . A A . 11 ALA O 1 1 6 1120 1 1 13 NH2 HN1 H -5.122 13.546 -0.057 1.00 . A A . 12 NH2 HN1 1 1 6 1121 1 1 13 NH2 HN2 H -5.554 13.228 -1.668 1.00 . A A . 12 NH2 HN2 1 1 6 1122 1 1 13 NH2 N N -4.882 13.233 -0.955 1.00 . A A . 12 NH2 N 1 1 7 1123 1 1 2 ILE C C -1.990 -5.042 1.627 1.00 . A A . 1 ILE C 1 1 7 1124 1 1 2 ILE CA C -0.835 -5.268 2.606 1.00 . A A . 1 ILE CA 1 1 7 1125 1 1 2 ILE CB C 0.484 -4.853 1.955 1.00 . A A . 1 ILE CB 1 1 7 1126 1 1 2 ILE CD1 C 1.324 -3.439 3.852 1.00 . A A . 1 ILE CD1 1 1 7 1127 1 1 2 ILE CG1 C 1.567 -4.706 3.030 1.00 . A A . 1 ILE CG1 1 1 7 1128 1 1 2 ILE CG2 C 0.298 -3.524 1.207 1.00 . A A . 1 ILE CG2 1 1 7 1129 1 1 2 ILE H H 0.206 -7.126 2.930 1.00 . A A . 1 ILE H 1 1 7 1130 1 1 2 ILE HA H -0.985 -4.711 3.514 1.00 . A A . 1 ILE HA 1 1 7 1131 1 1 2 ILE HB H 0.777 -5.614 1.253 1.00 . A A . 1 ILE HB 1 1 7 1132 1 1 2 ILE HD11 H 1.094 -2.617 3.191 1.00 . A A . 1 ILE HD11 1 1 7 1133 1 1 2 ILE HD12 H 0.498 -3.601 4.526 1.00 . A A . 1 ILE HD12 1 1 7 1134 1 1 2 ILE HD13 H 2.212 -3.205 4.421 1.00 . A A . 1 ILE HD13 1 1 7 1135 1 1 2 ILE HG12 H 1.537 -5.566 3.685 1.00 . A A . 1 ILE HG12 1 1 7 1136 1 1 2 ILE HG13 H 2.537 -4.646 2.557 1.00 . A A . 1 ILE HG13 1 1 7 1137 1 1 2 ILE HG21 H -0.712 -3.165 1.350 1.00 . A A . 1 ILE HG21 1 1 7 1138 1 1 2 ILE HG22 H 0.994 -2.793 1.589 1.00 . A A . 1 ILE HG22 1 1 7 1139 1 1 2 ILE HG23 H 0.475 -3.675 0.153 1.00 . A A . 1 ILE HG23 1 1 7 1140 1 1 2 ILE N N -0.685 -6.720 2.900 1.00 . A A . 1 ILE N 1 1 7 1141 1 1 2 ILE O O -3.122 -4.827 2.014 1.00 . A A . 1 ILE O 1 1 7 1142 1 1 3 ASP C C -3.298 -3.442 -0.563 1.00 . A A . 2 ASP C 1 1 7 1143 1 1 3 ASP CA C -2.746 -4.860 -0.671 1.00 . A A . 2 ASP CA 1 1 7 1144 1 1 3 ASP CB C -3.833 -5.892 -0.366 1.00 . A A . 2 ASP CB 1 1 7 1145 1 1 3 ASP CG C -3.187 -7.257 -0.117 1.00 . A A . 2 ASP CG 1 1 7 1146 1 1 3 ASP H H -0.774 -5.250 0.077 1.00 . A A . 2 ASP H 1 1 7 1147 1 1 3 ASP HA H -2.348 -5.023 -1.658 1.00 . A A . 2 ASP HA 1 1 7 1148 1 1 3 ASP HB2 H -4.382 -5.587 0.513 1.00 . A A . 2 ASP HB2 1 1 7 1149 1 1 3 ASP HB3 H -4.507 -5.964 -1.205 1.00 . A A . 2 ASP HB3 1 1 7 1150 1 1 3 ASP N N -1.695 -5.081 0.356 1.00 . A A . 2 ASP N 1 1 7 1151 1 1 3 ASP O O -3.073 -2.613 -1.421 1.00 . A A . 2 ASP O 1 1 7 1152 1 1 3 ASP OD1 O -2.033 -7.419 -0.479 1.00 . A A . 2 ASP OD1 1 1 7 1153 1 1 3 ASP OD2 O -3.857 -8.116 0.431 1.00 . A A . 2 ASP OD2 1 1 7 1154 1 1 4 TYR C C -3.549 -0.765 1.049 1.00 . A A . 3 TYR C 1 1 7 1155 1 1 4 TYR CA C -4.604 -1.791 0.606 1.00 . A A . 3 TYR CA 1 1 7 1156 1 1 4 TYR CB C -5.752 -1.918 1.616 1.00 . A A . 3 TYR CB 1 1 7 1157 1 1 4 TYR CD1 C -5.003 -3.588 3.341 1.00 . A A . 3 TYR CD1 1 1 7 1158 1 1 4 TYR CD2 C -4.929 -1.227 3.887 1.00 . A A . 3 TYR CD2 1 1 7 1159 1 1 4 TYR CE1 C -4.505 -3.897 4.609 1.00 . A A . 3 TYR CE1 1 1 7 1160 1 1 4 TYR CE2 C -4.430 -1.535 5.155 1.00 . A A . 3 TYR CE2 1 1 7 1161 1 1 4 TYR CG C -5.215 -2.253 2.980 1.00 . A A . 3 TYR CG 1 1 7 1162 1 1 4 TYR CZ C -4.219 -2.870 5.515 1.00 . A A . 3 TYR CZ 1 1 7 1163 1 1 4 TYR H H -4.212 -3.842 1.149 1.00 . A A . 3 TYR H 1 1 7 1164 1 1 4 TYR HA H -5.003 -1.488 -0.341 1.00 . A A . 3 TYR HA 1 1 7 1165 1 1 4 TYR HB2 H -6.290 -0.985 1.664 1.00 . A A . 3 TYR HB2 1 1 7 1166 1 1 4 TYR HB3 H -6.423 -2.700 1.295 1.00 . A A . 3 TYR HB3 1 1 7 1167 1 1 4 TYR HD1 H -5.224 -4.379 2.639 1.00 . A A . 3 TYR HD1 1 1 7 1168 1 1 4 TYR HD2 H -5.092 -0.197 3.607 1.00 . A A . 3 TYR HD2 1 1 7 1169 1 1 4 TYR HE1 H -4.340 -4.927 4.890 1.00 . A A . 3 TYR HE1 1 1 7 1170 1 1 4 TYR HE2 H -4.208 -0.744 5.856 1.00 . A A . 3 TYR HE2 1 1 7 1171 1 1 4 TYR HH H -3.418 -2.362 7.172 1.00 . A A . 3 TYR HH 1 1 7 1172 1 1 4 TYR N N -4.031 -3.157 0.472 1.00 . A A . 3 TYR N 1 1 7 1173 1 1 4 TYR O O -3.377 0.232 0.385 1.00 . A A . 3 TYR O 1 1 7 1174 1 1 4 TYR OH O -3.732 -3.175 6.770 1.00 . A A . 3 TYR OH 1 1 7 1175 1 1 5 TRP C C -1.411 0.985 1.598 1.00 . A A . 4 TRP C 1 1 7 1176 1 1 5 TRP CA C -1.810 -0.037 2.662 1.00 . A A . 4 TRP CA 1 1 7 1177 1 1 5 TRP CB C -0.593 -0.899 2.997 1.00 . A A . 4 TRP CB 1 1 7 1178 1 1 5 TRP CD1 C -1.671 -2.745 4.359 1.00 . A A . 4 TRP CD1 1 1 7 1179 1 1 5 TRP CD2 C -0.197 -1.538 5.545 1.00 . A A . 4 TRP CD2 1 1 7 1180 1 1 5 TRP CE2 C -0.709 -2.523 6.418 1.00 . A A . 4 TRP CE2 1 1 7 1181 1 1 5 TRP CE3 C 0.756 -0.642 6.046 1.00 . A A . 4 TRP CE3 1 1 7 1182 1 1 5 TRP CG C -0.827 -1.696 4.242 1.00 . A A . 4 TRP CG 1 1 7 1183 1 1 5 TRP CH2 C 0.659 -1.715 8.228 1.00 . A A . 4 TRP CH2 1 1 7 1184 1 1 5 TRP CZ2 C -0.291 -2.616 7.743 1.00 . A A . 4 TRP CZ2 1 1 7 1185 1 1 5 TRP CZ3 C 1.183 -0.729 7.381 1.00 . A A . 4 TRP CZ3 1 1 7 1186 1 1 5 TRP H H -3.029 -1.818 2.651 1.00 . A A . 4 TRP H 1 1 7 1187 1 1 5 TRP HA H -2.159 0.461 3.552 1.00 . A A . 4 TRP HA 1 1 7 1188 1 1 5 TRP HB2 H -0.399 -1.567 2.179 1.00 . A A . 4 TRP HB2 1 1 7 1189 1 1 5 TRP HB3 H 0.264 -0.258 3.141 1.00 . A A . 4 TRP HB3 1 1 7 1190 1 1 5 TRP HD1 H -2.290 -3.145 3.573 1.00 . A A . 4 TRP HD1 1 1 7 1191 1 1 5 TRP HE1 H -2.114 -3.996 5.991 1.00 . A A . 4 TRP HE1 1 1 7 1192 1 1 5 TRP HE3 H 1.164 0.116 5.398 1.00 . A A . 4 TRP HE3 1 1 7 1193 1 1 5 TRP HH2 H 0.990 -1.779 9.255 1.00 . A A . 4 TRP HH2 1 1 7 1194 1 1 5 TRP HZ2 H -0.699 -3.380 8.385 1.00 . A A . 4 TRP HZ2 1 1 7 1195 1 1 5 TRP HZ3 H 1.918 -0.032 7.757 1.00 . A A . 4 TRP HZ3 1 1 7 1196 1 1 5 TRP N N -2.857 -1.002 2.151 1.00 . A A . 4 TRP N 1 1 7 1197 1 1 5 TRP NE1 N -1.598 -3.238 5.647 1.00 . A A . 4 TRP NE1 1 1 7 1198 1 1 5 TRP O O -1.464 2.179 1.812 1.00 . A A . 4 TRP O 1 1 7 1199 1 1 6 LEU C C -1.433 2.694 -0.676 1.00 . A A . 5 LEU C 1 1 7 1200 1 1 6 LEU CA C -0.597 1.403 -0.661 1.00 . A A . 5 LEU CA 1 1 7 1201 1 1 6 LEU CB C -0.849 0.544 -1.907 1.00 . A A . 5 LEU CB 1 1 7 1202 1 1 6 LEU CD1 C 0.151 2.126 -3.566 1.00 . A A . 5 LEU CD1 1 1 7 1203 1 1 6 LEU CD2 C -1.632 0.518 -4.266 1.00 . A A . 5 LEU CD2 1 1 7 1204 1 1 6 LEU CG C -1.132 1.416 -3.131 1.00 . A A . 5 LEU CG 1 1 7 1205 1 1 6 LEU H H -0.980 -0.466 0.327 1.00 . A A . 5 LEU H 1 1 7 1206 1 1 6 LEU HA H 0.453 1.635 -0.586 1.00 . A A . 5 LEU HA 1 1 7 1207 1 1 6 LEU HB2 H 0.022 -0.065 -2.101 1.00 . A A . 5 LEU HB2 1 1 7 1208 1 1 6 LEU HB3 H -1.697 -0.099 -1.728 1.00 . A A . 5 LEU HB3 1 1 7 1209 1 1 6 LEU HD11 H 1.003 1.506 -3.330 1.00 . A A . 5 LEU HD11 1 1 7 1210 1 1 6 LEU HD12 H 0.120 2.307 -4.630 1.00 . A A . 5 LEU HD12 1 1 7 1211 1 1 6 LEU HD13 H 0.235 3.068 -3.043 1.00 . A A . 5 LEU HD13 1 1 7 1212 1 1 6 LEU HD21 H -2.081 -0.373 -3.848 1.00 . A A . 5 LEU HD21 1 1 7 1213 1 1 6 LEU HD22 H -2.367 1.049 -4.850 1.00 . A A . 5 LEU HD22 1 1 7 1214 1 1 6 LEU HD23 H -0.801 0.239 -4.898 1.00 . A A . 5 LEU HD23 1 1 7 1215 1 1 6 LEU HG H -1.889 2.149 -2.889 1.00 . A A . 5 LEU HG 1 1 7 1216 1 1 6 LEU N N -1.009 0.506 0.455 1.00 . A A . 5 LEU N 1 1 7 1217 1 1 6 LEU O O -0.900 3.784 -0.721 1.00 . A A . 5 LEU O 1 1 7 1218 1 1 7 ALA C C -3.901 4.315 0.740 1.00 . A A . 6 ALA C 1 1 7 1219 1 1 7 ALA CA C -3.591 3.813 -0.678 1.00 . A A . 6 ALA CA 1 1 7 1220 1 1 7 ALA CB C -4.877 3.376 -1.380 1.00 . A A . 6 ALA CB 1 1 7 1221 1 1 7 ALA H H -3.152 1.698 -0.624 1.00 . A A . 6 ALA H 1 1 7 1222 1 1 7 ALA HA H -3.110 4.588 -1.252 1.00 . A A . 6 ALA HA 1 1 7 1223 1 1 7 ALA HB1 H -4.858 2.308 -1.536 1.00 . A A . 6 ALA HB1 1 1 7 1224 1 1 7 ALA HB2 H -5.727 3.636 -0.766 1.00 . A A . 6 ALA HB2 1 1 7 1225 1 1 7 ALA HB3 H -4.955 3.878 -2.334 1.00 . A A . 6 ALA HB3 1 1 7 1226 1 1 7 ALA N N -2.736 2.584 -0.651 1.00 . A A . 6 ALA N 1 1 7 1227 1 1 7 ALA O O -4.850 5.046 0.948 1.00 . A A . 6 ALA O 1 1 7 1228 1 1 8 HIS C C -2.138 4.991 3.732 1.00 . A A . 7 HIS C 1 1 7 1229 1 1 8 HIS CA C -3.405 4.393 3.112 1.00 . A A . 7 HIS CA 1 1 7 1230 1 1 8 HIS CB C -3.843 3.137 3.882 1.00 . A A . 7 HIS CB 1 1 7 1231 1 1 8 HIS CD2 C -4.761 1.863 1.777 1.00 . A A . 7 HIS CD2 1 1 7 1232 1 1 8 HIS CE1 C -6.659 1.212 2.586 1.00 . A A . 7 HIS CE1 1 1 7 1233 1 1 8 HIS CG C -4.821 2.336 3.061 1.00 . A A . 7 HIS CG 1 1 7 1234 1 1 8 HIS H H -2.368 3.335 1.540 1.00 . A A . 7 HIS H 1 1 7 1235 1 1 8 HIS HA H -4.203 5.120 3.112 1.00 . A A . 7 HIS HA 1 1 7 1236 1 1 8 HIS HB2 H -2.977 2.530 4.098 1.00 . A A . 7 HIS HB2 1 1 7 1237 1 1 8 HIS HB3 H -4.312 3.433 4.808 1.00 . A A . 7 HIS HB3 1 1 7 1238 1 1 8 HIS HD1 H -6.396 2.084 4.460 1.00 . A A . 7 HIS HD1 1 1 7 1239 1 1 8 HIS HD2 H -3.939 2.013 1.103 1.00 . A A . 7 HIS HD2 1 1 7 1240 1 1 8 HIS HE1 H -7.625 0.743 2.687 1.00 . A A . 7 HIS HE1 1 1 7 1241 1 1 8 HIS HE2 H -6.143 0.714 0.637 1.00 . A A . 7 HIS HE2 1 1 7 1242 1 1 8 HIS N N -3.126 3.930 1.718 1.00 . A A . 7 HIS N 1 1 7 1243 1 1 8 HIS ND1 N -6.044 1.910 3.562 1.00 . A A . 7 HIS ND1 1 1 7 1244 1 1 8 HIS NE2 N -5.918 1.157 1.482 1.00 . A A . 7 HIS NE2 1 1 7 1245 1 1 8 HIS O O -1.412 5.723 3.090 1.00 . A A . 7 HIS O 1 1 7 1246 1 1 9 LYS C C -0.756 6.762 5.750 1.00 . A A . 8 LYS C 1 1 7 1247 1 1 9 LYS CA C -0.650 5.240 5.634 1.00 . A A . 8 LYS CA 1 1 7 1248 1 1 9 LYS CB C 0.514 4.848 4.723 1.00 . A A . 8 LYS CB 1 1 7 1249 1 1 9 LYS CD C 1.554 2.978 3.432 1.00 . A A . 8 LYS CD 1 1 7 1250 1 1 9 LYS CE C 2.660 2.414 4.328 1.00 . A A . 8 LYS CE 1 1 7 1251 1 1 9 LYS CG C 0.359 3.386 4.294 1.00 . A A . 8 LYS CG 1 1 7 1252 1 1 9 LYS H H -2.465 4.100 5.478 1.00 . A A . 8 LYS H 1 1 7 1253 1 1 9 LYS HA H -0.519 4.798 6.608 1.00 . A A . 8 LYS HA 1 1 7 1254 1 1 9 LYS HB2 H 0.520 5.483 3.850 1.00 . A A . 8 LYS HB2 1 1 7 1255 1 1 9 LYS HB3 H 1.443 4.964 5.258 1.00 . A A . 8 LYS HB3 1 1 7 1256 1 1 9 LYS HD2 H 1.245 2.225 2.722 1.00 . A A . 8 LYS HD2 1 1 7 1257 1 1 9 LYS HD3 H 1.928 3.840 2.902 1.00 . A A . 8 LYS HD3 1 1 7 1258 1 1 9 LYS HE2 H 3.172 3.216 4.840 1.00 . A A . 8 LYS HE2 1 1 7 1259 1 1 9 LYS HE3 H 2.249 1.713 5.038 1.00 . A A . 8 LYS HE3 1 1 7 1260 1 1 9 LYS HG2 H 0.313 2.757 5.171 1.00 . A A . 8 LYS HG2 1 1 7 1261 1 1 9 LYS HG3 H -0.550 3.274 3.721 1.00 . A A . 8 LYS HG3 1 1 7 1262 1 1 9 LYS HZ1 H 3.037 1.181 2.694 1.00 . A A . 8 LYS HZ1 1 1 7 1263 1 1 9 LYS HZ2 H 4.186 2.412 2.912 1.00 . A A . 8 LYS HZ2 1 1 7 1264 1 1 9 LYS HZ3 H 4.186 1.054 3.934 1.00 . A A . 8 LYS HZ3 1 1 7 1265 1 1 9 LYS N N -1.868 4.689 4.975 1.00 . A A . 8 LYS N 1 1 7 1266 1 1 9 LYS NZ N 3.587 1.712 3.396 1.00 . A A . 8 LYS NZ 1 1 7 1267 1 1 9 LYS O O -1.671 7.373 5.236 1.00 . A A . 8 LYS O 1 1 7 1268 1 1 10 ALA C C -0.288 9.525 5.277 1.00 . A A . 9 ALA C 1 1 7 1269 1 1 10 ALA CA C 0.141 8.857 6.585 1.00 . A A . 9 ALA CA 1 1 7 1270 1 1 10 ALA CB C 1.576 9.250 6.941 1.00 . A A . 9 ALA CB 1 1 7 1271 1 1 10 ALA H H 0.901 6.854 6.832 1.00 . A A . 9 ALA H 1 1 7 1272 1 1 10 ALA HA H -0.524 9.134 7.387 1.00 . A A . 9 ALA HA 1 1 7 1273 1 1 10 ALA HB1 H 2.248 8.452 6.660 1.00 . A A . 9 ALA HB1 1 1 7 1274 1 1 10 ALA HB2 H 1.845 10.151 6.409 1.00 . A A . 9 ALA HB2 1 1 7 1275 1 1 10 ALA HB3 H 1.649 9.424 8.005 1.00 . A A . 9 ALA HB3 1 1 7 1276 1 1 10 ALA N N 0.177 7.373 6.426 1.00 . A A . 9 ALA N 1 1 7 1277 1 1 10 ALA O O -0.858 10.598 5.274 1.00 . A A . 9 ALA O 1 1 7 1278 1 1 11 LEU C C -1.898 9.220 2.576 1.00 . A A . 10 LEU C 1 1 7 1279 1 1 11 LEU CA C -0.418 9.497 2.857 1.00 . A A . 10 LEU CA 1 1 7 1280 1 1 11 LEU CB C 0.464 8.803 1.819 1.00 . A A . 10 LEU CB 1 1 7 1281 1 1 11 LEU CD1 C 2.705 9.898 1.662 1.00 . A A . 10 LEU CD1 1 1 7 1282 1 1 11 LEU CD2 C 1.373 9.473 -0.408 1.00 . A A . 10 LEU CD2 1 1 7 1283 1 1 11 LEU CG C 1.293 9.850 1.074 1.00 . A A . 10 LEU CG 1 1 7 1284 1 1 11 LEU H H 0.437 8.033 4.187 1.00 . A A . 10 LEU H 1 1 7 1285 1 1 11 LEU HA H -0.225 10.559 2.854 1.00 . A A . 10 LEU HA 1 1 7 1286 1 1 11 LEU HB2 H 1.124 8.107 2.316 1.00 . A A . 10 LEU HB2 1 1 7 1287 1 1 11 LEU HB3 H -0.158 8.272 1.115 1.00 . A A . 10 LEU HB3 1 1 7 1288 1 1 11 LEU HD11 H 2.704 9.432 2.637 1.00 . A A . 10 LEU HD11 1 1 7 1289 1 1 11 LEU HD12 H 3.385 9.370 1.011 1.00 . A A . 10 LEU HD12 1 1 7 1290 1 1 11 LEU HD13 H 3.021 10.927 1.756 1.00 . A A . 10 LEU HD13 1 1 7 1291 1 1 11 LEU HD21 H 1.559 8.413 -0.501 1.00 . A A . 10 LEU HD21 1 1 7 1292 1 1 11 LEU HD22 H 0.440 9.721 -0.892 1.00 . A A . 10 LEU HD22 1 1 7 1293 1 1 11 LEU HD23 H 2.177 10.022 -0.875 1.00 . A A . 10 LEU HD23 1 1 7 1294 1 1 11 LEU HG H 0.827 10.819 1.177 1.00 . A A . 10 LEU HG 1 1 7 1295 1 1 11 LEU N N -0.022 8.898 4.164 1.00 . A A . 10 LEU N 1 1 7 1296 1 1 11 LEU O O -2.257 8.711 1.534 1.00 . A A . 10 LEU O 1 1 7 1297 1 1 12 ALA C C -4.652 9.873 1.932 1.00 . A A . 11 ALA C 1 1 7 1298 1 1 12 ALA CA C -4.214 9.307 3.285 1.00 . A A . 11 ALA CA 1 1 7 1299 1 1 12 ALA CB C -4.912 10.046 4.428 1.00 . A A . 11 ALA CB 1 1 7 1300 1 1 12 ALA H H -2.449 9.962 4.334 1.00 . A A . 11 ALA H 1 1 7 1301 1 1 12 ALA HA H -4.431 8.252 3.342 1.00 . A A . 11 ALA HA 1 1 7 1302 1 1 12 ALA HB1 H -4.568 9.654 5.373 1.00 . A A . 11 ALA HB1 1 1 7 1303 1 1 12 ALA HB2 H -4.680 11.100 4.370 1.00 . A A . 11 ALA HB2 1 1 7 1304 1 1 12 ALA HB3 H -5.979 9.906 4.347 1.00 . A A . 11 ALA HB3 1 1 7 1305 1 1 12 ALA N N -2.758 9.552 3.500 1.00 . A A . 11 ALA N 1 1 7 1306 1 1 12 ALA O O -4.615 11.068 1.715 1.00 . A A . 11 ALA O 1 1 7 1307 1 1 13 NH2 HN1 H -5.101 8.092 1.177 1.00 . A A . 12 NH2 HN1 1 1 7 1308 1 1 13 NH2 HN2 H -5.353 9.407 0.134 1.00 . A A . 12 NH2 HN2 1 1 7 1309 1 1 13 NH2 N N -5.070 9.056 1.004 1.00 . A A . 12 NH2 N 1 1 8 1310 1 1 2 ILE C C -2.001 -4.920 1.704 1.00 . A A . 1 ILE C 1 1 8 1311 1 1 2 ILE CA C -0.822 -5.130 2.655 1.00 . A A . 1 ILE CA 1 1 8 1312 1 1 2 ILE CB C 0.498 -4.624 2.050 1.00 . A A . 1 ILE CB 1 1 8 1313 1 1 2 ILE CD1 C 1.915 -5.276 4.001 1.00 . A A . 1 ILE CD1 1 1 8 1314 1 1 2 ILE CG1 C 1.387 -4.100 3.178 1.00 . A A . 1 ILE CG1 1 1 8 1315 1 1 2 ILE CG2 C 0.249 -3.487 1.044 1.00 . A A . 1 ILE CG2 1 1 8 1316 1 1 2 ILE H H 0.285 -6.967 2.857 1.00 . A A . 1 ILE H 1 1 8 1317 1 1 2 ILE HA H -1.004 -4.634 3.588 1.00 . A A . 1 ILE HA 1 1 8 1318 1 1 2 ILE HB H 0.995 -5.440 1.553 1.00 . A A . 1 ILE HB 1 1 8 1319 1 1 2 ILE HD11 H 2.444 -5.959 3.354 1.00 . A A . 1 ILE HD11 1 1 8 1320 1 1 2 ILE HD12 H 2.586 -4.909 4.764 1.00 . A A . 1 ILE HD12 1 1 8 1321 1 1 2 ILE HD13 H 1.087 -5.789 4.468 1.00 . A A . 1 ILE HD13 1 1 8 1322 1 1 2 ILE HG12 H 2.217 -3.552 2.756 1.00 . A A . 1 ILE HG12 1 1 8 1323 1 1 2 ILE HG13 H 0.809 -3.448 3.817 1.00 . A A . 1 ILE HG13 1 1 8 1324 1 1 2 ILE HG21 H -0.744 -3.086 1.184 1.00 . A A . 1 ILE HG21 1 1 8 1325 1 1 2 ILE HG22 H 0.974 -2.703 1.199 1.00 . A A . 1 ILE HG22 1 1 8 1326 1 1 2 ILE HG23 H 0.342 -3.868 0.038 1.00 . A A . 1 ILE HG23 1 1 8 1327 1 1 2 ILE N N -0.617 -6.586 2.885 1.00 . A A . 1 ILE N 1 1 8 1328 1 1 2 ILE O O -3.104 -4.631 2.120 1.00 . A A . 1 ILE O 1 1 8 1329 1 1 3 ASP C C -3.375 -3.424 -0.486 1.00 . A A . 2 ASP C 1 1 8 1330 1 1 3 ASP CA C -2.851 -4.856 -0.567 1.00 . A A . 2 ASP CA 1 1 8 1331 1 1 3 ASP CB C -3.942 -5.854 -0.176 1.00 . A A . 2 ASP CB 1 1 8 1332 1 1 3 ASP CG C -4.076 -6.919 -1.266 1.00 . A A . 2 ASP CG 1 1 8 1333 1 1 3 ASP H H -0.863 -5.289 0.130 1.00 . A A . 2 ASP H 1 1 8 1334 1 1 3 ASP HA H -2.496 -5.064 -1.562 1.00 . A A . 2 ASP HA 1 1 8 1335 1 1 3 ASP HB2 H -3.679 -6.327 0.760 1.00 . A A . 2 ASP HB2 1 1 8 1336 1 1 3 ASP HB3 H -4.882 -5.335 -0.066 1.00 . A A . 2 ASP HB3 1 1 8 1337 1 1 3 ASP N N -1.764 -5.058 0.430 1.00 . A A . 2 ASP N 1 1 8 1338 1 1 3 ASP O O -3.166 -2.625 -1.378 1.00 . A A . 2 ASP O 1 1 8 1339 1 1 3 ASP OD1 O -3.697 -6.639 -2.392 1.00 . A A . 2 ASP OD1 1 1 8 1340 1 1 3 ASP OD2 O -4.555 -7.998 -0.957 1.00 . A A . 2 ASP OD2 1 1 8 1341 1 1 4 TYR C C -3.516 -0.701 1.067 1.00 . A A . 3 TYR C 1 1 8 1342 1 1 4 TYR CA C -4.609 -1.720 0.696 1.00 . A A . 3 TYR CA 1 1 8 1343 1 1 4 TYR CB C -5.706 -1.816 1.764 1.00 . A A . 3 TYR CB 1 1 8 1344 1 1 4 TYR CD1 C -4.904 -3.392 3.559 1.00 . A A . 3 TYR CD1 1 1 8 1345 1 1 4 TYR CD2 C -4.757 -1.003 3.946 1.00 . A A . 3 TYR CD2 1 1 8 1346 1 1 4 TYR CE1 C -4.352 -3.629 4.822 1.00 . A A . 3 TYR CE1 1 1 8 1347 1 1 4 TYR CE2 C -4.207 -1.240 5.208 1.00 . A A . 3 TYR CE2 1 1 8 1348 1 1 4 TYR CG C -5.105 -2.078 3.121 1.00 . A A . 3 TYR CG 1 1 8 1349 1 1 4 TYR CZ C -4.005 -2.552 5.647 1.00 . A A . 3 TYR CZ 1 1 8 1350 1 1 4 TYR H H -4.225 -3.759 1.269 1.00 . A A . 3 TYR H 1 1 8 1351 1 1 4 TYR HA H -5.053 -1.429 -0.237 1.00 . A A . 3 TYR HA 1 1 8 1352 1 1 4 TYR HB2 H -6.257 -0.889 1.793 1.00 . A A . 3 TYR HB2 1 1 8 1353 1 1 4 TYR HB3 H -6.378 -2.621 1.511 1.00 . A A . 3 TYR HB3 1 1 8 1354 1 1 4 TYR HD1 H -5.173 -4.221 2.921 1.00 . A A . 3 TYR HD1 1 1 8 1355 1 1 4 TYR HD2 H -4.912 0.011 3.606 1.00 . A A . 3 TYR HD2 1 1 8 1356 1 1 4 TYR HE1 H -4.196 -4.642 5.162 1.00 . A A . 3 TYR HE1 1 1 8 1357 1 1 4 TYR HE2 H -3.937 -0.410 5.845 1.00 . A A . 3 TYR HE2 1 1 8 1358 1 1 4 TYR HH H -3.661 -2.027 7.449 1.00 . A A . 3 TYR HH 1 1 8 1359 1 1 4 TYR N N -4.062 -3.096 0.567 1.00 . A A . 3 TYR N 1 1 8 1360 1 1 4 TYR O O -3.360 0.280 0.378 1.00 . A A . 3 TYR O 1 1 8 1361 1 1 4 TYR OH O -3.465 -2.786 6.895 1.00 . A A . 3 TYR OH 1 1 8 1362 1 1 5 TRP C C -1.318 1.013 1.466 1.00 . A A . 4 TRP C 1 1 8 1363 1 1 5 TRP CA C -1.687 0.029 2.577 1.00 . A A . 4 TRP CA 1 1 8 1364 1 1 5 TRP CB C -0.470 -0.847 2.882 1.00 . A A . 4 TRP CB 1 1 8 1365 1 1 5 TRP CD1 C -1.523 -2.604 4.370 1.00 . A A . 4 TRP CD1 1 1 8 1366 1 1 5 TRP CD2 C 0.062 -1.417 5.421 1.00 . A A . 4 TRP CD2 1 1 8 1367 1 1 5 TRP CE2 C -0.434 -2.350 6.360 1.00 . A A . 4 TRP CE2 1 1 8 1368 1 1 5 TRP CE3 C 1.076 -0.543 5.830 1.00 . A A . 4 TRP CE3 1 1 8 1369 1 1 5 TRP CG C -0.651 -1.594 4.166 1.00 . A A . 4 TRP CG 1 1 8 1370 1 1 5 TRP CH2 C 1.074 -1.534 8.053 1.00 . A A . 4 TRP CH2 1 1 8 1371 1 1 5 TRP CZ2 C 0.062 -2.413 7.659 1.00 . A A . 4 TRP CZ2 1 1 8 1372 1 1 5 TRP CZ3 C 1.581 -0.600 7.138 1.00 . A A . 4 TRP CZ3 1 1 8 1373 1 1 5 TRP H H -2.933 -1.731 2.661 1.00 . A A . 4 TRP H 1 1 8 1374 1 1 5 TRP HA H -1.988 0.559 3.467 1.00 . A A . 4 TRP HA 1 1 8 1375 1 1 5 TRP HB2 H -0.332 -1.545 2.082 1.00 . A A . 4 TRP HB2 1 1 8 1376 1 1 5 TRP HB3 H 0.407 -0.219 2.958 1.00 . A A . 4 TRP HB3 1 1 8 1377 1 1 5 TRP HD1 H -2.203 -3.007 3.639 1.00 . A A . 4 TRP HD1 1 1 8 1378 1 1 5 TRP HE1 H -1.916 -3.779 6.072 1.00 . A A . 4 TRP HE1 1 1 8 1379 1 1 5 TRP HE3 H 1.471 0.173 5.130 1.00 . A A . 4 TRP HE3 1 1 8 1380 1 1 5 TRP HH2 H 1.464 -1.574 9.058 1.00 . A A . 4 TRP HH2 1 1 8 1381 1 1 5 TRP HZ2 H -0.333 -3.136 8.356 1.00 . A A . 4 TRP HZ2 1 1 8 1382 1 1 5 TRP HZ3 H 2.364 0.079 7.442 1.00 . A A . 4 TRP HZ3 1 1 8 1383 1 1 5 TRP N N -2.774 -0.928 2.139 1.00 . A A . 4 TRP N 1 1 8 1384 1 1 5 TRP NE1 N -1.394 -3.054 5.670 1.00 . A A . 4 TRP NE1 1 1 8 1385 1 1 5 TRP O O -1.344 2.214 1.643 1.00 . A A . 4 TRP O 1 1 8 1386 1 1 6 LEU C C -1.431 2.642 -0.869 1.00 . A A . 5 LEU C 1 1 8 1387 1 1 6 LEU CA C -0.595 1.351 -0.836 1.00 . A A . 5 LEU CA 1 1 8 1388 1 1 6 LEU CB C -0.889 0.453 -2.045 1.00 . A A . 5 LEU CB 1 1 8 1389 1 1 6 LEU CD1 C 0.120 1.954 -3.771 1.00 . A A . 5 LEU CD1 1 1 8 1390 1 1 6 LEU CD2 C -1.709 0.364 -4.390 1.00 . A A . 5 LEU CD2 1 1 8 1391 1 1 6 LEU CG C -1.172 1.288 -3.294 1.00 . A A . 5 LEU CG 1 1 8 1392 1 1 6 LEU H H -0.964 -0.481 0.220 1.00 . A A . 5 LEU H 1 1 8 1393 1 1 6 LEU HA H 0.457 1.584 -0.804 1.00 . A A . 5 LEU HA 1 1 8 1394 1 1 6 LEU HB2 H -0.036 -0.184 -2.230 1.00 . A A . 5 LEU HB2 1 1 8 1395 1 1 6 LEU HB3 H -1.749 -0.162 -1.828 1.00 . A A . 5 LEU HB3 1 1 8 1396 1 1 6 LEU HD11 H 0.510 2.586 -2.987 1.00 . A A . 5 LEU HD11 1 1 8 1397 1 1 6 LEU HD12 H 0.848 1.194 -4.016 1.00 . A A . 5 LEU HD12 1 1 8 1398 1 1 6 LEU HD13 H -0.085 2.552 -4.647 1.00 . A A . 5 LEU HD13 1 1 8 1399 1 1 6 LEU HD21 H -1.276 -0.620 -4.275 1.00 . A A . 5 LEU HD21 1 1 8 1400 1 1 6 LEU HD22 H -2.784 0.295 -4.308 1.00 . A A . 5 LEU HD22 1 1 8 1401 1 1 6 LEU HD23 H -1.445 0.761 -5.358 1.00 . A A . 5 LEU HD23 1 1 8 1402 1 1 6 LEU HG H -1.907 2.045 -3.065 1.00 . A A . 5 LEU HG 1 1 8 1403 1 1 6 LEU N N -0.974 0.493 0.322 1.00 . A A . 5 LEU N 1 1 8 1404 1 1 6 LEU O O -0.899 3.730 -0.960 1.00 . A A . 5 LEU O 1 1 8 1405 1 1 7 ALA C C -3.857 4.299 0.568 1.00 . A A . 6 ALA C 1 1 8 1406 1 1 7 ALA CA C -3.589 3.760 -0.844 1.00 . A A . 6 ALA CA 1 1 8 1407 1 1 7 ALA CB C -4.895 3.300 -1.490 1.00 . A A . 6 ALA CB 1 1 8 1408 1 1 7 ALA H H -3.145 1.648 -0.737 1.00 . A A . 6 ALA H 1 1 8 1409 1 1 7 ALA HA H -3.128 4.519 -1.454 1.00 . A A . 6 ALA HA 1 1 8 1410 1 1 7 ALA HB1 H -4.708 2.429 -2.101 1.00 . A A . 6 ALA HB1 1 1 8 1411 1 1 7 ALA HB2 H -5.609 3.050 -0.719 1.00 . A A . 6 ALA HB2 1 1 8 1412 1 1 7 ALA HB3 H -5.292 4.093 -2.105 1.00 . A A . 6 ALA HB3 1 1 8 1413 1 1 7 ALA N N -2.731 2.534 -0.805 1.00 . A A . 6 ALA N 1 1 8 1414 1 1 7 ALA O O -4.751 5.097 0.772 1.00 . A A . 6 ALA O 1 1 8 1415 1 1 8 HIS C C -2.057 4.915 3.533 1.00 . A A . 7 HIS C 1 1 8 1416 1 1 8 HIS CA C -3.349 4.352 2.936 1.00 . A A . 7 HIS CA 1 1 8 1417 1 1 8 HIS CB C -3.809 3.119 3.725 1.00 . A A . 7 HIS CB 1 1 8 1418 1 1 8 HIS CD2 C -4.878 1.909 1.647 1.00 . A A . 7 HIS CD2 1 1 8 1419 1 1 8 HIS CE1 C -6.750 1.306 2.547 1.00 . A A . 7 HIS CE1 1 1 8 1420 1 1 8 HIS CG C -4.852 2.362 2.942 1.00 . A A . 7 HIS CG 1 1 8 1421 1 1 8 HIS H H -2.399 3.213 1.369 1.00 . A A . 7 HIS H 1 1 8 1422 1 1 8 HIS HA H -4.124 5.102 2.943 1.00 . A A . 7 HIS HA 1 1 8 1423 1 1 8 HIS HB2 H -2.962 2.475 3.907 1.00 . A A . 7 HIS HB2 1 1 8 1424 1 1 8 HIS HB3 H -4.229 3.434 4.668 1.00 . A A . 7 HIS HB3 1 1 8 1425 1 1 8 HIS HD1 H -6.358 2.134 4.419 1.00 . A A . 7 HIS HD1 1 1 8 1426 1 1 8 HIS HD2 H -4.088 2.039 0.932 1.00 . A A . 7 HIS HD2 1 1 8 1427 1 1 8 HIS HE1 H -7.723 0.869 2.692 1.00 . A A . 7 HIS HE1 1 1 8 1428 1 1 8 HIS HE2 H -6.357 0.827 0.566 1.00 . A A . 7 HIS HE2 1 1 8 1429 1 1 8 HIS N N -3.109 3.865 1.546 1.00 . A A . 7 HIS N 1 1 8 1430 1 1 8 HIS ND1 N -6.061 1.966 3.500 1.00 . A A . 7 HIS ND1 1 1 8 1431 1 1 8 HIS NE2 N -6.072 1.248 1.404 1.00 . A A . 7 HIS NE2 1 1 8 1432 1 1 8 HIS O O -1.934 5.070 4.732 1.00 . A A . 7 HIS O 1 1 8 1433 1 1 9 LYS C C 0.084 7.304 3.359 1.00 . A A . 8 LYS C 1 1 8 1434 1 1 9 LYS CA C 0.183 5.783 3.240 1.00 . A A . 8 LYS CA 1 1 8 1435 1 1 9 LYS CB C 1.250 5.389 2.219 1.00 . A A . 8 LYS CB 1 1 8 1436 1 1 9 LYS CD C 2.302 3.472 1.005 1.00 . A A . 8 LYS CD 1 1 8 1437 1 1 9 LYS CE C 3.725 3.702 1.516 1.00 . A A . 8 LYS CE 1 1 8 1438 1 1 9 LYS CG C 1.298 3.864 2.092 1.00 . A A . 8 LYS CG 1 1 8 1439 1 1 9 LYS H H -1.210 5.099 1.745 1.00 . A A . 8 LYS H 1 1 8 1440 1 1 9 LYS HA H 0.408 5.349 4.197 1.00 . A A . 8 LYS HA 1 1 8 1441 1 1 9 LYS HB2 H 1.007 5.823 1.259 1.00 . A A . 8 LYS HB2 1 1 8 1442 1 1 9 LYS HB3 H 2.213 5.751 2.545 1.00 . A A . 8 LYS HB3 1 1 8 1443 1 1 9 LYS HD2 H 2.172 2.429 0.756 1.00 . A A . 8 LYS HD2 1 1 8 1444 1 1 9 LYS HD3 H 2.136 4.076 0.126 1.00 . A A . 8 LYS HD3 1 1 8 1445 1 1 9 LYS HE2 H 3.808 4.683 1.966 1.00 . A A . 8 LYS HE2 1 1 8 1446 1 1 9 LYS HE3 H 3.999 2.937 2.226 1.00 . A A . 8 LYS HE3 1 1 8 1447 1 1 9 LYS HG2 H 1.602 3.434 3.036 1.00 . A A . 8 LYS HG2 1 1 8 1448 1 1 9 LYS HG3 H 0.320 3.494 1.826 1.00 . A A . 8 LYS HG3 1 1 8 1449 1 1 9 LYS HZ1 H 4.330 2.758 -0.237 1.00 . A A . 8 LYS HZ1 1 1 8 1450 1 1 9 LYS HZ2 H 4.454 4.452 -0.283 1.00 . A A . 8 LYS HZ2 1 1 8 1451 1 1 9 LYS HZ3 H 5.586 3.546 0.596 1.00 . A A . 8 LYS HZ3 1 1 8 1452 1 1 9 LYS N N -1.094 5.227 2.710 1.00 . A A . 8 LYS N 1 1 8 1453 1 1 9 LYS NZ N 4.589 3.607 0.307 1.00 . A A . 8 LYS NZ 1 1 8 1454 1 1 9 LYS O O 1.076 7.999 3.454 1.00 . A A . 8 LYS O 1 1 8 1455 1 1 10 ALA C C -1.413 9.692 4.956 1.00 . A A . 9 ALA C 1 1 8 1456 1 1 10 ALA CA C -1.291 9.294 3.482 1.00 . A A . 9 ALA CA 1 1 8 1457 1 1 10 ALA CB C -2.589 9.597 2.734 1.00 . A A . 9 ALA CB 1 1 8 1458 1 1 10 ALA H H -1.890 7.233 3.292 1.00 . A A . 9 ALA H 1 1 8 1459 1 1 10 ALA HA H -0.467 9.813 3.017 1.00 . A A . 9 ALA HA 1 1 8 1460 1 1 10 ALA HB1 H -3.195 8.703 2.688 1.00 . A A . 9 ALA HB1 1 1 8 1461 1 1 10 ALA HB2 H -3.131 10.374 3.253 1.00 . A A . 9 ALA HB2 1 1 8 1462 1 1 10 ALA HB3 H -2.358 9.927 1.732 1.00 . A A . 9 ALA HB3 1 1 8 1463 1 1 10 ALA N N -1.110 7.819 3.363 1.00 . A A . 9 ALA N 1 1 8 1464 1 1 10 ALA O O -0.626 10.461 5.469 1.00 . A A . 9 ALA O 1 1 8 1465 1 1 11 LEU C C -1.241 9.380 7.821 1.00 . A A . 10 LEU C 1 1 8 1466 1 1 11 LEU CA C -2.572 9.514 7.078 1.00 . A A . 10 LEU CA 1 1 8 1467 1 1 11 LEU CB C -3.586 8.498 7.605 1.00 . A A . 10 LEU CB 1 1 8 1468 1 1 11 LEU CD1 C -5.657 8.614 8.997 1.00 . A A . 10 LEU CD1 1 1 8 1469 1 1 11 LEU CD2 C -3.425 8.376 10.096 1.00 . A A . 10 LEU CD2 1 1 8 1470 1 1 11 LEU CG C -4.180 9.004 8.921 1.00 . A A . 10 LEU CG 1 1 8 1471 1 1 11 LEU H H -3.018 8.550 5.203 1.00 . A A . 10 LEU H 1 1 8 1472 1 1 11 LEU HA H -2.964 10.514 7.181 1.00 . A A . 10 LEU HA 1 1 8 1473 1 1 11 LEU HB2 H -4.376 8.370 6.879 1.00 . A A . 10 LEU HB2 1 1 8 1474 1 1 11 LEU HB3 H -3.094 7.552 7.773 1.00 . A A . 10 LEU HB3 1 1 8 1475 1 1 11 LEU HD11 H -6.068 8.566 8.000 1.00 . A A . 10 LEU HD11 1 1 8 1476 1 1 11 LEU HD12 H -5.749 7.647 9.470 1.00 . A A . 10 LEU HD12 1 1 8 1477 1 1 11 LEU HD13 H -6.195 9.351 9.574 1.00 . A A . 10 LEU HD13 1 1 8 1478 1 1 11 LEU HD21 H -2.690 7.679 9.722 1.00 . A A . 10 LEU HD21 1 1 8 1479 1 1 11 LEU HD22 H -2.931 9.150 10.662 1.00 . A A . 10 LEU HD22 1 1 8 1480 1 1 11 LEU HD23 H -4.124 7.853 10.734 1.00 . A A . 10 LEU HD23 1 1 8 1481 1 1 11 LEU HG H -4.089 10.080 8.965 1.00 . A A . 10 LEU HG 1 1 8 1482 1 1 11 LEU N N -2.395 9.169 5.638 1.00 . A A . 10 LEU N 1 1 8 1483 1 1 11 LEU O O -0.703 10.343 8.332 1.00 . A A . 10 LEU O 1 1 8 1484 1 1 12 ALA C C 1.729 8.666 7.813 1.00 . A A . 11 ALA C 1 1 8 1485 1 1 12 ALA CA C 0.594 7.997 8.593 1.00 . A A . 11 ALA CA 1 1 8 1486 1 1 12 ALA CB C 0.793 6.482 8.638 1.00 . A A . 11 ALA CB 1 1 8 1487 1 1 12 ALA H H -1.153 7.430 7.465 1.00 . A A . 11 ALA H 1 1 8 1488 1 1 12 ALA HA H 0.540 8.391 9.595 1.00 . A A . 11 ALA HA 1 1 8 1489 1 1 12 ALA HB1 H -0.168 5.993 8.692 1.00 . A A . 11 ALA HB1 1 1 8 1490 1 1 12 ALA HB2 H 1.311 6.161 7.745 1.00 . A A . 11 ALA HB2 1 1 8 1491 1 1 12 ALA HB3 H 1.380 6.221 9.506 1.00 . A A . 11 ALA HB3 1 1 8 1492 1 1 12 ALA N N -0.703 8.193 7.884 1.00 . A A . 11 ALA N 1 1 8 1493 1 1 12 ALA O O 2.436 8.020 7.064 1.00 . A A . 11 ALA O 1 1 8 1494 1 1 13 NH2 HN1 H 1.365 10.469 8.561 1.00 . A A . 12 NH2 HN1 1 1 8 1495 1 1 13 NH2 HN2 H 2.656 10.386 7.462 1.00 . A A . 12 NH2 HN2 1 1 8 1496 1 1 13 NH2 N N 1.933 9.946 7.957 1.00 . A A . 12 NH2 N 1 1 9 1497 1 1 2 ILE C C -2.065 -4.903 1.613 1.00 . A A . 1 ILE C 1 1 9 1498 1 1 2 ILE CA C -0.856 -5.215 2.496 1.00 . A A . 1 ILE CA 1 1 9 1499 1 1 2 ILE CB C 0.459 -4.762 1.840 1.00 . A A . 1 ILE CB 1 1 9 1500 1 1 2 ILE CD1 C 1.931 -5.577 3.689 1.00 . A A . 1 ILE CD1 1 1 9 1501 1 1 2 ILE CG1 C 1.439 -4.340 2.937 1.00 . A A . 1 ILE CG1 1 1 9 1502 1 1 2 ILE CG2 C 0.226 -3.569 0.894 1.00 . A A . 1 ILE CG2 1 1 9 1503 1 1 2 ILE H H 0.142 -7.124 2.531 1.00 . A A . 1 ILE H 1 1 9 1504 1 1 2 ILE HA H -0.960 -4.744 3.453 1.00 . A A . 1 ILE HA 1 1 9 1505 1 1 2 ILE HB H 0.878 -5.582 1.283 1.00 . A A . 1 ILE HB 1 1 9 1506 1 1 2 ILE HD11 H 2.265 -6.321 2.980 1.00 . A A . 1 ILE HD11 1 1 9 1507 1 1 2 ILE HD12 H 2.752 -5.302 4.335 1.00 . A A . 1 ILE HD12 1 1 9 1508 1 1 2 ILE HD13 H 1.124 -5.981 4.282 1.00 . A A . 1 ILE HD13 1 1 9 1509 1 1 2 ILE HG12 H 2.281 -3.830 2.489 1.00 . A A . 1 ILE HG12 1 1 9 1510 1 1 2 ILE HG13 H 0.941 -3.676 3.628 1.00 . A A . 1 ILE HG13 1 1 9 1511 1 1 2 ILE HG21 H -0.734 -3.121 1.104 1.00 . A A . 1 ILE HG21 1 1 9 1512 1 1 2 ILE HG22 H 1.003 -2.835 1.041 1.00 . A A . 1 ILE HG22 1 1 9 1513 1 1 2 ILE HG23 H 0.243 -3.911 -0.129 1.00 . A A . 1 ILE HG23 1 1 9 1514 1 1 2 ILE N N -0.725 -6.687 2.665 1.00 . A A . 1 ILE N 1 1 9 1515 1 1 2 ILE O O -3.129 -4.574 2.095 1.00 . A A . 1 ILE O 1 1 9 1516 1 1 3 ASP C C -3.463 -3.249 -0.447 1.00 . A A . 2 ASP C 1 1 9 1517 1 1 3 ASP CA C -3.014 -4.702 -0.611 1.00 . A A . 2 ASP CA 1 1 9 1518 1 1 3 ASP CB C -4.137 -5.665 -0.218 1.00 . A A . 2 ASP CB 1 1 9 1519 1 1 3 ASP CG C -5.078 -5.867 -1.407 1.00 . A A . 2 ASP CG 1 1 9 1520 1 1 3 ASP H H -1.025 -5.269 -0.028 1.00 . A A . 2 ASP H 1 1 9 1521 1 1 3 ASP HA H -2.711 -4.882 -1.628 1.00 . A A . 2 ASP HA 1 1 9 1522 1 1 3 ASP HB2 H -3.711 -6.615 0.070 1.00 . A A . 2 ASP HB2 1 1 9 1523 1 1 3 ASP HB3 H -4.692 -5.254 0.611 1.00 . A A . 2 ASP HB3 1 1 9 1524 1 1 3 ASP N N -1.897 -5.002 0.325 1.00 . A A . 2 ASP N 1 1 9 1525 1 1 3 ASP O O -3.264 -2.425 -1.318 1.00 . A A . 2 ASP O 1 1 9 1526 1 1 3 ASP OD1 O -5.072 -5.025 -2.290 1.00 . A A . 2 ASP OD1 1 1 9 1527 1 1 3 ASP OD2 O -5.788 -6.858 -1.413 1.00 . A A . 2 ASP OD2 1 1 9 1528 1 1 4 TYR C C -3.388 -0.588 1.228 1.00 . A A . 3 TYR C 1 1 9 1529 1 1 4 TYR CA C -4.547 -1.540 0.874 1.00 . A A . 3 TYR CA 1 1 9 1530 1 1 4 TYR CB C -5.582 -1.644 2.000 1.00 . A A . 3 TYR CB 1 1 9 1531 1 1 4 TYR CD1 C -4.476 -0.888 4.124 1.00 . A A . 3 TYR CD1 1 1 9 1532 1 1 4 TYR CD2 C -4.721 -3.266 3.720 1.00 . A A . 3 TYR CD2 1 1 9 1533 1 1 4 TYR CE1 C -3.855 -1.158 5.345 1.00 . A A . 3 TYR CE1 1 1 9 1534 1 1 4 TYR CE2 C -4.101 -3.535 4.944 1.00 . A A . 3 TYR CE2 1 1 9 1535 1 1 4 TYR CG C -4.908 -1.942 3.312 1.00 . A A . 3 TYR CG 1 1 9 1536 1 1 4 TYR CZ C -3.668 -2.480 5.755 1.00 . A A . 3 TYR CZ 1 1 9 1537 1 1 4 TYR H H -4.230 -3.615 1.338 1.00 . A A . 3 TYR H 1 1 9 1538 1 1 4 TYR HA H -5.034 -1.185 -0.017 1.00 . A A . 3 TYR HA 1 1 9 1539 1 1 4 TYR HB2 H -6.117 -0.715 2.081 1.00 . A A . 3 TYR HB2 1 1 9 1540 1 1 4 TYR HB3 H -6.279 -2.436 1.770 1.00 . A A . 3 TYR HB3 1 1 9 1541 1 1 4 TYR HD1 H -4.621 0.133 3.806 1.00 . A A . 3 TYR HD1 1 1 9 1542 1 1 4 TYR HD2 H -5.056 -4.079 3.092 1.00 . A A . 3 TYR HD2 1 1 9 1543 1 1 4 TYR HE1 H -3.520 -0.345 5.973 1.00 . A A . 3 TYR HE1 1 1 9 1544 1 1 4 TYR HE2 H -3.954 -4.557 5.262 1.00 . A A . 3 TYR HE2 1 1 9 1545 1 1 4 TYR HH H -2.734 -1.916 7.321 1.00 . A A . 3 TYR HH 1 1 9 1546 1 1 4 TYR N N -4.075 -2.933 0.656 1.00 . A A . 3 TYR N 1 1 9 1547 1 1 4 TYR O O -3.227 0.424 0.587 1.00 . A A . 3 TYR O 1 1 9 1548 1 1 4 TYR OH O -3.058 -2.746 6.963 1.00 . A A . 3 TYR OH 1 1 9 1549 1 1 5 TRP C C -1.094 0.988 1.544 1.00 . A A . 4 TRP C 1 1 9 1550 1 1 5 TRP CA C -1.438 -0.020 2.643 1.00 . A A . 4 TRP CA 1 1 9 1551 1 1 5 TRP CB C -0.246 -0.958 2.842 1.00 . A A . 4 TRP CB 1 1 9 1552 1 1 5 TRP CD1 C -1.294 -2.720 4.332 1.00 . A A . 4 TRP CD1 1 1 9 1553 1 1 5 TRP CD2 C 0.416 -1.657 5.318 1.00 . A A . 4 TRP CD2 1 1 9 1554 1 1 5 TRP CE2 C -0.068 -2.598 6.254 1.00 . A A . 4 TRP CE2 1 1 9 1555 1 1 5 TRP CE3 C 1.500 -0.852 5.690 1.00 . A A . 4 TRP CE3 1 1 9 1556 1 1 5 TRP CG C -0.386 -1.746 4.109 1.00 . A A . 4 TRP CG 1 1 9 1557 1 1 5 TRP CH2 C 1.588 -1.927 7.872 1.00 . A A . 4 TRP CH2 1 1 9 1558 1 1 5 TRP CZ2 C 0.506 -2.736 7.516 1.00 . A A . 4 TRP CZ2 1 1 9 1559 1 1 5 TRP CZ3 C 2.084 -0.986 6.959 1.00 . A A . 4 TRP CZ3 1 1 9 1560 1 1 5 TRP H H -2.749 -1.733 2.719 1.00 . A A . 4 TRP H 1 1 9 1561 1 1 5 TRP HA H -1.664 0.489 3.567 1.00 . A A . 4 TRP HA 1 1 9 1562 1 1 5 TRP HB2 H -0.188 -1.632 2.010 1.00 . A A . 4 TRP HB2 1 1 9 1563 1 1 5 TRP HB3 H 0.661 -0.373 2.886 1.00 . A A . 4 TRP HB3 1 1 9 1564 1 1 5 TRP HD1 H -2.039 -3.058 3.634 1.00 . A A . 4 TRP HD1 1 1 9 1565 1 1 5 TRP HE1 H -1.642 -3.936 6.015 1.00 . A A . 4 TRP HE1 1 1 9 1566 1 1 5 TRP HE3 H 1.887 -0.132 4.990 1.00 . A A . 4 TRP HE3 1 1 9 1567 1 1 5 TRP HH2 H 2.040 -2.026 8.847 1.00 . A A . 4 TRP HH2 1 1 9 1568 1 1 5 TRP HZ2 H 0.119 -3.465 8.211 1.00 . A A . 4 TRP HZ2 1 1 9 1569 1 1 5 TRP HZ3 H 2.921 -0.360 7.234 1.00 . A A . 4 TRP HZ3 1 1 9 1570 1 1 5 TRP N N -2.591 -0.907 2.232 1.00 . A A . 4 TRP N 1 1 9 1571 1 1 5 TRP NE1 N -1.108 -3.224 5.605 1.00 . A A . 4 TRP NE1 1 1 9 1572 1 1 5 TRP O O -1.117 2.186 1.743 1.00 . A A . 4 TRP O 1 1 9 1573 1 1 6 LEU C C -1.356 2.597 -0.819 1.00 . A A . 5 LEU C 1 1 9 1574 1 1 6 LEU CA C -0.432 1.372 -0.762 1.00 . A A . 5 LEU CA 1 1 9 1575 1 1 6 LEU CB C -0.638 0.470 -1.982 1.00 . A A . 5 LEU CB 1 1 9 1576 1 1 6 LEU CD1 C 0.652 1.836 -3.629 1.00 . A A . 5 LEU CD1 1 1 9 1577 1 1 6 LEU CD2 C -1.264 0.418 -4.387 1.00 . A A . 5 LEU CD2 1 1 9 1578 1 1 6 LEU CG C -0.735 1.305 -3.257 1.00 . A A . 5 LEU CG 1 1 9 1579 1 1 6 LEU H H -0.779 -0.482 0.262 1.00 . A A . 5 LEU H 1 1 9 1580 1 1 6 LEU HA H 0.600 1.679 -0.704 1.00 . A A . 5 LEU HA 1 1 9 1581 1 1 6 LEU HB2 H 0.194 -0.215 -2.064 1.00 . A A . 5 LEU HB2 1 1 9 1582 1 1 6 LEU HB3 H -1.550 -0.094 -1.857 1.00 . A A . 5 LEU HB3 1 1 9 1583 1 1 6 LEU HD11 H 1.384 1.452 -2.934 1.00 . A A . 5 LEU HD11 1 1 9 1584 1 1 6 LEU HD12 H 0.903 1.516 -4.629 1.00 . A A . 5 LEU HD12 1 1 9 1585 1 1 6 LEU HD13 H 0.648 2.915 -3.588 1.00 . A A . 5 LEU HD13 1 1 9 1586 1 1 6 LEU HD21 H -2.189 -0.046 -4.077 1.00 . A A . 5 LEU HD21 1 1 9 1587 1 1 6 LEU HD22 H -1.438 1.018 -5.267 1.00 . A A . 5 LEU HD22 1 1 9 1588 1 1 6 LEU HD23 H -0.537 -0.350 -4.613 1.00 . A A . 5 LEU HD23 1 1 9 1589 1 1 6 LEU HG H -1.410 2.133 -3.100 1.00 . A A . 5 LEU HG 1 1 9 1590 1 1 6 LEU N N -0.782 0.490 0.384 1.00 . A A . 5 LEU N 1 1 9 1591 1 1 6 LEU O O -0.905 3.719 -0.938 1.00 . A A . 5 LEU O 1 1 9 1592 1 1 7 ALA C C -3.901 4.102 0.575 1.00 . A A . 6 ALA C 1 1 9 1593 1 1 7 ALA CA C -3.593 3.546 -0.821 1.00 . A A . 6 ALA CA 1 1 9 1594 1 1 7 ALA CB C -4.862 2.969 -1.450 1.00 . A A . 6 ALA CB 1 1 9 1595 1 1 7 ALA H H -2.991 1.479 -0.670 1.00 . A A . 6 ALA H 1 1 9 1596 1 1 7 ALA HA H -3.194 4.322 -1.454 1.00 . A A . 6 ALA HA 1 1 9 1597 1 1 7 ALA HB1 H -4.816 1.890 -1.425 1.00 . A A . 6 ALA HB1 1 1 9 1598 1 1 7 ALA HB2 H -5.724 3.304 -0.891 1.00 . A A . 6 ALA HB2 1 1 9 1599 1 1 7 ALA HB3 H -4.943 3.304 -2.472 1.00 . A A . 6 ALA HB3 1 1 9 1600 1 1 7 ALA N N -2.645 2.392 -0.753 1.00 . A A . 6 ALA N 1 1 9 1601 1 1 7 ALA O O -4.676 5.027 0.720 1.00 . A A . 6 ALA O 1 1 9 1602 1 1 8 HIS C C -2.346 4.553 3.652 1.00 . A A . 7 HIS C 1 1 9 1603 1 1 8 HIS CA C -3.623 4.042 2.976 1.00 . A A . 7 HIS CA 1 1 9 1604 1 1 8 HIS CB C -4.191 2.831 3.726 1.00 . A A . 7 HIS CB 1 1 9 1605 1 1 8 HIS CD2 C -5.330 1.804 1.585 1.00 . A A . 7 HIS CD2 1 1 9 1606 1 1 8 HIS CE1 C -7.242 1.287 2.451 1.00 . A A . 7 HIS CE1 1 1 9 1607 1 1 8 HIS CG C -5.278 2.185 2.904 1.00 . A A . 7 HIS CG 1 1 9 1608 1 1 8 HIS H H -2.715 2.786 1.474 1.00 . A A . 7 HIS H 1 1 9 1609 1 1 8 HIS HA H -4.363 4.826 2.936 1.00 . A A . 7 HIS HA 1 1 9 1610 1 1 8 HIS HB2 H -3.401 2.116 3.902 1.00 . A A . 7 HIS HB2 1 1 9 1611 1 1 8 HIS HB3 H -4.600 3.155 4.672 1.00 . A A . 7 HIS HB3 1 1 9 1612 1 1 8 HIS HD1 H -6.802 1.983 4.366 1.00 . A A . 7 HIS HD1 1 1 9 1613 1 1 8 HIS HD2 H -4.530 1.905 0.881 1.00 . A A . 7 HIS HD2 1 1 9 1614 1 1 8 HIS HE1 H -8.239 0.901 2.574 1.00 . A A . 7 HIS HE1 1 1 9 1615 1 1 8 HIS HE2 H -6.879 0.891 0.448 1.00 . A A . 7 HIS HE2 1 1 9 1616 1 1 8 HIS N N -3.326 3.541 1.602 1.00 . A A . 7 HIS N 1 1 9 1617 1 1 8 HIS ND1 N -6.514 1.844 3.439 1.00 . A A . 7 HIS ND1 1 1 9 1618 1 1 8 HIS NE2 N -6.568 1.245 1.307 1.00 . A A . 7 HIS NE2 1 1 9 1619 1 1 8 HIS O O -2.172 5.739 3.851 1.00 . A A . 7 HIS O 1 1 9 1620 1 1 9 LYS C C -0.508 5.170 5.729 1.00 . A A . 8 LYS C 1 1 9 1621 1 1 9 LYS CA C -0.198 4.109 4.673 1.00 . A A . 8 LYS CA 1 1 9 1622 1 1 9 LYS CB C 0.658 4.695 3.549 1.00 . A A . 8 LYS CB 1 1 9 1623 1 1 9 LYS CD C 2.333 3.648 2.020 1.00 . A A . 8 LYS CD 1 1 9 1624 1 1 9 LYS CE C 2.743 2.238 1.587 1.00 . A A . 8 LYS CE 1 1 9 1625 1 1 9 LYS CG C 0.868 3.640 2.463 1.00 . A A . 8 LYS CG 1 1 9 1626 1 1 9 LYS H H -1.609 2.722 3.846 1.00 . A A . 8 LYS H 1 1 9 1627 1 1 9 LYS HA H 0.307 3.269 5.121 1.00 . A A . 8 LYS HA 1 1 9 1628 1 1 9 LYS HB2 H 0.157 5.555 3.126 1.00 . A A . 8 LYS HB2 1 1 9 1629 1 1 9 LYS HB3 H 1.616 4.996 3.945 1.00 . A A . 8 LYS HB3 1 1 9 1630 1 1 9 LYS HD2 H 2.455 4.330 1.190 1.00 . A A . 8 LYS HD2 1 1 9 1631 1 1 9 LYS HD3 H 2.957 3.965 2.842 1.00 . A A . 8 LYS HD3 1 1 9 1632 1 1 9 LYS HE2 H 1.929 1.755 1.063 1.00 . A A . 8 LYS HE2 1 1 9 1633 1 1 9 LYS HE3 H 3.623 2.276 0.965 1.00 . A A . 8 LYS HE3 1 1 9 1634 1 1 9 LYS HG2 H 0.615 2.666 2.854 1.00 . A A . 8 LYS HG2 1 1 9 1635 1 1 9 LYS HG3 H 0.237 3.865 1.616 1.00 . A A . 8 LYS HG3 1 1 9 1636 1 1 9 LYS HZ1 H 2.429 1.880 3.613 1.00 . A A . 8 LYS HZ1 1 1 9 1637 1 1 9 LYS HZ2 H 2.879 0.502 2.727 1.00 . A A . 8 LYS HZ2 1 1 9 1638 1 1 9 LYS HZ3 H 4.041 1.676 3.114 1.00 . A A . 8 LYS HZ3 1 1 9 1639 1 1 9 LYS N N -1.454 3.670 4.010 1.00 . A A . 8 LYS N 1 1 9 1640 1 1 9 LYS NZ N 3.046 1.520 2.855 1.00 . A A . 8 LYS NZ 1 1 9 1641 1 1 9 LYS O O -1.510 5.109 6.415 1.00 . A A . 8 LYS O 1 1 9 1642 1 1 10 ALA C C -0.920 8.215 6.344 1.00 . A A . 9 ALA C 1 1 9 1643 1 1 10 ALA CA C 0.112 7.214 6.870 1.00 . A A . 9 ALA CA 1 1 9 1644 1 1 10 ALA CB C 1.471 7.890 7.054 1.00 . A A . 9 ALA CB 1 1 9 1645 1 1 10 ALA H H 1.141 6.164 5.296 1.00 . A A . 9 ALA H 1 1 9 1646 1 1 10 ALA HA H -0.218 6.788 7.805 1.00 . A A . 9 ALA HA 1 1 9 1647 1 1 10 ALA HB1 H 2.252 7.146 7.000 1.00 . A A . 9 ALA HB1 1 1 9 1648 1 1 10 ALA HB2 H 1.616 8.622 6.273 1.00 . A A . 9 ALA HB2 1 1 9 1649 1 1 10 ALA HB3 H 1.503 8.378 8.016 1.00 . A A . 9 ALA HB3 1 1 9 1650 1 1 10 ALA N N 0.346 6.141 5.862 1.00 . A A . 9 ALA N 1 1 9 1651 1 1 10 ALA O O -1.891 8.526 7.005 1.00 . A A . 9 ALA O 1 1 9 1652 1 1 11 LEU C C -3.119 9.173 4.739 1.00 . A A . 10 LEU C 1 1 9 1653 1 1 11 LEU CA C -1.689 9.700 4.590 1.00 . A A . 10 LEU CA 1 1 9 1654 1 1 11 LEU CB C -1.312 9.818 3.113 1.00 . A A . 10 LEU CB 1 1 9 1655 1 1 11 LEU CD1 C -2.300 12.107 3.268 1.00 . A A . 10 LEU CD1 1 1 9 1656 1 1 11 LEU CD2 C 0.175 11.803 3.401 1.00 . A A . 10 LEU CD2 1 1 9 1657 1 1 11 LEU CG C -1.113 11.290 2.753 1.00 . A A . 10 LEU CG 1 1 9 1658 1 1 11 LEU H H 0.070 8.455 4.641 1.00 . A A . 10 LEU H 1 1 9 1659 1 1 11 LEU HA H -1.586 10.657 5.075 1.00 . A A . 10 LEU HA 1 1 9 1660 1 1 11 LEU HB2 H -0.397 9.274 2.930 1.00 . A A . 10 LEU HB2 1 1 9 1661 1 1 11 LEU HB3 H -2.104 9.405 2.505 1.00 . A A . 10 LEU HB3 1 1 9 1662 1 1 11 LEU HD11 H -3.137 11.449 3.453 1.00 . A A . 10 LEU HD11 1 1 9 1663 1 1 11 LEU HD12 H -2.024 12.604 4.186 1.00 . A A . 10 LEU HD12 1 1 9 1664 1 1 11 LEU HD13 H -2.578 12.844 2.529 1.00 . A A . 10 LEU HD13 1 1 9 1665 1 1 11 LEU HD21 H 0.775 10.963 3.721 1.00 . A A . 10 LEU HD21 1 1 9 1666 1 1 11 LEU HD22 H 0.730 12.390 2.684 1.00 . A A . 10 LEU HD22 1 1 9 1667 1 1 11 LEU HD23 H -0.070 12.416 4.256 1.00 . A A . 10 LEU HD23 1 1 9 1668 1 1 11 LEU HG H -1.045 11.393 1.679 1.00 . A A . 10 LEU HG 1 1 9 1669 1 1 11 LEU N N -0.718 8.720 5.158 1.00 . A A . 10 LEU N 1 1 9 1670 1 1 11 LEU O O -3.404 8.030 4.443 1.00 . A A . 10 LEU O 1 1 9 1671 1 1 12 ALA C C -6.257 10.626 6.061 1.00 . A A . 11 ALA C 1 1 9 1672 1 1 12 ALA CA C -5.430 9.542 5.365 1.00 . A A . 11 ALA CA 1 1 9 1673 1 1 12 ALA CB C -5.340 8.291 6.239 1.00 . A A . 11 ALA CB 1 1 9 1674 1 1 12 ALA H H -3.771 10.916 5.431 1.00 . A A . 11 ALA H 1 1 9 1675 1 1 12 ALA HA H -5.862 9.293 4.408 1.00 . A A . 11 ALA HA 1 1 9 1676 1 1 12 ALA HB1 H -4.346 8.212 6.653 1.00 . A A . 11 ALA HB1 1 1 9 1677 1 1 12 ALA HB2 H -6.061 8.359 7.040 1.00 . A A . 11 ALA HB2 1 1 9 1678 1 1 12 ALA HB3 H -5.550 7.416 5.639 1.00 . A A . 11 ALA HB3 1 1 9 1679 1 1 12 ALA N N -4.021 9.998 5.198 1.00 . A A . 11 ALA N 1 1 9 1680 1 1 12 ALA O O -6.302 10.694 7.273 1.00 . A A . 11 ALA O 1 1 9 1681 1 1 13 NH2 HN1 H -6.887 11.431 4.358 1.00 . A A . 12 NH2 HN1 1 1 9 1682 1 1 13 NH2 HN2 H -7.453 12.184 5.771 1.00 . A A . 12 NH2 HN2 1 1 9 1683 1 1 13 NH2 N N -6.921 11.485 5.336 1.00 . A A . 12 NH2 N 1 1 10 1684 1 1 2 ILE C C -1.999 -5.004 1.616 1.00 . A A . 1 ILE C 1 1 10 1685 1 1 2 ILE CA C -0.867 -5.234 2.620 1.00 . A A . 1 ILE CA 1 1 10 1686 1 1 2 ILE CB C 0.470 -4.661 2.119 1.00 . A A . 1 ILE CB 1 1 10 1687 1 1 2 ILE CD1 C 2.481 -3.371 2.883 1.00 . A A . 1 ILE CD1 1 1 10 1688 1 1 2 ILE CG1 C 1.274 -4.192 3.336 1.00 . A A . 1 ILE CG1 1 1 10 1689 1 1 2 ILE CG2 C 0.236 -3.477 1.158 1.00 . A A . 1 ILE CG2 1 1 10 1690 1 1 2 ILE H H 0.280 -7.050 2.786 1.00 . A A . 1 ILE H 1 1 10 1691 1 1 2 ILE HA H -1.115 -4.791 3.566 1.00 . A A . 1 ILE HA 1 1 10 1692 1 1 2 ILE HB H 1.017 -5.436 1.605 1.00 . A A . 1 ILE HB 1 1 10 1693 1 1 2 ILE HD11 H 2.837 -3.750 1.938 1.00 . A A . 1 ILE HD11 1 1 10 1694 1 1 2 ILE HD12 H 2.188 -2.338 2.771 1.00 . A A . 1 ILE HD12 1 1 10 1695 1 1 2 ILE HD13 H 3.264 -3.447 3.622 1.00 . A A . 1 ILE HD13 1 1 10 1696 1 1 2 ILE HG12 H 0.644 -3.582 3.969 1.00 . A A . 1 ILE HG12 1 1 10 1697 1 1 2 ILE HG13 H 1.617 -5.053 3.893 1.00 . A A . 1 ILE HG13 1 1 10 1698 1 1 2 ILE HG21 H -0.776 -3.113 1.270 1.00 . A A . 1 ILE HG21 1 1 10 1699 1 1 2 ILE HG22 H 0.926 -2.679 1.381 1.00 . A A . 1 ILE HG22 1 1 10 1700 1 1 2 ILE HG23 H 0.384 -3.804 0.141 1.00 . A A . 1 ILE HG23 1 1 10 1701 1 1 2 ILE N N -0.634 -6.693 2.784 1.00 . A A . 1 ILE N 1 1 10 1702 1 1 2 ILE O O -3.129 -4.763 1.985 1.00 . A A . 1 ILE O 1 1 10 1703 1 1 3 ASP C C -3.289 -3.432 -0.578 1.00 . A A . 2 ASP C 1 1 10 1704 1 1 3 ASP CA C -2.728 -4.849 -0.690 1.00 . A A . 2 ASP CA 1 1 10 1705 1 1 3 ASP CB C -3.816 -5.886 -0.403 1.00 . A A . 2 ASP CB 1 1 10 1706 1 1 3 ASP CG C -3.173 -7.259 -0.204 1.00 . A A . 2 ASP CG 1 1 10 1707 1 1 3 ASP H H -0.770 -5.267 0.092 1.00 . A A . 2 ASP H 1 1 10 1708 1 1 3 ASP HA H -2.316 -5.007 -1.672 1.00 . A A . 2 ASP HA 1 1 10 1709 1 1 3 ASP HB2 H -4.353 -5.606 0.492 1.00 . A A . 2 ASP HB2 1 1 10 1710 1 1 3 ASP HB3 H -4.501 -5.929 -1.235 1.00 . A A . 2 ASP HB3 1 1 10 1711 1 1 3 ASP N N -1.691 -5.073 0.353 1.00 . A A . 2 ASP N 1 1 10 1712 1 1 3 ASP O O -3.058 -2.594 -1.428 1.00 . A A . 2 ASP O 1 1 10 1713 1 1 3 ASP OD1 O -2.394 -7.656 -1.056 1.00 . A A . 2 ASP OD1 1 1 10 1714 1 1 3 ASP OD2 O -3.470 -7.891 0.796 1.00 . A A . 2 ASP OD2 1 1 10 1715 1 1 4 TYR C C -3.563 -0.775 1.065 1.00 . A A . 3 TYR C 1 1 10 1716 1 1 4 TYR CA C -4.614 -1.798 0.605 1.00 . A A . 3 TYR CA 1 1 10 1717 1 1 4 TYR CB C -5.760 -1.948 1.616 1.00 . A A . 3 TYR CB 1 1 10 1718 1 1 4 TYR CD1 C -5.023 -3.646 3.324 1.00 . A A . 3 TYR CD1 1 1 10 1719 1 1 4 TYR CD2 C -4.957 -1.295 3.908 1.00 . A A . 3 TYR CD2 1 1 10 1720 1 1 4 TYR CE1 C -4.546 -3.974 4.597 1.00 . A A . 3 TYR CE1 1 1 10 1721 1 1 4 TYR CE2 C -4.477 -1.622 5.179 1.00 . A A . 3 TYR CE2 1 1 10 1722 1 1 4 TYR CG C -5.230 -2.307 2.980 1.00 . A A . 3 TYR CG 1 1 10 1723 1 1 4 TYR CZ C -4.272 -2.960 5.523 1.00 . A A . 3 TYR CZ 1 1 10 1724 1 1 4 TYR H H -4.213 -3.852 1.122 1.00 . A A . 3 TYR H 1 1 10 1725 1 1 4 TYR HA H -5.020 -1.481 -0.338 1.00 . A A . 3 TYR HA 1 1 10 1726 1 1 4 TYR HB2 H -6.302 -1.016 1.679 1.00 . A A . 3 TYR HB2 1 1 10 1727 1 1 4 TYR HB3 H -6.431 -2.725 1.279 1.00 . A A . 3 TYR HB3 1 1 10 1728 1 1 4 TYR HD1 H -5.234 -4.427 2.608 1.00 . A A . 3 TYR HD1 1 1 10 1729 1 1 4 TYR HD2 H -5.115 -0.261 3.641 1.00 . A A . 3 TYR HD2 1 1 10 1730 1 1 4 TYR HE1 H -4.385 -5.009 4.865 1.00 . A A . 3 TYR HE1 1 1 10 1731 1 1 4 TYR HE2 H -4.266 -0.841 5.894 1.00 . A A . 3 TYR HE2 1 1 10 1732 1 1 4 TYR HH H -4.466 -3.831 7.211 1.00 . A A . 3 TYR HH 1 1 10 1733 1 1 4 TYR N N -4.032 -3.159 0.453 1.00 . A A . 3 TYR N 1 1 10 1734 1 1 4 TYR O O -3.380 0.223 0.407 1.00 . A A . 3 TYR O 1 1 10 1735 1 1 4 TYR OH O -3.805 -3.284 6.781 1.00 . A A . 3 TYR OH 1 1 10 1736 1 1 5 TRP C C -1.428 0.966 1.642 1.00 . A A . 4 TRP C 1 1 10 1737 1 1 5 TRP CA C -1.839 -0.061 2.700 1.00 . A A . 4 TRP CA 1 1 10 1738 1 1 5 TRP CB C -0.624 -0.929 3.044 1.00 . A A . 4 TRP CB 1 1 10 1739 1 1 5 TRP CD1 C -1.724 -2.782 4.382 1.00 . A A . 4 TRP CD1 1 1 10 1740 1 1 5 TRP CD2 C -0.243 -1.604 5.585 1.00 . A A . 4 TRP CD2 1 1 10 1741 1 1 5 TRP CE2 C -0.767 -2.591 6.447 1.00 . A A . 4 TRP CE2 1 1 10 1742 1 1 5 TRP CE3 C 0.715 -0.721 6.098 1.00 . A A . 4 TRP CE3 1 1 10 1743 1 1 5 TRP CG C -0.869 -1.740 4.280 1.00 . A A . 4 TRP CG 1 1 10 1744 1 1 5 TRP CH2 C 0.603 -1.813 8.270 1.00 . A A . 4 TRP CH2 1 1 10 1745 1 1 5 TRP CZ2 C -0.353 -2.702 7.773 1.00 . A A . 4 TRP CZ2 1 1 10 1746 1 1 5 TRP CZ3 C 1.138 -0.824 7.433 1.00 . A A . 4 TRP CZ3 1 1 10 1747 1 1 5 TRP H H -3.059 -1.838 2.664 1.00 . A A . 4 TRP H 1 1 10 1748 1 1 5 TRP HA H -2.196 0.434 3.589 1.00 . A A . 4 TRP HA 1 1 10 1749 1 1 5 TRP HB2 H -0.420 -1.586 2.222 1.00 . A A . 4 TRP HB2 1 1 10 1750 1 1 5 TRP HB3 H 0.231 -0.288 3.204 1.00 . A A . 4 TRP HB3 1 1 10 1751 1 1 5 TRP HD1 H -2.345 -3.168 3.591 1.00 . A A . 4 TRP HD1 1 1 10 1752 1 1 5 TRP HE1 H -2.182 -4.048 6.000 1.00 . A A . 4 TRP HE1 1 1 10 1753 1 1 5 TRP HE3 H 1.131 0.037 5.457 1.00 . A A . 4 TRP HE3 1 1 10 1754 1 1 5 TRP HH2 H 0.930 -1.889 9.296 1.00 . A A . 4 TRP HH2 1 1 10 1755 1 1 5 TRP HZ2 H -0.770 -3.467 8.409 1.00 . A A . 4 TRP HZ2 1 1 10 1756 1 1 5 TRP HZ3 H 1.877 -0.136 7.817 1.00 . A A . 4 TRP HZ3 1 1 10 1757 1 1 5 TRP N N -2.883 -1.020 2.172 1.00 . A A . 4 TRP N 1 1 10 1758 1 1 5 TRP NE1 N -1.659 -3.290 5.666 1.00 . A A . 4 TRP NE1 1 1 10 1759 1 1 5 TRP O O -1.500 2.160 1.854 1.00 . A A . 4 TRP O 1 1 10 1760 1 1 6 LEU C C -1.432 2.667 -0.645 1.00 . A A . 5 LEU C 1 1 10 1761 1 1 6 LEU CA C -0.568 1.396 -0.597 1.00 . A A . 5 LEU CA 1 1 10 1762 1 1 6 LEU CB C -0.760 0.533 -1.852 1.00 . A A . 5 LEU CB 1 1 10 1763 1 1 6 LEU CD1 C 0.321 2.105 -3.468 1.00 . A A . 5 LEU CD1 1 1 10 1764 1 1 6 LEU CD2 C -1.440 0.509 -4.245 1.00 . A A . 5 LEU CD2 1 1 10 1765 1 1 6 LEU CG C -0.985 1.405 -3.089 1.00 . A A . 5 LEU CG 1 1 10 1766 1 1 6 LEU H H -0.951 -0.479 0.380 1.00 . A A . 5 LEU H 1 1 10 1767 1 1 6 LEU HA H 0.473 1.653 -0.489 1.00 . A A . 5 LEU HA 1 1 10 1768 1 1 6 LEU HB2 H 0.118 -0.076 -2.002 1.00 . A A . 5 LEU HB2 1 1 10 1769 1 1 6 LEU HB3 H -1.617 -0.110 -1.712 1.00 . A A . 5 LEU HB3 1 1 10 1770 1 1 6 LEU HD11 H 1.152 1.440 -3.289 1.00 . A A . 5 LEU HD11 1 1 10 1771 1 1 6 LEU HD12 H 0.294 2.375 -4.513 1.00 . A A . 5 LEU HD12 1 1 10 1772 1 1 6 LEU HD13 H 0.438 2.997 -2.869 1.00 . A A . 5 LEU HD13 1 1 10 1773 1 1 6 LEU HD21 H -1.988 -0.336 -3.851 1.00 . A A . 5 LEU HD21 1 1 10 1774 1 1 6 LEU HD22 H -2.078 1.072 -4.909 1.00 . A A . 5 LEU HD22 1 1 10 1775 1 1 6 LEU HD23 H -0.576 0.155 -4.788 1.00 . A A . 5 LEU HD23 1 1 10 1776 1 1 6 LEU HG H -1.745 2.142 -2.883 1.00 . A A . 5 LEU HG 1 1 10 1777 1 1 6 LEU N N -0.996 0.492 0.509 1.00 . A A . 5 LEU N 1 1 10 1778 1 1 6 LEU O O -0.922 3.766 -0.737 1.00 . A A . 5 LEU O 1 1 10 1779 1 1 7 ALA C C -3.916 4.290 0.737 1.00 . A A . 6 ALA C 1 1 10 1780 1 1 7 ALA CA C -3.611 3.738 -0.664 1.00 . A A . 6 ALA CA 1 1 10 1781 1 1 7 ALA CB C -4.896 3.250 -1.334 1.00 . A A . 6 ALA CB 1 1 10 1782 1 1 7 ALA H H -3.127 1.636 -0.540 1.00 . A A . 6 ALA H 1 1 10 1783 1 1 7 ALA HA H -3.153 4.501 -1.273 1.00 . A A . 6 ALA HA 1 1 10 1784 1 1 7 ALA HB1 H -5.198 2.312 -0.892 1.00 . A A . 6 ALA HB1 1 1 10 1785 1 1 7 ALA HB2 H -5.676 3.983 -1.193 1.00 . A A . 6 ALA HB2 1 1 10 1786 1 1 7 ALA HB3 H -4.720 3.110 -2.390 1.00 . A A . 6 ALA HB3 1 1 10 1787 1 1 7 ALA N N -2.730 2.530 -0.602 1.00 . A A . 6 ALA N 1 1 10 1788 1 1 7 ALA O O -4.871 5.017 0.926 1.00 . A A . 6 ALA O 1 1 10 1789 1 1 8 HIS C C -2.116 5.069 3.690 1.00 . A A . 7 HIS C 1 1 10 1790 1 1 8 HIS CA C -3.395 4.472 3.096 1.00 . A A . 7 HIS CA 1 1 10 1791 1 1 8 HIS CB C -3.847 3.255 3.919 1.00 . A A . 7 HIS CB 1 1 10 1792 1 1 8 HIS CD2 C -4.697 1.856 1.863 1.00 . A A . 7 HIS CD2 1 1 10 1793 1 1 8 HIS CE1 C -6.611 1.231 2.654 1.00 . A A . 7 HIS CE1 1 1 10 1794 1 1 8 HIS CG C -4.796 2.400 3.116 1.00 . A A . 7 HIS CG 1 1 10 1795 1 1 8 HIS H H -2.358 3.366 1.557 1.00 . A A . 7 HIS H 1 1 10 1796 1 1 8 HIS HA H -4.179 5.212 3.072 1.00 . A A . 7 HIS HA 1 1 10 1797 1 1 8 HIS HB2 H -2.983 2.669 4.192 1.00 . A A . 7 HIS HB2 1 1 10 1798 1 1 8 HIS HB3 H -4.345 3.596 4.815 1.00 . A A . 7 HIS HB3 1 1 10 1799 1 1 8 HIS HD1 H -6.408 2.210 4.483 1.00 . A A . 7 HIS HD1 1 1 10 1800 1 1 8 HIS HD2 H -3.859 1.983 1.203 1.00 . A A . 7 HIS HD2 1 1 10 1801 1 1 8 HIS HE1 H -7.575 0.759 2.753 1.00 . A A . 7 HIS HE1 1 1 10 1802 1 1 8 HIS HE2 H -6.035 0.630 0.752 1.00 . A A . 7 HIS HE2 1 1 10 1803 1 1 8 HIS N N -3.124 3.956 1.721 1.00 . A A . 7 HIS N 1 1 10 1804 1 1 8 HIS ND1 N -6.030 1.990 3.606 1.00 . A A . 7 HIS ND1 1 1 10 1805 1 1 8 HIS NE2 N -5.838 1.123 1.576 1.00 . A A . 7 HIS NE2 1 1 10 1806 1 1 8 HIS O O -1.330 5.686 2.999 1.00 . A A . 7 HIS O 1 1 10 1807 1 1 9 LYS C C -0.667 6.970 5.504 1.00 . A A . 8 LYS C 1 1 10 1808 1 1 9 LYS CA C -0.673 5.444 5.600 1.00 . A A . 8 LYS CA 1 1 10 1809 1 1 9 LYS CB C 0.491 4.853 4.802 1.00 . A A . 8 LYS CB 1 1 10 1810 1 1 9 LYS CD C 1.554 2.590 4.815 1.00 . A A . 8 LYS CD 1 1 10 1811 1 1 9 LYS CE C 2.700 3.278 4.069 1.00 . A A . 8 LYS CE 1 1 10 1812 1 1 9 LYS CG C 0.252 3.359 4.576 1.00 . A A . 8 LYS CG 1 1 10 1813 1 1 9 LYS H H -2.544 4.389 5.504 1.00 . A A . 8 LYS H 1 1 10 1814 1 1 9 LYS HA H -0.609 5.130 6.629 1.00 . A A . 8 LYS HA 1 1 10 1815 1 1 9 LYS HB2 H 0.566 5.354 3.848 1.00 . A A . 8 LYS HB2 1 1 10 1816 1 1 9 LYS HB3 H 1.409 4.989 5.353 1.00 . A A . 8 LYS HB3 1 1 10 1817 1 1 9 LYS HD2 H 1.772 2.571 5.873 1.00 . A A . 8 LYS HD2 1 1 10 1818 1 1 9 LYS HD3 H 1.446 1.579 4.451 1.00 . A A . 8 LYS HD3 1 1 10 1819 1 1 9 LYS HE2 H 2.321 3.798 3.200 1.00 . A A . 8 LYS HE2 1 1 10 1820 1 1 9 LYS HE3 H 3.217 3.962 4.724 1.00 . A A . 8 LYS HE3 1 1 10 1821 1 1 9 LYS HG2 H -0.505 3.009 5.263 1.00 . A A . 8 LYS HG2 1 1 10 1822 1 1 9 LYS HG3 H -0.079 3.197 3.562 1.00 . A A . 8 LYS HG3 1 1 10 1823 1 1 9 LYS HZ1 H 3.843 1.592 4.491 1.00 . A A . 8 LYS HZ1 1 1 10 1824 1 1 9 LYS HZ2 H 3.142 1.582 2.947 1.00 . A A . 8 LYS HZ2 1 1 10 1825 1 1 9 LYS HZ3 H 4.485 2.574 3.263 1.00 . A A . 8 LYS HZ3 1 1 10 1826 1 1 9 LYS N N -1.900 4.889 4.964 1.00 . A A . 8 LYS N 1 1 10 1827 1 1 9 LYS NZ N 3.612 2.174 3.662 1.00 . A A . 8 LYS NZ 1 1 10 1828 1 1 9 LYS O O -1.504 7.567 4.856 1.00 . A A . 8 LYS O 1 1 10 1829 1 1 10 ALA C C 0.074 9.588 4.677 1.00 . A A . 9 ALA C 1 1 10 1830 1 1 10 ALA CA C 0.345 9.092 6.099 1.00 . A A . 9 ALA CA 1 1 10 1831 1 1 10 ALA CB C 1.773 9.433 6.523 1.00 . A A . 9 ALA CB 1 1 10 1832 1 1 10 ALA H H 0.934 7.097 6.659 1.00 . A A . 9 ALA H 1 1 10 1833 1 1 10 ALA HA H -0.359 9.525 6.791 1.00 . A A . 9 ALA HA 1 1 10 1834 1 1 10 ALA HB1 H 2.469 8.809 5.983 1.00 . A A . 9 ALA HB1 1 1 10 1835 1 1 10 ALA HB2 H 1.977 10.471 6.303 1.00 . A A . 9 ALA HB2 1 1 10 1836 1 1 10 ALA HB3 H 1.885 9.262 7.583 1.00 . A A . 9 ALA HB3 1 1 10 1837 1 1 10 ALA N N 0.274 7.603 6.146 1.00 . A A . 9 ALA N 1 1 10 1838 1 1 10 ALA O O 0.455 8.963 3.709 1.00 . A A . 9 ALA O 1 1 10 1839 1 1 11 LEU C C -1.607 12.584 3.292 1.00 . A A . 10 LEU C 1 1 10 1840 1 1 11 LEU CA C -0.882 11.239 3.186 1.00 . A A . 10 LEU CA 1 1 10 1841 1 1 11 LEU CB C -1.789 10.188 2.544 1.00 . A A . 10 LEU CB 1 1 10 1842 1 1 11 LEU CD1 C -2.433 11.783 0.731 1.00 . A A . 10 LEU CD1 1 1 10 1843 1 1 11 LEU CD2 C -0.420 10.329 0.461 1.00 . A A . 10 LEU CD2 1 1 10 1844 1 1 11 LEU CG C -1.838 10.407 1.032 1.00 . A A . 10 LEU CG 1 1 10 1845 1 1 11 LEU H H -0.885 11.195 5.340 1.00 . A A . 10 LEU H 1 1 10 1846 1 1 11 LEU HA H 0.025 11.343 2.613 1.00 . A A . 10 LEU HA 1 1 10 1847 1 1 11 LEU HB2 H -1.399 9.202 2.755 1.00 . A A . 10 LEU HB2 1 1 10 1848 1 1 11 LEU HB3 H -2.784 10.275 2.952 1.00 . A A . 10 LEU HB3 1 1 10 1849 1 1 11 LEU HD11 H -3.266 11.968 1.393 1.00 . A A . 10 LEU HD11 1 1 10 1850 1 1 11 LEU HD12 H -1.679 12.542 0.880 1.00 . A A . 10 LEU HD12 1 1 10 1851 1 1 11 LEU HD13 H -2.775 11.812 -0.294 1.00 . A A . 10 LEU HD13 1 1 10 1852 1 1 11 LEU HD21 H 0.085 9.467 0.870 1.00 . A A . 10 LEU HD21 1 1 10 1853 1 1 11 LEU HD22 H -0.469 10.241 -0.614 1.00 . A A . 10 LEU HD22 1 1 10 1854 1 1 11 LEU HD23 H 0.124 11.224 0.724 1.00 . A A . 10 LEU HD23 1 1 10 1855 1 1 11 LEU HG H -2.453 9.643 0.577 1.00 . A A . 10 LEU HG 1 1 10 1856 1 1 11 LEU N N -0.584 10.707 4.546 1.00 . A A . 10 LEU N 1 1 10 1857 1 1 11 LEU O O -2.714 12.666 3.786 1.00 . A A . 10 LEU O 1 1 10 1858 1 1 12 ALA C C -1.066 15.909 1.841 1.00 . A A . 11 ALA C 1 1 10 1859 1 1 12 ALA CA C -1.645 14.976 2.909 1.00 . A A . 11 ALA CA 1 1 10 1860 1 1 12 ALA CB C -1.320 15.497 4.308 1.00 . A A . 11 ALA CB 1 1 10 1861 1 1 12 ALA H H -0.098 13.550 2.439 1.00 . A A . 11 ALA H 1 1 10 1862 1 1 12 ALA HA H -2.713 14.882 2.789 1.00 . A A . 11 ALA HA 1 1 10 1863 1 1 12 ALA HB1 H -0.523 14.907 4.735 1.00 . A A . 11 ALA HB1 1 1 10 1864 1 1 12 ALA HB2 H -1.010 16.529 4.245 1.00 . A A . 11 ALA HB2 1 1 10 1865 1 1 12 ALA HB3 H -2.198 15.422 4.934 1.00 . A A . 11 ALA HB3 1 1 10 1866 1 1 12 ALA N N -0.991 13.639 2.833 1.00 . A A . 11 ALA N 1 1 10 1867 1 1 12 ALA O O -0.190 15.529 1.090 1.00 . A A . 11 ALA O 1 1 10 1868 1 1 13 NH2 HN1 H -2.234 17.433 2.344 1.00 . A A . 12 NH2 HN1 1 1 10 1869 1 1 13 NH2 HN2 H -1.164 17.731 1.060 1.00 . A A . 12 NH2 HN2 1 1 10 1870 1 1 13 NH2 N N -1.526 17.125 1.740 1.00 . A A . 12 NH2 N 1 1 11 1871 1 1 2 ILE C C -2.054 -4.875 1.703 1.00 . A A . 1 ILE C 1 1 11 1872 1 1 2 ILE CA C -0.852 -5.142 2.612 1.00 . A A . 1 ILE CA 1 1 11 1873 1 1 2 ILE CB C 0.466 -4.694 1.959 1.00 . A A . 1 ILE CB 1 1 11 1874 1 1 2 ILE CD1 C 2.653 -3.578 2.463 1.00 . A A . 1 ILE CD1 1 1 11 1875 1 1 2 ILE CG1 C 1.435 -4.272 3.069 1.00 . A A . 1 ILE CG1 1 1 11 1876 1 1 2 ILE CG2 C 0.227 -3.511 1.000 1.00 . A A . 1 ILE CG2 1 1 11 1877 1 1 2 ILE H H 0.176 -7.030 2.752 1.00 . A A . 1 ILE H 1 1 11 1878 1 1 2 ILE HA H -0.975 -4.637 3.552 1.00 . A A . 1 ILE HA 1 1 11 1879 1 1 2 ILE HB H 0.887 -5.519 1.410 1.00 . A A . 1 ILE HB 1 1 11 1880 1 1 2 ILE HD11 H 2.992 -4.135 1.602 1.00 . A A . 1 ILE HD11 1 1 11 1881 1 1 2 ILE HD12 H 2.381 -2.577 2.160 1.00 . A A . 1 ILE HD12 1 1 11 1882 1 1 2 ILE HD13 H 3.443 -3.531 3.196 1.00 . A A . 1 ILE HD13 1 1 11 1883 1 1 2 ILE HG12 H 0.933 -3.591 3.744 1.00 . A A . 1 ILE HG12 1 1 11 1884 1 1 2 ILE HG13 H 1.757 -5.148 3.615 1.00 . A A . 1 ILE HG13 1 1 11 1885 1 1 2 ILE HG21 H -0.749 -3.084 1.183 1.00 . A A . 1 ILE HG21 1 1 11 1886 1 1 2 ILE HG22 H 0.977 -2.753 1.154 1.00 . A A . 1 ILE HG22 1 1 11 1887 1 1 2 ILE HG23 H 0.275 -3.860 -0.021 1.00 . A A . 1 ILE HG23 1 1 11 1888 1 1 2 ILE N N -0.704 -6.605 2.833 1.00 . A A . 1 ILE N 1 1 11 1889 1 1 2 ILE O O -3.132 -4.561 2.161 1.00 . A A . 1 ILE O 1 1 11 1890 1 1 3 ASP C C -3.437 -3.280 -0.419 1.00 . A A . 2 ASP C 1 1 11 1891 1 1 3 ASP CA C -2.972 -4.732 -0.536 1.00 . A A . 2 ASP CA 1 1 11 1892 1 1 3 ASP CB C -4.089 -5.693 -0.125 1.00 . A A . 2 ASP CB 1 1 11 1893 1 1 3 ASP CG C -5.160 -5.728 -1.215 1.00 . A A . 2 ASP CG 1 1 11 1894 1 1 3 ASP H H -0.979 -5.242 0.086 1.00 . A A . 2 ASP H 1 1 11 1895 1 1 3 ASP HA H -2.658 -4.940 -1.545 1.00 . A A . 2 ASP HA 1 1 11 1896 1 1 3 ASP HB2 H -3.678 -6.684 0.011 1.00 . A A . 2 ASP HB2 1 1 11 1897 1 1 3 ASP HB3 H -4.530 -5.356 0.802 1.00 . A A . 2 ASP HB3 1 1 11 1898 1 1 3 ASP N N -1.862 -4.991 0.421 1.00 . A A . 2 ASP N 1 1 11 1899 1 1 3 ASP O O -3.246 -2.481 -1.314 1.00 . A A . 2 ASP O 1 1 11 1900 1 1 3 ASP OD1 O -4.796 -5.679 -2.378 1.00 . A A . 2 ASP OD1 1 1 11 1901 1 1 3 ASP OD2 O -6.328 -5.803 -0.868 1.00 . A A . 2 ASP OD2 1 1 11 1902 1 1 4 TYR C C -3.404 -0.565 1.169 1.00 . A A . 3 TYR C 1 1 11 1903 1 1 4 TYR CA C -4.548 -1.543 0.844 1.00 . A A . 3 TYR CA 1 1 11 1904 1 1 4 TYR CB C -5.581 -1.619 1.974 1.00 . A A . 3 TYR CB 1 1 11 1905 1 1 4 TYR CD1 C -4.478 -0.798 4.077 1.00 . A A . 3 TYR CD1 1 1 11 1906 1 1 4 TYR CD2 C -4.722 -3.187 3.746 1.00 . A A . 3 TYR CD2 1 1 11 1907 1 1 4 TYR CE1 C -3.864 -1.028 5.308 1.00 . A A . 3 TYR CE1 1 1 11 1908 1 1 4 TYR CE2 C -4.104 -3.417 4.980 1.00 . A A . 3 TYR CE2 1 1 11 1909 1 1 4 TYR CG C -4.907 -1.876 3.296 1.00 . A A . 3 TYR CG 1 1 11 1910 1 1 4 TYR CZ C -3.678 -2.336 5.760 1.00 . A A . 3 TYR CZ 1 1 11 1911 1 1 4 TYR H H -4.206 -3.602 1.375 1.00 . A A . 3 TYR H 1 1 11 1912 1 1 4 TYR HA H -5.038 -1.224 -0.057 1.00 . A A . 3 TYR HA 1 1 11 1913 1 1 4 TYR HB2 H -6.120 -0.687 2.026 1.00 . A A . 3 TYR HB2 1 1 11 1914 1 1 4 TYR HB3 H -6.276 -2.420 1.766 1.00 . A A . 3 TYR HB3 1 1 11 1915 1 1 4 TYR HD1 H -4.622 0.211 3.727 1.00 . A A . 3 TYR HD1 1 1 11 1916 1 1 4 TYR HD2 H -5.052 -4.019 3.143 1.00 . A A . 3 TYR HD2 1 1 11 1917 1 1 4 TYR HE1 H -3.533 -0.195 5.912 1.00 . A A . 3 TYR HE1 1 1 11 1918 1 1 4 TYR HE2 H -3.959 -4.428 5.331 1.00 . A A . 3 TYR HE2 1 1 11 1919 1 1 4 TYR HH H -3.459 -1.961 7.619 1.00 . A A . 3 TYR HH 1 1 11 1920 1 1 4 TYR N N -4.056 -2.938 0.672 1.00 . A A . 3 TYR N 1 1 11 1921 1 1 4 TYR O O -3.262 0.433 0.501 1.00 . A A . 3 TYR O 1 1 11 1922 1 1 4 TYR OH O -3.073 -2.564 6.979 1.00 . A A . 3 TYR OH 1 1 11 1923 1 1 5 TRP C C -1.127 1.048 1.434 1.00 . A A . 4 TRP C 1 1 11 1924 1 1 5 TRP CA C -1.464 0.075 2.567 1.00 . A A . 4 TRP CA 1 1 11 1925 1 1 5 TRP CB C -0.261 -0.840 2.807 1.00 . A A . 4 TRP CB 1 1 11 1926 1 1 5 TRP CD1 C -1.302 -2.568 4.348 1.00 . A A . 4 TRP CD1 1 1 11 1927 1 1 5 TRP CD2 C 0.398 -1.462 5.304 1.00 . A A . 4 TRP CD2 1 1 11 1928 1 1 5 TRP CE2 C -0.080 -2.378 6.268 1.00 . A A . 4 TRP CE2 1 1 11 1929 1 1 5 TRP CE3 C 1.473 -0.637 5.653 1.00 . A A . 4 TRP CE3 1 1 11 1930 1 1 5 TRP CG C -0.400 -1.593 4.096 1.00 . A A . 4 TRP CG 1 1 11 1931 1 1 5 TRP CH2 C 1.566 -1.643 7.868 1.00 . A A . 4 TRP CH2 1 1 11 1932 1 1 5 TRP CZ2 C 0.492 -2.474 7.534 1.00 . A A . 4 TRP CZ2 1 1 11 1933 1 1 5 TRP CZ3 C 2.057 -0.726 6.927 1.00 . A A . 4 TRP CZ3 1 1 11 1934 1 1 5 TRP H H -2.747 -1.655 2.691 1.00 . A A . 4 TRP H 1 1 11 1935 1 1 5 TRP HA H -1.701 0.613 3.470 1.00 . A A . 4 TRP HA 1 1 11 1936 1 1 5 TRP HB2 H -0.184 -1.536 1.996 1.00 . A A . 4 TRP HB2 1 1 11 1937 1 1 5 TRP HB3 H 0.637 -0.240 2.842 1.00 . A A . 4 TRP HB3 1 1 11 1938 1 1 5 TRP HD1 H -2.045 -2.934 3.660 1.00 . A A . 4 TRP HD1 1 1 11 1939 1 1 5 TRP HE1 H -1.641 -3.736 6.067 1.00 . A A . 4 TRP HE1 1 1 11 1940 1 1 5 TRP HE3 H 1.854 0.064 4.933 1.00 . A A . 4 TRP HE3 1 1 11 1941 1 1 5 TRP HH2 H 2.017 -1.709 8.847 1.00 . A A . 4 TRP HH2 1 1 11 1942 1 1 5 TRP HZ2 H 0.109 -3.183 8.251 1.00 . A A . 4 TRP HZ2 1 1 11 1943 1 1 5 TRP HZ3 H 2.887 -0.085 7.185 1.00 . A A . 4 TRP HZ3 1 1 11 1944 1 1 5 TRP N N -2.602 -0.843 2.180 1.00 . A A . 4 TRP N 1 1 11 1945 1 1 5 TRP NE1 N -1.113 -3.032 5.636 1.00 . A A . 4 TRP NE1 1 1 11 1946 1 1 5 TRP O O -1.123 2.250 1.604 1.00 . A A . 4 TRP O 1 1 11 1947 1 1 6 LEU C C -1.401 2.624 -0.927 1.00 . A A . 5 LEU C 1 1 11 1948 1 1 6 LEU CA C -0.516 1.370 -0.896 1.00 . A A . 5 LEU CA 1 1 11 1949 1 1 6 LEU CB C -0.799 0.458 -2.094 1.00 . A A . 5 LEU CB 1 1 11 1950 1 1 6 LEU CD1 C 0.262 1.928 -3.816 1.00 . A A . 5 LEU CD1 1 1 11 1951 1 1 6 LEU CD2 C -1.576 0.359 -4.456 1.00 . A A . 5 LEU CD2 1 1 11 1952 1 1 6 LEU CG C -1.048 1.284 -3.356 1.00 . A A . 5 LEU CG 1 1 11 1953 1 1 6 LEU H H -0.869 -0.457 0.177 1.00 . A A . 5 LEU H 1 1 11 1954 1 1 6 LEU HA H 0.527 1.642 -0.879 1.00 . A A . 5 LEU HA 1 1 11 1955 1 1 6 LEU HB2 H 0.050 -0.192 -2.255 1.00 . A A . 5 LEU HB2 1 1 11 1956 1 1 6 LEU HB3 H -1.671 -0.144 -1.885 1.00 . A A . 5 LEU HB3 1 1 11 1957 1 1 6 LEU HD11 H 1.047 1.187 -3.816 1.00 . A A . 5 LEU HD11 1 1 11 1958 1 1 6 LEU HD12 H 0.138 2.322 -4.814 1.00 . A A . 5 LEU HD12 1 1 11 1959 1 1 6 LEU HD13 H 0.524 2.731 -3.141 1.00 . A A . 5 LEU HD13 1 1 11 1960 1 1 6 LEU HD21 H -2.341 -0.286 -4.046 1.00 . A A . 5 LEU HD21 1 1 11 1961 1 1 6 LEU HD22 H -1.995 0.950 -5.255 1.00 . A A . 5 LEU HD22 1 1 11 1962 1 1 6 LEU HD23 H -0.766 -0.244 -4.839 1.00 . A A . 5 LEU HD23 1 1 11 1963 1 1 6 LEU HG H -1.777 2.053 -3.150 1.00 . A A . 5 LEU HG 1 1 11 1964 1 1 6 LEU N N -0.851 0.517 0.278 1.00 . A A . 5 LEU N 1 1 11 1965 1 1 6 LEU O O -0.914 3.733 -1.027 1.00 . A A . 5 LEU O 1 1 11 1966 1 1 7 ALA C C -3.880 4.181 0.511 1.00 . A A . 6 ALA C 1 1 11 1967 1 1 7 ALA CA C -3.603 3.647 -0.900 1.00 . A A . 6 ALA CA 1 1 11 1968 1 1 7 ALA CB C -4.895 3.127 -1.530 1.00 . A A . 6 ALA CB 1 1 11 1969 1 1 7 ALA H H -3.070 1.558 -0.788 1.00 . A A . 6 ALA H 1 1 11 1970 1 1 7 ALA HA H -3.180 4.421 -1.518 1.00 . A A . 6 ALA HA 1 1 11 1971 1 1 7 ALA HB1 H -5.062 2.106 -1.220 1.00 . A A . 6 ALA HB1 1 1 11 1972 1 1 7 ALA HB2 H -5.723 3.741 -1.210 1.00 . A A . 6 ALA HB2 1 1 11 1973 1 1 7 ALA HB3 H -4.811 3.167 -2.606 1.00 . A A . 6 ALA HB3 1 1 11 1974 1 1 7 ALA N N -2.694 2.460 -0.858 1.00 . A A . 6 ALA N 1 1 11 1975 1 1 7 ALA O O -4.625 5.125 0.687 1.00 . A A . 6 ALA O 1 1 11 1976 1 1 8 HIS C C -2.241 4.485 3.568 1.00 . A A . 7 HIS C 1 1 11 1977 1 1 8 HIS CA C -3.556 4.065 2.906 1.00 . A A . 7 HIS CA 1 1 11 1978 1 1 8 HIS CB C -4.170 2.869 3.643 1.00 . A A . 7 HIS CB 1 1 11 1979 1 1 8 HIS CD2 C -5.304 1.857 1.490 1.00 . A A . 7 HIS CD2 1 1 11 1980 1 1 8 HIS CE1 C -7.221 1.343 2.347 1.00 . A A . 7 HIS CE1 1 1 11 1981 1 1 8 HIS CG C -5.259 2.241 2.807 1.00 . A A . 7 HIS CG 1 1 11 1982 1 1 8 HIS H H -2.710 2.820 1.361 1.00 . A A . 7 HIS H 1 1 11 1983 1 1 8 HIS HA H -4.252 4.888 2.896 1.00 . A A . 7 HIS HA 1 1 11 1984 1 1 8 HIS HB2 H -3.400 2.135 3.836 1.00 . A A . 7 HIS HB2 1 1 11 1985 1 1 8 HIS HB3 H -4.587 3.203 4.581 1.00 . A A . 7 HIS HB3 1 1 11 1986 1 1 8 HIS HD1 H -6.793 2.047 4.259 1.00 . A A . 7 HIS HD1 1 1 11 1987 1 1 8 HIS HD2 H -4.501 1.962 0.788 1.00 . A A . 7 HIS HD2 1 1 11 1988 1 1 8 HIS HE1 H -8.220 0.960 2.465 1.00 . A A . 7 HIS HE1 1 1 11 1989 1 1 8 HIS HE2 H -6.845 0.938 0.347 1.00 . A A . 7 HIS HE2 1 1 11 1990 1 1 8 HIS N N -3.301 3.585 1.517 1.00 . A A . 7 HIS N 1 1 11 1991 1 1 8 HIS ND1 N -6.498 1.903 3.336 1.00 . A A . 7 HIS ND1 1 1 11 1992 1 1 8 HIS NE2 N -6.540 1.295 1.206 1.00 . A A . 7 HIS NE2 1 1 11 1993 1 1 8 HIS O O -2.219 4.929 4.699 1.00 . A A . 7 HIS O 1 1 11 1994 1 1 9 LYS C C 0.193 6.246 3.743 1.00 . A A . 8 LYS C 1 1 11 1995 1 1 9 LYS CA C 0.167 4.741 3.465 1.00 . A A . 8 LYS CA 1 1 11 1996 1 1 9 LYS CB C 1.205 4.373 2.404 1.00 . A A . 8 LYS CB 1 1 11 1997 1 1 9 LYS CD C 2.717 2.389 2.565 1.00 . A A . 8 LYS CD 1 1 11 1998 1 1 9 LYS CE C 3.038 2.618 4.044 1.00 . A A . 8 LYS CE 1 1 11 1999 1 1 9 LYS CG C 1.287 2.851 2.276 1.00 . A A . 8 LYS CG 1 1 11 2000 1 1 9 LYS H H -1.184 3.989 1.962 1.00 . A A . 8 LYS H 1 1 11 2001 1 1 9 LYS HA H 0.353 4.186 4.370 1.00 . A A . 8 LYS HA 1 1 11 2002 1 1 9 LYS HB2 H 0.916 4.800 1.455 1.00 . A A . 8 LYS HB2 1 1 11 2003 1 1 9 LYS HB3 H 2.170 4.760 2.695 1.00 . A A . 8 LYS HB3 1 1 11 2004 1 1 9 LYS HD2 H 2.809 1.338 2.333 1.00 . A A . 8 LYS HD2 1 1 11 2005 1 1 9 LYS HD3 H 3.408 2.954 1.957 1.00 . A A . 8 LYS HD3 1 1 11 2006 1 1 9 LYS HE2 H 2.265 3.215 4.507 1.00 . A A . 8 LYS HE2 1 1 11 2007 1 1 9 LYS HE3 H 3.146 1.675 4.556 1.00 . A A . 8 LYS HE3 1 1 11 2008 1 1 9 LYS HG2 H 0.610 2.394 2.983 1.00 . A A . 8 LYS HG2 1 1 11 2009 1 1 9 LYS HG3 H 1.013 2.558 1.273 1.00 . A A . 8 LYS HG3 1 1 11 2010 1 1 9 LYS HZ1 H 4.267 4.179 3.421 1.00 . A A . 8 LYS HZ1 1 1 11 2011 1 1 9 LYS HZ2 H 4.555 3.663 5.014 1.00 . A A . 8 LYS HZ2 1 1 11 2012 1 1 9 LYS HZ3 H 5.089 2.724 3.704 1.00 . A A . 8 LYS HZ3 1 1 11 2013 1 1 9 LYS N N -1.145 4.349 2.873 1.00 . A A . 8 LYS N 1 1 11 2014 1 1 9 LYS NZ N 4.335 3.351 4.046 1.00 . A A . 8 LYS NZ 1 1 11 2015 1 1 9 LYS O O -0.830 6.901 3.765 1.00 . A A . 8 LYS O 1 1 11 2016 1 1 10 ALA C C 1.200 9.059 2.947 1.00 . A A . 9 ALA C 1 1 11 2017 1 1 10 ALA CA C 1.446 8.262 4.231 1.00 . A A . 9 ALA CA 1 1 11 2018 1 1 10 ALA CB C 2.873 8.483 4.733 1.00 . A A . 9 ALA CB 1 1 11 2019 1 1 10 ALA H H 2.169 6.254 3.932 1.00 . A A . 9 ALA H 1 1 11 2020 1 1 10 ALA HA H 0.738 8.546 4.993 1.00 . A A . 9 ALA HA 1 1 11 2021 1 1 10 ALA HB1 H 3.567 7.975 4.080 1.00 . A A . 9 ALA HB1 1 1 11 2022 1 1 10 ALA HB2 H 3.092 9.540 4.741 1.00 . A A . 9 ALA HB2 1 1 11 2023 1 1 10 ALA HB3 H 2.966 8.089 5.735 1.00 . A A . 9 ALA HB3 1 1 11 2024 1 1 10 ALA N N 1.356 6.800 3.954 1.00 . A A . 9 ALA N 1 1 11 2025 1 1 10 ALA O O 2.045 9.130 2.076 1.00 . A A . 9 ALA O 1 1 11 2026 1 1 11 LEU C C -1.042 11.711 1.955 1.00 . A A . 10 LEU C 1 1 11 2027 1 1 11 LEU CA C -0.252 10.450 1.594 1.00 . A A . 10 LEU CA 1 1 11 2028 1 1 11 LEU CB C -1.095 9.521 0.719 1.00 . A A . 10 LEU CB 1 1 11 2029 1 1 11 LEU CD1 C -0.414 8.798 -1.574 1.00 . A A . 10 LEU CD1 1 1 11 2030 1 1 11 LEU CD2 C -2.365 10.329 -1.274 1.00 . A A . 10 LEU CD2 1 1 11 2031 1 1 11 LEU CG C -0.979 9.952 -0.744 1.00 . A A . 10 LEU CG 1 1 11 2032 1 1 11 LEU H H -0.621 9.589 3.535 1.00 . A A . 10 LEU H 1 1 11 2033 1 1 11 LEU HA H 0.662 10.710 1.081 1.00 . A A . 10 LEU HA 1 1 11 2034 1 1 11 LEU HB2 H -0.739 8.507 0.825 1.00 . A A . 10 LEU HB2 1 1 11 2035 1 1 11 LEU HB3 H -2.128 9.575 1.028 1.00 . A A . 10 LEU HB3 1 1 11 2036 1 1 11 LEU HD11 H 0.516 8.464 -1.138 1.00 . A A . 10 LEU HD11 1 1 11 2037 1 1 11 LEU HD12 H -1.121 7.983 -1.584 1.00 . A A . 10 LEU HD12 1 1 11 2038 1 1 11 LEU HD13 H -0.237 9.135 -2.584 1.00 . A A . 10 LEU HD13 1 1 11 2039 1 1 11 LEU HD21 H -3.116 9.748 -0.761 1.00 . A A . 10 LEU HD21 1 1 11 2040 1 1 11 LEU HD22 H -2.542 11.380 -1.101 1.00 . A A . 10 LEU HD22 1 1 11 2041 1 1 11 LEU HD23 H -2.413 10.125 -2.333 1.00 . A A . 10 LEU HD23 1 1 11 2042 1 1 11 LEU HG H -0.319 10.805 -0.817 1.00 . A A . 10 LEU HG 1 1 11 2043 1 1 11 LEU N N 0.047 9.659 2.821 1.00 . A A . 10 LEU N 1 1 11 2044 1 1 11 LEU O O -1.303 11.981 3.111 1.00 . A A . 10 LEU O 1 1 11 2045 1 1 12 ALA C C -1.439 14.598 2.273 1.00 . A A . 11 ALA C 1 1 11 2046 1 1 12 ALA CA C -2.196 13.727 1.266 1.00 . A A . 11 ALA CA 1 1 11 2047 1 1 12 ALA CB C -3.518 13.241 1.863 1.00 . A A . 11 ALA CB 1 1 11 2048 1 1 12 ALA H H -1.203 12.249 0.051 1.00 . A A . 11 ALA H 1 1 11 2049 1 1 12 ALA HA H -2.382 14.276 0.356 1.00 . A A . 11 ALA HA 1 1 11 2050 1 1 12 ALA HB1 H -3.810 12.318 1.385 1.00 . A A . 11 ALA HB1 1 1 11 2051 1 1 12 ALA HB2 H -3.394 13.075 2.923 1.00 . A A . 11 ALA HB2 1 1 11 2052 1 1 12 ALA HB3 H -4.281 13.988 1.702 1.00 . A A . 11 ALA HB3 1 1 11 2053 1 1 12 ALA N N -1.424 12.485 0.977 1.00 . A A . 11 ALA N 1 1 11 2054 1 1 12 ALA O O -2.015 15.107 3.213 1.00 . A A . 11 ALA O 1 1 11 2055 1 1 13 NH2 HN1 H 0.307 14.383 1.354 1.00 . A A . 12 NH2 HN1 1 1 11 2056 1 1 13 NH2 HN2 H 0.336 15.348 2.749 1.00 . A A . 12 NH2 HN2 1 1 11 2057 1 1 13 NH2 N N -0.159 14.793 2.112 1.00 . A A . 12 NH2 N 1 1 12 2058 1 1 2 ILE C C -2.090 -4.963 1.545 1.00 . A A . 1 ILE C 1 1 12 2059 1 1 2 ILE CA C -0.907 -5.310 2.452 1.00 . A A . 1 ILE CA 1 1 12 2060 1 1 2 ILE CB C 0.425 -4.849 1.842 1.00 . A A . 1 ILE CB 1 1 12 2061 1 1 2 ILE CD1 C 2.665 -3.892 2.424 1.00 . A A . 1 ILE CD1 1 1 12 2062 1 1 2 ILE CG1 C 1.409 -4.562 2.981 1.00 . A A . 1 ILE CG1 1 1 12 2063 1 1 2 ILE CG2 C 0.226 -3.574 0.999 1.00 . A A . 1 ILE CG2 1 1 12 2064 1 1 2 ILE H H 0.068 -7.230 2.416 1.00 . A A . 1 ILE H 1 1 12 2065 1 1 2 ILE HA H -1.031 -4.861 3.418 1.00 . A A . 1 ILE HA 1 1 12 2066 1 1 2 ILE HB H 0.816 -5.632 1.219 1.00 . A A . 1 ILE HB 1 1 12 2067 1 1 2 ILE HD11 H 2.720 -4.061 1.360 1.00 . A A . 1 ILE HD11 1 1 12 2068 1 1 2 ILE HD12 H 2.620 -2.830 2.619 1.00 . A A . 1 ILE HD12 1 1 12 2069 1 1 2 ILE HD13 H 3.537 -4.309 2.903 1.00 . A A . 1 ILE HD13 1 1 12 2070 1 1 2 ILE HG12 H 0.941 -3.906 3.702 1.00 . A A . 1 ILE HG12 1 1 12 2071 1 1 2 ILE HG13 H 1.683 -5.491 3.461 1.00 . A A . 1 ILE HG13 1 1 12 2072 1 1 2 ILE HG21 H -0.738 -3.140 1.223 1.00 . A A . 1 ILE HG21 1 1 12 2073 1 1 2 ILE HG22 H 1.000 -2.860 1.226 1.00 . A A . 1 ILE HG22 1 1 12 2074 1 1 2 ILE HG23 H 0.267 -3.825 -0.050 1.00 . A A . 1 ILE HG23 1 1 12 2075 1 1 2 ILE N N -0.789 -6.787 2.585 1.00 . A A . 1 ILE N 1 1 12 2076 1 1 2 ILE O O -3.177 -4.686 2.009 1.00 . A A . 1 ILE O 1 1 12 2077 1 1 3 ASP C C -3.421 -3.186 -0.467 1.00 . A A . 2 ASP C 1 1 12 2078 1 1 3 ASP CA C -2.961 -4.626 -0.694 1.00 . A A . 2 ASP CA 1 1 12 2079 1 1 3 ASP CB C -4.090 -5.609 -0.385 1.00 . A A . 2 ASP CB 1 1 12 2080 1 1 3 ASP CG C -5.063 -5.658 -1.565 1.00 . A A . 2 ASP CG 1 1 12 2081 1 1 3 ASP H H -0.983 -5.196 -0.077 1.00 . A A . 2 ASP H 1 1 12 2082 1 1 3 ASP HA H -2.628 -4.752 -1.709 1.00 . A A . 2 ASP HA 1 1 12 2083 1 1 3 ASP HB2 H -3.675 -6.594 -0.219 1.00 . A A . 2 ASP HB2 1 1 12 2084 1 1 3 ASP HB3 H -4.618 -5.287 0.500 1.00 . A A . 2 ASP HB3 1 1 12 2085 1 1 3 ASP N N -1.872 -4.970 0.260 1.00 . A A . 2 ASP N 1 1 12 2086 1 1 3 ASP O O -3.240 -2.324 -1.303 1.00 . A A . 2 ASP O 1 1 12 2087 1 1 3 ASP OD1 O -4.659 -5.284 -2.654 1.00 . A A . 2 ASP OD1 1 1 12 2088 1 1 3 ASP OD2 O -6.192 -6.068 -1.360 1.00 . A A . 2 ASP OD2 1 1 12 2089 1 1 4 TYR C C -3.364 -0.599 1.326 1.00 . A A . 3 TYR C 1 1 12 2090 1 1 4 TYR CA C -4.513 -1.549 0.940 1.00 . A A . 3 TYR CA 1 1 12 2091 1 1 4 TYR CB C -5.531 -1.721 2.074 1.00 . A A . 3 TYR CB 1 1 12 2092 1 1 4 TYR CD1 C -4.448 -0.880 4.178 1.00 . A A . 3 TYR CD1 1 1 12 2093 1 1 4 TYR CD2 C -4.569 -3.272 3.808 1.00 . A A . 3 TYR CD2 1 1 12 2094 1 1 4 TYR CE1 C -3.805 -1.098 5.397 1.00 . A A . 3 TYR CE1 1 1 12 2095 1 1 4 TYR CE2 C -3.924 -3.491 5.028 1.00 . A A . 3 TYR CE2 1 1 12 2096 1 1 4 TYR CG C -4.829 -1.966 3.382 1.00 . A A . 3 TYR CG 1 1 12 2097 1 1 4 TYR CZ C -3.543 -2.403 5.823 1.00 . A A . 3 TYR CZ 1 1 12 2098 1 1 4 TYR H H -4.167 -3.641 1.307 1.00 . A A . 3 TYR H 1 1 12 2099 1 1 4 TYR HA H -5.016 -1.163 0.074 1.00 . A A . 3 TYR HA 1 1 12 2100 1 1 4 TYR HB2 H -6.131 -0.829 2.155 1.00 . A A . 3 TYR HB2 1 1 12 2101 1 1 4 TYR HB3 H -6.172 -2.561 1.851 1.00 . A A . 3 TYR HB3 1 1 12 2102 1 1 4 TYR HD1 H -4.651 0.127 3.847 1.00 . A A . 3 TYR HD1 1 1 12 2103 1 1 4 TYR HD2 H -4.864 -4.109 3.192 1.00 . A A . 3 TYR HD2 1 1 12 2104 1 1 4 TYR HE1 H -3.510 -0.260 6.011 1.00 . A A . 3 TYR HE1 1 1 12 2105 1 1 4 TYR HE2 H -3.720 -4.500 5.358 1.00 . A A . 3 TYR HE2 1 1 12 2106 1 1 4 TYR HH H -3.038 -3.539 7.272 1.00 . A A . 3 TYR HH 1 1 12 2107 1 1 4 TYR N N -4.025 -2.925 0.654 1.00 . A A . 3 TYR N 1 1 12 2108 1 1 4 TYR O O -3.230 0.452 0.743 1.00 . A A . 3 TYR O 1 1 12 2109 1 1 4 TYR OH O -2.908 -2.620 7.028 1.00 . A A . 3 TYR OH 1 1 12 2110 1 1 5 TRP C C -1.054 0.960 1.657 1.00 . A A . 4 TRP C 1 1 12 2111 1 1 5 TRP CA C -1.404 -0.070 2.735 1.00 . A A . 4 TRP CA 1 1 12 2112 1 1 5 TRP CB C -0.205 -1.005 2.932 1.00 . A A . 4 TRP CB 1 1 12 2113 1 1 5 TRP CD1 C -1.268 -2.846 4.324 1.00 . A A . 4 TRP CD1 1 1 12 2114 1 1 5 TRP CD2 C 0.419 -1.819 5.383 1.00 . A A . 4 TRP CD2 1 1 12 2115 1 1 5 TRP CE2 C -0.073 -2.803 6.269 1.00 . A A . 4 TRP CE2 1 1 12 2116 1 1 5 TRP CE3 C 1.491 -1.028 5.805 1.00 . A A . 4 TRP CE3 1 1 12 2117 1 1 5 TRP CG C -0.364 -1.855 4.158 1.00 . A A . 4 TRP CG 1 1 12 2118 1 1 5 TRP CH2 C 1.555 -2.196 7.939 1.00 . A A . 4 TRP CH2 1 1 12 2119 1 1 5 TRP CZ2 C 0.484 -2.995 7.533 1.00 . A A . 4 TRP CZ2 1 1 12 2120 1 1 5 TRP CZ3 C 2.060 -1.213 7.076 1.00 . A A . 4 TRP CZ3 1 1 12 2121 1 1 5 TRP H H -2.682 -1.808 2.739 1.00 . A A . 4 TRP H 1 1 12 2122 1 1 5 TRP HA H -1.643 0.420 3.665 1.00 . A A . 4 TRP HA 1 1 12 2123 1 1 5 TRP HB2 H -0.113 -1.635 2.073 1.00 . A A . 4 TRP HB2 1 1 12 2124 1 1 5 TRP HB3 H 0.691 -0.409 3.028 1.00 . A A . 4 TRP HB3 1 1 12 2125 1 1 5 TRP HD1 H -2.002 -3.158 3.601 1.00 . A A . 4 TRP HD1 1 1 12 2126 1 1 5 TRP HE1 H -1.635 -4.137 5.946 1.00 . A A . 4 TRP HE1 1 1 12 2127 1 1 5 TRP HE3 H 1.882 -0.279 5.142 1.00 . A A . 4 TRP HE3 1 1 12 2128 1 1 5 TRP HH2 H 1.995 -2.335 8.916 1.00 . A A . 4 TRP HH2 1 1 12 2129 1 1 5 TRP HZ2 H 0.089 -3.755 8.190 1.00 . A A . 4 TRP HZ2 1 1 12 2130 1 1 5 TRP HZ3 H 2.887 -0.595 7.390 1.00 . A A . 4 TRP HZ3 1 1 12 2131 1 1 5 TRP N N -2.546 -0.957 2.296 1.00 . A A . 4 TRP N 1 1 12 2132 1 1 5 TRP NE1 N -1.099 -3.405 5.577 1.00 . A A . 4 TRP NE1 1 1 12 2133 1 1 5 TRP O O -1.010 2.149 1.900 1.00 . A A . 4 TRP O 1 1 12 2134 1 1 6 LEU C C -1.416 2.593 -0.741 1.00 . A A . 5 LEU C 1 1 12 2135 1 1 6 LEU CA C -0.445 1.405 -0.658 1.00 . A A . 5 LEU CA 1 1 12 2136 1 1 6 LEU CB C -0.551 0.507 -1.897 1.00 . A A . 5 LEU CB 1 1 12 2137 1 1 6 LEU CD1 C 0.541 1.121 -4.057 1.00 . A A . 5 LEU CD1 1 1 12 2138 1 1 6 LEU CD2 C -1.942 0.902 -3.923 1.00 . A A . 5 LEU CD2 1 1 12 2139 1 1 6 LEU CG C -0.685 1.344 -3.171 1.00 . A A . 5 LEU CG 1 1 12 2140 1 1 6 LEU H H -0.845 -0.473 0.308 1.00 . A A . 5 LEU H 1 1 12 2141 1 1 6 LEU HA H 0.569 1.756 -0.550 1.00 . A A . 5 LEU HA 1 1 12 2142 1 1 6 LEU HB2 H 0.333 -0.109 -1.966 1.00 . A A . 5 LEU HB2 1 1 12 2143 1 1 6 LEU HB3 H -1.420 -0.129 -1.798 1.00 . A A . 5 LEU HB3 1 1 12 2144 1 1 6 LEU HD11 H 1.434 1.138 -3.449 1.00 . A A . 5 LEU HD11 1 1 12 2145 1 1 6 LEU HD12 H 0.461 0.163 -4.550 1.00 . A A . 5 LEU HD12 1 1 12 2146 1 1 6 LEU HD13 H 0.598 1.903 -4.799 1.00 . A A . 5 LEU HD13 1 1 12 2147 1 1 6 LEU HD21 H -1.874 -0.153 -4.147 1.00 . A A . 5 LEU HD21 1 1 12 2148 1 1 6 LEU HD22 H -2.812 1.082 -3.308 1.00 . A A . 5 LEU HD22 1 1 12 2149 1 1 6 LEU HD23 H -2.028 1.461 -4.842 1.00 . A A . 5 LEU HD23 1 1 12 2150 1 1 6 LEU HG H -0.760 2.390 -2.919 1.00 . A A . 5 LEU HG 1 1 12 2151 1 1 6 LEU N N -0.802 0.494 0.467 1.00 . A A . 5 LEU N 1 1 12 2152 1 1 6 LEU O O -1.005 3.734 -0.805 1.00 . A A . 5 LEU O 1 1 12 2153 1 1 7 ALA C C -3.948 4.082 0.517 1.00 . A A . 6 ALA C 1 1 12 2154 1 1 7 ALA CA C -3.678 3.461 -0.858 1.00 . A A . 6 ALA CA 1 1 12 2155 1 1 7 ALA CB C -4.953 2.815 -1.401 1.00 . A A . 6 ALA CB 1 1 12 2156 1 1 7 ALA H H -3.011 1.412 -0.719 1.00 . A A . 6 ALA H 1 1 12 2157 1 1 7 ALA HA H -3.326 4.211 -1.548 1.00 . A A . 6 ALA HA 1 1 12 2158 1 1 7 ALA HB1 H -5.062 1.826 -0.980 1.00 . A A . 6 ALA HB1 1 1 12 2159 1 1 7 ALA HB2 H -5.807 3.417 -1.127 1.00 . A A . 6 ALA HB2 1 1 12 2160 1 1 7 ALA HB3 H -4.893 2.745 -2.476 1.00 . A A . 6 ALA HB3 1 1 12 2161 1 1 7 ALA N N -2.695 2.339 -0.758 1.00 . A A . 6 ALA N 1 1 12 2162 1 1 7 ALA O O -4.720 5.011 0.646 1.00 . A A . 6 ALA O 1 1 12 2163 1 1 8 HIS C C -2.290 4.682 3.496 1.00 . A A . 7 HIS C 1 1 12 2164 1 1 8 HIS CA C -3.587 4.119 2.907 1.00 . A A . 7 HIS CA 1 1 12 2165 1 1 8 HIS CB C -4.095 2.928 3.729 1.00 . A A . 7 HIS CB 1 1 12 2166 1 1 8 HIS CD2 C -5.309 1.798 1.676 1.00 . A A . 7 HIS CD2 1 1 12 2167 1 1 8 HIS CE1 C -7.149 1.235 2.658 1.00 . A A . 7 HIS CE1 1 1 12 2168 1 1 8 HIS CG C -5.200 2.219 2.981 1.00 . A A . 7 HIS CG 1 1 12 2169 1 1 8 HIS H H -2.730 2.805 1.428 1.00 . A A . 7 HIS H 1 1 12 2170 1 1 8 HIS HA H -4.345 4.884 2.866 1.00 . A A . 7 HIS HA 1 1 12 2171 1 1 8 HIS HB2 H -3.282 2.239 3.903 1.00 . A A . 7 HIS HB2 1 1 12 2172 1 1 8 HIS HB3 H -4.474 3.282 4.676 1.00 . A A . 7 HIS HB3 1 1 12 2173 1 1 8 HIS HD1 H -6.635 2.002 4.527 1.00 . A A . 7 HIS HD1 1 1 12 2174 1 1 8 HIS HD2 H -4.554 1.909 0.925 1.00 . A A . 7 HIS HD2 1 1 12 2175 1 1 8 HIS HE1 H -8.124 0.821 2.844 1.00 . A A . 7 HIS HE1 1 1 12 2176 1 1 8 HIS HE2 H -6.877 0.795 0.650 1.00 . A A . 7 HIS HE2 1 1 12 2177 1 1 8 HIS N N -3.339 3.565 1.547 1.00 . A A . 7 HIS N 1 1 12 2178 1 1 8 HIS ND1 N -6.391 1.848 3.591 1.00 . A A . 7 HIS ND1 1 1 12 2179 1 1 8 HIS NE2 N -6.534 1.185 1.482 1.00 . A A . 7 HIS NE2 1 1 12 2180 1 1 8 HIS O O -2.116 5.881 3.594 1.00 . A A . 7 HIS O 1 1 12 2181 1 1 9 LYS C C -0.358 5.490 5.409 1.00 . A A . 8 LYS C 1 1 12 2182 1 1 9 LYS CA C -0.099 4.319 4.465 1.00 . A A . 8 LYS CA 1 1 12 2183 1 1 9 LYS CB C 0.730 4.769 3.261 1.00 . A A . 8 LYS CB 1 1 12 2184 1 1 9 LYS CD C 2.558 3.583 2.040 1.00 . A A . 8 LYS CD 1 1 12 2185 1 1 9 LYS CE C 3.243 2.346 2.625 1.00 . A A . 8 LYS CE 1 1 12 2186 1 1 9 LYS CG C 1.070 3.558 2.391 1.00 . A A . 8 LYS CG 1 1 12 2187 1 1 9 LYS H H -1.533 2.875 3.798 1.00 . A A . 8 LYS H 1 1 12 2188 1 1 9 LYS HA H 0.408 3.521 4.982 1.00 . A A . 8 LYS HA 1 1 12 2189 1 1 9 LYS HB2 H 0.164 5.483 2.681 1.00 . A A . 8 LYS HB2 1 1 12 2190 1 1 9 LYS HB3 H 1.644 5.230 3.604 1.00 . A A . 8 LYS HB3 1 1 12 2191 1 1 9 LYS HD2 H 2.674 3.585 0.965 1.00 . A A . 8 LYS HD2 1 1 12 2192 1 1 9 LYS HD3 H 3.011 4.472 2.451 1.00 . A A . 8 LYS HD3 1 1 12 2193 1 1 9 LYS HE2 H 2.586 1.490 2.565 1.00 . A A . 8 LYS HE2 1 1 12 2194 1 1 9 LYS HE3 H 4.169 2.148 2.108 1.00 . A A . 8 LYS HE3 1 1 12 2195 1 1 9 LYS HG2 H 0.841 2.652 2.933 1.00 . A A . 8 LYS HG2 1 1 12 2196 1 1 9 LYS HG3 H 0.486 3.592 1.483 1.00 . A A . 8 LYS HG3 1 1 12 2197 1 1 9 LYS HZ1 H 2.848 3.427 4.360 1.00 . A A . 8 LYS HZ1 1 1 12 2198 1 1 9 LYS HZ2 H 3.407 1.847 4.640 1.00 . A A . 8 LYS HZ2 1 1 12 2199 1 1 9 LYS HZ3 H 4.487 3.057 4.134 1.00 . A A . 8 LYS HZ3 1 1 12 2200 1 1 9 LYS N N -1.380 3.832 3.887 1.00 . A A . 8 LYS N 1 1 12 2201 1 1 9 LYS NZ N 3.517 2.696 4.047 1.00 . A A . 8 LYS NZ 1 1 12 2202 1 1 9 LYS O O -1.451 5.676 5.908 1.00 . A A . 8 LYS O 1 1 12 2203 1 1 10 ALA C C -0.035 8.660 5.776 1.00 . A A . 9 ALA C 1 1 12 2204 1 1 10 ALA CA C 0.474 7.449 6.562 1.00 . A A . 9 ALA CA 1 1 12 2205 1 1 10 ALA CB C 1.870 7.719 7.121 1.00 . A A . 9 ALA CB 1 1 12 2206 1 1 10 ALA H H 1.506 6.103 5.234 1.00 . A A . 9 ALA H 1 1 12 2207 1 1 10 ALA HA H -0.205 7.208 7.365 1.00 . A A . 9 ALA HA 1 1 12 2208 1 1 10 ALA HB1 H 2.273 6.809 7.540 1.00 . A A . 9 ALA HB1 1 1 12 2209 1 1 10 ALA HB2 H 2.514 8.066 6.326 1.00 . A A . 9 ALA HB2 1 1 12 2210 1 1 10 ALA HB3 H 1.811 8.475 7.890 1.00 . A A . 9 ALA HB3 1 1 12 2211 1 1 10 ALA N N 0.642 6.279 5.652 1.00 . A A . 9 ALA N 1 1 12 2212 1 1 10 ALA O O -1.085 9.202 6.060 1.00 . A A . 9 ALA O 1 1 12 2213 1 1 11 LEU C C 0.012 11.469 4.893 1.00 . A A . 10 LEU C 1 1 12 2214 1 1 11 LEU CA C 0.261 10.263 3.982 1.00 . A A . 10 LEU CA 1 1 12 2215 1 1 11 LEU CB C -1.042 9.819 3.316 1.00 . A A . 10 LEU CB 1 1 12 2216 1 1 11 LEU CD1 C -0.811 11.388 1.386 1.00 . A A . 10 LEU CD1 1 1 12 2217 1 1 11 LEU CD2 C -3.076 10.619 2.107 1.00 . A A . 10 LEU CD2 1 1 12 2218 1 1 11 LEU CG C -1.675 11.006 2.589 1.00 . A A . 10 LEU CG 1 1 12 2219 1 1 11 LEU H H 1.545 8.637 4.574 1.00 . A A . 10 LEU H 1 1 12 2220 1 1 11 LEU HA H 0.996 10.503 3.231 1.00 . A A . 10 LEU HA 1 1 12 2221 1 1 11 LEU HB2 H -0.832 9.031 2.607 1.00 . A A . 10 LEU HB2 1 1 12 2222 1 1 11 LEU HB3 H -1.725 9.454 4.068 1.00 . A A . 10 LEU HB3 1 1 12 2223 1 1 11 LEU HD11 H -0.346 10.501 0.981 1.00 . A A . 10 LEU HD11 1 1 12 2224 1 1 11 LEU HD12 H -1.430 11.847 0.630 1.00 . A A . 10 LEU HD12 1 1 12 2225 1 1 11 LEU HD13 H -0.046 12.084 1.699 1.00 . A A . 10 LEU HD13 1 1 12 2226 1 1 11 LEU HD21 H -3.216 9.554 2.223 1.00 . A A . 10 LEU HD21 1 1 12 2227 1 1 11 LEU HD22 H -3.816 11.145 2.693 1.00 . A A . 10 LEU HD22 1 1 12 2228 1 1 11 LEU HD23 H -3.185 10.886 1.066 1.00 . A A . 10 LEU HD23 1 1 12 2229 1 1 11 LEU HG H -1.744 11.846 3.265 1.00 . A A . 10 LEU HG 1 1 12 2230 1 1 11 LEU N N 0.702 9.089 4.788 1.00 . A A . 10 LEU N 1 1 12 2231 1 1 11 LEU O O 0.893 12.272 5.129 1.00 . A A . 10 LEU O 1 1 12 2232 1 1 12 ALA C C -1.317 14.074 5.539 1.00 . A A . 11 ALA C 1 1 12 2233 1 1 12 ALA CA C -1.482 12.756 6.302 1.00 . A A . 11 ALA CA 1 1 12 2234 1 1 12 ALA CB C -0.459 12.658 7.432 1.00 . A A . 11 ALA CB 1 1 12 2235 1 1 12 ALA H H -1.876 10.943 5.204 1.00 . A A . 11 ALA H 1 1 12 2236 1 1 12 ALA HA H -2.481 12.672 6.699 1.00 . A A . 11 ALA HA 1 1 12 2237 1 1 12 ALA HB1 H 0.134 11.765 7.305 1.00 . A A . 11 ALA HB1 1 1 12 2238 1 1 12 ALA HB2 H 0.185 13.525 7.411 1.00 . A A . 11 ALA HB2 1 1 12 2239 1 1 12 ALA HB3 H -0.974 12.615 8.381 1.00 . A A . 11 ALA HB3 1 1 12 2240 1 1 12 ALA N N -1.180 11.601 5.406 1.00 . A A . 11 ALA N 1 1 12 2241 1 1 12 ALA O O -0.436 14.211 4.713 1.00 . A A . 11 ALA O 1 1 12 2242 1 1 13 NH2 HN1 H -2.848 14.951 6.449 1.00 . A A . 12 NH2 HN1 1 1 12 2243 1 1 13 NH2 HN2 H -2.040 15.908 5.302 1.00 . A A . 12 NH2 HN2 1 1 12 2244 1 1 13 NH2 N N -2.137 15.059 5.783 1.00 . A A . 12 NH2 N 1 1 13 2245 1 1 2 ILE C C -2.049 -4.812 1.552 1.00 . A A . 1 ILE C 1 1 13 2246 1 1 2 ILE CA C -0.891 -5.179 2.484 1.00 . A A . 1 ILE CA 1 1 13 2247 1 1 2 ILE CB C 0.459 -4.680 1.938 1.00 . A A . 1 ILE CB 1 1 13 2248 1 1 2 ILE CD1 C 1.766 -5.574 3.875 1.00 . A A . 1 ILE CD1 1 1 13 2249 1 1 2 ILE CG1 C 1.366 -4.309 3.114 1.00 . A A . 1 ILE CG1 1 1 13 2250 1 1 2 ILE CG2 C 0.276 -3.441 1.042 1.00 . A A . 1 ILE CG2 1 1 13 2251 1 1 2 ILE H H 0.088 -7.093 2.346 1.00 . A A . 1 ILE H 1 1 13 2252 1 1 2 ILE HA H -1.055 -4.774 3.462 1.00 . A A . 1 ILE HA 1 1 13 2253 1 1 2 ILE HB H 0.916 -5.466 1.369 1.00 . A A . 1 ILE HB 1 1 13 2254 1 1 2 ILE HD11 H 0.877 -6.098 4.195 1.00 . A A . 1 ILE HD11 1 1 13 2255 1 1 2 ILE HD12 H 2.349 -6.213 3.228 1.00 . A A . 1 ILE HD12 1 1 13 2256 1 1 2 ILE HD13 H 2.355 -5.303 4.740 1.00 . A A . 1 ILE HD13 1 1 13 2257 1 1 2 ILE HG12 H 2.253 -3.816 2.741 1.00 . A A . 1 ILE HG12 1 1 13 2258 1 1 2 ILE HG13 H 0.836 -3.644 3.781 1.00 . A A . 1 ILE HG13 1 1 13 2259 1 1 2 ILE HG21 H -0.702 -3.009 1.210 1.00 . A A . 1 ILE HG21 1 1 13 2260 1 1 2 ILE HG22 H 1.032 -2.709 1.278 1.00 . A A . 1 ILE HG22 1 1 13 2261 1 1 2 ILE HG23 H 0.364 -3.727 0.004 1.00 . A A . 1 ILE HG23 1 1 13 2262 1 1 2 ILE N N -0.763 -6.658 2.564 1.00 . A A . 1 ILE N 1 1 13 2263 1 1 2 ILE O O -3.141 -4.519 1.994 1.00 . A A . 1 ILE O 1 1 13 2264 1 1 3 ASP C C -3.357 -3.041 -0.468 1.00 . A A . 2 ASP C 1 1 13 2265 1 1 3 ASP CA C -2.862 -4.466 -0.715 1.00 . A A . 2 ASP CA 1 1 13 2266 1 1 3 ASP CB C -3.984 -5.479 -0.489 1.00 . A A . 2 ASP CB 1 1 13 2267 1 1 3 ASP CG C -3.980 -6.507 -1.622 1.00 . A A . 2 ASP CG 1 1 13 2268 1 1 3 ASP H H -0.912 -5.068 -0.043 1.00 . A A . 2 ASP H 1 1 13 2269 1 1 3 ASP HA H -2.481 -4.550 -1.718 1.00 . A A . 2 ASP HA 1 1 13 2270 1 1 3 ASP HB2 H -3.831 -5.981 0.455 1.00 . A A . 2 ASP HB2 1 1 13 2271 1 1 3 ASP HB3 H -4.934 -4.966 -0.475 1.00 . A A . 2 ASP HB3 1 1 13 2272 1 1 3 ASP N N -1.804 -4.824 0.271 1.00 . A A . 2 ASP N 1 1 13 2273 1 1 3 ASP O O -3.135 -2.150 -1.263 1.00 . A A . 2 ASP O 1 1 13 2274 1 1 3 ASP OD1 O -4.399 -6.159 -2.713 1.00 . A A . 2 ASP OD1 1 1 13 2275 1 1 3 ASP OD2 O -3.559 -7.626 -1.378 1.00 . A A . 2 ASP OD2 1 1 13 2276 1 1 4 TYR C C -3.424 -0.525 1.379 1.00 . A A . 3 TYR C 1 1 13 2277 1 1 4 TYR CA C -4.547 -1.461 0.910 1.00 . A A . 3 TYR CA 1 1 13 2278 1 1 4 TYR CB C -5.615 -1.660 1.986 1.00 . A A . 3 TYR CB 1 1 13 2279 1 1 4 TYR CD1 C -4.616 -0.854 4.143 1.00 . A A . 3 TYR CD1 1 1 13 2280 1 1 4 TYR CD2 C -4.733 -3.240 3.734 1.00 . A A . 3 TYR CD2 1 1 13 2281 1 1 4 TYR CE1 C -4.029 -1.093 5.385 1.00 . A A . 3 TYR CE1 1 1 13 2282 1 1 4 TYR CE2 C -4.143 -3.479 4.977 1.00 . A A . 3 TYR CE2 1 1 13 2283 1 1 4 TYR CG C -4.968 -1.926 3.318 1.00 . A A . 3 TYR CG 1 1 13 2284 1 1 4 TYR CZ C -3.792 -2.404 5.801 1.00 . A A . 3 TYR CZ 1 1 13 2285 1 1 4 TYR H H -4.203 -3.559 1.243 1.00 . A A . 3 TYR H 1 1 13 2286 1 1 4 TYR HA H -5.003 -1.056 0.027 1.00 . A A . 3 TYR HA 1 1 13 2287 1 1 4 TYR HB2 H -6.223 -0.772 2.057 1.00 . A A . 3 TYR HB2 1 1 13 2288 1 1 4 TYR HB3 H -6.240 -2.499 1.719 1.00 . A A . 3 TYR HB3 1 1 13 2289 1 1 4 TYR HD1 H -4.798 0.158 3.819 1.00 . A A . 3 TYR HD1 1 1 13 2290 1 1 4 TYR HD2 H -5.005 -4.067 3.095 1.00 . A A . 3 TYR HD2 1 1 13 2291 1 1 4 TYR HE1 H -3.757 -0.266 6.023 1.00 . A A . 3 TYR HE1 1 1 13 2292 1 1 4 TYR HE2 H -3.959 -4.492 5.301 1.00 . A A . 3 TYR HE2 1 1 13 2293 1 1 4 TYR HH H -3.903 -2.925 7.636 1.00 . A A . 3 TYR HH 1 1 13 2294 1 1 4 TYR N N -4.031 -2.823 0.620 1.00 . A A . 3 TYR N 1 1 13 2295 1 1 4 TYR O O -3.305 0.566 0.876 1.00 . A A . 3 TYR O 1 1 13 2296 1 1 4 TYR OH O -3.213 -2.642 7.032 1.00 . A A . 3 TYR OH 1 1 13 2297 1 1 5 TRP C C -1.055 0.910 1.698 1.00 . A A . 4 TRP C 1 1 13 2298 1 1 5 TRP CA C -1.479 -0.054 2.809 1.00 . A A . 4 TRP CA 1 1 13 2299 1 1 5 TRP CB C -0.298 -0.985 3.109 1.00 . A A . 4 TRP CB 1 1 13 2300 1 1 5 TRP CD1 C -1.439 -2.832 4.423 1.00 . A A . 4 TRP CD1 1 1 13 2301 1 1 5 TRP CD2 C 0.159 -1.789 5.597 1.00 . A A . 4 TRP CD2 1 1 13 2302 1 1 5 TRP CE2 C -0.378 -2.783 6.444 1.00 . A A . 4 TRP CE2 1 1 13 2303 1 1 5 TRP CE3 C 1.190 -0.984 6.096 1.00 . A A . 4 TRP CE3 1 1 13 2304 1 1 5 TRP CG C -0.538 -1.831 4.322 1.00 . A A . 4 TRP CG 1 1 13 2305 1 1 5 TRP CH2 C 1.123 -2.165 8.224 1.00 . A A . 4 TRP CH2 1 1 13 2306 1 1 5 TRP CZ2 C 0.092 -2.974 7.740 1.00 . A A . 4 TRP CZ2 1 1 13 2307 1 1 5 TRP CZ3 C 1.672 -1.170 7.401 1.00 . A A . 4 TRP CZ3 1 1 13 2308 1 1 5 TRP H H -2.721 -1.826 2.702 1.00 . A A . 4 TRP H 1 1 13 2309 1 1 5 TRP HA H -1.768 0.483 3.697 1.00 . A A . 4 TRP HA 1 1 13 2310 1 1 5 TRP HB2 H -0.137 -1.621 2.266 1.00 . A A . 4 TRP HB2 1 1 13 2311 1 1 5 TRP HB3 H 0.588 -0.388 3.268 1.00 . A A . 4 TRP HB3 1 1 13 2312 1 1 5 TRP HD1 H -2.117 -3.152 3.653 1.00 . A A . 4 TRP HD1 1 1 13 2313 1 1 5 TRP HE1 H -1.895 -4.137 6.012 1.00 . A A . 4 TRP HE1 1 1 13 2314 1 1 5 TRP HE3 H 1.616 -0.223 5.466 1.00 . A A . 4 TRP HE3 1 1 13 2315 1 1 5 TRP HH2 H 1.496 -2.305 9.228 1.00 . A A . 4 TRP HH2 1 1 13 2316 1 1 5 TRP HZ2 H -0.337 -3.743 8.364 1.00 . A A . 4 TRP HZ2 1 1 13 2317 1 1 5 TRP HZ3 H 2.469 -0.545 7.774 1.00 . A A . 4 TRP HZ3 1 1 13 2318 1 1 5 TRP N N -2.602 -0.940 2.321 1.00 . A A . 4 TRP N 1 1 13 2319 1 1 5 TRP NE1 N -1.345 -3.396 5.682 1.00 . A A . 4 TRP NE1 1 1 13 2320 1 1 5 TRP O O -0.853 2.089 1.907 1.00 . A A . 4 TRP O 1 1 13 2321 1 1 6 LEU C C -1.422 2.476 -0.761 1.00 . A A . 5 LEU C 1 1 13 2322 1 1 6 LEU CA C -0.535 1.226 -0.655 1.00 . A A . 5 LEU CA 1 1 13 2323 1 1 6 LEU CB C -0.753 0.301 -1.860 1.00 . A A . 5 LEU CB 1 1 13 2324 1 1 6 LEU CD1 C 0.638 2.060 -3.008 1.00 . A A . 5 LEU CD1 1 1 13 2325 1 1 6 LEU CD2 C 1.563 -0.232 -2.619 1.00 . A A . 5 LEU CD2 1 1 13 2326 1 1 6 LEU CG C 0.299 0.566 -2.944 1.00 . A A . 5 LEU CG 1 1 13 2327 1 1 6 LEU H H -1.111 -0.564 0.379 1.00 . A A . 5 LEU H 1 1 13 2328 1 1 6 LEU HA H 0.505 1.502 -0.587 1.00 . A A . 5 LEU HA 1 1 13 2329 1 1 6 LEU HB2 H -0.672 -0.726 -1.534 1.00 . A A . 5 LEU HB2 1 1 13 2330 1 1 6 LEU HB3 H -1.739 0.463 -2.269 1.00 . A A . 5 LEU HB3 1 1 13 2331 1 1 6 LEU HD11 H -0.275 2.637 -2.985 1.00 . A A . 5 LEU HD11 1 1 13 2332 1 1 6 LEU HD12 H 1.254 2.326 -2.162 1.00 . A A . 5 LEU HD12 1 1 13 2333 1 1 6 LEU HD13 H 1.172 2.268 -3.923 1.00 . A A . 5 LEU HD13 1 1 13 2334 1 1 6 LEU HD21 H 1.347 -0.944 -1.835 1.00 . A A . 5 LEU HD21 1 1 13 2335 1 1 6 LEU HD22 H 1.892 -0.761 -3.502 1.00 . A A . 5 LEU HD22 1 1 13 2336 1 1 6 LEU HD23 H 2.340 0.440 -2.290 1.00 . A A . 5 LEU HD23 1 1 13 2337 1 1 6 LEU HG H -0.087 0.248 -3.901 1.00 . A A . 5 LEU HG 1 1 13 2338 1 1 6 LEU N N -0.933 0.392 0.509 1.00 . A A . 5 LEU N 1 1 13 2339 1 1 6 LEU O O -0.935 3.582 -0.894 1.00 . A A . 5 LEU O 1 1 13 2340 1 1 7 ALA C C -3.964 4.077 0.540 1.00 . A A . 6 ALA C 1 1 13 2341 1 1 7 ALA CA C -3.635 3.482 -0.835 1.00 . A A . 6 ALA CA 1 1 13 2342 1 1 7 ALA CB C -4.906 2.914 -1.469 1.00 . A A . 6 ALA CB 1 1 13 2343 1 1 7 ALA H H -3.087 1.404 -0.622 1.00 . A A . 6 ALA H 1 1 13 2344 1 1 7 ALA HA H -3.209 4.232 -1.480 1.00 . A A . 6 ALA HA 1 1 13 2345 1 1 7 ALA HB1 H -4.660 2.039 -2.051 1.00 . A A . 6 ALA HB1 1 1 13 2346 1 1 7 ALA HB2 H -5.606 2.642 -0.691 1.00 . A A . 6 ALA HB2 1 1 13 2347 1 1 7 ALA HB3 H -5.354 3.659 -2.110 1.00 . A A . 6 ALA HB3 1 1 13 2348 1 1 7 ALA N N -2.716 2.306 -0.719 1.00 . A A . 6 ALA N 1 1 13 2349 1 1 7 ALA O O -4.688 5.047 0.643 1.00 . A A . 6 ALA O 1 1 13 2350 1 1 8 HIS C C -2.539 4.552 3.644 1.00 . A A . 7 HIS C 1 1 13 2351 1 1 8 HIS CA C -3.799 4.025 2.949 1.00 . A A . 7 HIS CA 1 1 13 2352 1 1 8 HIS CB C -4.386 2.828 3.705 1.00 . A A . 7 HIS CB 1 1 13 2353 1 1 8 HIS CD2 C -5.499 1.790 1.550 1.00 . A A . 7 HIS CD2 1 1 13 2354 1 1 8 HIS CE1 C -7.399 1.226 2.405 1.00 . A A . 7 HIS CE1 1 1 13 2355 1 1 8 HIS CG C -5.460 2.167 2.870 1.00 . A A . 7 HIS CG 1 1 13 2356 1 1 8 HIS H H -2.907 2.698 1.502 1.00 . A A . 7 HIS H 1 1 13 2357 1 1 8 HIS HA H -4.539 4.806 2.874 1.00 . A A . 7 HIS HA 1 1 13 2358 1 1 8 HIS HB2 H -3.601 2.114 3.910 1.00 . A A . 7 HIS HB2 1 1 13 2359 1 1 8 HIS HB3 H -4.814 3.167 4.637 1.00 . A A . 7 HIS HB3 1 1 13 2360 1 1 8 HIS HD1 H -6.985 1.925 4.325 1.00 . A A . 7 HIS HD1 1 1 13 2361 1 1 8 HIS HD2 H -4.704 1.919 0.847 1.00 . A A . 7 HIS HD2 1 1 13 2362 1 1 8 HIS HE1 H -8.389 0.824 2.518 1.00 . A A . 7 HIS HE1 1 1 13 2363 1 1 8 HIS HE2 H -7.019 0.845 0.403 1.00 . A A . 7 HIS HE2 1 1 13 2364 1 1 8 HIS N N -3.470 3.494 1.596 1.00 . A A . 7 HIS N 1 1 13 2365 1 1 8 HIS ND1 N -6.688 1.797 3.399 1.00 . A A . 7 HIS ND1 1 1 13 2366 1 1 8 HIS NE2 N -6.720 1.202 1.264 1.00 . A A . 7 HIS NE2 1 1 13 2367 1 1 8 HIS O O -1.711 5.200 3.037 1.00 . A A . 7 HIS O 1 1 13 2368 1 1 9 LYS C C -1.204 6.314 5.690 1.00 . A A . 8 LYS C 1 1 13 2369 1 1 9 LYS CA C -1.197 4.785 5.653 1.00 . A A . 8 LYS CA 1 1 13 2370 1 1 9 LYS CB C 0.009 4.278 4.863 1.00 . A A . 8 LYS CB 1 1 13 2371 1 1 9 LYS CD C 1.005 2.324 3.675 1.00 . A A . 8 LYS CD 1 1 13 2372 1 1 9 LYS CE C 2.147 1.981 4.634 1.00 . A A . 8 LYS CE 1 1 13 2373 1 1 9 LYS CG C -0.204 2.815 4.475 1.00 . A A . 8 LYS CG 1 1 13 2374 1 1 9 LYS H H -3.076 3.774 5.390 1.00 . A A . 8 LYS H 1 1 13 2375 1 1 9 LYS HA H -1.178 4.383 6.653 1.00 . A A . 8 LYS HA 1 1 13 2376 1 1 9 LYS HB2 H 0.132 4.874 3.970 1.00 . A A . 8 LYS HB2 1 1 13 2377 1 1 9 LYS HB3 H 0.896 4.360 5.473 1.00 . A A . 8 LYS HB3 1 1 13 2378 1 1 9 LYS HD2 H 0.731 1.446 3.112 1.00 . A A . 8 LYS HD2 1 1 13 2379 1 1 9 LYS HD3 H 1.328 3.100 2.998 1.00 . A A . 8 LYS HD3 1 1 13 2380 1 1 9 LYS HE2 H 1.801 2.016 5.658 1.00 . A A . 8 LYS HE2 1 1 13 2381 1 1 9 LYS HE3 H 2.552 1.007 4.405 1.00 . A A . 8 LYS HE3 1 1 13 2382 1 1 9 LYS HG2 H -0.314 2.218 5.369 1.00 . A A . 8 LYS HG2 1 1 13 2383 1 1 9 LYS HG3 H -1.094 2.728 3.871 1.00 . A A . 8 LYS HG3 1 1 13 2384 1 1 9 LYS HZ1 H 2.713 3.954 4.289 1.00 . A A . 8 LYS HZ1 1 1 13 2385 1 1 9 LYS HZ2 H 3.834 3.061 5.201 1.00 . A A . 8 LYS HZ2 1 1 13 2386 1 1 9 LYS HZ3 H 3.704 2.808 3.526 1.00 . A A . 8 LYS HZ3 1 1 13 2387 1 1 9 LYS N N -2.394 4.289 4.916 1.00 . A A . 8 LYS N 1 1 13 2388 1 1 9 LYS NZ N 3.178 3.030 4.394 1.00 . A A . 8 LYS NZ 1 1 13 2389 1 1 9 LYS O O -2.000 6.956 5.035 1.00 . A A . 8 LYS O 1 1 13 2390 1 1 10 ALA C C -0.439 8.994 5.131 1.00 . A A . 9 ALA C 1 1 13 2391 1 1 10 ALA CA C -0.272 8.386 6.527 1.00 . A A . 9 ALA CA 1 1 13 2392 1 1 10 ALA CB C 1.113 8.708 7.090 1.00 . A A . 9 ALA CB 1 1 13 2393 1 1 10 ALA H H 0.311 6.357 6.966 1.00 . A A . 9 ALA H 1 1 13 2394 1 1 10 ALA HA H -1.036 8.754 7.193 1.00 . A A . 9 ALA HA 1 1 13 2395 1 1 10 ALA HB1 H 1.255 8.178 8.020 1.00 . A A . 9 ALA HB1 1 1 13 2396 1 1 10 ALA HB2 H 1.868 8.401 6.382 1.00 . A A . 9 ALA HB2 1 1 13 2397 1 1 10 ALA HB3 H 1.192 9.770 7.265 1.00 . A A . 9 ALA HB3 1 1 13 2398 1 1 10 ALA N N -0.321 6.898 6.448 1.00 . A A . 9 ALA N 1 1 13 2399 1 1 10 ALA O O -0.905 10.106 4.979 1.00 . A A . 9 ALA O 1 1 13 2400 1 1 11 LEU C C -1.592 9.414 2.529 1.00 . A A . 10 LEU C 1 1 13 2401 1 1 11 LEU CA C -0.199 8.807 2.726 1.00 . A A . 10 LEU CA 1 1 13 2402 1 1 11 LEU CB C -0.008 7.596 1.813 1.00 . A A . 10 LEU CB 1 1 13 2403 1 1 11 LEU CD1 C 0.888 6.999 -0.442 1.00 . A A . 10 LEU CD1 1 1 13 2404 1 1 11 LEU CD2 C -1.237 8.295 -0.245 1.00 . A A . 10 LEU CD2 1 1 13 2405 1 1 11 LEU CG C 0.147 8.066 0.366 1.00 . A A . 10 LEU CG 1 1 13 2406 1 1 11 LEU H H 0.311 7.377 4.256 1.00 . A A . 10 LEU H 1 1 13 2407 1 1 11 LEU HA H 0.564 9.543 2.529 1.00 . A A . 10 LEU HA 1 1 13 2408 1 1 11 LEU HB2 H 0.878 7.055 2.114 1.00 . A A . 10 LEU HB2 1 1 13 2409 1 1 11 LEU HB3 H -0.869 6.949 1.889 1.00 . A A . 10 LEU HB3 1 1 13 2410 1 1 11 LEU HD11 H 0.398 6.046 -0.314 1.00 . A A . 10 LEU HD11 1 1 13 2411 1 1 11 LEU HD12 H 0.882 7.270 -1.486 1.00 . A A . 10 LEU HD12 1 1 13 2412 1 1 11 LEU HD13 H 1.908 6.929 -0.092 1.00 . A A . 10 LEU HD13 1 1 13 2413 1 1 11 LEU HD21 H -1.953 7.643 0.232 1.00 . A A . 10 LEU HD21 1 1 13 2414 1 1 11 LEU HD22 H -1.531 9.323 -0.097 1.00 . A A . 10 LEU HD22 1 1 13 2415 1 1 11 LEU HD23 H -1.204 8.079 -1.303 1.00 . A A . 10 LEU HD23 1 1 13 2416 1 1 11 LEU HG H 0.708 8.989 0.345 1.00 . A A . 10 LEU HG 1 1 13 2417 1 1 11 LEU N N -0.062 8.272 4.111 1.00 . A A . 10 LEU N 1 1 13 2418 1 1 11 LEU O O -1.741 10.480 1.967 1.00 . A A . 10 LEU O 1 1 13 2419 1 1 12 ALA C C -4.786 9.106 4.126 1.00 . A A . 11 ALA C 1 1 13 2420 1 1 12 ALA CA C -3.994 9.282 2.827 1.00 . A A . 11 ALA CA 1 1 13 2421 1 1 12 ALA CB C -4.613 8.452 1.704 1.00 . A A . 11 ALA CB 1 1 13 2422 1 1 12 ALA H H -2.472 7.884 3.441 1.00 . A A . 11 ALA H 1 1 13 2423 1 1 12 ALA HA H -3.961 10.322 2.542 1.00 . A A . 11 ALA HA 1 1 13 2424 1 1 12 ALA HB1 H -3.832 8.079 1.058 1.00 . A A . 11 ALA HB1 1 1 13 2425 1 1 12 ALA HB2 H -5.157 7.621 2.129 1.00 . A A . 11 ALA HB2 1 1 13 2426 1 1 12 ALA HB3 H -5.289 9.069 1.131 1.00 . A A . 11 ALA HB3 1 1 13 2427 1 1 12 ALA N N -2.612 8.743 2.990 1.00 . A A . 11 ALA N 1 1 13 2428 1 1 12 ALA O O -5.265 8.030 4.423 1.00 . A A . 11 ALA O 1 1 13 2429 1 1 13 NH2 HN1 H -4.560 10.999 4.682 1.00 . A A . 12 NH2 HN1 1 1 13 2430 1 1 13 NH2 HN2 H -5.450 10.029 5.753 1.00 . A A . 12 NH2 HN2 1 1 13 2431 1 1 13 NH2 N N -4.945 10.129 4.919 1.00 . A A . 12 NH2 N 1 1 14 2432 1 1 2 ILE C C -2.003 -4.923 1.696 1.00 . A A . 1 ILE C 1 1 14 2433 1 1 2 ILE CA C -0.826 -5.143 2.648 1.00 . A A . 1 ILE CA 1 1 14 2434 1 1 2 ILE CB C 0.496 -4.634 2.048 1.00 . A A . 1 ILE CB 1 1 14 2435 1 1 2 ILE CD1 C 1.898 -5.275 4.016 1.00 . A A . 1 ILE CD1 1 1 14 2436 1 1 2 ILE CG1 C 1.378 -4.104 3.181 1.00 . A A . 1 ILE CG1 1 1 14 2437 1 1 2 ILE CG2 C 0.250 -3.501 1.036 1.00 . A A . 1 ILE CG2 1 1 14 2438 1 1 2 ILE H H 0.277 -6.983 2.835 1.00 . A A . 1 ILE H 1 1 14 2439 1 1 2 ILE HA H -1.008 -4.655 3.586 1.00 . A A . 1 ILE HA 1 1 14 2440 1 1 2 ILE HB H 0.998 -5.450 1.558 1.00 . A A . 1 ILE HB 1 1 14 2441 1 1 2 ILE HD11 H 2.396 -5.985 3.371 1.00 . A A . 1 ILE HD11 1 1 14 2442 1 1 2 ILE HD12 H 2.594 -4.909 4.756 1.00 . A A . 1 ILE HD12 1 1 14 2443 1 1 2 ILE HD13 H 1.068 -5.759 4.511 1.00 . A A . 1 ILE HD13 1 1 14 2444 1 1 2 ILE HG12 H 2.213 -3.560 2.761 1.00 . A A . 1 ILE HG12 1 1 14 2445 1 1 2 ILE HG13 H 0.797 -3.446 3.810 1.00 . A A . 1 ILE HG13 1 1 14 2446 1 1 2 ILE HG21 H -0.740 -3.093 1.178 1.00 . A A . 1 ILE HG21 1 1 14 2447 1 1 2 ILE HG22 H 0.981 -2.720 1.183 1.00 . A A . 1 ILE HG22 1 1 14 2448 1 1 2 ILE HG23 H 0.336 -3.888 0.032 1.00 . A A . 1 ILE HG23 1 1 14 2449 1 1 2 ILE N N -0.624 -6.600 2.864 1.00 . A A . 1 ILE N 1 1 14 2450 1 1 2 ILE O O -3.102 -4.620 2.111 1.00 . A A . 1 ILE O 1 1 14 2451 1 1 3 ASP C C -3.368 -3.422 -0.497 1.00 . A A . 2 ASP C 1 1 14 2452 1 1 3 ASP CA C -2.846 -4.857 -0.579 1.00 . A A . 2 ASP CA 1 1 14 2453 1 1 3 ASP CB C -3.943 -5.853 -0.201 1.00 . A A . 2 ASP CB 1 1 14 2454 1 1 3 ASP CG C -5.022 -5.860 -1.286 1.00 . A A . 2 ASP CG 1 1 14 2455 1 1 3 ASP H H -0.866 -5.307 0.126 1.00 . A A . 2 ASP H 1 1 14 2456 1 1 3 ASP HA H -2.486 -5.061 -1.572 1.00 . A A . 2 ASP HA 1 1 14 2457 1 1 3 ASP HB2 H -3.515 -6.842 -0.113 1.00 . A A . 2 ASP HB2 1 1 14 2458 1 1 3 ASP HB3 H -4.384 -5.565 0.740 1.00 . A A . 2 ASP HB3 1 1 14 2459 1 1 3 ASP N N -1.765 -5.066 0.423 1.00 . A A . 2 ASP N 1 1 14 2460 1 1 3 ASP O O -3.151 -2.619 -1.382 1.00 . A A . 2 ASP O 1 1 14 2461 1 1 3 ASP OD1 O -4.958 -5.013 -2.162 1.00 . A A . 2 ASP OD1 1 1 14 2462 1 1 3 ASP OD2 O -5.893 -6.711 -1.222 1.00 . A A . 2 ASP OD2 1 1 14 2463 1 1 4 TYR C C -3.523 -0.707 1.067 1.00 . A A . 3 TYR C 1 1 14 2464 1 1 4 TYR CA C -4.613 -1.723 0.682 1.00 . A A . 3 TYR CA 1 1 14 2465 1 1 4 TYR CB C -5.714 -1.825 1.743 1.00 . A A . 3 TYR CB 1 1 14 2466 1 1 4 TYR CD1 C -4.892 -3.409 3.519 1.00 . A A . 3 TYR CD1 1 1 14 2467 1 1 4 TYR CD2 C -4.807 -1.024 3.946 1.00 . A A . 3 TYR CD2 1 1 14 2468 1 1 4 TYR CE1 C -4.348 -3.654 4.783 1.00 . A A . 3 TYR CE1 1 1 14 2469 1 1 4 TYR CE2 C -4.265 -1.269 5.211 1.00 . A A . 3 TYR CE2 1 1 14 2470 1 1 4 TYR CG C -5.120 -2.094 3.101 1.00 . A A . 3 TYR CG 1 1 14 2471 1 1 4 TYR CZ C -4.035 -2.583 5.628 1.00 . A A . 3 TYR CZ 1 1 14 2472 1 1 4 TYR H H -4.235 -3.766 1.248 1.00 . A A . 3 TYR H 1 1 14 2473 1 1 4 TYR HA H -5.052 -1.427 -0.252 1.00 . A A . 3 TYR HA 1 1 14 2474 1 1 4 TYR HB2 H -6.268 -0.901 1.775 1.00 . A A . 3 TYR HB2 1 1 14 2475 1 1 4 TYR HB3 H -6.385 -2.630 1.482 1.00 . A A . 3 TYR HB3 1 1 14 2476 1 1 4 TYR HD1 H -5.133 -4.235 2.865 1.00 . A A . 3 TYR HD1 1 1 14 2477 1 1 4 TYR HD2 H -4.985 -0.009 3.622 1.00 . A A . 3 TYR HD2 1 1 14 2478 1 1 4 TYR HE1 H -4.170 -4.669 5.108 1.00 . A A . 3 TYR HE1 1 1 14 2479 1 1 4 TYR HE2 H -4.022 -0.443 5.864 1.00 . A A . 3 TYR HE2 1 1 14 2480 1 1 4 TYR HH H -2.915 -2.098 7.096 1.00 . A A . 3 TYR HH 1 1 14 2481 1 1 4 TYR N N -4.065 -3.099 0.551 1.00 . A A . 3 TYR N 1 1 14 2482 1 1 4 TYR O O -3.374 0.286 0.394 1.00 . A A . 3 TYR O 1 1 14 2483 1 1 4 TYR OH O -3.504 -2.825 6.879 1.00 . A A . 3 TYR OH 1 1 14 2484 1 1 5 TRP C C -1.312 0.990 1.469 1.00 . A A . 4 TRP C 1 1 14 2485 1 1 5 TRP CA C -1.691 0.005 2.579 1.00 . A A . 4 TRP CA 1 1 14 2486 1 1 5 TRP CB C -0.476 -0.870 2.896 1.00 . A A . 4 TRP CB 1 1 14 2487 1 1 5 TRP CD1 C -1.542 -2.633 4.370 1.00 . A A . 4 TRP CD1 1 1 14 2488 1 1 5 TRP CD2 C 0.026 -1.440 5.441 1.00 . A A . 4 TRP CD2 1 1 14 2489 1 1 5 TRP CE2 C -0.476 -2.375 6.373 1.00 . A A . 4 TRP CE2 1 1 14 2490 1 1 5 TRP CE3 C 1.033 -0.562 5.864 1.00 . A A . 4 TRP CE3 1 1 14 2491 1 1 5 TRP CG C -0.671 -1.619 4.178 1.00 . A A . 4 TRP CG 1 1 14 2492 1 1 5 TRP CH2 C 1.007 -1.555 8.085 1.00 . A A . 4 TRP CH2 1 1 14 2493 1 1 5 TRP CZ2 C 0.003 -2.438 7.678 1.00 . A A . 4 TRP CZ2 1 1 14 2494 1 1 5 TRP CZ3 C 1.522 -0.618 7.179 1.00 . A A . 4 TRP CZ3 1 1 14 2495 1 1 5 TRP H H -2.929 -1.762 2.639 1.00 . A A . 4 TRP H 1 1 14 2496 1 1 5 TRP HA H -2.000 0.537 3.464 1.00 . A A . 4 TRP HA 1 1 14 2497 1 1 5 TRP HB2 H -0.329 -1.568 2.096 1.00 . A A . 4 TRP HB2 1 1 14 2498 1 1 5 TRP HB3 H 0.399 -0.242 2.981 1.00 . A A . 4 TRP HB3 1 1 14 2499 1 1 5 TRP HD1 H -2.211 -3.037 3.631 1.00 . A A . 4 TRP HD1 1 1 14 2500 1 1 5 TRP HE1 H -1.950 -3.810 6.067 1.00 . A A . 4 TRP HE1 1 1 14 2501 1 1 5 TRP HE3 H 1.434 0.156 5.169 1.00 . A A . 4 TRP HE3 1 1 14 2502 1 1 5 TRP HH2 H 1.384 -1.595 9.096 1.00 . A A . 4 TRP HH2 1 1 14 2503 1 1 5 TRP HZ2 H -0.398 -3.164 8.369 1.00 . A A . 4 TRP HZ2 1 1 14 2504 1 1 5 TRP HZ3 H 2.297 0.064 7.493 1.00 . A A . 4 TRP HZ3 1 1 14 2505 1 1 5 TRP N N -2.776 -0.950 2.129 1.00 . A A . 4 TRP N 1 1 14 2506 1 1 5 TRP NE1 N -1.425 -3.083 5.672 1.00 . A A . 4 TRP NE1 1 1 14 2507 1 1 5 TRP O O -1.317 2.190 1.655 1.00 . A A . 4 TRP O 1 1 14 2508 1 1 6 LEU C C -1.433 2.629 -0.858 1.00 . A A . 5 LEU C 1 1 14 2509 1 1 6 LEU CA C -0.602 1.335 -0.835 1.00 . A A . 5 LEU CA 1 1 14 2510 1 1 6 LEU CB C -0.897 0.447 -2.050 1.00 . A A . 5 LEU CB 1 1 14 2511 1 1 6 LEU CD1 C 0.060 1.975 -3.783 1.00 . A A . 5 LEU CD1 1 1 14 2512 1 1 6 LEU CD2 C -1.760 0.367 -4.382 1.00 . A A . 5 LEU CD2 1 1 14 2513 1 1 6 LEU CG C -1.214 1.289 -3.288 1.00 . A A . 5 LEU CG 1 1 14 2514 1 1 6 LEU H H -0.993 -0.502 0.210 1.00 . A A . 5 LEU H 1 1 14 2515 1 1 6 LEU HA H 0.451 1.565 -0.798 1.00 . A A . 5 LEU HA 1 1 14 2516 1 1 6 LEU HB2 H -0.036 -0.173 -2.255 1.00 . A A . 5 LEU HB2 1 1 14 2517 1 1 6 LEU HB3 H -1.743 -0.187 -1.828 1.00 . A A . 5 LEU HB3 1 1 14 2518 1 1 6 LEU HD11 H 0.921 1.392 -3.490 1.00 . A A . 5 LEU HD11 1 1 14 2519 1 1 6 LEU HD12 H 0.030 2.054 -4.860 1.00 . A A . 5 LEU HD12 1 1 14 2520 1 1 6 LEU HD13 H 0.129 2.962 -3.351 1.00 . A A . 5 LEU HD13 1 1 14 2521 1 1 6 LEU HD21 H -2.042 -0.581 -3.945 1.00 . A A . 5 LEU HD21 1 1 14 2522 1 1 6 LEU HD22 H -2.625 0.823 -4.838 1.00 . A A . 5 LEU HD22 1 1 14 2523 1 1 6 LEU HD23 H -0.999 0.206 -5.130 1.00 . A A . 5 LEU HD23 1 1 14 2524 1 1 6 LEU HG H -1.955 2.034 -3.040 1.00 . A A . 5 LEU HG 1 1 14 2525 1 1 6 LEU N N -0.985 0.473 0.319 1.00 . A A . 5 LEU N 1 1 14 2526 1 1 6 LEU O O -0.897 3.716 -0.951 1.00 . A A . 5 LEU O 1 1 14 2527 1 1 7 ALA C C -3.839 4.290 0.600 1.00 . A A . 6 ALA C 1 1 14 2528 1 1 7 ALA CA C -3.587 3.753 -0.816 1.00 . A A . 6 ALA CA 1 1 14 2529 1 1 7 ALA CB C -4.902 3.298 -1.449 1.00 . A A . 6 ALA CB 1 1 14 2530 1 1 7 ALA H H -3.150 1.640 -0.719 1.00 . A A . 6 ALA H 1 1 14 2531 1 1 7 ALA HA H -3.130 4.513 -1.430 1.00 . A A . 6 ALA HA 1 1 14 2532 1 1 7 ALA HB1 H -4.792 2.290 -1.819 1.00 . A A . 6 ALA HB1 1 1 14 2533 1 1 7 ALA HB2 H -5.685 3.325 -0.706 1.00 . A A . 6 ALA HB2 1 1 14 2534 1 1 7 ALA HB3 H -5.156 3.957 -2.265 1.00 . A A . 6 ALA HB3 1 1 14 2535 1 1 7 ALA N N -2.733 2.524 -0.785 1.00 . A A . 6 ALA N 1 1 14 2536 1 1 7 ALA O O -4.695 5.126 0.809 1.00 . A A . 6 ALA O 1 1 14 2537 1 1 8 HIS C C -2.034 4.816 3.565 1.00 . A A . 7 HIS C 1 1 14 2538 1 1 8 HIS CA C -3.341 4.287 2.970 1.00 . A A . 7 HIS CA 1 1 14 2539 1 1 8 HIS CB C -3.826 3.056 3.748 1.00 . A A . 7 HIS CB 1 1 14 2540 1 1 8 HIS CD2 C -4.921 1.892 1.653 1.00 . A A . 7 HIS CD2 1 1 14 2541 1 1 8 HIS CE1 C -6.781 1.270 2.560 1.00 . A A . 7 HIS CE1 1 1 14 2542 1 1 8 HIS CG C -4.879 2.317 2.958 1.00 . A A . 7 HIS CG 1 1 14 2543 1 1 8 HIS H H -2.439 3.125 1.393 1.00 . A A . 7 HIS H 1 1 14 2544 1 1 8 HIS HA H -4.100 5.054 2.987 1.00 . A A . 7 HIS HA 1 1 14 2545 1 1 8 HIS HB2 H -2.989 2.397 3.930 1.00 . A A . 7 HIS HB2 1 1 14 2546 1 1 8 HIS HB3 H -4.243 3.371 4.692 1.00 . A A . 7 HIS HB3 1 1 14 2547 1 1 8 HIS HD1 H -6.368 2.056 4.446 1.00 . A A . 7 HIS HD1 1 1 14 2548 1 1 8 HIS HD2 H -4.139 2.034 0.932 1.00 . A A . 7 HIS HD2 1 1 14 2549 1 1 8 HIS HE1 H -7.752 0.827 2.707 1.00 . A A . 7 HIS HE1 1 1 14 2550 1 1 8 HIS HE2 H -6.412 0.836 0.566 1.00 . A A . 7 HIS HE2 1 1 14 2551 1 1 8 HIS N N -3.117 3.808 1.575 1.00 . A A . 7 HIS N 1 1 14 2552 1 1 8 HIS ND1 N -6.081 1.908 3.520 1.00 . A A . 7 HIS ND1 1 1 14 2553 1 1 8 HIS NE2 N -6.117 1.238 1.409 1.00 . A A . 7 HIS NE2 1 1 14 2554 1 1 8 HIS O O -2.027 5.471 4.588 1.00 . A A . 7 HIS O 1 1 14 2555 1 1 9 LYS C C 0.772 6.337 2.785 1.00 . A A . 8 LYS C 1 1 14 2556 1 1 9 LYS CA C 0.379 5.023 3.467 1.00 . A A . 8 LYS CA 1 1 14 2557 1 1 9 LYS CB C 1.382 3.920 3.127 1.00 . A A . 8 LYS CB 1 1 14 2558 1 1 9 LYS CD C 2.767 3.063 1.232 1.00 . A A . 8 LYS CD 1 1 14 2559 1 1 9 LYS CE C 2.707 1.580 1.603 1.00 . A A . 8 LYS CE 1 1 14 2560 1 1 9 LYS CG C 1.447 3.739 1.609 1.00 . A A . 8 LYS CG 1 1 14 2561 1 1 9 LYS H H -0.952 4.005 2.109 1.00 . A A . 8 LYS H 1 1 14 2562 1 1 9 LYS HA H 0.324 5.155 4.535 1.00 . A A . 8 LYS HA 1 1 14 2563 1 1 9 LYS HB2 H 2.358 4.195 3.500 1.00 . A A . 8 LYS HB2 1 1 14 2564 1 1 9 LYS HB3 H 1.068 2.994 3.584 1.00 . A A . 8 LYS HB3 1 1 14 2565 1 1 9 LYS HD2 H 2.932 3.164 0.169 1.00 . A A . 8 LYS HD2 1 1 14 2566 1 1 9 LYS HD3 H 3.578 3.534 1.767 1.00 . A A . 8 LYS HD3 1 1 14 2567 1 1 9 LYS HE2 H 2.171 1.449 2.534 1.00 . A A . 8 LYS HE2 1 1 14 2568 1 1 9 LYS HE3 H 2.239 1.013 0.814 1.00 . A A . 8 LYS HE3 1 1 14 2569 1 1 9 LYS HG2 H 0.621 3.122 1.284 1.00 . A A . 8 LYS HG2 1 1 14 2570 1 1 9 LYS HG3 H 1.388 4.704 1.128 1.00 . A A . 8 LYS HG3 1 1 14 2571 1 1 9 LYS HZ1 H 4.720 1.694 1.085 1.00 . A A . 8 LYS HZ1 1 1 14 2572 1 1 9 LYS HZ2 H 4.446 1.363 2.726 1.00 . A A . 8 LYS HZ2 1 1 14 2573 1 1 9 LYS HZ3 H 4.214 0.145 1.564 1.00 . A A . 8 LYS HZ3 1 1 14 2574 1 1 9 LYS N N -0.926 4.536 2.933 1.00 . A A . 8 LYS N 1 1 14 2575 1 1 9 LYS NZ N 4.129 1.164 1.756 1.00 . A A . 8 LYS NZ 1 1 14 2576 1 1 9 LYS O O -0.037 6.985 2.151 1.00 . A A . 8 LYS O 1 1 14 2577 1 1 10 ALA C C 2.342 7.903 0.749 1.00 . A A . 9 ALA C 1 1 14 2578 1 1 10 ALA CA C 2.452 8.007 2.273 1.00 . A A . 9 ALA CA 1 1 14 2579 1 1 10 ALA CB C 3.912 8.173 2.696 1.00 . A A . 9 ALA CB 1 1 14 2580 1 1 10 ALA H H 2.645 6.197 3.428 1.00 . A A . 9 ALA H 1 1 14 2581 1 1 10 ALA HA H 1.866 8.836 2.638 1.00 . A A . 9 ALA HA 1 1 14 2582 1 1 10 ALA HB1 H 4.110 7.552 3.556 1.00 . A A . 9 ALA HB1 1 1 14 2583 1 1 10 ALA HB2 H 4.558 7.879 1.882 1.00 . A A . 9 ALA HB2 1 1 14 2584 1 1 10 ALA HB3 H 4.098 9.207 2.947 1.00 . A A . 9 ALA HB3 1 1 14 2585 1 1 10 ALA N N 2.008 6.734 2.912 1.00 . A A . 9 ALA N 1 1 14 2586 1 1 10 ALA O O 3.316 7.662 0.063 1.00 . A A . 9 ALA O 1 1 14 2587 1 1 11 LEU C C 0.743 9.389 -1.849 1.00 . A A . 10 LEU C 1 1 14 2588 1 1 11 LEU CA C 0.996 7.997 -1.264 1.00 . A A . 10 LEU CA 1 1 14 2589 1 1 11 LEU CB C -0.222 7.097 -1.473 1.00 . A A . 10 LEU CB 1 1 14 2590 1 1 11 LEU CD1 C -0.401 5.773 -3.583 1.00 . A A . 10 LEU CD1 1 1 14 2591 1 1 11 LEU CD2 C -2.130 7.490 -3.037 1.00 . A A . 10 LEU CD2 1 1 14 2592 1 1 11 LEU CG C -0.643 7.140 -2.943 1.00 . A A . 10 LEU CG 1 1 14 2593 1 1 11 LEU H H 0.393 8.279 0.786 1.00 . A A . 10 LEU H 1 1 14 2594 1 1 11 LEU HA H 1.867 7.549 -1.718 1.00 . A A . 10 LEU HA 1 1 14 2595 1 1 11 LEU HB2 H 0.028 6.083 -1.197 1.00 . A A . 10 LEU HB2 1 1 14 2596 1 1 11 LEU HB3 H -1.038 7.447 -0.857 1.00 . A A . 10 LEU HB3 1 1 14 2597 1 1 11 LEU HD11 H 0.622 5.470 -3.411 1.00 . A A . 10 LEU HD11 1 1 14 2598 1 1 11 LEU HD12 H -1.070 5.046 -3.145 1.00 . A A . 10 LEU HD12 1 1 14 2599 1 1 11 LEU HD13 H -0.583 5.836 -4.646 1.00 . A A . 10 LEU HD13 1 1 14 2600 1 1 11 LEU HD21 H -2.492 7.787 -2.064 1.00 . A A . 10 LEU HD21 1 1 14 2601 1 1 11 LEU HD22 H -2.264 8.303 -3.735 1.00 . A A . 10 LEU HD22 1 1 14 2602 1 1 11 LEU HD23 H -2.681 6.627 -3.378 1.00 . A A . 10 LEU HD23 1 1 14 2603 1 1 11 LEU HG H -0.061 7.888 -3.461 1.00 . A A . 10 LEU HG 1 1 14 2604 1 1 11 LEU N N 1.166 8.084 0.215 1.00 . A A . 10 LEU N 1 1 14 2605 1 1 11 LEU O O 1.473 9.858 -2.700 1.00 . A A . 10 LEU O 1 1 14 2606 1 1 12 ALA C C -0.134 12.482 -0.929 1.00 . A A . 11 ALA C 1 1 14 2607 1 1 12 ALA CA C -0.585 11.415 -1.929 1.00 . A A . 11 ALA CA 1 1 14 2608 1 1 12 ALA CB C -2.104 11.450 -2.101 1.00 . A A . 11 ALA CB 1 1 14 2609 1 1 12 ALA H H -0.862 9.657 -0.712 1.00 . A A . 11 ALA H 1 1 14 2610 1 1 12 ALA HA H -0.102 11.563 -2.882 1.00 . A A . 11 ALA HA 1 1 14 2611 1 1 12 ALA HB1 H -2.455 10.472 -2.398 1.00 . A A . 11 ALA HB1 1 1 14 2612 1 1 12 ALA HB2 H -2.566 11.728 -1.165 1.00 . A A . 11 ALA HB2 1 1 14 2613 1 1 12 ALA HB3 H -2.364 12.171 -2.860 1.00 . A A . 11 ALA HB3 1 1 14 2614 1 1 12 ALA N N -0.286 10.054 -1.399 1.00 . A A . 11 ALA N 1 1 14 2615 1 1 12 ALA O O -0.903 13.338 -0.541 1.00 . A A . 11 ALA O 1 1 14 2616 1 1 13 NH2 HN1 H 1.718 11.777 -0.802 1.00 . A A . 12 NH2 HN1 1 1 14 2617 1 1 13 NH2 HN2 H 1.396 13.145 0.150 1.00 . A A . 12 NH2 HN2 1 1 14 2618 1 1 13 NH2 N N 1.096 12.467 -0.490 1.00 . A A . 12 NH2 N 1 1 15 2619 1 1 2 ILE C C -2.000 -5.014 1.584 1.00 . A A . 1 ILE C 1 1 15 2620 1 1 2 ILE CA C -0.775 -5.302 2.455 1.00 . A A . 1 ILE CA 1 1 15 2621 1 1 2 ILE CB C 0.526 -4.818 1.789 1.00 . A A . 1 ILE CB 1 1 15 2622 1 1 2 ILE CD1 C 2.682 -3.633 2.267 1.00 . A A . 1 ILE CD1 1 1 15 2623 1 1 2 ILE CG1 C 1.481 -4.343 2.889 1.00 . A A . 1 ILE CG1 1 1 15 2624 1 1 2 ILE CG2 C 0.249 -3.663 0.803 1.00 . A A . 1 ILE CG2 1 1 15 2625 1 1 2 ILE H H 0.261 -7.190 2.474 1.00 . A A . 1 ILE H 1 1 15 2626 1 1 2 ILE HA H -0.880 -4.836 3.416 1.00 . A A . 1 ILE HA 1 1 15 2627 1 1 2 ILE HB H 0.974 -5.639 1.258 1.00 . A A . 1 ILE HB 1 1 15 2628 1 1 2 ILE HD11 H 2.334 -2.827 1.637 1.00 . A A . 1 ILE HD11 1 1 15 2629 1 1 2 ILE HD12 H 3.307 -3.232 3.051 1.00 . A A . 1 ILE HD12 1 1 15 2630 1 1 2 ILE HD13 H 3.248 -4.335 1.675 1.00 . A A . 1 ILE HD13 1 1 15 2631 1 1 2 ILE HG12 H 0.960 -3.659 3.545 1.00 . A A . 1 ILE HG12 1 1 15 2632 1 1 2 ILE HG13 H 1.826 -5.195 3.458 1.00 . A A . 1 ILE HG13 1 1 15 2633 1 1 2 ILE HG21 H -0.719 -3.229 1.012 1.00 . A A . 1 ILE HG21 1 1 15 2634 1 1 2 ILE HG22 H 1.004 -2.901 0.907 1.00 . A A . 1 ILE HG22 1 1 15 2635 1 1 2 ILE HG23 H 0.258 -4.041 -0.208 1.00 . A A . 1 ILE HG23 1 1 15 2636 1 1 2 ILE N N -0.612 -6.771 2.619 1.00 . A A . 1 ILE N 1 1 15 2637 1 1 2 ILE O O -3.057 -4.677 2.075 1.00 . A A . 1 ILE O 1 1 15 2638 1 1 3 ASP C C -3.448 -3.420 -0.485 1.00 . A A . 2 ASP C 1 1 15 2639 1 1 3 ASP CA C -2.979 -4.867 -0.634 1.00 . A A . 2 ASP CA 1 1 15 2640 1 1 3 ASP CB C -4.082 -5.841 -0.220 1.00 . A A . 2 ASP CB 1 1 15 2641 1 1 3 ASP CG C -5.248 -5.740 -1.206 1.00 . A A . 2 ASP CG 1 1 15 2642 1 1 3 ASP H H -0.980 -5.414 -0.061 1.00 . A A . 2 ASP H 1 1 15 2643 1 1 3 ASP HA H -2.684 -5.055 -1.653 1.00 . A A . 2 ASP HA 1 1 15 2644 1 1 3 ASP HB2 H -3.693 -6.849 -0.224 1.00 . A A . 2 ASP HB2 1 1 15 2645 1 1 3 ASP HB3 H -4.429 -5.592 0.771 1.00 . A A . 2 ASP HB3 1 1 15 2646 1 1 3 ASP N N -1.848 -5.141 0.295 1.00 . A A . 2 ASP N 1 1 15 2647 1 1 3 ASP O O -3.251 -2.597 -1.357 1.00 . A A . 2 ASP O 1 1 15 2648 1 1 3 ASP OD1 O -5.532 -4.639 -1.645 1.00 . A A . 2 ASP OD1 1 1 15 2649 1 1 3 ASP OD2 O -5.837 -6.766 -1.503 1.00 . A A . 2 ASP OD2 1 1 15 2650 1 1 4 TYR C C -3.466 -0.742 1.182 1.00 . A A . 3 TYR C 1 1 15 2651 1 1 4 TYR CA C -4.587 -1.727 0.815 1.00 . A A . 3 TYR CA 1 1 15 2652 1 1 4 TYR CB C -5.604 -1.849 1.945 1.00 . A A . 3 TYR CB 1 1 15 2653 1 1 4 TYR CD1 C -4.470 -1.004 4.024 1.00 . A A . 3 TYR CD1 1 1 15 2654 1 1 4 TYR CD2 C -4.676 -3.398 3.700 1.00 . A A . 3 TYR CD2 1 1 15 2655 1 1 4 TYR CE1 C -3.827 -1.224 5.244 1.00 . A A . 3 TYR CE1 1 1 15 2656 1 1 4 TYR CE2 C -4.036 -3.618 4.925 1.00 . A A . 3 TYR CE2 1 1 15 2657 1 1 4 TYR CG C -4.894 -2.092 3.252 1.00 . A A . 3 TYR CG 1 1 15 2658 1 1 4 TYR CZ C -3.610 -2.529 5.694 1.00 . A A . 3 TYR CZ 1 1 15 2659 1 1 4 TYR H H -4.237 -3.797 1.287 1.00 . A A . 3 TYR H 1 1 15 2660 1 1 4 TYR HA H -5.082 -1.388 -0.075 1.00 . A A . 3 TYR HA 1 1 15 2661 1 1 4 TYR HB2 H -6.177 -0.937 2.012 1.00 . A A . 3 TYR HB2 1 1 15 2662 1 1 4 TYR HB3 H -6.269 -2.675 1.741 1.00 . A A . 3 TYR HB3 1 1 15 2663 1 1 4 TYR HD1 H -4.638 0.004 3.675 1.00 . A A . 3 TYR HD1 1 1 15 2664 1 1 4 TYR HD2 H -5.004 -4.237 3.103 1.00 . A A . 3 TYR HD2 1 1 15 2665 1 1 4 TYR HE1 H -3.497 -0.384 5.840 1.00 . A A . 3 TYR HE1 1 1 15 2666 1 1 4 TYR HE2 H -3.866 -4.626 5.273 1.00 . A A . 3 TYR HE2 1 1 15 2667 1 1 4 TYR HH H -3.263 -3.601 7.236 1.00 . A A . 3 TYR HH 1 1 15 2668 1 1 4 TYR N N -4.081 -3.111 0.607 1.00 . A A . 3 TYR N 1 1 15 2669 1 1 4 TYR O O -3.449 0.365 0.692 1.00 . A A . 3 TYR O 1 1 15 2670 1 1 4 TYR OH O -2.984 -2.743 6.906 1.00 . A A . 3 TYR OH 1 1 15 2671 1 1 5 TRP C C -1.098 0.763 1.306 1.00 . A A . 4 TRP C 1 1 15 2672 1 1 5 TRP CA C -1.440 -0.190 2.452 1.00 . A A . 4 TRP CA 1 1 15 2673 1 1 5 TRP CB C -0.226 -1.069 2.741 1.00 . A A . 4 TRP CB 1 1 15 2674 1 1 5 TRP CD1 C -1.250 -2.838 4.239 1.00 . A A . 4 TRP CD1 1 1 15 2675 1 1 5 TRP CD2 C 0.332 -1.634 5.273 1.00 . A A . 4 TRP CD2 1 1 15 2676 1 1 5 TRP CE2 C -0.134 -2.578 6.211 1.00 . A A . 4 TRP CE2 1 1 15 2677 1 1 5 TRP CE3 C 1.334 -0.744 5.672 1.00 . A A . 4 TRP CE3 1 1 15 2678 1 1 5 TRP CG C -0.391 -1.818 4.026 1.00 . A A . 4 TRP CG 1 1 15 2679 1 1 5 TRP CH2 C 1.380 -1.744 7.890 1.00 . A A . 4 TRP CH2 1 1 15 2680 1 1 5 TRP CZ2 C 0.379 -2.641 7.503 1.00 . A A . 4 TRP CZ2 1 1 15 2681 1 1 5 TRP CZ3 C 1.858 -0.796 6.974 1.00 . A A . 4 TRP CZ3 1 1 15 2682 1 1 5 TRP H H -2.599 -2.018 2.431 1.00 . A A . 4 TRP H 1 1 15 2683 1 1 5 TRP HA H -1.715 0.363 3.335 1.00 . A A . 4 TRP HA 1 1 15 2684 1 1 5 TRP HB2 H -0.099 -1.766 1.939 1.00 . A A . 4 TRP HB2 1 1 15 2685 1 1 5 TRP HB3 H 0.652 -0.445 2.807 1.00 . A A . 4 TRP HB3 1 1 15 2686 1 1 5 TRP HD1 H -1.935 -3.247 3.516 1.00 . A A . 4 TRP HD1 1 1 15 2687 1 1 5 TRP HE1 H -1.593 -4.033 5.936 1.00 . A A . 4 TRP HE1 1 1 15 2688 1 1 5 TRP HE3 H 1.703 -0.016 4.970 1.00 . A A . 4 TRP HE3 1 1 15 2689 1 1 5 TRP HH2 H 1.784 -1.783 8.890 1.00 . A A . 4 TRP HH2 1 1 15 2690 1 1 5 TRP HZ2 H 0.006 -3.377 8.199 1.00 . A A . 4 TRP HZ2 1 1 15 2691 1 1 5 TRP HZ3 H 2.631 -0.104 7.271 1.00 . A A . 4 TRP HZ3 1 1 15 2692 1 1 5 TRP N N -2.550 -1.126 2.044 1.00 . A A . 4 TRP N 1 1 15 2693 1 1 5 TRP NE1 N -1.089 -3.297 5.531 1.00 . A A . 4 TRP NE1 1 1 15 2694 1 1 5 TRP O O -0.844 1.932 1.514 1.00 . A A . 4 TRP O 1 1 15 2695 1 1 6 LEU C C -1.400 2.503 -0.879 1.00 . A A . 5 LEU C 1 1 15 2696 1 1 6 LEU CA C -0.794 1.110 -1.087 1.00 . A A . 5 LEU CA 1 1 15 2697 1 1 6 LEU CB C -1.442 0.351 -2.256 1.00 . A A . 5 LEU CB 1 1 15 2698 1 1 6 LEU CD1 C -0.939 2.029 -4.042 1.00 . A A . 5 LEU CD1 1 1 15 2699 1 1 6 LEU CD2 C -2.908 0.502 -4.259 1.00 . A A . 5 LEU CD2 1 1 15 2700 1 1 6 LEU CG C -2.054 1.310 -3.279 1.00 . A A . 5 LEU CG 1 1 15 2701 1 1 6 LEU H H -1.317 -0.690 -0.030 1.00 . A A . 5 LEU H 1 1 15 2702 1 1 6 LEU HA H 0.273 1.180 -1.235 1.00 . A A . 5 LEU HA 1 1 15 2703 1 1 6 LEU HB2 H -0.691 -0.253 -2.744 1.00 . A A . 5 LEU HB2 1 1 15 2704 1 1 6 LEU HB3 H -2.217 -0.295 -1.869 1.00 . A A . 5 LEU HB3 1 1 15 2705 1 1 6 LEU HD11 H -0.157 2.313 -3.355 1.00 . A A . 5 LEU HD11 1 1 15 2706 1 1 6 LEU HD12 H -0.535 1.369 -4.795 1.00 . A A . 5 LEU HD12 1 1 15 2707 1 1 6 LEU HD13 H -1.340 2.913 -4.516 1.00 . A A . 5 LEU HD13 1 1 15 2708 1 1 6 LEU HD21 H -2.365 -0.382 -4.564 1.00 . A A . 5 LEU HD21 1 1 15 2709 1 1 6 LEU HD22 H -3.828 0.207 -3.776 1.00 . A A . 5 LEU HD22 1 1 15 2710 1 1 6 LEU HD23 H -3.132 1.105 -5.126 1.00 . A A . 5 LEU HD23 1 1 15 2711 1 1 6 LEU HG H -2.673 2.036 -2.772 1.00 . A A . 5 LEU HG 1 1 15 2712 1 1 6 LEU N N -1.101 0.258 0.098 1.00 . A A . 5 LEU N 1 1 15 2713 1 1 6 LEU O O -0.710 3.502 -0.911 1.00 . A A . 5 LEU O 1 1 15 2714 1 1 7 ALA C C -3.261 4.176 1.134 1.00 . A A . 6 ALA C 1 1 15 2715 1 1 7 ALA CA C -3.317 3.889 -0.372 1.00 . A A . 6 ALA CA 1 1 15 2716 1 1 7 ALA CB C -4.761 3.727 -0.855 1.00 . A A . 6 ALA CB 1 1 15 2717 1 1 7 ALA H H -3.209 1.748 -0.577 1.00 . A A . 6 ALA H 1 1 15 2718 1 1 7 ALA HA H -2.819 4.668 -0.929 1.00 . A A . 6 ALA HA 1 1 15 2719 1 1 7 ALA HB1 H -5.218 2.889 -0.350 1.00 . A A . 6 ALA HB1 1 1 15 2720 1 1 7 ALA HB2 H -5.317 4.626 -0.635 1.00 . A A . 6 ALA HB2 1 1 15 2721 1 1 7 ALA HB3 H -4.767 3.552 -1.920 1.00 . A A . 6 ALA HB3 1 1 15 2722 1 1 7 ALA N N -2.676 2.569 -0.627 1.00 . A A . 6 ALA N 1 1 15 2723 1 1 7 ALA O O -2.223 4.049 1.752 1.00 . A A . 6 ALA O 1 1 15 2724 1 1 8 HIS C C -3.090 5.555 3.613 1.00 . A A . 7 HIS C 1 1 15 2725 1 1 8 HIS CA C -4.367 4.794 3.209 1.00 . A A . 7 HIS CA 1 1 15 2726 1 1 8 HIS CB C -4.424 3.397 3.854 1.00 . A A . 7 HIS CB 1 1 15 2727 1 1 8 HIS CD2 C -5.203 1.971 1.797 1.00 . A A . 7 HIS CD2 1 1 15 2728 1 1 8 HIS CE1 C -7.088 1.252 2.582 1.00 . A A . 7 HIS CE1 1 1 15 2729 1 1 8 HIS CG C -5.330 2.498 3.056 1.00 . A A . 7 HIS CG 1 1 15 2730 1 1 8 HIS H H -5.199 4.611 1.230 1.00 . A A . 7 HIS H 1 1 15 2731 1 1 8 HIS HA H -5.242 5.361 3.486 1.00 . A A . 7 HIS HA 1 1 15 2732 1 1 8 HIS HB2 H -3.435 2.968 3.871 1.00 . A A . 7 HIS HB2 1 1 15 2733 1 1 8 HIS HB3 H -4.798 3.482 4.863 1.00 . A A . 7 HIS HB3 1 1 15 2734 1 1 8 HIS HD1 H -6.930 2.223 4.420 1.00 . A A . 7 HIS HD1 1 1 15 2735 1 1 8 HIS HD2 H -4.368 2.136 1.138 1.00 . A A . 7 HIS HD2 1 1 15 2736 1 1 8 HIS HE1 H -8.032 0.742 2.676 1.00 . A A . 7 HIS HE1 1 1 15 2737 1 1 8 HIS HE2 H -6.484 0.694 0.676 1.00 . A A . 7 HIS HE2 1 1 15 2738 1 1 8 HIS N N -4.366 4.533 1.736 1.00 . A A . 7 HIS N 1 1 15 2739 1 1 8 HIS ND1 N -6.542 2.028 3.542 1.00 . A A . 7 HIS ND1 1 1 15 2740 1 1 8 HIS NE2 N -6.310 1.189 1.503 1.00 . A A . 7 HIS NE2 1 1 15 2741 1 1 8 HIS O O -2.857 6.659 3.162 1.00 . A A . 7 HIS O 1 1 15 2742 1 1 9 LYS C C -1.348 7.025 5.504 1.00 . A A . 8 LYS C 1 1 15 2743 1 1 9 LYS CA C -1.018 5.675 4.872 1.00 . A A . 8 LYS CA 1 1 15 2744 1 1 9 LYS CB C -0.212 5.863 3.586 1.00 . A A . 8 LYS CB 1 1 15 2745 1 1 9 LYS CD C 1.795 4.417 3.242 1.00 . A A . 8 LYS CD 1 1 15 2746 1 1 9 LYS CE C 2.441 4.229 1.868 1.00 . A A . 8 LYS CE 1 1 15 2747 1 1 9 LYS CG C 0.276 4.502 3.085 1.00 . A A . 8 LYS CG 1 1 15 2748 1 1 9 LYS H H -2.456 4.105 4.811 1.00 . A A . 8 LYS H 1 1 15 2749 1 1 9 LYS HA H -0.462 5.059 5.564 1.00 . A A . 8 LYS HA 1 1 15 2750 1 1 9 LYS HB2 H -0.834 6.323 2.833 1.00 . A A . 8 LYS HB2 1 1 15 2751 1 1 9 LYS HB3 H 0.638 6.495 3.786 1.00 . A A . 8 LYS HB3 1 1 15 2752 1 1 9 LYS HD2 H 2.162 5.328 3.692 1.00 . A A . 8 LYS HD2 1 1 15 2753 1 1 9 LYS HD3 H 2.046 3.578 3.873 1.00 . A A . 8 LYS HD3 1 1 15 2754 1 1 9 LYS HE2 H 3.513 4.136 1.968 1.00 . A A . 8 LYS HE2 1 1 15 2755 1 1 9 LYS HE3 H 2.031 3.363 1.373 1.00 . A A . 8 LYS HE3 1 1 15 2756 1 1 9 LYS HG2 H -0.192 3.718 3.663 1.00 . A A . 8 LYS HG2 1 1 15 2757 1 1 9 LYS HG3 H 0.016 4.388 2.044 1.00 . A A . 8 LYS HG3 1 1 15 2758 1 1 9 LYS HZ1 H 1.948 6.249 1.774 1.00 . A A . 8 LYS HZ1 1 1 15 2759 1 1 9 LYS HZ2 H 2.868 5.698 0.455 1.00 . A A . 8 LYS HZ2 1 1 15 2760 1 1 9 LYS HZ3 H 1.222 5.302 0.565 1.00 . A A . 8 LYS HZ3 1 1 15 2761 1 1 9 LYS N N -2.263 4.983 4.454 1.00 . A A . 8 LYS N 1 1 15 2762 1 1 9 LYS NZ N 2.093 5.463 1.108 1.00 . A A . 8 LYS NZ 1 1 15 2763 1 1 9 LYS O O -2.471 7.290 5.887 1.00 . A A . 8 LYS O 1 1 15 2764 1 1 10 ALA C C -1.940 9.797 5.732 1.00 . A A . 9 ALA C 1 1 15 2765 1 1 10 ALA CA C -0.609 9.219 6.221 1.00 . A A . 9 ALA CA 1 1 15 2766 1 1 10 ALA CB C 0.557 10.082 5.738 1.00 . A A . 9 ALA CB 1 1 15 2767 1 1 10 ALA H H 0.518 7.630 5.297 1.00 . A A . 9 ALA H 1 1 15 2768 1 1 10 ALA HA H -0.597 9.153 7.297 1.00 . A A . 9 ALA HA 1 1 15 2769 1 1 10 ALA HB1 H 1.188 9.499 5.082 1.00 . A A . 9 ALA HB1 1 1 15 2770 1 1 10 ALA HB2 H 0.176 10.938 5.203 1.00 . A A . 9 ALA HB2 1 1 15 2771 1 1 10 ALA HB3 H 1.133 10.416 6.588 1.00 . A A . 9 ALA HB3 1 1 15 2772 1 1 10 ALA N N -0.374 7.877 5.613 1.00 . A A . 9 ALA N 1 1 15 2773 1 1 10 ALA O O -2.693 10.375 6.492 1.00 . A A . 9 ALA O 1 1 15 2774 1 1 11 LEU C C -3.763 11.599 4.477 1.00 . A A . 10 LEU C 1 1 15 2775 1 1 11 LEU CA C -3.519 10.188 3.937 1.00 . A A . 10 LEU CA 1 1 15 2776 1 1 11 LEU CB C -4.597 9.227 4.441 1.00 . A A . 10 LEU CB 1 1 15 2777 1 1 11 LEU CD1 C -6.547 8.769 2.948 1.00 . A A . 10 LEU CD1 1 1 15 2778 1 1 11 LEU CD2 C -6.911 9.779 5.202 1.00 . A A . 10 LEU CD2 1 1 15 2779 1 1 11 LEU CG C -5.973 9.725 3.995 1.00 . A A . 10 LEU CG 1 1 15 2780 1 1 11 LEU H H -1.616 9.178 3.874 1.00 . A A . 10 LEU H 1 1 15 2781 1 1 11 LEU HA H -3.506 10.194 2.858 1.00 . A A . 10 LEU HA 1 1 15 2782 1 1 11 LEU HB2 H -4.419 8.242 4.035 1.00 . A A . 10 LEU HB2 1 1 15 2783 1 1 11 LEU HB3 H -4.564 9.184 5.520 1.00 . A A . 10 LEU HB3 1 1 15 2784 1 1 11 LEU HD11 H -6.221 7.762 3.162 1.00 . A A . 10 LEU HD11 1 1 15 2785 1 1 11 LEU HD12 H -7.625 8.812 2.974 1.00 . A A . 10 LEU HD12 1 1 15 2786 1 1 11 LEU HD13 H -6.199 9.059 1.967 1.00 . A A . 10 LEU HD13 1 1 15 2787 1 1 11 LEU HD21 H -6.884 8.832 5.721 1.00 . A A . 10 LEU HD21 1 1 15 2788 1 1 11 LEU HD22 H -6.592 10.565 5.871 1.00 . A A . 10 LEU HD22 1 1 15 2789 1 1 11 LEU HD23 H -7.918 9.977 4.868 1.00 . A A . 10 LEU HD23 1 1 15 2790 1 1 11 LEU HG H -5.876 10.712 3.566 1.00 . A A . 10 LEU HG 1 1 15 2791 1 1 11 LEU N N -2.237 9.646 4.471 1.00 . A A . 10 LEU N 1 1 15 2792 1 1 11 LEU O O -4.425 11.786 5.478 1.00 . A A . 10 LEU O 1 1 15 2793 1 1 12 ALA C C -4.898 14.401 4.138 1.00 . A A . 11 ALA C 1 1 15 2794 1 1 12 ALA CA C -3.431 13.993 4.300 1.00 . A A . 11 ALA CA 1 1 15 2795 1 1 12 ALA CB C -2.534 14.849 3.406 1.00 . A A . 11 ALA CB 1 1 15 2796 1 1 12 ALA H H -2.699 12.424 3.018 1.00 . A A . 11 ALA H 1 1 15 2797 1 1 12 ALA HA H -3.124 14.088 5.330 1.00 . A A . 11 ALA HA 1 1 15 2798 1 1 12 ALA HB1 H -2.786 14.675 2.371 1.00 . A A . 11 ALA HB1 1 1 15 2799 1 1 12 ALA HB2 H -2.680 15.893 3.642 1.00 . A A . 11 ALA HB2 1 1 15 2800 1 1 12 ALA HB3 H -1.500 14.583 3.574 1.00 . A A . 11 ALA HB3 1 1 15 2801 1 1 12 ALA N N -3.231 12.594 3.823 1.00 . A A . 11 ALA N 1 1 15 2802 1 1 12 ALA O O -5.720 13.619 3.704 1.00 . A A . 11 ALA O 1 1 15 2803 1 1 13 NH2 HN1 H -4.603 16.241 4.825 1.00 . A A . 12 NH2 HN1 1 1 15 2804 1 1 13 NH2 HN2 H -6.200 15.882 4.376 1.00 . A A . 12 NH2 HN2 1 1 15 2805 1 1 13 NH2 N N -5.264 15.609 4.475 1.00 . A A . 12 NH2 N 1 1 16 2806 1 1 2 ILE C C -1.980 -4.907 1.648 1.00 . A A . 1 ILE C 1 1 16 2807 1 1 2 ILE CA C -0.830 -5.128 2.630 1.00 . A A . 1 ILE CA 1 1 16 2808 1 1 2 ILE CB C 0.498 -4.566 2.091 1.00 . A A . 1 ILE CB 1 1 16 2809 1 1 2 ILE CD1 C 1.854 -5.174 4.100 1.00 . A A . 1 ILE CD1 1 1 16 2810 1 1 2 ILE CG1 C 1.311 -4.015 3.262 1.00 . A A . 1 ILE CG1 1 1 16 2811 1 1 2 ILE CG2 C 0.258 -3.432 1.075 1.00 . A A . 1 ILE CG2 1 1 16 2812 1 1 2 ILE H H 0.316 -6.947 2.776 1.00 . A A . 1 ILE H 1 1 16 2813 1 1 2 ILE HA H -1.053 -4.678 3.578 1.00 . A A . 1 ILE HA 1 1 16 2814 1 1 2 ILE HB H 1.049 -5.359 1.617 1.00 . A A . 1 ILE HB 1 1 16 2815 1 1 2 ILE HD11 H 1.990 -6.040 3.470 1.00 . A A . 1 ILE HD11 1 1 16 2816 1 1 2 ILE HD12 H 2.800 -4.891 4.534 1.00 . A A . 1 ILE HD12 1 1 16 2817 1 1 2 ILE HD13 H 1.152 -5.408 4.887 1.00 . A A . 1 ILE HD13 1 1 16 2818 1 1 2 ILE HG12 H 2.133 -3.426 2.883 1.00 . A A . 1 ILE HG12 1 1 16 2819 1 1 2 ILE HG13 H 0.675 -3.395 3.880 1.00 . A A . 1 ILE HG13 1 1 16 2820 1 1 2 ILE HG21 H -0.744 -3.046 1.187 1.00 . A A . 1 ILE HG21 1 1 16 2821 1 1 2 ILE HG22 H 0.968 -2.638 1.247 1.00 . A A . 1 ILE HG22 1 1 16 2822 1 1 2 ILE HG23 H 0.383 -3.814 0.072 1.00 . A A . 1 ILE HG23 1 1 16 2823 1 1 2 ILE N N -0.596 -6.586 2.802 1.00 . A A . 1 ILE N 1 1 16 2824 1 1 2 ILE O O -3.096 -4.626 2.036 1.00 . A A . 1 ILE O 1 1 16 2825 1 1 3 ASP C C -3.307 -3.396 -0.554 1.00 . A A . 2 ASP C 1 1 16 2826 1 1 3 ASP CA C -2.758 -4.818 -0.648 1.00 . A A . 2 ASP CA 1 1 16 2827 1 1 3 ASP CB C -3.847 -5.840 -0.321 1.00 . A A . 2 ASP CB 1 1 16 2828 1 1 3 ASP CG C -3.838 -6.948 -1.374 1.00 . A A . 2 ASP CG 1 1 16 2829 1 1 3 ASP H H -0.794 -5.256 0.108 1.00 . A A . 2 ASP H 1 1 16 2830 1 1 3 ASP HA H -2.364 -4.996 -1.635 1.00 . A A . 2 ASP HA 1 1 16 2831 1 1 3 ASP HB2 H -3.658 -6.267 0.653 1.00 . A A . 2 ASP HB2 1 1 16 2832 1 1 3 ASP HB3 H -4.809 -5.352 -0.322 1.00 . A A . 2 ASP HB3 1 1 16 2833 1 1 3 ASP N N -1.703 -5.030 0.381 1.00 . A A . 2 ASP N 1 1 16 2834 1 1 3 ASP O O -3.060 -2.566 -1.406 1.00 . A A . 2 ASP O 1 1 16 2835 1 1 3 ASP OD1 O -3.279 -6.726 -2.435 1.00 . A A . 2 ASP OD1 1 1 16 2836 1 1 3 ASP OD2 O -4.394 -8.000 -1.103 1.00 . A A . 2 ASP OD2 1 1 16 2837 1 1 4 TYR C C -3.580 -0.731 1.073 1.00 . A A . 3 TYR C 1 1 16 2838 1 1 4 TYR CA C -4.635 -1.751 0.609 1.00 . A A . 3 TYR CA 1 1 16 2839 1 1 4 TYR CB C -5.782 -1.901 1.614 1.00 . A A . 3 TYR CB 1 1 16 2840 1 1 4 TYR CD1 C -5.040 -3.545 3.370 1.00 . A A . 3 TYR CD1 1 1 16 2841 1 1 4 TYR CD2 C -4.965 -1.174 3.876 1.00 . A A . 3 TYR CD2 1 1 16 2842 1 1 4 TYR CE1 C -4.552 -3.831 4.649 1.00 . A A . 3 TYR CE1 1 1 16 2843 1 1 4 TYR CE2 C -4.479 -1.461 5.155 1.00 . A A . 3 TYR CE2 1 1 16 2844 1 1 4 TYR CG C -5.246 -2.215 2.986 1.00 . A A . 3 TYR CG 1 1 16 2845 1 1 4 TYR CZ C -4.272 -2.789 5.541 1.00 . A A . 3 TYR CZ 1 1 16 2846 1 1 4 TYR H H -4.251 -3.803 1.137 1.00 . A A . 3 TYR H 1 1 16 2847 1 1 4 TYR HA H -5.035 -1.435 -0.336 1.00 . A A . 3 TYR HA 1 1 16 2848 1 1 4 TYR HB2 H -6.345 -0.983 1.655 1.00 . A A . 3 TYR HB2 1 1 16 2849 1 1 4 TYR HB3 H -6.432 -2.701 1.294 1.00 . A A . 3 TYR HB3 1 1 16 2850 1 1 4 TYR HD1 H -5.255 -4.347 2.681 1.00 . A A . 3 TYR HD1 1 1 16 2851 1 1 4 TYR HD2 H -5.124 -0.150 3.577 1.00 . A A . 3 TYR HD2 1 1 16 2852 1 1 4 TYR HE1 H -4.391 -4.856 4.950 1.00 . A A . 3 TYR HE1 1 1 16 2853 1 1 4 TYR HE2 H -4.263 -0.659 5.843 1.00 . A A . 3 TYR HE2 1 1 16 2854 1 1 4 TYR HH H -4.166 -3.916 7.078 1.00 . A A . 3 TYR HH 1 1 16 2855 1 1 4 TYR N N -4.058 -3.113 0.467 1.00 . A A . 3 TYR N 1 1 16 2856 1 1 4 TYR O O -3.412 0.282 0.435 1.00 . A A . 3 TYR O 1 1 16 2857 1 1 4 TYR OH O -3.799 -3.072 6.806 1.00 . A A . 3 TYR OH 1 1 16 2858 1 1 5 TRP C C -1.409 0.976 1.618 1.00 . A A . 4 TRP C 1 1 16 2859 1 1 5 TRP CA C -1.831 -0.033 2.686 1.00 . A A . 4 TRP CA 1 1 16 2860 1 1 5 TRP CB C -0.621 -0.900 3.037 1.00 . A A . 4 TRP CB 1 1 16 2861 1 1 5 TRP CD1 C -1.713 -2.713 4.419 1.00 . A A . 4 TRP CD1 1 1 16 2862 1 1 5 TRP CD2 C -0.241 -1.496 5.594 1.00 . A A . 4 TRP CD2 1 1 16 2863 1 1 5 TRP CE2 C -0.765 -2.464 6.480 1.00 . A A . 4 TRP CE2 1 1 16 2864 1 1 5 TRP CE3 C 0.713 -0.597 6.086 1.00 . A A . 4 TRP CE3 1 1 16 2865 1 1 5 TRP CG C -0.863 -1.673 4.292 1.00 . A A . 4 TRP CG 1 1 16 2866 1 1 5 TRP CH2 C 0.596 -1.633 8.285 1.00 . A A . 4 TRP CH2 1 1 16 2867 1 1 5 TRP CZ2 C -0.355 -2.537 7.808 1.00 . A A . 4 TRP CZ2 1 1 16 2868 1 1 5 TRP CZ3 C 1.132 -0.663 7.425 1.00 . A A . 4 TRP CZ3 1 1 16 2869 1 1 5 TRP H H -3.043 -1.821 2.647 1.00 . A A . 4 TRP H 1 1 16 2870 1 1 5 TRP HA H -2.187 0.474 3.568 1.00 . A A . 4 TRP HA 1 1 16 2871 1 1 5 TRP HB2 H -0.432 -1.582 2.231 1.00 . A A . 4 TRP HB2 1 1 16 2872 1 1 5 TRP HB3 H 0.242 -0.264 3.172 1.00 . A A . 4 TRP HB3 1 1 16 2873 1 1 5 TRP HD1 H -2.330 -3.122 3.635 1.00 . A A . 4 TRP HD1 1 1 16 2874 1 1 5 TRP HE1 H -2.175 -3.936 6.069 1.00 . A A . 4 TRP HE1 1 1 16 2875 1 1 5 TRP HE3 H 1.129 0.148 5.428 1.00 . A A . 4 TRP HE3 1 1 16 2876 1 1 5 TRP HH2 H 0.919 -1.681 9.314 1.00 . A A . 4 TRP HH2 1 1 16 2877 1 1 5 TRP HZ2 H -0.772 -3.288 8.460 1.00 . A A . 4 TRP HZ2 1 1 16 2878 1 1 5 TRP HZ3 H 1.867 0.036 7.794 1.00 . A A . 4 TRP HZ3 1 1 16 2879 1 1 5 TRP N N -2.880 -0.992 2.164 1.00 . A A . 4 TRP N 1 1 16 2880 1 1 5 TRP NE1 N -1.653 -3.186 5.715 1.00 . A A . 4 TRP NE1 1 1 16 2881 1 1 5 TRP O O -1.436 2.172 1.824 1.00 . A A . 4 TRP O 1 1 16 2882 1 1 6 LEU C C -1.426 2.649 -0.689 1.00 . A A . 5 LEU C 1 1 16 2883 1 1 6 LEU CA C -0.582 1.365 -0.635 1.00 . A A . 5 LEU CA 1 1 16 2884 1 1 6 LEU CB C -0.807 0.497 -1.874 1.00 . A A . 5 LEU CB 1 1 16 2885 1 1 6 LEU CD1 C 0.491 1.968 -3.418 1.00 . A A . 5 LEU CD1 1 1 16 2886 1 1 6 LEU CD2 C -1.311 0.475 -4.305 1.00 . A A . 5 LEU CD2 1 1 16 2887 1 1 6 LEU CG C -0.882 1.359 -3.130 1.00 . A A . 5 LEU CG 1 1 16 2888 1 1 6 LEU H H -1.006 -0.490 0.357 1.00 . A A . 5 LEU H 1 1 16 2889 1 1 6 LEU HA H 0.465 1.604 -0.542 1.00 . A A . 5 LEU HA 1 1 16 2890 1 1 6 LEU HB2 H 0.011 -0.203 -1.971 1.00 . A A . 5 LEU HB2 1 1 16 2891 1 1 6 LEU HB3 H -1.731 -0.050 -1.762 1.00 . A A . 5 LEU HB3 1 1 16 2892 1 1 6 LEU HD11 H 1.254 1.390 -2.916 1.00 . A A . 5 LEU HD11 1 1 16 2893 1 1 6 LEU HD12 H 0.675 1.956 -4.482 1.00 . A A . 5 LEU HD12 1 1 16 2894 1 1 6 LEU HD13 H 0.517 2.986 -3.059 1.00 . A A . 5 LEU HD13 1 1 16 2895 1 1 6 LEU HD21 H -2.027 -0.258 -3.961 1.00 . A A . 5 LEU HD21 1 1 16 2896 1 1 6 LEU HD22 H -1.761 1.085 -5.072 1.00 . A A . 5 LEU HD22 1 1 16 2897 1 1 6 LEU HD23 H -0.445 -0.032 -4.707 1.00 . A A . 5 LEU HD23 1 1 16 2898 1 1 6 LEU HG H -1.606 2.147 -2.986 1.00 . A A . 5 LEU HG 1 1 16 2899 1 1 6 LEU N N -1.017 0.482 0.481 1.00 . A A . 5 LEU N 1 1 16 2900 1 1 6 LEU O O -0.899 3.740 -0.777 1.00 . A A . 5 LEU O 1 1 16 2901 1 1 7 ALA C C -3.889 4.294 0.706 1.00 . A A . 6 ALA C 1 1 16 2902 1 1 7 ALA CA C -3.592 3.752 -0.700 1.00 . A A . 6 ALA CA 1 1 16 2903 1 1 7 ALA CB C -4.883 3.283 -1.372 1.00 . A A . 6 ALA CB 1 1 16 2904 1 1 7 ALA H H -3.136 1.643 -0.578 1.00 . A A . 6 ALA H 1 1 16 2905 1 1 7 ALA HA H -3.125 4.513 -1.304 1.00 . A A . 6 ALA HA 1 1 16 2906 1 1 7 ALA HB1 H -5.019 2.227 -1.189 1.00 . A A . 6 ALA HB1 1 1 16 2907 1 1 7 ALA HB2 H -5.720 3.830 -0.963 1.00 . A A . 6 ALA HB2 1 1 16 2908 1 1 7 ALA HB3 H -4.821 3.460 -2.434 1.00 . A A . 6 ALA HB3 1 1 16 2909 1 1 7 ALA N N -2.727 2.531 -0.644 1.00 . A A . 6 ALA N 1 1 16 2910 1 1 7 ALA O O -4.744 5.140 0.881 1.00 . A A . 6 ALA O 1 1 16 2911 1 1 8 HIS C C -2.181 4.799 3.732 1.00 . A A . 7 HIS C 1 1 16 2912 1 1 8 HIS CA C -3.478 4.296 3.093 1.00 . A A . 7 HIS CA 1 1 16 2913 1 1 8 HIS CB C -4.011 3.078 3.865 1.00 . A A . 7 HIS CB 1 1 16 2914 1 1 8 HIS CD2 C -4.962 1.862 1.725 1.00 . A A . 7 HIS CD2 1 1 16 2915 1 1 8 HIS CE1 C -6.846 1.189 2.545 1.00 . A A . 7 HIS CE1 1 1 16 2916 1 1 8 HIS CG C -5.001 2.303 3.025 1.00 . A A . 7 HIS CG 1 1 16 2917 1 1 8 HIS H H -2.531 3.119 1.554 1.00 . A A . 7 HIS H 1 1 16 2918 1 1 8 HIS HA H -4.220 5.078 3.080 1.00 . A A . 7 HIS HA 1 1 16 2919 1 1 8 HIS HB2 H -3.186 2.433 4.126 1.00 . A A . 7 HIS HB2 1 1 16 2920 1 1 8 HIS HB3 H -4.498 3.416 4.768 1.00 . A A . 7 HIS HB3 1 1 16 2921 1 1 8 HIS HD1 H -6.557 2.011 4.438 1.00 . A A . 7 HIS HD1 1 1 16 2922 1 1 8 HIS HD2 H -4.149 2.020 1.044 1.00 . A A . 7 HIS HD2 1 1 16 2923 1 1 8 HIS HE1 H -7.808 0.713 2.648 1.00 . A A . 7 HIS HE1 1 1 16 2924 1 1 8 HIS HE2 H -6.360 0.744 0.577 1.00 . A A . 7 HIS HE2 1 1 16 2925 1 1 8 HIS N N -3.209 3.810 1.709 1.00 . A A . 7 HIS N 1 1 16 2926 1 1 8 HIS ND1 N -6.219 1.861 3.531 1.00 . A A . 7 HIS ND1 1 1 16 2927 1 1 8 HIS NE2 N -6.122 1.165 1.430 1.00 . A A . 7 HIS NE2 1 1 16 2928 1 1 8 HIS O O -1.330 5.361 3.071 1.00 . A A . 7 HIS O 1 1 16 2929 1 1 9 LYS C C -0.377 6.432 5.191 1.00 . A A . 8 LYS C 1 1 16 2930 1 1 9 LYS CA C -0.785 5.050 5.700 1.00 . A A . 8 LYS CA 1 1 16 2931 1 1 9 LYS CB C 0.273 4.004 5.342 1.00 . A A . 8 LYS CB 1 1 16 2932 1 1 9 LYS CD C -0.214 2.285 7.095 1.00 . A A . 8 LYS CD 1 1 16 2933 1 1 9 LYS CE C -1.375 2.974 7.816 1.00 . A A . 8 LYS CE 1 1 16 2934 1 1 9 LYS CG C -0.281 2.598 5.598 1.00 . A A . 8 LYS CG 1 1 16 2935 1 1 9 LYS H H -2.717 4.137 5.520 1.00 . A A . 8 LYS H 1 1 16 2936 1 1 9 LYS HA H -0.933 5.071 6.767 1.00 . A A . 8 LYS HA 1 1 16 2937 1 1 9 LYS HB2 H 0.537 4.102 4.299 1.00 . A A . 8 LYS HB2 1 1 16 2938 1 1 9 LYS HB3 H 1.150 4.158 5.952 1.00 . A A . 8 LYS HB3 1 1 16 2939 1 1 9 LYS HD2 H -0.280 1.217 7.242 1.00 . A A . 8 LYS HD2 1 1 16 2940 1 1 9 LYS HD3 H 0.721 2.647 7.496 1.00 . A A . 8 LYS HD3 1 1 16 2941 1 1 9 LYS HE2 H -1.000 3.622 8.597 1.00 . A A . 8 LYS HE2 1 1 16 2942 1 1 9 LYS HE3 H -1.975 3.534 7.117 1.00 . A A . 8 LYS HE3 1 1 16 2943 1 1 9 LYS HG2 H -1.307 2.548 5.264 1.00 . A A . 8 LYS HG2 1 1 16 2944 1 1 9 LYS HG3 H 0.309 1.875 5.055 1.00 . A A . 8 LYS HG3 1 1 16 2945 1 1 9 LYS HZ1 H -2.330 1.128 7.681 1.00 . A A . 8 LYS HZ1 1 1 16 2946 1 1 9 LYS HZ2 H -1.669 1.456 9.211 1.00 . A A . 8 LYS HZ2 1 1 16 2947 1 1 9 LYS HZ3 H -3.099 2.229 8.717 1.00 . A A . 8 LYS HZ3 1 1 16 2948 1 1 9 LYS N N -2.023 4.594 5.012 1.00 . A A . 8 LYS N 1 1 16 2949 1 1 9 LYS NZ N -2.179 1.863 8.400 1.00 . A A . 8 LYS NZ 1 1 16 2950 1 1 9 LYS O O -1.204 7.290 4.954 1.00 . A A . 8 LYS O 1 1 16 2951 1 1 10 ALA C C 0.666 8.328 3.214 1.00 . A A . 9 ALA C 1 1 16 2952 1 1 10 ALA CA C 1.369 7.972 4.526 1.00 . A A . 9 ALA CA 1 1 16 2953 1 1 10 ALA CB C 2.870 7.794 4.298 1.00 . A A . 9 ALA CB 1 1 16 2954 1 1 10 ALA H H 1.533 5.939 5.220 1.00 . A A . 9 ALA H 1 1 16 2955 1 1 10 ALA HA H 1.197 8.736 5.267 1.00 . A A . 9 ALA HA 1 1 16 2956 1 1 10 ALA HB1 H 3.042 6.920 3.687 1.00 . A A . 9 ALA HB1 1 1 16 2957 1 1 10 ALA HB2 H 3.264 8.666 3.796 1.00 . A A . 9 ALA HB2 1 1 16 2958 1 1 10 ALA HB3 H 3.367 7.670 5.249 1.00 . A A . 9 ALA HB3 1 1 16 2959 1 1 10 ALA N N 0.893 6.648 5.021 1.00 . A A . 9 ALA N 1 1 16 2960 1 1 10 ALA O O 0.543 7.510 2.325 1.00 . A A . 9 ALA O 1 1 16 2961 1 1 11 LEU C C -0.503 11.473 1.707 1.00 . A A . 10 LEU C 1 1 16 2962 1 1 11 LEU CA C -0.492 9.947 1.834 1.00 . A A . 10 LEU CA 1 1 16 2963 1 1 11 LEU CB C -1.914 9.407 1.982 1.00 . A A . 10 LEU CB 1 1 16 2964 1 1 11 LEU CD1 C -3.219 8.841 -0.072 1.00 . A A . 10 LEU CD1 1 1 16 2965 1 1 11 LEU CD2 C -4.040 10.618 1.476 1.00 . A A . 10 LEU CD2 1 1 16 2966 1 1 11 LEU CG C -2.794 9.972 0.866 1.00 . A A . 10 LEU CG 1 1 16 2967 1 1 11 LEU H H 0.314 10.185 3.820 1.00 . A A . 10 LEU H 1 1 16 2968 1 1 11 LEU HA H -0.014 9.500 0.977 1.00 . A A . 10 LEU HA 1 1 16 2969 1 1 11 LEU HB2 H -1.897 8.329 1.920 1.00 . A A . 10 LEU HB2 1 1 16 2970 1 1 11 LEU HB3 H -2.314 9.706 2.939 1.00 . A A . 10 LEU HB3 1 1 16 2971 1 1 11 LEU HD11 H -2.843 7.901 0.304 1.00 . A A . 10 LEU HD11 1 1 16 2972 1 1 11 LEU HD12 H -4.296 8.803 -0.124 1.00 . A A . 10 LEU HD12 1 1 16 2973 1 1 11 LEU HD13 H -2.816 9.021 -1.058 1.00 . A A . 10 LEU HD13 1 1 16 2974 1 1 11 LEU HD21 H -4.057 10.431 2.540 1.00 . A A . 10 LEU HD21 1 1 16 2975 1 1 11 LEU HD22 H -4.017 11.682 1.299 1.00 . A A . 10 LEU HD22 1 1 16 2976 1 1 11 LEU HD23 H -4.924 10.196 1.022 1.00 . A A . 10 LEU HD23 1 1 16 2977 1 1 11 LEU HG H -2.239 10.713 0.308 1.00 . A A . 10 LEU HG 1 1 16 2978 1 1 11 LEU N N 0.204 9.540 3.089 1.00 . A A . 10 LEU N 1 1 16 2979 1 1 11 LEU O O -0.011 12.028 0.745 1.00 . A A . 10 LEU O 1 1 16 2980 1 1 12 ALA C C -0.554 14.246 3.902 1.00 . A A . 11 ALA C 1 1 16 2981 1 1 12 ALA CA C -1.101 13.643 2.605 1.00 . A A . 11 ALA CA 1 1 16 2982 1 1 12 ALA CB C -2.579 13.990 2.432 1.00 . A A . 11 ALA CB 1 1 16 2983 1 1 12 ALA H H -1.450 11.687 3.440 1.00 . A A . 11 ALA H 1 1 16 2984 1 1 12 ALA HA H -0.537 13.998 1.756 1.00 . A A . 11 ALA HA 1 1 16 2985 1 1 12 ALA HB1 H -3.112 13.125 2.066 1.00 . A A . 11 ALA HB1 1 1 16 2986 1 1 12 ALA HB2 H -2.992 14.292 3.384 1.00 . A A . 11 ALA HB2 1 1 16 2987 1 1 12 ALA HB3 H -2.678 14.800 1.725 1.00 . A A . 11 ALA HB3 1 1 16 2988 1 1 12 ALA N N -1.059 12.154 2.672 1.00 . A A . 11 ALA N 1 1 16 2989 1 1 12 ALA O O 0.033 13.557 4.712 1.00 . A A . 11 ALA O 1 1 16 2990 1 1 13 NH2 HN1 H -1.197 16.078 3.482 1.00 . A A . 12 NH2 HN1 1 1 16 2991 1 1 13 NH2 HN2 H -0.376 15.917 4.959 1.00 . A A . 12 NH2 HN2 1 1 16 2992 1 1 13 NH2 N N -0.723 15.519 4.133 1.00 . A A . 12 NH2 N 1 1 17 2993 1 1 2 ILE C C -1.949 -5.006 1.563 1.00 . A A . 1 ILE C 1 1 17 2994 1 1 2 ILE CA C -0.742 -5.260 2.470 1.00 . A A . 1 ILE CA 1 1 17 2995 1 1 2 ILE CB C 0.560 -4.705 1.864 1.00 . A A . 1 ILE CB 1 1 17 2996 1 1 2 ILE CD1 C 2.616 -3.394 2.459 1.00 . A A . 1 ILE CD1 1 1 17 2997 1 1 2 ILE CG1 C 1.443 -4.200 3.012 1.00 . A A . 1 ILE CG1 1 1 17 2998 1 1 2 ILE CG2 C 0.268 -3.551 0.879 1.00 . A A . 1 ILE CG2 1 1 17 2999 1 1 2 ILE H H 0.385 -7.096 2.524 1.00 . A A . 1 ILE H 1 1 17 3000 1 1 2 ILE HA H -0.901 -4.823 3.439 1.00 . A A . 1 ILE HA 1 1 17 3001 1 1 2 ILE HB H 1.072 -5.497 1.343 1.00 . A A . 1 ILE HB 1 1 17 3002 1 1 2 ILE HD11 H 2.692 -3.555 1.394 1.00 . A A . 1 ILE HD11 1 1 17 3003 1 1 2 ILE HD12 H 2.452 -2.344 2.654 1.00 . A A . 1 ILE HD12 1 1 17 3004 1 1 2 ILE HD13 H 3.528 -3.711 2.939 1.00 . A A . 1 ILE HD13 1 1 17 3005 1 1 2 ILE HG12 H 0.854 -3.572 3.667 1.00 . A A . 1 ILE HG12 1 1 17 3006 1 1 2 ILE HG13 H 1.822 -5.045 3.570 1.00 . A A . 1 ILE HG13 1 1 17 3007 1 1 2 ILE HG21 H -0.725 -3.161 1.058 1.00 . A A . 1 ILE HG21 1 1 17 3008 1 1 2 ILE HG22 H 0.984 -2.758 1.015 1.00 . A A . 1 ILE HG22 1 1 17 3009 1 1 2 ILE HG23 H 0.327 -3.918 -0.134 1.00 . A A . 1 ILE HG23 1 1 17 3010 1 1 2 ILE N N -0.519 -6.724 2.604 1.00 . A A . 1 ILE N 1 1 17 3011 1 1 2 ILE O O -3.034 -4.719 2.023 1.00 . A A . 1 ILE O 1 1 17 3012 1 1 3 ASP C C -3.396 -3.438 -0.526 1.00 . A A . 2 ASP C 1 1 17 3013 1 1 3 ASP CA C -2.861 -4.860 -0.683 1.00 . A A . 2 ASP CA 1 1 17 3014 1 1 3 ASP CB C -3.937 -5.886 -0.324 1.00 . A A . 2 ASP CB 1 1 17 3015 1 1 3 ASP CG C -5.058 -5.836 -1.364 1.00 . A A . 2 ASP CG 1 1 17 3016 1 1 3 ASP H H -0.861 -5.337 -0.053 1.00 . A A . 2 ASP H 1 1 17 3017 1 1 3 ASP HA H -2.525 -5.015 -1.694 1.00 . A A . 2 ASP HA 1 1 17 3018 1 1 3 ASP HB2 H -3.500 -6.874 -0.310 1.00 . A A . 2 ASP HB2 1 1 17 3019 1 1 3 ASP HB3 H -4.341 -5.657 0.650 1.00 . A A . 2 ASP HB3 1 1 17 3020 1 1 3 ASP N N -1.751 -5.104 0.279 1.00 . A A . 2 ASP N 1 1 17 3021 1 1 3 ASP O O -3.203 -2.592 -1.377 1.00 . A A . 2 ASP O 1 1 17 3022 1 1 3 ASP OD1 O -5.132 -4.851 -2.079 1.00 . A A . 2 ASP OD1 1 1 17 3023 1 1 3 ASP OD2 O -5.823 -6.785 -1.427 1.00 . A A . 2 ASP OD2 1 1 17 3024 1 1 4 TYR C C -3.568 -0.798 1.159 1.00 . A A . 3 TYR C 1 1 17 3025 1 1 4 TYR CA C -4.643 -1.809 0.746 1.00 . A A . 3 TYR CA 1 1 17 3026 1 1 4 TYR CB C -5.706 -1.967 1.831 1.00 . A A . 3 TYR CB 1 1 17 3027 1 1 4 TYR CD1 C -4.831 -3.623 3.517 1.00 . A A . 3 TYR CD1 1 1 17 3028 1 1 4 TYR CD2 C -4.704 -1.255 4.026 1.00 . A A . 3 TYR CD2 1 1 17 3029 1 1 4 TYR CE1 C -4.248 -3.918 4.753 1.00 . A A . 3 TYR CE1 1 1 17 3030 1 1 4 TYR CE2 C -4.127 -1.552 5.264 1.00 . A A . 3 TYR CE2 1 1 17 3031 1 1 4 TYR CG C -5.057 -2.290 3.153 1.00 . A A . 3 TYR CG 1 1 17 3032 1 1 4 TYR CZ C -3.899 -2.883 5.626 1.00 . A A . 3 TYR CZ 1 1 17 3033 1 1 4 TYR H H -4.235 -3.872 1.212 1.00 . A A . 3 TYR H 1 1 17 3034 1 1 4 TYR HA H -5.110 -1.479 -0.162 1.00 . A A . 3 TYR HA 1 1 17 3035 1 1 4 TYR HB2 H -6.263 -1.046 1.922 1.00 . A A . 3 TYR HB2 1 1 17 3036 1 1 4 TYR HB3 H -6.379 -2.767 1.559 1.00 . A A . 3 TYR HB3 1 1 17 3037 1 1 4 TYR HD1 H -5.102 -4.421 2.841 1.00 . A A . 3 TYR HD1 1 1 17 3038 1 1 4 TYR HD2 H -4.880 -0.227 3.745 1.00 . A A . 3 TYR HD2 1 1 17 3039 1 1 4 TYR HE1 H -4.071 -4.946 5.035 1.00 . A A . 3 TYR HE1 1 1 17 3040 1 1 4 TYR HE2 H -3.854 -0.753 5.939 1.00 . A A . 3 TYR HE2 1 1 17 3041 1 1 4 TYR HH H -3.774 -2.636 7.516 1.00 . A A . 3 TYR HH 1 1 17 3042 1 1 4 TYR N N -4.081 -3.171 0.545 1.00 . A A . 3 TYR N 1 1 17 3043 1 1 4 TYR O O -3.546 0.299 0.648 1.00 . A A . 3 TYR O 1 1 17 3044 1 1 4 TYR OH O -3.336 -3.175 6.853 1.00 . A A . 3 TYR OH 1 1 17 3045 1 1 5 TRP C C -1.247 0.759 1.385 1.00 . A A . 4 TRP C 1 1 17 3046 1 1 5 TRP CA C -1.621 -0.185 2.527 1.00 . A A . 4 TRP CA 1 1 17 3047 1 1 5 TRP CB C -0.399 -1.033 2.871 1.00 . A A . 4 TRP CB 1 1 17 3048 1 1 5 TRP CD1 C -1.426 -2.857 4.297 1.00 . A A . 4 TRP CD1 1 1 17 3049 1 1 5 TRP CD2 C 0.057 -1.607 5.420 1.00 . A A . 4 TRP CD2 1 1 17 3050 1 1 5 TRP CE2 C -0.414 -2.582 6.323 1.00 . A A . 4 TRP CE2 1 1 17 3051 1 1 5 TRP CE3 C 1.003 -0.683 5.877 1.00 . A A . 4 TRP CE3 1 1 17 3052 1 1 5 TRP CG C -0.598 -1.802 4.137 1.00 . A A . 4 TRP CG 1 1 17 3053 1 1 5 TRP CH2 C 0.984 -1.715 8.082 1.00 . A A . 4 TRP CH2 1 1 17 3054 1 1 5 TRP CZ2 C 0.040 -2.644 7.636 1.00 . A A . 4 TRP CZ2 1 1 17 3055 1 1 5 TRP CZ3 C 1.466 -0.735 7.202 1.00 . A A . 4 TRP CZ3 1 1 17 3056 1 1 5 TRP H H -2.742 -2.036 2.475 1.00 . A A . 4 TRP H 1 1 17 3057 1 1 5 TRP HA H -1.945 0.370 3.392 1.00 . A A . 4 TRP HA 1 1 17 3058 1 1 5 TRP HB2 H -0.211 -1.716 2.070 1.00 . A A . 4 TRP HB2 1 1 17 3059 1 1 5 TRP HB3 H 0.457 -0.382 2.986 1.00 . A A . 4 TRP HB3 1 1 17 3060 1 1 5 TRP HD1 H -2.061 -3.282 3.536 1.00 . A A . 4 TRP HD1 1 1 17 3061 1 1 5 TRP HE1 H -1.797 -4.090 5.960 1.00 . A A . 4 TRP HE1 1 1 17 3062 1 1 5 TRP HE3 H 1.375 0.070 5.203 1.00 . A A . 4 TRP HE3 1 1 17 3063 1 1 5 TRP HH2 H 1.342 -1.753 9.099 1.00 . A A . 4 TRP HH2 1 1 17 3064 1 1 5 TRP HZ2 H -0.336 -3.405 8.301 1.00 . A A . 4 TRP HZ2 1 1 17 3065 1 1 5 TRP HZ3 H 2.197 -0.016 7.545 1.00 . A A . 4 TRP HZ3 1 1 17 3066 1 1 5 TRP N N -2.692 -1.149 2.078 1.00 . A A . 4 TRP N 1 1 17 3067 1 1 5 TRP NE1 N -1.306 -3.329 5.589 1.00 . A A . 4 TRP NE1 1 1 17 3068 1 1 5 TRP O O -1.034 1.938 1.585 1.00 . A A . 4 TRP O 1 1 17 3069 1 1 6 LEU C C -1.427 2.462 -0.841 1.00 . A A . 5 LEU C 1 1 17 3070 1 1 6 LEU CA C -0.833 1.061 -1.001 1.00 . A A . 5 LEU CA 1 1 17 3071 1 1 6 LEU CB C -1.473 0.307 -2.168 1.00 . A A . 5 LEU CB 1 1 17 3072 1 1 6 LEU CD1 C -0.141 1.800 -3.665 1.00 . A A . 5 LEU CD1 1 1 17 3073 1 1 6 LEU CD2 C -1.934 0.335 -4.609 1.00 . A A . 5 LEU CD2 1 1 17 3074 1 1 6 LEU CG C -1.523 1.193 -3.410 1.00 . A A . 5 LEU CG 1 1 17 3075 1 1 6 LEU H H -1.361 -0.725 0.073 1.00 . A A . 5 LEU H 1 1 17 3076 1 1 6 LEU HA H 0.237 1.112 -1.133 1.00 . A A . 5 LEU HA 1 1 17 3077 1 1 6 LEU HB2 H -0.889 -0.576 -2.384 1.00 . A A . 5 LEU HB2 1 1 17 3078 1 1 6 LEU HB3 H -2.476 0.014 -1.898 1.00 . A A . 5 LEU HB3 1 1 17 3079 1 1 6 LEU HD11 H 0.621 1.084 -3.396 1.00 . A A . 5 LEU HD11 1 1 17 3080 1 1 6 LEU HD12 H -0.046 2.052 -4.711 1.00 . A A . 5 LEU HD12 1 1 17 3081 1 1 6 LEU HD13 H -0.024 2.692 -3.067 1.00 . A A . 5 LEU HD13 1 1 17 3082 1 1 6 LEU HD21 H -1.559 -0.670 -4.478 1.00 . A A . 5 LEU HD21 1 1 17 3083 1 1 6 LEU HD22 H -3.012 0.309 -4.680 1.00 . A A . 5 LEU HD22 1 1 17 3084 1 1 6 LEU HD23 H -1.523 0.757 -5.514 1.00 . A A . 5 LEU HD23 1 1 17 3085 1 1 6 LEU HG H -2.244 1.983 -3.263 1.00 . A A . 5 LEU HG 1 1 17 3086 1 1 6 LEU N N -1.177 0.230 0.189 1.00 . A A . 5 LEU N 1 1 17 3087 1 1 6 LEU O O -0.737 3.457 -0.944 1.00 . A A . 5 LEU O 1 1 17 3088 1 1 7 ALA C C -3.225 4.232 1.153 1.00 . A A . 6 ALA C 1 1 17 3089 1 1 7 ALA CA C -3.328 3.874 -0.336 1.00 . A A . 6 ALA CA 1 1 17 3090 1 1 7 ALA CB C -4.785 3.693 -0.766 1.00 . A A . 6 ALA CB 1 1 17 3091 1 1 7 ALA H H -3.225 1.726 -0.443 1.00 . A A . 6 ALA H 1 1 17 3092 1 1 7 ALA HA H -2.848 4.626 -0.944 1.00 . A A . 6 ALA HA 1 1 17 3093 1 1 7 ALA HB1 H -4.828 3.045 -1.628 1.00 . A A . 6 ALA HB1 1 1 17 3094 1 1 7 ALA HB2 H -5.348 3.252 0.044 1.00 . A A . 6 ALA HB2 1 1 17 3095 1 1 7 ALA HB3 H -5.209 4.654 -1.016 1.00 . A A . 6 ALA HB3 1 1 17 3096 1 1 7 ALA N N -2.694 2.543 -0.550 1.00 . A A . 6 ALA N 1 1 17 3097 1 1 7 ALA O O -2.162 4.153 1.735 1.00 . A A . 6 ALA O 1 1 17 3098 1 1 8 HIS C C -2.971 5.642 3.588 1.00 . A A . 7 HIS C 1 1 17 3099 1 1 8 HIS CA C -4.288 4.930 3.237 1.00 . A A . 7 HIS CA 1 1 17 3100 1 1 8 HIS CB C -4.401 3.577 3.968 1.00 . A A . 7 HIS CB 1 1 17 3101 1 1 8 HIS CD2 C -4.979 1.977 1.974 1.00 . A A . 7 HIS CD2 1 1 17 3102 1 1 8 HIS CE1 C -6.920 1.290 2.647 1.00 . A A . 7 HIS CE1 1 1 17 3103 1 1 8 HIS CG C -5.226 2.605 3.165 1.00 . A A . 7 HIS CG 1 1 17 3104 1 1 8 HIS H H -5.167 4.632 1.298 1.00 . A A . 7 HIS H 1 1 17 3105 1 1 8 HIS HA H -5.129 5.555 3.493 1.00 . A A . 7 HIS HA 1 1 17 3106 1 1 8 HIS HB2 H -3.414 3.161 4.105 1.00 . A A . 7 HIS HB2 1 1 17 3107 1 1 8 HIS HB3 H -4.862 3.728 4.933 1.00 . A A . 7 HIS HB3 1 1 17 3108 1 1 8 HIS HD1 H -6.940 2.416 4.401 1.00 . A A . 7 HIS HD1 1 1 17 3109 1 1 8 HIS HD2 H -4.088 2.103 1.382 1.00 . A A . 7 HIS HD2 1 1 17 3110 1 1 8 HIS HE1 H -7.863 0.770 2.700 1.00 . A A . 7 HIS HE1 1 1 17 3111 1 1 8 HIS HE2 H -6.139 0.585 0.856 1.00 . A A . 7 HIS HE2 1 1 17 3112 1 1 8 HIS N N -4.320 4.595 1.778 1.00 . A A . 7 HIS N 1 1 17 3113 1 1 8 HIS ND1 N -6.472 2.155 3.580 1.00 . A A . 7 HIS ND1 1 1 17 3114 1 1 8 HIS NE2 N -6.046 1.151 1.649 1.00 . A A . 7 HIS NE2 1 1 17 3115 1 1 8 HIS O O -2.597 6.611 2.956 1.00 . A A . 7 HIS O 1 1 17 3116 1 1 9 LYS C C -1.205 7.276 5.343 1.00 . A A . 8 LYS C 1 1 17 3117 1 1 9 LYS CA C -0.975 5.815 4.954 1.00 . A A . 8 LYS CA 1 1 17 3118 1 1 9 LYS CB C -0.111 5.721 3.696 1.00 . A A . 8 LYS CB 1 1 17 3119 1 1 9 LYS CD C 2.132 4.872 4.395 1.00 . A A . 8 LYS CD 1 1 17 3120 1 1 9 LYS CE C 3.077 3.670 4.354 1.00 . A A . 8 LYS CE 1 1 17 3121 1 1 9 LYS CG C 0.785 4.485 3.782 1.00 . A A . 8 LYS CG 1 1 17 3122 1 1 9 LYS H H -2.570 4.393 5.075 1.00 . A A . 8 LYS H 1 1 17 3123 1 1 9 LYS HA H -0.504 5.275 5.762 1.00 . A A . 8 LYS HA 1 1 17 3124 1 1 9 LYS HB2 H -0.748 5.645 2.827 1.00 . A A . 8 LYS HB2 1 1 17 3125 1 1 9 LYS HB3 H 0.502 6.603 3.617 1.00 . A A . 8 LYS HB3 1 1 17 3126 1 1 9 LYS HD2 H 2.562 5.688 3.832 1.00 . A A . 8 LYS HD2 1 1 17 3127 1 1 9 LYS HD3 H 1.986 5.178 5.420 1.00 . A A . 8 LYS HD3 1 1 17 3128 1 1 9 LYS HE2 H 2.772 2.929 5.080 1.00 . A A . 8 LYS HE2 1 1 17 3129 1 1 9 LYS HE3 H 3.100 3.241 3.364 1.00 . A A . 8 LYS HE3 1 1 17 3130 1 1 9 LYS HG2 H 0.308 3.737 4.400 1.00 . A A . 8 LYS HG2 1 1 17 3131 1 1 9 LYS HG3 H 0.944 4.086 2.791 1.00 . A A . 8 LYS HG3 1 1 17 3132 1 1 9 LYS HZ1 H 4.306 4.986 5.398 1.00 . A A . 8 LYS HZ1 1 1 17 3133 1 1 9 LYS HZ2 H 5.008 3.466 5.105 1.00 . A A . 8 LYS HZ2 1 1 17 3134 1 1 9 LYS HZ3 H 4.870 4.598 3.846 1.00 . A A . 8 LYS HZ3 1 1 17 3135 1 1 9 LYS N N -2.262 5.170 4.580 1.00 . A A . 8 LYS N 1 1 17 3136 1 1 9 LYS NZ N 4.416 4.221 4.702 1.00 . A A . 8 LYS NZ 1 1 17 3137 1 1 9 LYS O O -2.253 7.838 5.089 1.00 . A A . 8 LYS O 1 1 17 3138 1 1 10 ALA C C -0.543 10.209 5.121 1.00 . A A . 9 ALA C 1 1 17 3139 1 1 10 ALA CA C -0.398 9.322 6.361 1.00 . A A . 9 ALA CA 1 1 17 3140 1 1 10 ALA CB C 0.881 9.667 7.122 1.00 . A A . 9 ALA CB 1 1 17 3141 1 1 10 ALA H H 0.601 7.424 6.150 1.00 . A A . 9 ALA H 1 1 17 3142 1 1 10 ALA HA H -1.254 9.435 7.007 1.00 . A A . 9 ALA HA 1 1 17 3143 1 1 10 ALA HB1 H 1.509 8.791 7.186 1.00 . A A . 9 ALA HB1 1 1 17 3144 1 1 10 ALA HB2 H 1.410 10.452 6.600 1.00 . A A . 9 ALA HB2 1 1 17 3145 1 1 10 ALA HB3 H 0.629 10.003 8.117 1.00 . A A . 9 ALA HB3 1 1 17 3146 1 1 10 ALA N N -0.235 7.896 5.956 1.00 . A A . 9 ALA N 1 1 17 3147 1 1 10 ALA O O 0.330 10.991 4.799 1.00 . A A . 9 ALA O 1 1 17 3148 1 1 11 LEU C C -2.814 12.068 3.494 1.00 . A A . 10 LEU C 1 1 17 3149 1 1 11 LEU CA C -1.837 10.927 3.200 1.00 . A A . 10 LEU CA 1 1 17 3150 1 1 11 LEU CB C -2.423 9.972 2.160 1.00 . A A . 10 LEU CB 1 1 17 3151 1 1 11 LEU CD1 C -1.201 9.466 0.042 1.00 . A A . 10 LEU CD1 1 1 17 3152 1 1 11 LEU CD2 C -3.391 10.662 -0.036 1.00 . A A . 10 LEU CD2 1 1 17 3153 1 1 11 LEU CG C -2.094 10.480 0.756 1.00 . A A . 10 LEU CG 1 1 17 3154 1 1 11 LEU H H -2.329 9.454 4.696 1.00 . A A . 10 LEU H 1 1 17 3155 1 1 11 LEU HA H -0.894 11.316 2.853 1.00 . A A . 10 LEU HA 1 1 17 3156 1 1 11 LEU HB2 H -2.000 8.987 2.296 1.00 . A A . 10 LEU HB2 1 1 17 3157 1 1 11 LEU HB3 H -3.495 9.923 2.282 1.00 . A A . 10 LEU HB3 1 1 17 3158 1 1 11 LEU HD11 H -1.313 8.497 0.507 1.00 . A A . 10 LEU HD11 1 1 17 3159 1 1 11 LEU HD12 H -1.488 9.401 -0.998 1.00 . A A . 10 LEU HD12 1 1 17 3160 1 1 11 LEU HD13 H -0.170 9.781 0.111 1.00 . A A . 10 LEU HD13 1 1 17 3161 1 1 11 LEU HD21 H -4.063 11.303 0.517 1.00 . A A . 10 LEU HD21 1 1 17 3162 1 1 11 LEU HD22 H -3.169 11.113 -0.992 1.00 . A A . 10 LEU HD22 1 1 17 3163 1 1 11 LEU HD23 H -3.856 9.701 -0.190 1.00 . A A . 10 LEU HD23 1 1 17 3164 1 1 11 LEU HG H -1.577 11.427 0.828 1.00 . A A . 10 LEU HG 1 1 17 3165 1 1 11 LEU N N -1.638 10.092 4.420 1.00 . A A . 10 LEU N 1 1 17 3166 1 1 11 LEU O O -3.225 12.789 2.607 1.00 . A A . 10 LEU O 1 1 17 3167 1 1 12 ALA C C -3.970 13.732 6.549 1.00 . A A . 11 ALA C 1 1 17 3168 1 1 12 ALA CA C -4.138 13.333 5.081 1.00 . A A . 11 ALA CA 1 1 17 3169 1 1 12 ALA CB C -5.528 12.742 4.842 1.00 . A A . 11 ALA CB 1 1 17 3170 1 1 12 ALA H H -2.845 11.645 5.433 1.00 . A A . 11 ALA H 1 1 17 3171 1 1 12 ALA HA H -3.985 14.184 4.438 1.00 . A A . 11 ALA HA 1 1 17 3172 1 1 12 ALA HB1 H -5.503 11.678 5.025 1.00 . A A . 11 ALA HB1 1 1 17 3173 1 1 12 ALA HB2 H -6.236 13.206 5.512 1.00 . A A . 11 ALA HB2 1 1 17 3174 1 1 12 ALA HB3 H -5.826 12.924 3.820 1.00 . A A . 11 ALA HB3 1 1 17 3175 1 1 12 ALA N N -3.188 12.237 4.733 1.00 . A A . 11 ALA N 1 1 17 3176 1 1 12 ALA O O -3.955 12.892 7.426 1.00 . A A . 11 ALA O 1 1 17 3177 1 1 13 NH2 HN1 H -3.851 15.673 6.150 1.00 . A A . 12 NH2 HN1 1 1 17 3178 1 1 13 NH2 HN2 H -3.732 15.262 7.792 1.00 . A A . 12 NH2 HN2 1 1 17 3179 1 1 13 NH2 N N -3.840 14.994 6.856 1.00 . A A . 12 NH2 N 1 1 18 3180 1 1 2 ILE C C -2.020 -4.923 1.647 1.00 . A A . 1 ILE C 1 1 18 3181 1 1 2 ILE CA C -0.850 -5.170 2.602 1.00 . A A . 1 ILE CA 1 1 18 3182 1 1 2 ILE CB C 0.478 -4.661 2.019 1.00 . A A . 1 ILE CB 1 1 18 3183 1 1 2 ILE CD1 C 1.875 -5.373 3.965 1.00 . A A . 1 ILE CD1 1 1 18 3184 1 1 2 ILE CG1 C 1.365 -4.173 3.166 1.00 . A A . 1 ILE CG1 1 1 18 3185 1 1 2 ILE CG2 C 0.248 -3.496 1.038 1.00 . A A . 1 ILE CG2 1 1 18 3186 1 1 2 ILE H H 0.234 -7.026 2.739 1.00 . A A . 1 ILE H 1 1 18 3187 1 1 2 ILE HA H -1.033 -4.699 3.547 1.00 . A A . 1 ILE HA 1 1 18 3188 1 1 2 ILE HB H 0.972 -5.468 1.505 1.00 . A A . 1 ILE HB 1 1 18 3189 1 1 2 ILE HD11 H 1.979 -6.224 3.309 1.00 . A A . 1 ILE HD11 1 1 18 3190 1 1 2 ILE HD12 H 2.834 -5.134 4.399 1.00 . A A . 1 ILE HD12 1 1 18 3191 1 1 2 ILE HD13 H 1.171 -5.607 4.750 1.00 . A A . 1 ILE HD13 1 1 18 3192 1 1 2 ILE HG12 H 2.204 -3.623 2.763 1.00 . A A . 1 ILE HG12 1 1 18 3193 1 1 2 ILE HG13 H 0.790 -3.529 3.816 1.00 . A A . 1 ILE HG13 1 1 18 3194 1 1 2 ILE HG21 H -0.742 -3.087 1.184 1.00 . A A . 1 ILE HG21 1 1 18 3195 1 1 2 ILE HG22 H 0.981 -2.725 1.214 1.00 . A A . 1 ILE HG22 1 1 18 3196 1 1 2 ILE HG23 H 0.338 -3.855 0.023 1.00 . A A . 1 ILE HG23 1 1 18 3197 1 1 2 ILE N N -0.662 -6.633 2.791 1.00 . A A . 1 ILE N 1 1 18 3198 1 1 2 ILE O O -3.121 -4.631 2.064 1.00 . A A . 1 ILE O 1 1 18 3199 1 1 3 ASP C C -3.363 -3.356 -0.512 1.00 . A A . 2 ASP C 1 1 18 3200 1 1 3 ASP CA C -2.852 -4.792 -0.627 1.00 . A A . 2 ASP CA 1 1 18 3201 1 1 3 ASP CB C -3.955 -5.790 -0.276 1.00 . A A . 2 ASP CB 1 1 18 3202 1 1 3 ASP CG C -4.578 -6.334 -1.563 1.00 . A A . 2 ASP CG 1 1 18 3203 1 1 3 ASP H H -0.876 -5.267 0.074 1.00 . A A . 2 ASP H 1 1 18 3204 1 1 3 ASP HA H -2.488 -4.975 -1.624 1.00 . A A . 2 ASP HA 1 1 18 3205 1 1 3 ASP HB2 H -3.535 -6.605 0.294 1.00 . A A . 2 ASP HB2 1 1 18 3206 1 1 3 ASP HB3 H -4.716 -5.295 0.309 1.00 . A A . 2 ASP HB3 1 1 18 3207 1 1 3 ASP N N -1.776 -5.032 0.373 1.00 . A A . 2 ASP N 1 1 18 3208 1 1 3 ASP O O -3.138 -2.534 -1.378 1.00 . A A . 2 ASP O 1 1 18 3209 1 1 3 ASP OD1 O -4.822 -5.544 -2.460 1.00 . A A . 2 ASP OD1 1 1 18 3210 1 1 3 ASP OD2 O -4.803 -7.532 -1.629 1.00 . A A . 2 ASP OD2 1 1 18 3211 1 1 4 TYR C C -3.500 -0.677 1.122 1.00 . A A . 3 TYR C 1 1 18 3212 1 1 4 TYR CA C -4.597 -1.677 0.709 1.00 . A A . 3 TYR CA 1 1 18 3213 1 1 4 TYR CB C -5.700 -1.800 1.767 1.00 . A A . 3 TYR CB 1 1 18 3214 1 1 4 TYR CD1 C -4.853 -3.402 3.516 1.00 . A A . 3 TYR CD1 1 1 18 3215 1 1 4 TYR CD2 C -4.814 -1.024 3.986 1.00 . A A . 3 TYR CD2 1 1 18 3216 1 1 4 TYR CE1 C -4.307 -3.659 4.777 1.00 . A A . 3 TYR CE1 1 1 18 3217 1 1 4 TYR CE2 C -4.270 -1.281 5.247 1.00 . A A . 3 TYR CE2 1 1 18 3218 1 1 4 TYR CG C -5.106 -2.084 3.121 1.00 . A A . 3 TYR CG 1 1 18 3219 1 1 4 TYR CZ C -4.016 -2.598 5.641 1.00 . A A . 3 TYR CZ 1 1 18 3220 1 1 4 TYR H H -4.234 -3.735 1.224 1.00 . A A . 3 TYR H 1 1 18 3221 1 1 4 TYR HA H -5.034 -1.353 -0.217 1.00 . A A . 3 TYR HA 1 1 18 3222 1 1 4 TYR HB2 H -6.258 -0.879 1.810 1.00 . A A . 3 TYR HB2 1 1 18 3223 1 1 4 TYR HB3 H -6.366 -2.605 1.494 1.00 . A A . 3 TYR HB3 1 1 18 3224 1 1 4 TYR HD1 H -5.079 -4.219 2.846 1.00 . A A . 3 TYR HD1 1 1 18 3225 1 1 4 TYR HD2 H -5.011 -0.008 3.680 1.00 . A A . 3 TYR HD2 1 1 18 3226 1 1 4 TYR HE1 H -4.110 -4.675 5.083 1.00 . A A . 3 TYR HE1 1 1 18 3227 1 1 4 TYR HE2 H -4.045 -0.463 5.916 1.00 . A A . 3 TYR HE2 1 1 18 3228 1 1 4 TYR HH H -4.100 -3.408 7.368 1.00 . A A . 3 TYR HH 1 1 18 3229 1 1 4 TYR N N -4.059 -3.053 0.544 1.00 . A A . 3 TYR N 1 1 18 3230 1 1 4 TYR O O -3.341 0.331 0.476 1.00 . A A . 3 TYR O 1 1 18 3231 1 1 4 TYR OH O -3.483 -2.852 6.889 1.00 . A A . 3 TYR OH 1 1 18 3232 1 1 5 TRP C C -1.289 0.996 1.568 1.00 . A A . 4 TRP C 1 1 18 3233 1 1 5 TRP CA C -1.669 -0.013 2.653 1.00 . A A . 4 TRP CA 1 1 18 3234 1 1 5 TRP CB C -0.458 -0.902 2.947 1.00 . A A . 4 TRP CB 1 1 18 3235 1 1 5 TRP CD1 C -1.533 -2.689 4.383 1.00 . A A . 4 TRP CD1 1 1 18 3236 1 1 5 TRP CD2 C 0.054 -1.542 5.474 1.00 . A A . 4 TRP CD2 1 1 18 3237 1 1 5 TRP CE2 C -0.455 -2.493 6.386 1.00 . A A . 4 TRP CE2 1 1 18 3238 1 1 5 TRP CE3 C 1.071 -0.684 5.912 1.00 . A A . 4 TRP CE3 1 1 18 3239 1 1 5 TRP CG C -0.653 -1.680 4.211 1.00 . A A . 4 TRP CG 1 1 18 3240 1 1 5 TRP CH2 C 1.046 -1.732 8.110 1.00 . A A . 4 TRP CH2 1 1 18 3241 1 1 5 TRP CZ2 C 0.031 -2.593 7.686 1.00 . A A . 4 TRP CZ2 1 1 18 3242 1 1 5 TRP CZ3 C 1.568 -0.779 7.222 1.00 . A A . 4 TRP CZ3 1 1 18 3243 1 1 5 TRP H H -2.917 -1.775 2.669 1.00 . A A . 4 TRP H 1 1 18 3244 1 1 5 TRP HA H -1.974 0.497 3.552 1.00 . A A . 4 TRP HA 1 1 18 3245 1 1 5 TRP HB2 H -0.316 -1.582 2.130 1.00 . A A . 4 TRP HB2 1 1 18 3246 1 1 5 TRP HB3 H 0.420 -0.281 3.044 1.00 . A A . 4 TRP HB3 1 1 18 3247 1 1 5 TRP HD1 H -2.211 -3.069 3.638 1.00 . A A . 4 TRP HD1 1 1 18 3248 1 1 5 TRP HE1 H -1.947 -3.903 6.052 1.00 . A A . 4 TRP HE1 1 1 18 3249 1 1 5 TRP HE3 H 1.477 0.046 5.233 1.00 . A A . 4 TRP HE3 1 1 18 3250 1 1 5 TRP HH2 H 1.430 -1.801 9.116 1.00 . A A . 4 TRP HH2 1 1 18 3251 1 1 5 TRP HZ2 H -0.374 -3.331 8.362 1.00 . A A . 4 TRP HZ2 1 1 18 3252 1 1 5 TRP HZ3 H 2.353 -0.113 7.549 1.00 . A A . 4 TRP HZ3 1 1 18 3253 1 1 5 TRP N N -2.758 -0.952 2.181 1.00 . A A . 4 TRP N 1 1 18 3254 1 1 5 TRP NE1 N -1.416 -3.172 5.672 1.00 . A A . 4 TRP NE1 1 1 18 3255 1 1 5 TRP O O -1.320 2.193 1.771 1.00 . A A . 4 TRP O 1 1 18 3256 1 1 6 LEU C C -1.401 2.663 -0.740 1.00 . A A . 5 LEU C 1 1 18 3257 1 1 6 LEU CA C -0.545 1.386 -0.719 1.00 . A A . 5 LEU CA 1 1 18 3258 1 1 6 LEU CB C -0.802 0.514 -1.953 1.00 . A A . 5 LEU CB 1 1 18 3259 1 1 6 LEU CD1 C 0.249 2.055 -3.617 1.00 . A A . 5 LEU CD1 1 1 18 3260 1 1 6 LEU CD2 C -1.558 0.476 -4.322 1.00 . A A . 5 LEU CD2 1 1 18 3261 1 1 6 LEU CG C -1.054 1.375 -3.190 1.00 . A A . 5 LEU CG 1 1 18 3262 1 1 6 LEU H H -0.922 -0.470 0.292 1.00 . A A . 5 LEU H 1 1 18 3263 1 1 6 LEU HA H 0.502 1.636 -0.660 1.00 . A A . 5 LEU HA 1 1 18 3264 1 1 6 LEU HB2 H 0.056 -0.117 -2.128 1.00 . A A . 5 LEU HB2 1 1 18 3265 1 1 6 LEU HB3 H -1.667 -0.108 -1.772 1.00 . A A . 5 LEU HB3 1 1 18 3266 1 1 6 LEU HD11 H 1.063 1.349 -3.546 1.00 . A A . 5 LEU HD11 1 1 18 3267 1 1 6 LEU HD12 H 0.158 2.398 -4.638 1.00 . A A . 5 LEU HD12 1 1 18 3268 1 1 6 LEU HD13 H 0.444 2.897 -2.970 1.00 . A A . 5 LEU HD13 1 1 18 3269 1 1 6 LEU HD21 H -1.002 -0.452 -4.318 1.00 . A A . 5 LEU HD21 1 1 18 3270 1 1 6 LEU HD22 H -2.608 0.266 -4.176 1.00 . A A . 5 LEU HD22 1 1 18 3271 1 1 6 LEU HD23 H -1.418 0.974 -5.269 1.00 . A A . 5 LEU HD23 1 1 18 3272 1 1 6 LEU HG H -1.798 2.125 -2.966 1.00 . A A . 5 LEU HG 1 1 18 3273 1 1 6 LEU N N -0.932 0.502 0.415 1.00 . A A . 5 LEU N 1 1 18 3274 1 1 6 LEU O O -0.886 3.762 -0.787 1.00 . A A . 5 LEU O 1 1 18 3275 1 1 7 ALA C C -3.886 4.230 0.673 1.00 . A A . 6 ALA C 1 1 18 3276 1 1 7 ALA CA C -3.577 3.738 -0.746 1.00 . A A . 6 ALA CA 1 1 18 3277 1 1 7 ALA CB C -4.861 3.271 -1.433 1.00 . A A . 6 ALA CB 1 1 18 3278 1 1 7 ALA H H -3.098 1.633 -0.686 1.00 . A A . 6 ALA H 1 1 18 3279 1 1 7 ALA HA H -3.117 4.523 -1.325 1.00 . A A . 6 ALA HA 1 1 18 3280 1 1 7 ALA HB1 H -5.286 2.448 -0.878 1.00 . A A . 6 ALA HB1 1 1 18 3281 1 1 7 ALA HB2 H -5.568 4.086 -1.467 1.00 . A A . 6 ALA HB2 1 1 18 3282 1 1 7 ALA HB3 H -4.635 2.949 -2.439 1.00 . A A . 6 ALA HB3 1 1 18 3283 1 1 7 ALA N N -2.699 2.528 -0.717 1.00 . A A . 6 ALA N 1 1 18 3284 1 1 7 ALA O O -4.711 5.101 0.868 1.00 . A A . 6 ALA O 1 1 18 3285 1 1 8 HIS C C -2.248 4.615 3.732 1.00 . A A . 7 HIS C 1 1 18 3286 1 1 8 HIS CA C -3.534 4.107 3.064 1.00 . A A . 7 HIS CA 1 1 18 3287 1 1 8 HIS CB C -4.073 2.853 3.766 1.00 . A A . 7 HIS CB 1 1 18 3288 1 1 8 HIS CD2 C -5.145 1.833 1.587 1.00 . A A . 7 HIS CD2 1 1 18 3289 1 1 8 HIS CE1 C -7.052 1.235 2.411 1.00 . A A . 7 HIS CE1 1 1 18 3290 1 1 8 HIS CG C -5.128 2.193 2.912 1.00 . A A . 7 HIS CG 1 1 18 3291 1 1 8 HIS H H -2.597 2.962 1.495 1.00 . A A . 7 HIS H 1 1 18 3292 1 1 8 HIS HA H -4.287 4.881 3.068 1.00 . A A . 7 HIS HA 1 1 18 3293 1 1 8 HIS HB2 H -3.262 2.160 3.932 1.00 . A A . 7 HIS HB2 1 1 18 3294 1 1 8 HIS HB3 H -4.505 3.133 4.715 1.00 . A A . 7 HIS HB3 1 1 18 3295 1 1 8 HIS HD1 H -6.668 1.915 4.343 1.00 . A A . 7 HIS HD1 1 1 18 3296 1 1 8 HIS HD2 H -4.340 1.983 0.896 1.00 . A A . 7 HIS HD2 1 1 18 3297 1 1 8 HIS HE1 H -8.039 0.818 2.509 1.00 . A A . 7 HIS HE1 1 1 18 3298 1 1 8 HIS HE2 H -6.638 0.883 0.409 1.00 . A A . 7 HIS HE2 1 1 18 3299 1 1 8 HIS N N -3.250 3.673 1.666 1.00 . A A . 7 HIS N 1 1 18 3300 1 1 8 HIS ND1 N -6.359 1.801 3.420 1.00 . A A . 7 HIS ND1 1 1 18 3301 1 1 8 HIS NE2 N -6.355 1.234 1.278 1.00 . A A . 7 HIS NE2 1 1 18 3302 1 1 8 HIS O O -1.663 5.587 3.299 1.00 . A A . 7 HIS O 1 1 18 3303 1 1 9 LYS C C -0.789 5.807 6.095 1.00 . A A . 8 LYS C 1 1 18 3304 1 1 9 LYS CA C -0.560 4.434 5.465 1.00 . A A . 8 LYS CA 1 1 18 3305 1 1 9 LYS CB C 0.502 4.513 4.364 1.00 . A A . 8 LYS CB 1 1 18 3306 1 1 9 LYS CD C 1.746 2.604 3.335 1.00 . A A . 8 LYS CD 1 1 18 3307 1 1 9 LYS CE C 2.271 2.729 1.903 1.00 . A A . 8 LYS CE 1 1 18 3308 1 1 9 LYS CG C 0.386 3.296 3.443 1.00 . A A . 8 LYS CG 1 1 18 3309 1 1 9 LYS H H -2.277 3.200 5.128 1.00 . A A . 8 LYS H 1 1 18 3310 1 1 9 LYS HA H -0.258 3.722 6.216 1.00 . A A . 8 LYS HA 1 1 18 3311 1 1 9 LYS HB2 H 0.359 5.416 3.790 1.00 . A A . 8 LYS HB2 1 1 18 3312 1 1 9 LYS HB3 H 1.484 4.527 4.814 1.00 . A A . 8 LYS HB3 1 1 18 3313 1 1 9 LYS HD2 H 2.441 3.070 4.017 1.00 . A A . 8 LYS HD2 1 1 18 3314 1 1 9 LYS HD3 H 1.639 1.560 3.587 1.00 . A A . 8 LYS HD3 1 1 18 3315 1 1 9 LYS HE2 H 1.987 1.862 1.323 1.00 . A A . 8 LYS HE2 1 1 18 3316 1 1 9 LYS HE3 H 1.897 3.631 1.443 1.00 . A A . 8 LYS HE3 1 1 18 3317 1 1 9 LYS HG2 H -0.340 2.606 3.849 1.00 . A A . 8 LYS HG2 1 1 18 3318 1 1 9 LYS HG3 H 0.068 3.616 2.461 1.00 . A A . 8 LYS HG3 1 1 18 3319 1 1 9 LYS HZ1 H 3.994 3.242 2.953 1.00 . A A . 8 LYS HZ1 1 1 18 3320 1 1 9 LYS HZ2 H 4.152 1.843 2.006 1.00 . A A . 8 LYS HZ2 1 1 18 3321 1 1 9 LYS HZ3 H 4.144 3.372 1.265 1.00 . A A . 8 LYS HZ3 1 1 18 3322 1 1 9 LYS N N -1.801 3.975 4.784 1.00 . A A . 8 LYS N 1 1 18 3323 1 1 9 LYS NZ N 3.751 2.802 2.042 1.00 . A A . 8 LYS NZ 1 1 18 3324 1 1 9 LYS O O -1.852 6.101 6.605 1.00 . A A . 8 LYS O 1 1 18 3325 1 1 10 ALA C C -1.119 8.743 6.004 1.00 . A A . 9 ALA C 1 1 18 3326 1 1 10 ALA CA C 0.054 8.006 6.656 1.00 . A A . 9 ALA CA 1 1 18 3327 1 1 10 ALA CB C 1.372 8.717 6.351 1.00 . A A . 9 ALA CB 1 1 18 3328 1 1 10 ALA H H 1.045 6.381 5.644 1.00 . A A . 9 ALA H 1 1 18 3329 1 1 10 ALA HA H -0.090 7.937 7.723 1.00 . A A . 9 ALA HA 1 1 18 3330 1 1 10 ALA HB1 H 1.935 8.139 5.634 1.00 . A A . 9 ALA HB1 1 1 18 3331 1 1 10 ALA HB2 H 1.167 9.696 5.944 1.00 . A A . 9 ALA HB2 1 1 18 3332 1 1 10 ALA HB3 H 1.946 8.819 7.261 1.00 . A A . 9 ALA HB3 1 1 18 3333 1 1 10 ALA N N 0.202 6.646 6.062 1.00 . A A . 9 ALA N 1 1 18 3334 1 1 10 ALA O O -1.737 9.600 6.605 1.00 . A A . 9 ALA O 1 1 18 3335 1 1 11 LEU C C -3.895 8.511 4.551 1.00 . A A . 10 LEU C 1 1 18 3336 1 1 11 LEU CA C -2.561 9.102 4.090 1.00 . A A . 10 LEU CA 1 1 18 3337 1 1 11 LEU CB C -2.340 8.830 2.602 1.00 . A A . 10 LEU CB 1 1 18 3338 1 1 11 LEU CD1 C -0.089 8.438 1.590 1.00 . A A . 10 LEU CD1 1 1 18 3339 1 1 11 LEU CD2 C -1.351 10.527 1.059 1.00 . A A . 10 LEU CD2 1 1 18 3340 1 1 11 LEU CG C -1.041 9.497 2.148 1.00 . A A . 10 LEU CG 1 1 18 3341 1 1 11 LEU H H -0.918 7.725 4.312 1.00 . A A . 10 LEU H 1 1 18 3342 1 1 11 LEU HA H -2.531 10.163 4.278 1.00 . A A . 10 LEU HA 1 1 18 3343 1 1 11 LEU HB2 H -2.274 7.764 2.437 1.00 . A A . 10 LEU HB2 1 1 18 3344 1 1 11 LEU HB3 H -3.165 9.233 2.035 1.00 . A A . 10 LEU HB3 1 1 18 3345 1 1 11 LEU HD11 H -0.613 7.498 1.493 1.00 . A A . 10 LEU HD11 1 1 18 3346 1 1 11 LEU HD12 H 0.270 8.750 0.619 1.00 . A A . 10 LEU HD12 1 1 18 3347 1 1 11 LEU HD13 H 0.748 8.316 2.260 1.00 . A A . 10 LEU HD13 1 1 18 3348 1 1 11 LEU HD21 H -2.373 10.406 0.729 1.00 . A A . 10 LEU HD21 1 1 18 3349 1 1 11 LEU HD22 H -1.216 11.522 1.455 1.00 . A A . 10 LEU HD22 1 1 18 3350 1 1 11 LEU HD23 H -0.683 10.379 0.223 1.00 . A A . 10 LEU HD23 1 1 18 3351 1 1 11 LEU HG H -0.575 9.990 2.990 1.00 . A A . 10 LEU HG 1 1 18 3352 1 1 11 LEU N N -1.429 8.418 4.779 1.00 . A A . 10 LEU N 1 1 18 3353 1 1 11 LEU O O -4.925 9.154 4.484 1.00 . A A . 10 LEU O 1 1 18 3354 1 1 12 ALA C C -6.143 6.541 4.320 1.00 . A A . 11 ALA C 1 1 18 3355 1 1 12 ALA CA C -5.156 6.664 5.484 1.00 . A A . 11 ALA CA 1 1 18 3356 1 1 12 ALA CB C -5.701 7.613 6.552 1.00 . A A . 11 ALA CB 1 1 18 3357 1 1 12 ALA H H -3.045 6.793 5.065 1.00 . A A . 11 ALA H 1 1 18 3358 1 1 12 ALA HA H -4.960 5.696 5.918 1.00 . A A . 11 ALA HA 1 1 18 3359 1 1 12 ALA HB1 H -4.959 8.366 6.777 1.00 . A A . 11 ALA HB1 1 1 18 3360 1 1 12 ALA HB2 H -6.598 8.091 6.185 1.00 . A A . 11 ALA HB2 1 1 18 3361 1 1 12 ALA HB3 H -5.931 7.055 7.447 1.00 . A A . 11 ALA HB3 1 1 18 3362 1 1 12 ALA N N -3.887 7.294 5.019 1.00 . A A . 11 ALA N 1 1 18 3363 1 1 12 ALA O O -6.691 7.523 3.861 1.00 . A A . 11 ALA O 1 1 18 3364 1 1 13 NH2 HN1 H -5.953 4.569 4.187 1.00 . A A . 12 NH2 HN1 1 1 18 3365 1 1 13 NH2 HN2 H -7.024 5.272 3.073 1.00 . A A . 12 NH2 HN2 1 1 18 3366 1 1 13 NH2 N N -6.394 5.363 3.818 1.00 . A A . 12 NH2 N 1 1 19 3367 1 1 2 ILE C C -1.983 -5.072 1.609 1.00 . A A . 1 ILE C 1 1 19 3368 1 1 2 ILE CA C -0.813 -5.286 2.572 1.00 . A A . 1 ILE CA 1 1 19 3369 1 1 2 ILE CB C 0.496 -4.862 1.906 1.00 . A A . 1 ILE CB 1 1 19 3370 1 1 2 ILE CD1 C 1.325 -3.436 3.796 1.00 . A A . 1 ILE CD1 1 1 19 3371 1 1 2 ILE CG1 C 1.584 -4.698 2.972 1.00 . A A . 1 ILE CG1 1 1 19 3372 1 1 2 ILE CG2 C 0.290 -3.538 1.155 1.00 . A A . 1 ILE CG2 1 1 19 3373 1 1 2 ILE H H 0.244 -7.139 2.880 1.00 . A A . 1 ILE H 1 1 19 3374 1 1 2 ILE HA H -0.957 -4.732 3.482 1.00 . A A . 1 ILE HA 1 1 19 3375 1 1 2 ILE HB H 0.793 -5.624 1.205 1.00 . A A . 1 ILE HB 1 1 19 3376 1 1 2 ILE HD11 H 1.080 -2.616 3.138 1.00 . A A . 1 ILE HD11 1 1 19 3377 1 1 2 ILE HD12 H 0.502 -3.612 4.473 1.00 . A A . 1 ILE HD12 1 1 19 3378 1 1 2 ILE HD13 H 2.210 -3.189 4.364 1.00 . A A . 1 ILE HD13 1 1 19 3379 1 1 2 ILE HG12 H 1.575 -5.559 3.626 1.00 . A A . 1 ILE HG12 1 1 19 3380 1 1 2 ILE HG13 H 2.550 -4.619 2.492 1.00 . A A . 1 ILE HG13 1 1 19 3381 1 1 2 ILE HG21 H -0.720 -3.183 1.314 1.00 . A A . 1 ILE HG21 1 1 19 3382 1 1 2 ILE HG22 H 0.988 -2.801 1.521 1.00 . A A . 1 ILE HG22 1 1 19 3383 1 1 2 ILE HG23 H 0.450 -3.694 0.098 1.00 . A A . 1 ILE HG23 1 1 19 3384 1 1 2 ILE N N -0.650 -6.738 2.865 1.00 . A A . 1 ILE N 1 1 19 3385 1 1 2 ILE O O -3.110 -4.865 2.011 1.00 . A A . 1 ILE O 1 1 19 3386 1 1 3 ASP C C -3.330 -3.480 -0.565 1.00 . A A . 2 ASP C 1 1 19 3387 1 1 3 ASP CA C -2.775 -4.897 -0.677 1.00 . A A . 2 ASP CA 1 1 19 3388 1 1 3 ASP CB C -3.851 -5.933 -0.347 1.00 . A A . 2 ASP CB 1 1 19 3389 1 1 3 ASP CG C -4.579 -6.338 -1.631 1.00 . A A . 2 ASP CG 1 1 19 3390 1 1 3 ASP H H -0.787 -5.271 0.042 1.00 . A A . 2 ASP H 1 1 19 3391 1 1 3 ASP HA H -2.392 -5.065 -1.669 1.00 . A A . 2 ASP HA 1 1 19 3392 1 1 3 ASP HB2 H -3.390 -6.802 0.095 1.00 . A A . 2 ASP HB2 1 1 19 3393 1 1 3 ASP HB3 H -4.560 -5.508 0.346 1.00 . A A . 2 ASP HB3 1 1 19 3394 1 1 3 ASP N N -1.706 -5.109 0.335 1.00 . A A . 2 ASP N 1 1 19 3395 1 1 3 ASP O O -3.122 -2.653 -1.431 1.00 . A A . 2 ASP O 1 1 19 3396 1 1 3 ASP OD1 O -5.022 -5.452 -2.342 1.00 . A A . 2 ASP OD1 1 1 19 3397 1 1 3 ASP OD2 O -4.680 -7.527 -1.880 1.00 . A A . 2 ASP OD2 1 1 19 3398 1 1 4 TYR C C -3.560 -0.799 1.041 1.00 . A A . 3 TYR C 1 1 19 3399 1 1 4 TYR CA C -4.621 -1.828 0.622 1.00 . A A . 3 TYR CA 1 1 19 3400 1 1 4 TYR CB C -5.759 -1.946 1.650 1.00 . A A . 3 TYR CB 1 1 19 3401 1 1 4 TYR CD1 C -5.050 -3.703 3.309 1.00 . A A . 3 TYR CD1 1 1 19 3402 1 1 4 TYR CD2 C -4.908 -1.368 3.947 1.00 . A A . 3 TYR CD2 1 1 19 3403 1 1 4 TYR CE1 C -4.558 -4.076 4.563 1.00 . A A . 3 TYR CE1 1 1 19 3404 1 1 4 TYR CE2 C -4.416 -1.742 5.200 1.00 . A A . 3 TYR CE2 1 1 19 3405 1 1 4 TYR CG C -5.224 -2.350 3.000 1.00 . A A . 3 TYR CG 1 1 19 3406 1 1 4 TYR CZ C -4.241 -3.095 5.508 1.00 . A A . 3 TYR CZ 1 1 19 3407 1 1 4 TYR H H -4.211 -3.875 1.162 1.00 . A A . 3 TYR H 1 1 19 3408 1 1 4 TYR HA H -5.033 -1.528 -0.321 1.00 . A A . 3 TYR HA 1 1 19 3409 1 1 4 TYR HB2 H -6.261 -0.995 1.738 1.00 . A A . 3 TYR HB2 1 1 19 3410 1 1 4 TYR HB3 H -6.466 -2.689 1.311 1.00 . A A . 3 TYR HB3 1 1 19 3411 1 1 4 TYR HD1 H -5.295 -4.460 2.578 1.00 . A A . 3 TYR HD1 1 1 19 3412 1 1 4 TYR HD2 H -5.043 -0.324 3.709 1.00 . A A . 3 TYR HD2 1 1 19 3413 1 1 4 TYR HE1 H -4.423 -5.120 4.802 1.00 . A A . 3 TYR HE1 1 1 19 3414 1 1 4 TYR HE2 H -4.170 -0.985 5.931 1.00 . A A . 3 TYR HE2 1 1 19 3415 1 1 4 TYR HH H -4.126 -4.322 6.965 1.00 . A A . 3 TYR HH 1 1 19 3416 1 1 4 TYR N N -4.046 -3.195 0.481 1.00 . A A . 3 TYR N 1 1 19 3417 1 1 4 TYR O O -3.384 0.182 0.357 1.00 . A A . 3 TYR O 1 1 19 3418 1 1 4 TYR OH O -3.757 -3.463 6.747 1.00 . A A . 3 TYR OH 1 1 19 3419 1 1 5 TRP C C -1.411 0.951 1.557 1.00 . A A . 4 TRP C 1 1 19 3420 1 1 5 TRP CA C -1.813 -0.058 2.637 1.00 . A A . 4 TRP CA 1 1 19 3421 1 1 5 TRP CB C -0.600 -0.923 2.978 1.00 . A A . 4 TRP CB 1 1 19 3422 1 1 5 TRP CD1 C -1.680 -2.775 4.330 1.00 . A A . 4 TRP CD1 1 1 19 3423 1 1 5 TRP CD2 C -0.229 -1.555 5.531 1.00 . A A . 4 TRP CD2 1 1 19 3424 1 1 5 TRP CE2 C -0.743 -2.543 6.399 1.00 . A A . 4 TRP CE2 1 1 19 3425 1 1 5 TRP CE3 C 0.711 -0.650 6.042 1.00 . A A . 4 TRP CE3 1 1 19 3426 1 1 5 TRP CG C -0.842 -1.719 4.222 1.00 . A A . 4 TRP CG 1 1 19 3427 1 1 5 TRP CH2 C 0.598 -1.723 8.225 1.00 . A A . 4 TRP CH2 1 1 19 3428 1 1 5 TRP CZ2 C -0.339 -2.632 7.728 1.00 . A A . 4 TRP CZ2 1 1 19 3429 1 1 5 TRP CZ3 C 1.124 -0.732 7.383 1.00 . A A . 4 TRP CZ3 1 1 19 3430 1 1 5 TRP H H -3.042 -1.829 2.657 1.00 . A A . 4 TRP H 1 1 19 3431 1 1 5 TRP HA H -2.154 0.455 3.522 1.00 . A A . 4 TRP HA 1 1 19 3432 1 1 5 TRP HB2 H -0.403 -1.591 2.161 1.00 . A A . 4 TRP HB2 1 1 19 3433 1 1 5 TRP HB3 H 0.258 -0.285 3.126 1.00 . A A . 4 TRP HB3 1 1 19 3434 1 1 5 TRP HD1 H -2.287 -3.182 3.538 1.00 . A A . 4 TRP HD1 1 1 19 3435 1 1 5 TRP HE1 H -2.130 -4.028 5.960 1.00 . A A . 4 TRP HE1 1 1 19 3436 1 1 5 TRP HE3 H 1.120 0.111 5.398 1.00 . A A . 4 TRP HE3 1 1 19 3437 1 1 5 TRP HH2 H 0.917 -1.782 9.254 1.00 . A A . 4 TRP HH2 1 1 19 3438 1 1 5 TRP HZ2 H -0.748 -3.399 8.367 1.00 . A A . 4 TRP HZ2 1 1 19 3439 1 1 5 TRP HZ3 H 1.848 -0.029 7.767 1.00 . A A . 4 TRP HZ3 1 1 19 3440 1 1 5 TRP N N -2.868 -1.022 2.144 1.00 . A A . 4 TRP N 1 1 19 3441 1 1 5 TRP NE1 N -1.616 -3.266 5.620 1.00 . A A . 4 TRP NE1 1 1 19 3442 1 1 5 TRP O O -1.478 2.147 1.749 1.00 . A A . 4 TRP O 1 1 19 3443 1 1 6 LEU C C -1.442 2.609 -0.759 1.00 . A A . 5 LEU C 1 1 19 3444 1 1 6 LEU CA C -0.574 1.341 -0.695 1.00 . A A . 5 LEU CA 1 1 19 3445 1 1 6 LEU CB C -0.776 0.459 -1.934 1.00 . A A . 5 LEU CB 1 1 19 3446 1 1 6 LEU CD1 C 0.323 2.007 -3.561 1.00 . A A . 5 LEU CD1 1 1 19 3447 1 1 6 LEU CD2 C -1.429 0.400 -4.333 1.00 . A A . 5 LEU CD2 1 1 19 3448 1 1 6 LEU CG C -0.986 1.311 -3.185 1.00 . A A . 5 LEU CG 1 1 19 3449 1 1 6 LEU H H -0.951 -0.517 0.315 1.00 . A A . 5 LEU H 1 1 19 3450 1 1 6 LEU HA H 0.468 1.602 -0.600 1.00 . A A . 5 LEU HA 1 1 19 3451 1 1 6 LEU HB2 H 0.095 -0.165 -2.071 1.00 . A A . 5 LEU HB2 1 1 19 3452 1 1 6 LEU HB3 H -1.642 -0.170 -1.783 1.00 . A A . 5 LEU HB3 1 1 19 3453 1 1 6 LEU HD11 H 0.689 2.568 -2.712 1.00 . A A . 5 LEU HD11 1 1 19 3454 1 1 6 LEU HD12 H 1.056 1.267 -3.845 1.00 . A A . 5 LEU HD12 1 1 19 3455 1 1 6 LEU HD13 H 0.151 2.679 -4.388 1.00 . A A . 5 LEU HD13 1 1 19 3456 1 1 6 LEU HD21 H -2.336 -0.116 -4.053 1.00 . A A . 5 LEU HD21 1 1 19 3457 1 1 6 LEU HD22 H -1.610 0.993 -5.216 1.00 . A A . 5 LEU HD22 1 1 19 3458 1 1 6 LEU HD23 H -0.653 -0.325 -4.538 1.00 . A A . 5 LEU HD23 1 1 19 3459 1 1 6 LEU HG H -1.749 2.052 -2.997 1.00 . A A . 5 LEU HG 1 1 19 3460 1 1 6 LEU N N -0.992 0.455 0.428 1.00 . A A . 5 LEU N 1 1 19 3461 1 1 6 LEU O O -0.941 3.702 -0.933 1.00 . A A . 5 LEU O 1 1 19 3462 1 1 7 ALA C C -3.854 4.297 0.681 1.00 . A A . 6 ALA C 1 1 19 3463 1 1 7 ALA CA C -3.622 3.677 -0.707 1.00 . A A . 6 ALA CA 1 1 19 3464 1 1 7 ALA CB C -4.939 3.156 -1.281 1.00 . A A . 6 ALA CB 1 1 19 3465 1 1 7 ALA H H -3.125 1.584 -0.507 1.00 . A A . 6 ALA H 1 1 19 3466 1 1 7 ALA HA H -3.201 4.410 -1.376 1.00 . A A . 6 ALA HA 1 1 19 3467 1 1 7 ALA HB1 H -4.744 2.297 -1.905 1.00 . A A . 6 ALA HB1 1 1 19 3468 1 1 7 ALA HB2 H -5.596 2.873 -0.472 1.00 . A A . 6 ALA HB2 1 1 19 3469 1 1 7 ALA HB3 H -5.407 3.931 -1.870 1.00 . A A . 6 ALA HB3 1 1 19 3470 1 1 7 ALA N N -2.735 2.474 -0.635 1.00 . A A . 6 ALA N 1 1 19 3471 1 1 7 ALA O O -4.821 5.000 0.893 1.00 . A A . 6 ALA O 1 1 19 3472 1 1 8 HIS C C -1.896 5.259 3.509 1.00 . A A . 7 HIS C 1 1 19 3473 1 1 8 HIS CA C -3.198 4.635 2.990 1.00 . A A . 7 HIS CA 1 1 19 3474 1 1 8 HIS CB C -3.627 3.470 3.898 1.00 . A A . 7 HIS CB 1 1 19 3475 1 1 8 HIS CD2 C -4.394 1.873 1.967 1.00 . A A . 7 HIS CD2 1 1 19 3476 1 1 8 HIS CE1 C -6.351 1.343 2.721 1.00 . A A . 7 HIS CE1 1 1 19 3477 1 1 8 HIS CG C -4.547 2.539 3.151 1.00 . A A . 7 HIS CG 1 1 19 3478 1 1 8 HIS H H -2.215 3.475 1.450 1.00 . A A . 7 HIS H 1 1 19 3479 1 1 8 HIS HA H -3.978 5.379 2.959 1.00 . A A . 7 HIS HA 1 1 19 3480 1 1 8 HIS HB2 H -2.752 2.926 4.218 1.00 . A A . 7 HIS HB2 1 1 19 3481 1 1 8 HIS HB3 H -4.141 3.862 4.763 1.00 . A A . 7 HIS HB3 1 1 19 3482 1 1 8 HIS HD1 H -6.223 2.498 4.452 1.00 . A A . 7 HIS HD1 1 1 19 3483 1 1 8 HIS HD2 H -3.523 1.928 1.340 1.00 . A A . 7 HIS HD2 1 1 19 3484 1 1 8 HIS HE1 H -7.327 0.893 2.819 1.00 . A A . 7 HIS HE1 1 1 19 3485 1 1 8 HIS HE2 H -5.694 0.558 0.915 1.00 . A A . 7 HIS HE2 1 1 19 3486 1 1 8 HIS N N -2.989 4.047 1.629 1.00 . A A . 7 HIS N 1 1 19 3487 1 1 8 HIS ND1 N -5.807 2.189 3.620 1.00 . A A . 7 HIS ND1 1 1 19 3488 1 1 8 HIS NE2 N -5.529 1.123 1.698 1.00 . A A . 7 HIS NE2 1 1 19 3489 1 1 8 HIS O O -1.914 6.194 4.284 1.00 . A A . 7 HIS O 1 1 19 3490 1 1 9 LYS C C 0.588 6.817 3.278 1.00 . A A . 8 LYS C 1 1 19 3491 1 1 9 LYS CA C 0.526 5.315 3.565 1.00 . A A . 8 LYS CA 1 1 19 3492 1 1 9 LYS CB C 1.598 4.573 2.767 1.00 . A A . 8 LYS CB 1 1 19 3493 1 1 9 LYS CD C 2.842 2.414 2.571 1.00 . A A . 8 LYS CD 1 1 19 3494 1 1 9 LYS CE C 4.112 3.125 3.042 1.00 . A A . 8 LYS CE 1 1 19 3495 1 1 9 LYS CG C 1.617 3.100 3.181 1.00 . A A . 8 LYS CG 1 1 19 3496 1 1 9 LYS H H -0.772 3.995 2.468 1.00 . A A . 8 LYS H 1 1 19 3497 1 1 9 LYS HA H 0.657 5.126 4.619 1.00 . A A . 8 LYS HA 1 1 19 3498 1 1 9 LYS HB2 H 1.377 4.648 1.711 1.00 . A A . 8 LYS HB2 1 1 19 3499 1 1 9 LYS HB3 H 2.564 5.013 2.965 1.00 . A A . 8 LYS HB3 1 1 19 3500 1 1 9 LYS HD2 H 2.868 1.381 2.886 1.00 . A A . 8 LYS HD2 1 1 19 3501 1 1 9 LYS HD3 H 2.783 2.462 1.494 1.00 . A A . 8 LYS HD3 1 1 19 3502 1 1 9 LYS HE2 H 4.239 4.057 2.509 1.00 . A A . 8 LYS HE2 1 1 19 3503 1 1 9 LYS HE3 H 4.074 3.300 4.105 1.00 . A A . 8 LYS HE3 1 1 19 3504 1 1 9 LYS HG2 H 1.662 3.030 4.258 1.00 . A A . 8 LYS HG2 1 1 19 3505 1 1 9 LYS HG3 H 0.721 2.615 2.825 1.00 . A A . 8 LYS HG3 1 1 19 3506 1 1 9 LYS HZ1 H 4.976 1.643 1.863 1.00 . A A . 8 LYS HZ1 1 1 19 3507 1 1 9 LYS HZ2 H 6.094 2.720 2.553 1.00 . A A . 8 LYS HZ2 1 1 19 3508 1 1 9 LYS HZ3 H 5.363 1.530 3.514 1.00 . A A . 8 LYS HZ3 1 1 19 3509 1 1 9 LYS N N -0.769 4.749 3.091 1.00 . A A . 8 LYS N 1 1 19 3510 1 1 9 LYS NZ N 5.220 2.183 2.719 1.00 . A A . 8 LYS NZ 1 1 19 3511 1 1 9 LYS O O -0.414 7.453 3.020 1.00 . A A . 8 LYS O 1 1 19 3512 1 1 10 ALA C C 1.584 9.143 1.579 1.00 . A A . 9 ALA C 1 1 19 3513 1 1 10 ALA CA C 1.890 8.849 3.051 1.00 . A A . 9 ALA CA 1 1 19 3514 1 1 10 ALA CB C 3.346 9.185 3.374 1.00 . A A . 9 ALA CB 1 1 19 3515 1 1 10 ALA H H 2.556 6.857 3.530 1.00 . A A . 9 ALA H 1 1 19 3516 1 1 10 ALA HA H 1.231 9.411 3.693 1.00 . A A . 9 ALA HA 1 1 19 3517 1 1 10 ALA HB1 H 3.866 8.284 3.664 1.00 . A A . 9 ALA HB1 1 1 19 3518 1 1 10 ALA HB2 H 3.820 9.608 2.500 1.00 . A A . 9 ALA HB2 1 1 19 3519 1 1 10 ALA HB3 H 3.380 9.897 4.184 1.00 . A A . 9 ALA HB3 1 1 19 3520 1 1 10 ALA N N 1.760 7.389 3.321 1.00 . A A . 9 ALA N 1 1 19 3521 1 1 10 ALA O O 2.411 9.663 0.856 1.00 . A A . 9 ALA O 1 1 19 3522 1 1 11 LEU C C -0.909 10.268 -0.388 1.00 . A A . 10 LEU C 1 1 19 3523 1 1 11 LEU CA C 0.046 9.075 -0.292 1.00 . A A . 10 LEU CA 1 1 19 3524 1 1 11 LEU CB C -0.644 7.796 -0.765 1.00 . A A . 10 LEU CB 1 1 19 3525 1 1 11 LEU CD1 C -0.039 8.271 -3.141 1.00 . A A . 10 LEU CD1 1 1 19 3526 1 1 11 LEU CD2 C 1.551 7.024 -1.673 1.00 . A A . 10 LEU CD2 1 1 19 3527 1 1 11 LEU CG C 0.074 7.256 -2.003 1.00 . A A . 10 LEU CG 1 1 19 3528 1 1 11 LEU H H -0.249 8.396 1.733 1.00 . A A . 10 LEU H 1 1 19 3529 1 1 11 LEU HA H 0.934 9.254 -0.876 1.00 . A A . 10 LEU HA 1 1 19 3530 1 1 11 LEU HB2 H -0.610 7.056 0.023 1.00 . A A . 10 LEU HB2 1 1 19 3531 1 1 11 LEU HB3 H -1.672 8.011 -1.013 1.00 . A A . 10 LEU HB3 1 1 19 3532 1 1 11 LEU HD11 H -0.856 8.949 -2.940 1.00 . A A . 10 LEU HD11 1 1 19 3533 1 1 11 LEU HD12 H 0.882 8.829 -3.219 1.00 . A A . 10 LEU HD12 1 1 19 3534 1 1 11 LEU HD13 H -0.225 7.751 -4.070 1.00 . A A . 10 LEU HD13 1 1 19 3535 1 1 11 LEU HD21 H 1.672 6.946 -0.603 1.00 . A A . 10 LEU HD21 1 1 19 3536 1 1 11 LEU HD22 H 1.885 6.110 -2.141 1.00 . A A . 10 LEU HD22 1 1 19 3537 1 1 11 LEU HD23 H 2.137 7.853 -2.043 1.00 . A A . 10 LEU HD23 1 1 19 3538 1 1 11 LEU HG H -0.381 6.324 -2.305 1.00 . A A . 10 LEU HG 1 1 19 3539 1 1 11 LEU N N 0.404 8.814 1.133 1.00 . A A . 10 LEU N 1 1 19 3540 1 1 11 LEU O O -1.398 10.599 -1.448 1.00 . A A . 10 LEU O 1 1 19 3541 1 1 12 ALA C C -2.392 12.566 2.109 1.00 . A A . 11 ALA C 1 1 19 3542 1 1 12 ALA CA C -2.100 12.087 0.684 1.00 . A A . 11 ALA CA 1 1 19 3543 1 1 12 ALA CB C -3.376 11.568 0.021 1.00 . A A . 11 ALA CB 1 1 19 3544 1 1 12 ALA H H -0.771 10.632 1.559 1.00 . A A . 11 ALA H 1 1 19 3545 1 1 12 ALA HA H -1.677 12.886 0.097 1.00 . A A . 11 ALA HA 1 1 19 3546 1 1 12 ALA HB1 H -3.235 10.541 -0.279 1.00 . A A . 11 ALA HB1 1 1 19 3547 1 1 12 ALA HB2 H -4.196 11.629 0.721 1.00 . A A . 11 ALA HB2 1 1 19 3548 1 1 12 ALA HB3 H -3.600 12.170 -0.849 1.00 . A A . 11 ALA HB3 1 1 19 3549 1 1 12 ALA N N -1.177 10.915 0.714 1.00 . A A . 11 ALA N 1 1 19 3550 1 1 12 ALA O O -3.262 12.042 2.777 1.00 . A A . 11 ALA O 1 1 19 3551 1 1 13 NH2 HN1 H -0.993 13.974 2.070 1.00 . A A . 12 NH2 HN1 1 1 19 3552 1 1 13 NH2 HN2 H -1.872 13.865 3.517 1.00 . A A . 12 NH2 HN2 1 1 19 3553 1 1 13 NH2 N N -1.694 13.550 2.607 1.00 . A A . 12 NH2 N 1 1 20 3554 1 1 2 ILE C C -1.993 -4.964 1.640 1.00 . A A . 1 ILE C 1 1 20 3555 1 1 2 ILE CA C -0.855 -5.189 2.635 1.00 . A A . 1 ILE CA 1 1 20 3556 1 1 2 ILE CB C 0.481 -4.630 2.113 1.00 . A A . 1 ILE CB 1 1 20 3557 1 1 2 ILE CD1 C 1.806 -5.289 4.126 1.00 . A A . 1 ILE CD1 1 1 20 3558 1 1 2 ILE CG1 C 1.294 -4.110 3.299 1.00 . A A . 1 ILE CG1 1 1 20 3559 1 1 2 ILE CG2 C 0.253 -3.476 1.121 1.00 . A A . 1 ILE CG2 1 1 20 3560 1 1 2 ILE H H 0.282 -7.011 2.803 1.00 . A A . 1 ILE H 1 1 20 3561 1 1 2 ILE HA H -1.089 -4.737 3.579 1.00 . A A . 1 ILE HA 1 1 20 3562 1 1 2 ILE HB H 1.028 -5.419 1.624 1.00 . A A . 1 ILE HB 1 1 20 3563 1 1 2 ILE HD11 H 1.836 -6.175 3.509 1.00 . A A . 1 ILE HD11 1 1 20 3564 1 1 2 ILE HD12 H 2.798 -5.070 4.491 1.00 . A A . 1 ILE HD12 1 1 20 3565 1 1 2 ILE HD13 H 1.144 -5.456 4.964 1.00 . A A . 1 ILE HD13 1 1 20 3566 1 1 2 ILE HG12 H 2.131 -3.532 2.935 1.00 . A A . 1 ILE HG12 1 1 20 3567 1 1 2 ILE HG13 H 0.666 -3.485 3.919 1.00 . A A . 1 ILE HG13 1 1 20 3568 1 1 2 ILE HG21 H -0.752 -3.094 1.231 1.00 . A A . 1 ILE HG21 1 1 20 3569 1 1 2 ILE HG22 H 0.959 -2.684 1.320 1.00 . A A . 1 ILE HG22 1 1 20 3570 1 1 2 ILE HG23 H 0.390 -3.834 0.112 1.00 . A A . 1 ILE HG23 1 1 20 3571 1 1 2 ILE N N -0.628 -6.647 2.811 1.00 . A A . 1 ILE N 1 1 20 3572 1 1 2 ILE O O -3.117 -4.699 2.015 1.00 . A A . 1 ILE O 1 1 20 3573 1 1 3 ASP C C -3.296 -3.430 -0.568 1.00 . A A . 2 ASP C 1 1 20 3574 1 1 3 ASP CA C -2.742 -4.850 -0.664 1.00 . A A . 2 ASP CA 1 1 20 3575 1 1 3 ASP CB C -3.832 -5.878 -0.357 1.00 . A A . 2 ASP CB 1 1 20 3576 1 1 3 ASP CG C -3.693 -7.069 -1.306 1.00 . A A . 2 ASP CG 1 1 20 3577 1 1 3 ASP H H -0.784 -5.279 0.110 1.00 . A A . 2 ASP H 1 1 20 3578 1 1 3 ASP HA H -2.338 -5.022 -1.647 1.00 . A A . 2 ASP HA 1 1 20 3579 1 1 3 ASP HB2 H -3.730 -6.216 0.665 1.00 . A A . 2 ASP HB2 1 1 20 3580 1 1 3 ASP HB3 H -4.803 -5.425 -0.490 1.00 . A A . 2 ASP HB3 1 1 20 3581 1 1 3 ASP N N -1.699 -5.066 0.375 1.00 . A A . 2 ASP N 1 1 20 3582 1 1 3 ASP O O -3.054 -2.599 -1.421 1.00 . A A . 2 ASP O 1 1 20 3583 1 1 3 ASP OD1 O -2.607 -7.263 -1.826 1.00 . A A . 2 ASP OD1 1 1 20 3584 1 1 3 ASP OD2 O -4.675 -7.767 -1.496 1.00 . A A . 2 ASP OD2 1 1 20 3585 1 1 4 TYR C C -3.567 -0.761 1.055 1.00 . A A . 3 TYR C 1 1 20 3586 1 1 4 TYR CA C -4.621 -1.783 0.595 1.00 . A A . 3 TYR CA 1 1 20 3587 1 1 4 TYR CB C -5.771 -1.923 1.602 1.00 . A A . 3 TYR CB 1 1 20 3588 1 1 4 TYR CD1 C -5.066 -3.590 3.354 1.00 . A A . 3 TYR CD1 1 1 20 3589 1 1 4 TYR CD2 C -4.939 -1.224 3.869 1.00 . A A . 3 TYR CD2 1 1 20 3590 1 1 4 TYR CE1 C -4.586 -3.892 4.632 1.00 . A A . 3 TYR CE1 1 1 20 3591 1 1 4 TYR CE2 C -4.458 -1.525 5.145 1.00 . A A . 3 TYR CE2 1 1 20 3592 1 1 4 TYR CG C -5.243 -2.255 2.973 1.00 . A A . 3 TYR CG 1 1 20 3593 1 1 4 TYR CZ C -4.281 -2.858 5.526 1.00 . A A . 3 TYR CZ 1 1 20 3594 1 1 4 TYR H H -4.233 -3.834 1.129 1.00 . A A . 3 TYR H 1 1 20 3595 1 1 4 TYR HA H -5.021 -1.470 -0.351 1.00 . A A . 3 TYR HA 1 1 20 3596 1 1 4 TYR HB2 H -6.320 -0.997 1.647 1.00 . A A . 3 TYR HB2 1 1 20 3597 1 1 4 TYR HB3 H -6.433 -2.712 1.274 1.00 . A A . 3 TYR HB3 1 1 20 3598 1 1 4 TYR HD1 H -5.299 -4.385 2.661 1.00 . A A . 3 TYR HD1 1 1 20 3599 1 1 4 TYR HD2 H -5.075 -0.195 3.573 1.00 . A A . 3 TYR HD2 1 1 20 3600 1 1 4 TYR HE1 H -4.448 -4.921 4.928 1.00 . A A . 3 TYR HE1 1 1 20 3601 1 1 4 TYR HE2 H -4.223 -0.730 5.836 1.00 . A A . 3 TYR HE2 1 1 20 3602 1 1 4 TYR HH H -3.315 -2.399 7.108 1.00 . A A . 3 TYR HH 1 1 20 3603 1 1 4 TYR N N -4.044 -3.147 0.457 1.00 . A A . 3 TYR N 1 1 20 3604 1 1 4 TYR O O -3.390 0.242 0.402 1.00 . A A . 3 TYR O 1 1 20 3605 1 1 4 TYR OH O -3.812 -3.157 6.789 1.00 . A A . 3 TYR OH 1 1 20 3606 1 1 5 TRP C C -1.416 0.969 1.620 1.00 . A A . 4 TRP C 1 1 20 3607 1 1 5 TRP CA C -1.830 -0.054 2.680 1.00 . A A . 4 TRP CA 1 1 20 3608 1 1 5 TRP CB C -0.619 -0.920 3.031 1.00 . A A . 4 TRP CB 1 1 20 3609 1 1 5 TRP CD1 C -1.723 -2.750 4.391 1.00 . A A . 4 TRP CD1 1 1 20 3610 1 1 5 TRP CD2 C -0.243 -1.558 5.583 1.00 . A A . 4 TRP CD2 1 1 20 3611 1 1 5 TRP CE2 C -0.773 -2.534 6.456 1.00 . A A . 4 TRP CE2 1 1 20 3612 1 1 5 TRP CE3 C 0.715 -0.671 6.088 1.00 . A A . 4 TRP CE3 1 1 20 3613 1 1 5 TRP CG C -0.866 -1.712 4.278 1.00 . A A . 4 TRP CG 1 1 20 3614 1 1 5 TRP CH2 C 0.592 -1.736 8.274 1.00 . A A . 4 TRP CH2 1 1 20 3615 1 1 5 TRP CZ2 C -0.365 -2.627 7.785 1.00 . A A . 4 TRP CZ2 1 1 20 3616 1 1 5 TRP CZ3 C 1.133 -0.758 7.426 1.00 . A A . 4 TRP CZ3 1 1 20 3617 1 1 5 TRP H H -3.050 -1.834 2.644 1.00 . A A . 4 TRP H 1 1 20 3618 1 1 5 TRP HA H -2.188 0.447 3.565 1.00 . A A . 4 TRP HA 1 1 20 3619 1 1 5 TRP HB2 H -0.420 -1.591 2.219 1.00 . A A . 4 TRP HB2 1 1 20 3620 1 1 5 TRP HB3 H 0.241 -0.283 3.180 1.00 . A A . 4 TRP HB3 1 1 20 3621 1 1 5 TRP HD1 H -2.340 -3.145 3.603 1.00 . A A . 4 TRP HD1 1 1 20 3622 1 1 5 TRP HE1 H -2.192 -3.992 6.025 1.00 . A A . 4 TRP HE1 1 1 20 3623 1 1 5 TRP HE3 H 1.137 0.079 5.440 1.00 . A A . 4 TRP HE3 1 1 20 3624 1 1 5 TRP HH2 H 0.915 -1.799 9.302 1.00 . A A . 4 TRP HH2 1 1 20 3625 1 1 5 TRP HZ2 H -0.786 -3.384 8.429 1.00 . A A . 4 TRP HZ2 1 1 20 3626 1 1 5 TRP HZ3 H 1.873 -0.068 7.804 1.00 . A A . 4 TRP HZ3 1 1 20 3627 1 1 5 TRP N N -2.878 -1.012 2.156 1.00 . A A . 4 TRP N 1 1 20 3628 1 1 5 TRP NE1 N -1.664 -3.240 5.681 1.00 . A A . 4 TRP NE1 1 1 20 3629 1 1 5 TRP O O -1.463 2.163 1.833 1.00 . A A . 4 TRP O 1 1 20 3630 1 1 6 LEU C C -1.431 2.675 -0.663 1.00 . A A . 5 LEU C 1 1 20 3631 1 1 6 LEU CA C -0.586 1.388 -0.633 1.00 . A A . 5 LEU CA 1 1 20 3632 1 1 6 LEU CB C -0.812 0.529 -1.883 1.00 . A A . 5 LEU CB 1 1 20 3633 1 1 6 LEU CD1 C 0.227 2.102 -3.525 1.00 . A A . 5 LEU CD1 1 1 20 3634 1 1 6 LEU CD2 C -1.554 0.504 -4.257 1.00 . A A . 5 LEU CD2 1 1 20 3635 1 1 6 LEU CG C -1.068 1.400 -3.113 1.00 . A A . 5 LEU CG 1 1 20 3636 1 1 6 LEU H H -0.987 -0.481 0.346 1.00 . A A . 5 LEU H 1 1 20 3637 1 1 6 LEU HA H 0.461 1.629 -0.540 1.00 . A A . 5 LEU HA 1 1 20 3638 1 1 6 LEU HB2 H 0.063 -0.080 -2.058 1.00 . A A . 5 LEU HB2 1 1 20 3639 1 1 6 LEU HB3 H -1.664 -0.114 -1.721 1.00 . A A . 5 LEU HB3 1 1 20 3640 1 1 6 LEU HD11 H 1.058 1.667 -2.991 1.00 . A A . 5 LEU HD11 1 1 20 3641 1 1 6 LEU HD12 H 0.380 1.980 -4.589 1.00 . A A . 5 LEU HD12 1 1 20 3642 1 1 6 LEU HD13 H 0.157 3.153 -3.290 1.00 . A A . 5 LEU HD13 1 1 20 3643 1 1 6 LEU HD21 H -2.126 -0.318 -3.850 1.00 . A A . 5 LEU HD21 1 1 20 3644 1 1 6 LEU HD22 H -2.176 1.078 -4.926 1.00 . A A . 5 LEU HD22 1 1 20 3645 1 1 6 LEU HD23 H -0.703 0.116 -4.796 1.00 . A A . 5 LEU HD23 1 1 20 3646 1 1 6 LEU HG H -1.824 2.139 -2.887 1.00 . A A . 5 LEU HG 1 1 20 3647 1 1 6 LEU N N -1.012 0.490 0.478 1.00 . A A . 5 LEU N 1 1 20 3648 1 1 6 LEU O O -0.904 3.768 -0.722 1.00 . A A . 5 LEU O 1 1 20 3649 1 1 7 ALA C C -3.907 4.296 0.731 1.00 . A A . 6 ALA C 1 1 20 3650 1 1 7 ALA CA C -3.596 3.778 -0.681 1.00 . A A . 6 ALA CA 1 1 20 3651 1 1 7 ALA CB C -4.881 3.323 -1.371 1.00 . A A . 6 ALA CB 1 1 20 3652 1 1 7 ALA H H -3.142 1.667 -0.600 1.00 . A A . 6 ALA H 1 1 20 3653 1 1 7 ALA HA H -3.122 4.550 -1.267 1.00 . A A . 6 ALA HA 1 1 20 3654 1 1 7 ALA HB1 H -4.652 2.539 -2.078 1.00 . A A . 6 ALA HB1 1 1 20 3655 1 1 7 ALA HB2 H -5.575 2.950 -0.632 1.00 . A A . 6 ALA HB2 1 1 20 3656 1 1 7 ALA HB3 H -5.326 4.158 -1.892 1.00 . A A . 6 ALA HB3 1 1 20 3657 1 1 7 ALA N N -2.732 2.556 -0.638 1.00 . A A . 6 ALA N 1 1 20 3658 1 1 7 ALA O O -4.843 5.044 0.930 1.00 . A A . 6 ALA O 1 1 20 3659 1 1 8 HIS C C -2.149 4.970 3.717 1.00 . A A . 7 HIS C 1 1 20 3660 1 1 8 HIS CA C -3.418 4.375 3.103 1.00 . A A . 7 HIS CA 1 1 20 3661 1 1 8 HIS CB C -3.857 3.128 3.883 1.00 . A A . 7 HIS CB 1 1 20 3662 1 1 8 HIS CD2 C -4.798 1.857 1.784 1.00 . A A . 7 HIS CD2 1 1 20 3663 1 1 8 HIS CE1 C -6.684 1.198 2.611 1.00 . A A . 7 HIS CE1 1 1 20 3664 1 1 8 HIS CG C -4.842 2.325 3.070 1.00 . A A . 7 HIS CG 1 1 20 3665 1 1 8 HIS H H -2.395 3.294 1.541 1.00 . A A . 7 HIS H 1 1 20 3666 1 1 8 HIS HA H -4.213 5.106 3.104 1.00 . A A . 7 HIS HA 1 1 20 3667 1 1 8 HIS HB2 H -2.992 2.518 4.099 1.00 . A A . 7 HIS HB2 1 1 20 3668 1 1 8 HIS HB3 H -4.320 3.430 4.810 1.00 . A A . 7 HIS HB3 1 1 20 3669 1 1 8 HIS HD1 H -6.401 2.064 4.487 1.00 . A A . 7 HIS HD1 1 1 20 3670 1 1 8 HIS HD2 H -3.983 2.008 1.101 1.00 . A A . 7 HIS HD2 1 1 20 3671 1 1 8 HIS HE1 H -7.646 0.726 2.721 1.00 . A A . 7 HIS HE1 1 1 20 3672 1 1 8 HIS HE2 H -6.190 0.710 0.656 1.00 . A A . 7 HIS HE2 1 1 20 3673 1 1 8 HIS N N -3.143 3.903 1.714 1.00 . A A . 7 HIS N 1 1 20 3674 1 1 8 HIS ND1 N -6.059 1.893 3.583 1.00 . A A . 7 HIS ND1 1 1 20 3675 1 1 8 HIS NE2 N -5.956 1.150 1.499 1.00 . A A . 7 HIS NE2 1 1 20 3676 1 1 8 HIS O O -1.331 5.555 3.036 1.00 . A A . 7 HIS O 1 1 20 3677 1 1 9 LYS C C -0.776 6.913 5.585 1.00 . A A . 8 LYS C 1 1 20 3678 1 1 9 LYS CA C -0.780 5.388 5.679 1.00 . A A . 8 LYS CA 1 1 20 3679 1 1 9 LYS CB C 0.416 4.793 4.935 1.00 . A A . 8 LYS CB 1 1 20 3680 1 1 9 LYS CD C 0.353 2.568 6.070 1.00 . A A . 8 LYS CD 1 1 20 3681 1 1 9 LYS CE C 1.834 2.515 6.455 1.00 . A A . 8 LYS CE 1 1 20 3682 1 1 9 LYS CG C 0.200 3.292 4.730 1.00 . A A . 8 LYS CG 1 1 20 3683 1 1 9 LYS H H -2.664 4.358 5.533 1.00 . A A . 8 LYS H 1 1 20 3684 1 1 9 LYS HA H -0.764 5.086 6.707 1.00 . A A . 8 LYS HA 1 1 20 3685 1 1 9 LYS HB2 H 0.520 5.277 3.974 1.00 . A A . 8 LYS HB2 1 1 20 3686 1 1 9 LYS HB3 H 1.312 4.949 5.515 1.00 . A A . 8 LYS HB3 1 1 20 3687 1 1 9 LYS HD2 H -0.200 3.099 6.831 1.00 . A A . 8 LYS HD2 1 1 20 3688 1 1 9 LYS HD3 H -0.029 1.562 5.982 1.00 . A A . 8 LYS HD3 1 1 20 3689 1 1 9 LYS HE2 H 2.254 1.553 6.198 1.00 . A A . 8 LYS HE2 1 1 20 3690 1 1 9 LYS HE3 H 2.379 3.308 5.967 1.00 . A A . 8 LYS HE3 1 1 20 3691 1 1 9 LYS HG2 H -0.790 3.119 4.337 1.00 . A A . 8 LYS HG2 1 1 20 3692 1 1 9 LYS HG3 H 0.934 2.915 4.035 1.00 . A A . 8 LYS HG3 1 1 20 3693 1 1 9 LYS HZ1 H 1.190 2.050 8.379 1.00 . A A . 8 LYS HZ1 1 1 20 3694 1 1 9 LYS HZ2 H 2.813 2.544 8.292 1.00 . A A . 8 LYS HZ2 1 1 20 3695 1 1 9 LYS HZ3 H 1.571 3.690 8.153 1.00 . A A . 8 LYS HZ3 1 1 20 3696 1 1 9 LYS N N -1.988 4.830 5.005 1.00 . A A . 8 LYS N 1 1 20 3697 1 1 9 LYS NZ N 1.854 2.715 7.931 1.00 . A A . 8 LYS NZ 1 1 20 3698 1 1 9 LYS O O 0.183 7.570 5.941 1.00 . A A . 8 LYS O 1 1 20 3699 1 1 10 ALA C C -2.529 9.530 6.306 1.00 . A A . 9 ALA C 1 1 20 3700 1 1 10 ALA CA C -1.938 8.960 5.017 1.00 . A A . 9 ALA CA 1 1 20 3701 1 1 10 ALA CB C -2.870 9.221 3.834 1.00 . A A . 9 ALA CB 1 1 20 3702 1 1 10 ALA H H -2.610 6.921 4.865 1.00 . A A . 9 ALA H 1 1 20 3703 1 1 10 ALA HA H -0.966 9.384 4.825 1.00 . A A . 9 ALA HA 1 1 20 3704 1 1 10 ALA HB1 H -2.619 8.553 3.024 1.00 . A A . 9 ALA HB1 1 1 20 3705 1 1 10 ALA HB2 H -3.892 9.050 4.137 1.00 . A A . 9 ALA HB2 1 1 20 3706 1 1 10 ALA HB3 H -2.758 10.244 3.506 1.00 . A A . 9 ALA HB3 1 1 20 3707 1 1 10 ALA N N -1.851 7.476 5.125 1.00 . A A . 9 ALA N 1 1 20 3708 1 1 10 ALA O O -2.121 10.567 6.790 1.00 . A A . 9 ALA O 1 1 20 3709 1 1 11 LEU C C -3.404 8.739 9.332 1.00 . A A . 10 LEU C 1 1 20 3710 1 1 11 LEU CA C -4.129 9.330 8.119 1.00 . A A . 10 LEU CA 1 1 20 3711 1 1 11 LEU CB C -5.570 8.817 8.041 1.00 . A A . 10 LEU CB 1 1 20 3712 1 1 11 LEU CD1 C -7.205 10.203 9.325 1.00 . A A . 10 LEU CD1 1 1 20 3713 1 1 11 LEU CD2 C -7.072 7.742 9.722 1.00 . A A . 10 LEU CD2 1 1 20 3714 1 1 11 LEU CG C -6.264 8.999 9.393 1.00 . A A . 10 LEU CG 1 1 20 3715 1 1 11 LEU H H -3.802 8.017 6.448 1.00 . A A . 10 LEU H 1 1 20 3716 1 1 11 LEU HA H -4.123 10.408 8.160 1.00 . A A . 10 LEU HA 1 1 20 3717 1 1 11 LEU HB2 H -6.105 9.371 7.284 1.00 . A A . 10 LEU HB2 1 1 20 3718 1 1 11 LEU HB3 H -5.563 7.767 7.778 1.00 . A A . 10 LEU HB3 1 1 20 3719 1 1 11 LEU HD11 H -7.414 10.439 8.291 1.00 . A A . 10 LEU HD11 1 1 20 3720 1 1 11 LEU HD12 H -8.128 9.967 9.834 1.00 . A A . 10 LEU HD12 1 1 20 3721 1 1 11 LEU HD13 H -6.739 11.052 9.801 1.00 . A A . 10 LEU HD13 1 1 20 3722 1 1 11 LEU HD21 H -7.705 7.491 8.883 1.00 . A A . 10 LEU HD21 1 1 20 3723 1 1 11 LEU HD22 H -6.398 6.922 9.920 1.00 . A A . 10 LEU HD22 1 1 20 3724 1 1 11 LEU HD23 H -7.684 7.924 10.593 1.00 . A A . 10 LEU HD23 1 1 20 3725 1 1 11 LEU HG H -5.525 9.165 10.162 1.00 . A A . 10 LEU HG 1 1 20 3726 1 1 11 LEU N N -3.494 8.849 6.861 1.00 . A A . 10 LEU N 1 1 20 3727 1 1 11 LEU O O -3.427 9.295 10.412 1.00 . A A . 10 LEU O 1 1 20 3728 1 1 12 ALA C C -0.846 7.865 10.717 1.00 . A A . 11 ALA C 1 1 20 3729 1 1 12 ALA CA C -2.034 6.992 10.305 1.00 . A A . 11 ALA CA 1 1 20 3730 1 1 12 ALA CB C -1.550 5.642 9.777 1.00 . A A . 11 ALA CB 1 1 20 3731 1 1 12 ALA H H -2.754 7.185 8.283 1.00 . A A . 11 ALA H 1 1 20 3732 1 1 12 ALA HA H -2.701 6.844 11.139 1.00 . A A . 11 ALA HA 1 1 20 3733 1 1 12 ALA HB1 H -2.145 5.354 8.923 1.00 . A A . 11 ALA HB1 1 1 20 3734 1 1 12 ALA HB2 H -0.514 5.721 9.483 1.00 . A A . 11 ALA HB2 1 1 20 3735 1 1 12 ALA HB3 H -1.648 4.896 10.552 1.00 . A A . 11 ALA HB3 1 1 20 3736 1 1 12 ALA N N -2.760 7.617 9.162 1.00 . A A . 11 ALA N 1 1 20 3737 1 1 12 ALA O O -0.572 8.876 10.101 1.00 . A A . 11 ALA O 1 1 20 3738 1 1 13 NH2 HN1 H -0.341 6.699 12.243 1.00 . A A . 12 NH2 HN1 1 1 20 3739 1 1 13 NH2 HN2 H 0.642 8.065 12.017 1.00 . A A . 12 NH2 HN2 1 1 20 3740 1 1 13 NH2 N N -0.121 7.514 11.744 1.00 . A A . 12 NH2 N 1 1 21 3741 1 1 2 ILE C C -1.960 -4.890 1.720 1.00 . A A . 1 ILE C 1 1 21 3742 1 1 2 ILE CA C -0.814 -5.063 2.718 1.00 . A A . 1 ILE CA 1 1 21 3743 1 1 2 ILE CB C 0.510 -4.488 2.181 1.00 . A A . 1 ILE CB 1 1 21 3744 1 1 2 ILE CD1 C 1.841 -5.002 4.231 1.00 . A A . 1 ILE CD1 1 1 21 3745 1 1 2 ILE CG1 C 1.292 -3.882 3.348 1.00 . A A . 1 ILE CG1 1 1 21 3746 1 1 2 ILE CG2 C 0.259 -3.392 1.128 1.00 . A A . 1 ILE CG2 1 1 21 3747 1 1 2 ILE H H 0.363 -6.857 2.917 1.00 . A A . 1 ILE H 1 1 21 3748 1 1 2 ILE HA H -1.058 -4.597 3.652 1.00 . A A . 1 ILE HA 1 1 21 3749 1 1 2 ILE HB H 1.088 -5.283 1.738 1.00 . A A . 1 ILE HB 1 1 21 3750 1 1 2 ILE HD11 H 2.002 -5.886 3.633 1.00 . A A . 1 ILE HD11 1 1 21 3751 1 1 2 ILE HD12 H 2.777 -4.689 4.669 1.00 . A A . 1 ILE HD12 1 1 21 3752 1 1 2 ILE HD13 H 1.132 -5.222 5.016 1.00 . A A . 1 ILE HD13 1 1 21 3753 1 1 2 ILE HG12 H 2.109 -3.289 2.962 1.00 . A A . 1 ILE HG12 1 1 21 3754 1 1 2 ILE HG13 H 0.635 -3.255 3.933 1.00 . A A . 1 ILE HG13 1 1 21 3755 1 1 2 ILE HG21 H -0.751 -3.020 1.221 1.00 . A A . 1 ILE HG21 1 1 21 3756 1 1 2 ILE HG22 H 0.953 -2.580 1.280 1.00 . A A . 1 ILE HG22 1 1 21 3757 1 1 2 ILE HG23 H 0.398 -3.803 0.139 1.00 . A A . 1 ILE HG23 1 1 21 3758 1 1 2 ILE N N -0.555 -6.512 2.927 1.00 . A A . 1 ILE N 1 1 21 3759 1 1 2 ILE O O -3.083 -4.616 2.090 1.00 . A A . 1 ILE O 1 1 21 3760 1 1 3 ASP C C -3.292 -3.462 -0.538 1.00 . A A . 2 ASP C 1 1 21 3761 1 1 3 ASP CA C -2.722 -4.878 -0.583 1.00 . A A . 2 ASP CA 1 1 21 3762 1 1 3 ASP CB C -3.800 -5.905 -0.232 1.00 . A A . 2 ASP CB 1 1 21 3763 1 1 3 ASP CG C -3.656 -7.128 -1.140 1.00 . A A . 2 ASP CG 1 1 21 3764 1 1 3 ASP H H -0.756 -5.260 0.199 1.00 . A A . 2 ASP H 1 1 21 3765 1 1 3 ASP HA H -2.319 -5.083 -1.560 1.00 . A A . 2 ASP HA 1 1 21 3766 1 1 3 ASP HB2 H -3.688 -6.206 0.799 1.00 . A A . 2 ASP HB2 1 1 21 3767 1 1 3 ASP HB3 H -4.775 -5.466 -0.376 1.00 . A A . 2 ASP HB3 1 1 21 3768 1 1 3 ASP N N -1.672 -5.043 0.459 1.00 . A A . 2 ASP N 1 1 21 3769 1 1 3 ASP O O -3.050 -2.657 -1.414 1.00 . A A . 2 ASP O 1 1 21 3770 1 1 3 ASP OD1 O -2.546 -7.395 -1.571 1.00 . A A . 2 ASP OD1 1 1 21 3771 1 1 3 ASP OD2 O -4.658 -7.778 -1.389 1.00 . A A . 2 ASP OD2 1 1 21 3772 1 1 4 TYR C C -3.606 -0.748 0.988 1.00 . A A . 3 TYR C 1 1 21 3773 1 1 4 TYR CA C -4.646 -1.792 0.556 1.00 . A A . 3 TYR CA 1 1 21 3774 1 1 4 TYR CB C -5.807 -1.898 1.557 1.00 . A A . 3 TYR CB 1 1 21 3775 1 1 4 TYR CD1 C -5.138 -3.604 3.291 1.00 . A A . 3 TYR CD1 1 1 21 3776 1 1 4 TYR CD2 C -5.018 -1.249 3.858 1.00 . A A . 3 TYR CD2 1 1 21 3777 1 1 4 TYR CE1 C -4.682 -3.935 4.572 1.00 . A A . 3 TYR CE1 1 1 21 3778 1 1 4 TYR CE2 C -4.564 -1.580 5.140 1.00 . A A . 3 TYR CE2 1 1 21 3779 1 1 4 TYR CG C -5.305 -2.261 2.933 1.00 . A A . 3 TYR CG 1 1 21 3780 1 1 4 TYR CZ C -4.396 -2.922 5.496 1.00 . A A . 3 TYR CZ 1 1 21 3781 1 1 4 TYR H H -4.242 -3.822 1.161 1.00 . A A . 3 TYR H 1 1 21 3782 1 1 4 TYR HA H -5.037 -1.517 -0.406 1.00 . A A . 3 TYR HA 1 1 21 3783 1 1 4 TYR HB2 H -6.320 -0.949 1.606 1.00 . A A . 3 TYR HB2 1 1 21 3784 1 1 4 TYR HB3 H -6.498 -2.657 1.219 1.00 . A A . 3 TYR HB3 1 1 21 3785 1 1 4 TYR HD1 H -5.360 -4.384 2.578 1.00 . A A . 3 TYR HD1 1 1 21 3786 1 1 4 TYR HD2 H -5.146 -0.213 3.582 1.00 . A A . 3 TYR HD2 1 1 21 3787 1 1 4 TYR HE1 H -4.552 -4.971 4.849 1.00 . A A . 3 TYR HE1 1 1 21 3788 1 1 4 TYR HE2 H -4.342 -0.800 5.852 1.00 . A A . 3 TYR HE2 1 1 21 3789 1 1 4 TYR HH H -4.137 -2.508 7.342 1.00 . A A . 3 TYR HH 1 1 21 3790 1 1 4 TYR N N -4.054 -3.155 0.469 1.00 . A A . 3 TYR N 1 1 21 3791 1 1 4 TYR O O -3.428 0.230 0.300 1.00 . A A . 3 TYR O 1 1 21 3792 1 1 4 TYR OH O -3.949 -3.249 6.761 1.00 . A A . 3 TYR OH 1 1 21 3793 1 1 5 TRP C C -1.471 1.012 1.527 1.00 . A A . 4 TRP C 1 1 21 3794 1 1 5 TRP CA C -1.899 0.026 2.615 1.00 . A A . 4 TRP CA 1 1 21 3795 1 1 5 TRP CB C -0.691 -0.822 3.013 1.00 . A A . 4 TRP CB 1 1 21 3796 1 1 5 TRP CD1 C -1.798 -2.625 4.402 1.00 . A A . 4 TRP CD1 1 1 21 3797 1 1 5 TRP CD2 C -0.390 -1.352 5.598 1.00 . A A . 4 TRP CD2 1 1 21 3798 1 1 5 TRP CE2 C -0.925 -2.310 6.487 1.00 . A A . 4 TRP CE2 1 1 21 3799 1 1 5 TRP CE3 C 0.528 -0.421 6.101 1.00 . A A . 4 TRP CE3 1 1 21 3800 1 1 5 TRP CG C -0.962 -1.571 4.278 1.00 . A A . 4 TRP CG 1 1 21 3801 1 1 5 TRP CH2 C 0.355 -1.410 8.319 1.00 . A A . 4 TRP CH2 1 1 21 3802 1 1 5 TRP CZ2 C -0.561 -2.345 7.829 1.00 . A A . 4 TRP CZ2 1 1 21 3803 1 1 5 TRP CZ3 C 0.900 -0.449 7.455 1.00 . A A . 4 TRP CZ3 1 1 21 3804 1 1 5 TRP H H -3.109 -1.761 2.624 1.00 . A A . 4 TRP H 1 1 21 3805 1 1 5 TRP HA H -2.273 0.555 3.476 1.00 . A A . 4 TRP HA 1 1 21 3806 1 1 5 TRP HB2 H -0.475 -1.518 2.227 1.00 . A A . 4 TRP HB2 1 1 21 3807 1 1 5 TRP HB3 H 0.162 -0.176 3.159 1.00 . A A . 4 TRP HB3 1 1 21 3808 1 1 5 TRP HD1 H -2.378 -3.063 3.607 1.00 . A A . 4 TRP HD1 1 1 21 3809 1 1 5 TRP HE1 H -2.289 -3.821 6.062 1.00 . A A . 4 TRP HE1 1 1 21 3810 1 1 5 TRP HE3 H 0.951 0.320 5.441 1.00 . A A . 4 TRP HE3 1 1 21 3811 1 1 5 TRP HH2 H 0.642 -1.428 9.359 1.00 . A A . 4 TRP HH2 1 1 21 3812 1 1 5 TRP HZ2 H -0.984 -3.090 8.485 1.00 . A A . 4 TRP HZ2 1 1 21 3813 1 1 5 TRP HZ3 H 1.607 0.274 7.833 1.00 . A A . 4 TRP HZ3 1 1 21 3814 1 1 5 TRP N N -2.934 -0.954 2.109 1.00 . A A . 4 TRP N 1 1 21 3815 1 1 5 TRP NE1 N -1.771 -3.068 5.709 1.00 . A A . 4 TRP NE1 1 1 21 3816 1 1 5 TRP O O -1.520 2.211 1.702 1.00 . A A . 4 TRP O 1 1 21 3817 1 1 6 LEU C C -1.476 2.636 -0.811 1.00 . A A . 5 LEU C 1 1 21 3818 1 1 6 LEU CA C -0.613 1.364 -0.721 1.00 . A A . 5 LEU CA 1 1 21 3819 1 1 6 LEU CB C -0.801 0.462 -1.947 1.00 . A A . 5 LEU CB 1 1 21 3820 1 1 6 LEU CD1 C 0.275 1.978 -3.618 1.00 . A A . 5 LEU CD1 1 1 21 3821 1 1 6 LEU CD2 C -1.488 0.354 -4.334 1.00 . A A . 5 LEU CD2 1 1 21 3822 1 1 6 LEU CG C -1.030 1.290 -3.212 1.00 . A A . 5 LEU CG 1 1 21 3823 1 1 6 LEU H H -1.026 -0.477 0.305 1.00 . A A . 5 LEU H 1 1 21 3824 1 1 6 LEU HA H 0.428 1.623 -0.614 1.00 . A A . 5 LEU HA 1 1 21 3825 1 1 6 LEU HB2 H 0.080 -0.148 -2.077 1.00 . A A . 5 LEU HB2 1 1 21 3826 1 1 6 LEU HB3 H -1.655 -0.181 -1.785 1.00 . A A . 5 LEU HB3 1 1 21 3827 1 1 6 LEU HD11 H 0.997 1.880 -2.822 1.00 . A A . 5 LEU HD11 1 1 21 3828 1 1 6 LEU HD12 H 0.661 1.517 -4.514 1.00 . A A . 5 LEU HD12 1 1 21 3829 1 1 6 LEU HD13 H 0.086 3.025 -3.806 1.00 . A A . 5 LEU HD13 1 1 21 3830 1 1 6 LEU HD21 H -1.134 -0.647 -4.133 1.00 . A A . 5 LEU HD21 1 1 21 3831 1 1 6 LEU HD22 H -2.567 0.350 -4.381 1.00 . A A . 5 LEU HD22 1 1 21 3832 1 1 6 LEU HD23 H -1.088 0.696 -5.276 1.00 . A A . 5 LEU HD23 1 1 21 3833 1 1 6 LEU HG H -1.791 2.034 -3.029 1.00 . A A . 5 LEU HG 1 1 21 3834 1 1 6 LEU N N -1.052 0.497 0.408 1.00 . A A . 5 LEU N 1 1 21 3835 1 1 6 LEU O O -0.969 3.723 -1.007 1.00 . A A . 5 LEU O 1 1 21 3836 1 1 7 ALA C C -3.883 4.359 0.598 1.00 . A A . 6 ALA C 1 1 21 3837 1 1 7 ALA CA C -3.655 3.715 -0.779 1.00 . A A . 6 ALA CA 1 1 21 3838 1 1 7 ALA CB C -4.974 3.186 -1.342 1.00 . A A . 6 ALA CB 1 1 21 3839 1 1 7 ALA H H -3.164 1.625 -0.535 1.00 . A A . 6 ALA H 1 1 21 3840 1 1 7 ALA HA H -3.232 4.434 -1.461 1.00 . A A . 6 ALA HA 1 1 21 3841 1 1 7 ALA HB1 H -5.185 2.217 -0.914 1.00 . A A . 6 ALA HB1 1 1 21 3842 1 1 7 ALA HB2 H -5.771 3.870 -1.093 1.00 . A A . 6 ALA HB2 1 1 21 3843 1 1 7 ALA HB3 H -4.896 3.097 -2.415 1.00 . A A . 6 ALA HB3 1 1 21 3844 1 1 7 ALA N N -2.771 2.509 -0.684 1.00 . A A . 6 ALA N 1 1 21 3845 1 1 7 ALA O O -4.811 5.121 0.783 1.00 . A A . 6 ALA O 1 1 21 3846 1 1 8 HIS C C -1.899 5.054 3.515 1.00 . A A . 7 HIS C 1 1 21 3847 1 1 8 HIS CA C -3.254 4.660 2.923 1.00 . A A . 7 HIS CA 1 1 21 3848 1 1 8 HIS CB C -3.908 3.570 3.798 1.00 . A A . 7 HIS CB 1 1 21 3849 1 1 8 HIS CD2 C -4.523 1.939 1.832 1.00 . A A . 7 HIS CD2 1 1 21 3850 1 1 8 HIS CE1 C -6.558 1.477 2.405 1.00 . A A . 7 HIS CE1 1 1 21 3851 1 1 8 HIS CG C -4.776 2.650 2.973 1.00 . A A . 7 HIS CG 1 1 21 3852 1 1 8 HIS H H -2.318 3.440 1.406 1.00 . A A . 7 HIS H 1 1 21 3853 1 1 8 HIS HA H -3.901 5.521 2.863 1.00 . A A . 7 HIS HA 1 1 21 3854 1 1 8 HIS HB2 H -3.134 2.989 4.275 1.00 . A A . 7 HIS HB2 1 1 21 3855 1 1 8 HIS HB3 H -4.514 4.041 4.558 1.00 . A A . 7 HIS HB3 1 1 21 3856 1 1 8 HIS HD1 H -6.574 2.692 4.099 1.00 . A A . 7 HIS HD1 1 1 21 3857 1 1 8 HIS HD2 H -3.595 1.965 1.284 1.00 . A A . 7 HIS HD2 1 1 21 3858 1 1 8 HIS HE1 H -7.550 1.052 2.421 1.00 . A A . 7 HIS HE1 1 1 21 3859 1 1 8 HIS HE2 H -5.744 0.606 0.705 1.00 . A A . 7 HIS HE2 1 1 21 3860 1 1 8 HIS N N -3.059 4.061 1.567 1.00 . A A . 7 HIS N 1 1 21 3861 1 1 8 HIS ND1 N -6.084 2.343 3.325 1.00 . A A . 7 HIS ND1 1 1 21 3862 1 1 8 HIS NE2 N -5.645 1.202 1.477 1.00 . A A . 7 HIS NE2 1 1 21 3863 1 1 8 HIS O O -1.499 4.563 4.552 1.00 . A A . 7 HIS O 1 1 21 3864 1 1 9 LYS C C 0.071 7.767 3.959 1.00 . A A . 8 LYS C 1 1 21 3865 1 1 9 LYS CA C 0.143 6.346 3.395 1.00 . A A . 8 LYS CA 1 1 21 3866 1 1 9 LYS CB C 1.082 6.292 2.190 1.00 . A A . 8 LYS CB 1 1 21 3867 1 1 9 LYS CD C 2.146 4.083 2.670 1.00 . A A . 8 LYS CD 1 1 21 3868 1 1 9 LYS CE C 3.098 3.202 1.859 1.00 . A A . 8 LYS CE 1 1 21 3869 1 1 9 LYS CG C 1.220 4.843 1.718 1.00 . A A . 8 LYS CG 1 1 21 3870 1 1 9 LYS H H -1.523 6.315 2.029 1.00 . A A . 8 LYS H 1 1 21 3871 1 1 9 LYS HA H 0.478 5.655 4.153 1.00 . A A . 8 LYS HA 1 1 21 3872 1 1 9 LYS HB2 H 0.675 6.895 1.390 1.00 . A A . 8 LYS HB2 1 1 21 3873 1 1 9 LYS HB3 H 2.053 6.672 2.470 1.00 . A A . 8 LYS HB3 1 1 21 3874 1 1 9 LYS HD2 H 2.716 4.789 3.257 1.00 . A A . 8 LYS HD2 1 1 21 3875 1 1 9 LYS HD3 H 1.556 3.463 3.327 1.00 . A A . 8 LYS HD3 1 1 21 3876 1 1 9 LYS HE2 H 3.187 2.227 2.316 1.00 . A A . 8 LYS HE2 1 1 21 3877 1 1 9 LYS HE3 H 2.754 3.114 0.841 1.00 . A A . 8 LYS HE3 1 1 21 3878 1 1 9 LYS HG2 H 0.247 4.373 1.710 1.00 . A A . 8 LYS HG2 1 1 21 3879 1 1 9 LYS HG3 H 1.638 4.826 0.723 1.00 . A A . 8 LYS HG3 1 1 21 3880 1 1 9 LYS HZ1 H 4.260 4.918 1.652 1.00 . A A . 8 LYS HZ1 1 1 21 3881 1 1 9 LYS HZ2 H 4.812 3.847 2.851 1.00 . A A . 8 LYS HZ2 1 1 21 3882 1 1 9 LYS HZ3 H 5.055 3.486 1.208 1.00 . A A . 8 LYS HZ3 1 1 21 3883 1 1 9 LYS N N -1.187 5.932 2.865 1.00 . A A . 8 LYS N 1 1 21 3884 1 1 9 LYS NZ N 4.405 3.917 1.895 1.00 . A A . 8 LYS NZ 1 1 21 3885 1 1 9 LYS O O -0.986 8.255 4.307 1.00 . A A . 8 LYS O 1 1 21 3886 1 1 10 ALA C C 0.376 10.742 3.677 1.00 . A A . 9 ALA C 1 1 21 3887 1 1 10 ALA CA C 1.185 9.824 4.595 1.00 . A A . 9 ALA CA 1 1 21 3888 1 1 10 ALA CB C 2.654 10.245 4.619 1.00 . A A . 9 ALA CB 1 1 21 3889 1 1 10 ALA H H 2.030 8.023 3.768 1.00 . A A . 9 ALA H 1 1 21 3890 1 1 10 ALA HA H 0.780 9.838 5.595 1.00 . A A . 9 ALA HA 1 1 21 3891 1 1 10 ALA HB1 H 3.250 9.447 5.036 1.00 . A A . 9 ALA HB1 1 1 21 3892 1 1 10 ALA HB2 H 2.984 10.453 3.612 1.00 . A A . 9 ALA HB2 1 1 21 3893 1 1 10 ALA HB3 H 2.764 11.132 5.225 1.00 . A A . 9 ALA HB3 1 1 21 3894 1 1 10 ALA N N 1.189 8.435 4.054 1.00 . A A . 9 ALA N 1 1 21 3895 1 1 10 ALA O O 0.798 11.073 2.587 1.00 . A A . 9 ALA O 1 1 21 3896 1 1 11 LEU C C -2.685 12.743 4.105 1.00 . A A . 10 LEU C 1 1 21 3897 1 1 11 LEU CA C -1.619 12.044 3.255 1.00 . A A . 10 LEU CA 1 1 21 3898 1 1 11 LEU CB C -2.264 11.110 2.229 1.00 . A A . 10 LEU CB 1 1 21 3899 1 1 11 LEU CD1 C -4.749 10.873 2.325 1.00 . A A . 10 LEU CD1 1 1 21 3900 1 1 11 LEU CD2 C -3.290 8.860 2.559 1.00 . A A . 10 LEU CD2 1 1 21 3901 1 1 11 LEU CG C -3.422 10.349 2.877 1.00 . A A . 10 LEU CG 1 1 21 3902 1 1 11 LEU H H -1.108 10.871 4.989 1.00 . A A . 10 LEU H 1 1 21 3903 1 1 11 LEU HA H -1.001 12.769 2.753 1.00 . A A . 10 LEU HA 1 1 21 3904 1 1 11 LEU HB2 H -2.633 11.690 1.397 1.00 . A A . 10 LEU HB2 1 1 21 3905 1 1 11 LEU HB3 H -1.528 10.402 1.875 1.00 . A A . 10 LEU HB3 1 1 21 3906 1 1 11 LEU HD11 H -4.681 11.940 2.176 1.00 . A A . 10 LEU HD11 1 1 21 3907 1 1 11 LEU HD12 H -4.963 10.391 1.382 1.00 . A A . 10 LEU HD12 1 1 21 3908 1 1 11 LEU HD13 H -5.542 10.657 3.027 1.00 . A A . 10 LEU HD13 1 1 21 3909 1 1 11 LEU HD21 H -2.322 8.672 2.116 1.00 . A A . 10 LEU HD21 1 1 21 3910 1 1 11 LEU HD22 H -3.387 8.287 3.469 1.00 . A A . 10 LEU HD22 1 1 21 3911 1 1 11 LEU HD23 H -4.065 8.569 1.866 1.00 . A A . 10 LEU HD23 1 1 21 3912 1 1 11 LEU HG H -3.395 10.496 3.947 1.00 . A A . 10 LEU HG 1 1 21 3913 1 1 11 LEU N N -0.784 11.152 4.107 1.00 . A A . 10 LEU N 1 1 21 3914 1 1 11 LEU O O -2.876 12.426 5.262 1.00 . A A . 10 LEU O 1 1 21 3915 1 1 12 ALA C C -3.835 15.009 5.590 1.00 . A A . 11 ALA C 1 1 21 3916 1 1 12 ALA CA C -4.434 14.407 4.315 1.00 . A A . 11 ALA CA 1 1 21 3917 1 1 12 ALA CB C -5.466 13.333 4.663 1.00 . A A . 11 ALA CB 1 1 21 3918 1 1 12 ALA H H -3.212 13.933 2.604 1.00 . A A . 11 ALA H 1 1 21 3919 1 1 12 ALA HA H -4.890 15.175 3.713 1.00 . A A . 11 ALA HA 1 1 21 3920 1 1 12 ALA HB1 H -4.957 12.417 4.921 1.00 . A A . 11 ALA HB1 1 1 21 3921 1 1 12 ALA HB2 H -6.061 13.664 5.502 1.00 . A A . 11 ALA HB2 1 1 21 3922 1 1 12 ALA HB3 H -6.107 13.162 3.811 1.00 . A A . 11 ALA HB3 1 1 21 3923 1 1 12 ALA N N -3.381 13.691 3.540 1.00 . A A . 11 ALA N 1 1 21 3924 1 1 12 ALA O O -2.631 15.095 5.733 1.00 . A A . 11 ALA O 1 1 21 3925 1 1 13 NH2 HN1 H -5.604 15.365 6.417 1.00 . A A . 12 NH2 HN1 1 1 21 3926 1 1 13 NH2 HN2 H -4.263 15.820 7.351 1.00 . A A . 12 NH2 HN2 1 1 21 3927 1 1 13 NH2 N N -4.633 15.434 6.531 1.00 . A A . 12 NH2 N 1 1 22 3928 1 1 2 ILE C C -2.008 -5.069 1.579 1.00 . A A . 1 ILE C 1 1 22 3929 1 1 2 ILE CA C -0.854 -5.313 2.553 1.00 . A A . 1 ILE CA 1 1 22 3930 1 1 2 ILE CB C 0.477 -4.755 2.018 1.00 . A A . 1 ILE CB 1 1 22 3931 1 1 2 ILE CD1 C 2.526 -3.501 2.738 1.00 . A A . 1 ILE CD1 1 1 22 3932 1 1 2 ILE CG1 C 1.321 -4.307 3.217 1.00 . A A . 1 ILE CG1 1 1 22 3933 1 1 2 ILE CG2 C 0.232 -3.558 1.076 1.00 . A A . 1 ILE CG2 1 1 22 3934 1 1 2 ILE H H 0.276 -7.142 2.679 1.00 . A A . 1 ILE H 1 1 22 3935 1 1 2 ILE HA H -1.072 -4.867 3.505 1.00 . A A . 1 ILE HA 1 1 22 3936 1 1 2 ILE HB H 1.000 -5.532 1.482 1.00 . A A . 1 ILE HB 1 1 22 3937 1 1 2 ILE HD11 H 2.500 -3.422 1.661 1.00 . A A . 1 ILE HD11 1 1 22 3938 1 1 2 ILE HD12 H 2.493 -2.514 3.173 1.00 . A A . 1 ILE HD12 1 1 22 3939 1 1 2 ILE HD13 H 3.435 -3.998 3.040 1.00 . A A . 1 ILE HD13 1 1 22 3940 1 1 2 ILE HG12 H 0.717 -3.692 3.871 1.00 . A A . 1 ILE HG12 1 1 22 3941 1 1 2 ILE HG13 H 1.665 -5.177 3.759 1.00 . A A . 1 ILE HG13 1 1 22 3942 1 1 2 ILE HG21 H -0.775 -3.190 1.211 1.00 . A A . 1 ILE HG21 1 1 22 3943 1 1 2 ILE HG22 H 0.930 -2.767 1.294 1.00 . A A . 1 ILE HG22 1 1 22 3944 1 1 2 ILE HG23 H 0.359 -3.875 0.052 1.00 . A A . 1 ILE HG23 1 1 22 3945 1 1 2 ILE N N -0.632 -6.775 2.711 1.00 . A A . 1 ILE N 1 1 22 3946 1 1 2 ILE O O -3.128 -4.827 1.977 1.00 . A A . 1 ILE O 1 1 22 3947 1 1 3 ASP C C -3.344 -3.469 -0.569 1.00 . A A . 2 ASP C 1 1 22 3948 1 1 3 ASP CA C -2.796 -4.889 -0.705 1.00 . A A . 2 ASP CA 1 1 22 3949 1 1 3 ASP CB C -3.882 -5.921 -0.399 1.00 . A A . 2 ASP CB 1 1 22 3950 1 1 3 ASP CG C -4.775 -6.102 -1.628 1.00 . A A . 2 ASP CG 1 1 22 3951 1 1 3 ASP H H -0.819 -5.323 0.022 1.00 . A A . 2 ASP H 1 1 22 3952 1 1 3 ASP HA H -2.409 -5.041 -1.698 1.00 . A A . 2 ASP HA 1 1 22 3953 1 1 3 ASP HB2 H -3.420 -6.865 -0.146 1.00 . A A . 2 ASP HB2 1 1 22 3954 1 1 3 ASP HB3 H -4.481 -5.579 0.431 1.00 . A A . 2 ASP HB3 1 1 22 3955 1 1 3 ASP N N -1.733 -5.128 0.309 1.00 . A A . 2 ASP N 1 1 22 3956 1 1 3 ASP O O -3.139 -2.631 -1.424 1.00 . A A . 2 ASP O 1 1 22 3957 1 1 3 ASP OD1 O -5.012 -5.121 -2.313 1.00 . A A . 2 ASP OD1 1 1 22 3958 1 1 3 ASP OD2 O -5.207 -7.218 -1.863 1.00 . A A . 2 ASP OD2 1 1 22 3959 1 1 4 TYR C C -3.538 -0.812 1.081 1.00 . A A . 3 TYR C 1 1 22 3960 1 1 4 TYR CA C -4.614 -1.826 0.660 1.00 . A A . 3 TYR CA 1 1 22 3961 1 1 4 TYR CB C -5.730 -1.961 1.709 1.00 . A A . 3 TYR CB 1 1 22 3962 1 1 4 TYR CD1 C -4.965 -3.695 3.373 1.00 . A A . 3 TYR CD1 1 1 22 3963 1 1 4 TYR CD2 C -4.857 -1.353 3.991 1.00 . A A . 3 TYR CD2 1 1 22 3964 1 1 4 TYR CE1 C -4.453 -4.046 4.628 1.00 . A A . 3 TYR CE1 1 1 22 3965 1 1 4 TYR CE2 C -4.345 -1.704 5.244 1.00 . A A . 3 TYR CE2 1 1 22 3966 1 1 4 TYR CG C -5.166 -2.347 3.055 1.00 . A A . 3 TYR CG 1 1 22 3967 1 1 4 TYR CZ C -4.144 -3.050 5.561 1.00 . A A . 3 TYR CZ 1 1 22 3968 1 1 4 TYR H H -4.209 -3.884 1.165 1.00 . A A . 3 TYR H 1 1 22 3969 1 1 4 TYR HA H -5.046 -1.508 -0.271 1.00 . A A . 3 TYR HA 1 1 22 3970 1 1 4 TYR HB2 H -6.247 -1.017 1.801 1.00 . A A . 3 TYR HB2 1 1 22 3971 1 1 4 TYR HB3 H -6.430 -2.717 1.386 1.00 . A A . 3 TYR HB3 1 1 22 3972 1 1 4 TYR HD1 H -5.202 -4.462 2.651 1.00 . A A . 3 TYR HD1 1 1 22 3973 1 1 4 TYR HD2 H -5.011 -0.313 3.746 1.00 . A A . 3 TYR HD2 1 1 22 3974 1 1 4 TYR HE1 H -4.297 -5.086 4.875 1.00 . A A . 3 TYR HE1 1 1 22 3975 1 1 4 TYR HE2 H -4.105 -0.936 5.965 1.00 . A A . 3 TYR HE2 1 1 22 3976 1 1 4 TYR HH H -4.386 -3.567 7.384 1.00 . A A . 3 TYR HH 1 1 22 3977 1 1 4 TYR N N -4.048 -3.193 0.490 1.00 . A A . 3 TYR N 1 1 22 3978 1 1 4 TYR O O -3.355 0.175 0.405 1.00 . A A . 3 TYR O 1 1 22 3979 1 1 4 TYR OH O -3.643 -3.399 6.799 1.00 . A A . 3 TYR OH 1 1 22 3980 1 1 5 TRP C C -1.380 0.918 1.603 1.00 . A A . 4 TRP C 1 1 22 3981 1 1 5 TRP CA C -1.766 -0.111 2.670 1.00 . A A . 4 TRP CA 1 1 22 3982 1 1 5 TRP CB C -0.552 -0.995 2.966 1.00 . A A . 4 TRP CB 1 1 22 3983 1 1 5 TRP CD1 C -1.633 -2.841 4.334 1.00 . A A . 4 TRP CD1 1 1 22 3984 1 1 5 TRP CD2 C -0.091 -1.690 5.489 1.00 . A A . 4 TRP CD2 1 1 22 3985 1 1 5 TRP CE2 C -0.600 -2.675 6.365 1.00 . A A . 4 TRP CE2 1 1 22 3986 1 1 5 TRP CE3 C 0.899 -0.826 5.969 1.00 . A A . 4 TRP CE3 1 1 22 3987 1 1 5 TRP CG C -0.766 -1.811 4.206 1.00 . A A . 4 TRP CG 1 1 22 3988 1 1 5 TRP CH2 C 0.848 -1.926 8.140 1.00 . A A . 4 TRP CH2 1 1 22 3989 1 1 5 TRP CZ2 C -0.140 -2.796 7.674 1.00 . A A . 4 TRP CZ2 1 1 22 3990 1 1 5 TRP CZ3 C 1.369 -0.941 7.288 1.00 . A A . 4 TRP CZ3 1 1 22 3991 1 1 5 TRP H H -3.014 -1.865 2.678 1.00 . A A . 4 TRP H 1 1 22 3992 1 1 5 TRP HA H -2.085 0.384 3.572 1.00 . A A . 4 TRP HA 1 1 22 3993 1 1 5 TRP HB2 H -0.386 -1.651 2.135 1.00 . A A . 4 TRP HB2 1 1 22 3994 1 1 5 TRP HB3 H 0.317 -0.368 3.100 1.00 . A A . 4 TRP HB3 1 1 22 3995 1 1 5 TRP HD1 H -2.289 -3.214 3.565 1.00 . A A . 4 TRP HD1 1 1 22 3996 1 1 5 TRP HE1 H -2.054 -4.106 5.965 1.00 . A A . 4 TRP HE1 1 1 22 3997 1 1 5 TRP HE3 H 1.304 -0.073 5.317 1.00 . A A . 4 TRP HE3 1 1 22 3998 1 1 5 TRP HH2 H 1.210 -2.012 9.153 1.00 . A A . 4 TRP HH2 1 1 22 3999 1 1 5 TRP HZ2 H -0.546 -3.558 8.324 1.00 . A A . 4 TRP HZ2 1 1 22 4000 1 1 5 TRP HZ3 H 2.132 -0.268 7.648 1.00 . A A . 4 TRP HZ3 1 1 22 4001 1 1 5 TRP N N -2.837 -1.055 2.175 1.00 . A A . 4 TRP N 1 1 22 4002 1 1 5 TRP NE1 N -1.530 -3.355 5.614 1.00 . A A . 4 TRP NE1 1 1 22 4003 1 1 5 TRP O O -1.463 2.112 1.809 1.00 . A A . 4 TRP O 1 1 22 4004 1 1 6 LEU C C -1.414 2.612 -0.694 1.00 . A A . 5 LEU C 1 1 22 4005 1 1 6 LEU CA C -0.546 1.343 -0.648 1.00 . A A . 5 LEU CA 1 1 22 4006 1 1 6 LEU CB C -0.754 0.475 -1.896 1.00 . A A . 5 LEU CB 1 1 22 4007 1 1 6 LEU CD1 C 0.340 2.052 -3.499 1.00 . A A . 5 LEU CD1 1 1 22 4008 1 1 6 LEU CD2 C -1.401 0.444 -4.297 1.00 . A A . 5 LEU CD2 1 1 22 4009 1 1 6 LEU CG C -0.967 1.342 -3.136 1.00 . A A . 5 LEU CG 1 1 22 4010 1 1 6 LEU H H -0.901 -0.529 0.346 1.00 . A A . 5 LEU H 1 1 22 4011 1 1 6 LEU HA H 0.495 1.603 -0.556 1.00 . A A . 5 LEU HA 1 1 22 4012 1 1 6 LEU HB2 H 0.116 -0.150 -2.043 1.00 . A A . 5 LEU HB2 1 1 22 4013 1 1 6 LEU HB3 H -1.620 -0.154 -1.750 1.00 . A A . 5 LEU HB3 1 1 22 4014 1 1 6 LEU HD11 H 1.111 1.767 -2.800 1.00 . A A . 5 LEU HD11 1 1 22 4015 1 1 6 LEU HD12 H 0.637 1.770 -4.498 1.00 . A A . 5 LEU HD12 1 1 22 4016 1 1 6 LEU HD13 H 0.192 3.121 -3.455 1.00 . A A . 5 LEU HD13 1 1 22 4017 1 1 6 LEU HD21 H -2.294 -0.098 -4.018 1.00 . A A . 5 LEU HD21 1 1 22 4018 1 1 6 LEU HD22 H -1.605 1.050 -5.166 1.00 . A A . 5 LEU HD22 1 1 22 4019 1 1 6 LEU HD23 H -0.612 -0.259 -4.523 1.00 . A A . 5 LEU HD23 1 1 22 4020 1 1 6 LEU HG H -1.735 2.075 -2.939 1.00 . A A . 5 LEU HG 1 1 22 4021 1 1 6 LEU N N -0.955 0.442 0.468 1.00 . A A . 5 LEU N 1 1 22 4022 1 1 6 LEU O O -0.909 3.709 -0.827 1.00 . A A . 5 LEU O 1 1 22 4023 1 1 7 ALA C C -3.860 4.272 0.724 1.00 . A A . 6 ALA C 1 1 22 4024 1 1 7 ALA CA C -3.590 3.684 -0.671 1.00 . A A . 6 ALA CA 1 1 22 4025 1 1 7 ALA CB C -4.892 3.183 -1.294 1.00 . A A . 6 ALA CB 1 1 22 4026 1 1 7 ALA H H -3.104 1.584 -0.515 1.00 . A A . 6 ALA H 1 1 22 4027 1 1 7 ALA HA H -3.149 4.431 -1.310 1.00 . A A . 6 ALA HA 1 1 22 4028 1 1 7 ALA HB1 H -4.697 2.285 -1.861 1.00 . A A . 6 ALA HB1 1 1 22 4029 1 1 7 ALA HB2 H -5.606 2.967 -0.513 1.00 . A A . 6 ALA HB2 1 1 22 4030 1 1 7 ALA HB3 H -5.294 3.943 -1.949 1.00 . A A . 6 ALA HB3 1 1 22 4031 1 1 7 ALA N N -2.709 2.476 -0.607 1.00 . A A . 6 ALA N 1 1 22 4032 1 1 7 ALA O O -4.846 4.951 0.929 1.00 . A A . 6 ALA O 1 1 22 4033 1 1 8 HIS C C -1.993 5.273 3.582 1.00 . A A . 7 HIS C 1 1 22 4034 1 1 8 HIS CA C -3.256 4.591 3.048 1.00 . A A . 7 HIS CA 1 1 22 4035 1 1 8 HIS CB C -3.640 3.398 3.935 1.00 . A A . 7 HIS CB 1 1 22 4036 1 1 8 HIS CD2 C -4.453 1.853 1.983 1.00 . A A . 7 HIS CD2 1 1 22 4037 1 1 8 HIS CE1 C -6.388 1.297 2.777 1.00 . A A . 7 HIS CE1 1 1 22 4038 1 1 8 HIS CG C -4.575 2.484 3.189 1.00 . A A . 7 HIS CG 1 1 22 4039 1 1 8 HIS H H -2.214 3.477 1.513 1.00 . A A . 7 HIS H 1 1 22 4040 1 1 8 HIS HA H -4.072 5.296 3.014 1.00 . A A . 7 HIS HA 1 1 22 4041 1 1 8 HIS HB2 H -2.749 2.852 4.208 1.00 . A A . 7 HIS HB2 1 1 22 4042 1 1 8 HIS HB3 H -4.127 3.758 4.829 1.00 . A A . 7 HIS HB3 1 1 22 4043 1 1 8 HIS HD1 H -6.214 2.402 4.535 1.00 . A A . 7 HIS HD1 1 1 22 4044 1 1 8 HIS HD2 H -3.600 1.933 1.332 1.00 . A A . 7 HIS HD2 1 1 22 4045 1 1 8 HIS HE1 H -7.359 0.842 2.890 1.00 . A A . 7 HIS HE1 1 1 22 4046 1 1 8 HIS HE2 H -5.777 0.560 0.933 1.00 . A A . 7 HIS HE2 1 1 22 4047 1 1 8 HIS N N -3.007 4.027 1.685 1.00 . A A . 7 HIS N 1 1 22 4048 1 1 8 HIS ND1 N -5.820 2.117 3.684 1.00 . A A . 7 HIS ND1 1 1 22 4049 1 1 8 HIS NE2 N -5.594 1.106 1.725 1.00 . A A . 7 HIS NE2 1 1 22 4050 1 1 8 HIS O O -1.926 6.482 3.679 1.00 . A A . 7 HIS O 1 1 22 4051 1 1 9 LYS C C -0.079 6.233 5.447 1.00 . A A . 8 LYS C 1 1 22 4052 1 1 9 LYS CA C 0.257 5.116 4.460 1.00 . A A . 8 LYS CA 1 1 22 4053 1 1 9 LYS CB C 0.975 5.672 3.230 1.00 . A A . 8 LYS CB 1 1 22 4054 1 1 9 LYS CD C 2.401 3.695 2.683 1.00 . A A . 8 LYS CD 1 1 22 4055 1 1 9 LYS CE C 2.002 2.218 2.696 1.00 . A A . 8 LYS CE 1 1 22 4056 1 1 9 LYS CG C 1.212 4.543 2.225 1.00 . A A . 8 LYS CG 1 1 22 4057 1 1 9 LYS H H -1.062 3.542 3.849 1.00 . A A . 8 LYS H 1 1 22 4058 1 1 9 LYS HA H 0.869 4.367 4.936 1.00 . A A . 8 LYS HA 1 1 22 4059 1 1 9 LYS HB2 H 0.366 6.440 2.773 1.00 . A A . 8 LYS HB2 1 1 22 4060 1 1 9 LYS HB3 H 1.925 6.092 3.524 1.00 . A A . 8 LYS HB3 1 1 22 4061 1 1 9 LYS HD2 H 3.228 3.840 2.003 1.00 . A A . 8 LYS HD2 1 1 22 4062 1 1 9 LYS HD3 H 2.695 3.996 3.677 1.00 . A A . 8 LYS HD3 1 1 22 4063 1 1 9 LYS HE2 H 1.703 1.920 3.691 1.00 . A A . 8 LYS HE2 1 1 22 4064 1 1 9 LYS HE3 H 1.205 2.038 1.992 1.00 . A A . 8 LYS HE3 1 1 22 4065 1 1 9 LYS HG2 H 0.329 3.923 2.165 1.00 . A A . 8 LYS HG2 1 1 22 4066 1 1 9 LYS HG3 H 1.425 4.963 1.254 1.00 . A A . 8 LYS HG3 1 1 22 4067 1 1 9 LYS HZ1 H 4.060 1.912 2.736 1.00 . A A . 8 LYS HZ1 1 1 22 4068 1 1 9 LYS HZ2 H 3.150 0.488 2.562 1.00 . A A . 8 LYS HZ2 1 1 22 4069 1 1 9 LYS HZ3 H 3.333 1.542 1.246 1.00 . A A . 8 LYS HZ3 1 1 22 4070 1 1 9 LYS N N -0.993 4.510 3.932 1.00 . A A . 8 LYS N 1 1 22 4071 1 1 9 LYS NZ N 3.228 1.484 2.279 1.00 . A A . 8 LYS NZ 1 1 22 4072 1 1 9 LYS O O -1.011 6.135 6.221 1.00 . A A . 8 LYS O 1 1 22 4073 1 1 10 ALA C C -0.594 9.402 5.734 1.00 . A A . 9 ALA C 1 1 22 4074 1 1 10 ALA CA C 0.403 8.422 6.359 1.00 . A A . 9 ALA CA 1 1 22 4075 1 1 10 ALA CB C 1.759 9.096 6.565 1.00 . A A . 9 ALA CB 1 1 22 4076 1 1 10 ALA H H 1.414 7.343 4.792 1.00 . A A . 9 ALA H 1 1 22 4077 1 1 10 ALA HA H 0.029 8.053 7.300 1.00 . A A . 9 ALA HA 1 1 22 4078 1 1 10 ALA HB1 H 2.547 8.369 6.437 1.00 . A A . 9 ALA HB1 1 1 22 4079 1 1 10 ALA HB2 H 1.882 9.889 5.841 1.00 . A A . 9 ALA HB2 1 1 22 4080 1 1 10 ALA HB3 H 1.808 9.509 7.562 1.00 . A A . 9 ALA HB3 1 1 22 4081 1 1 10 ALA N N 0.672 7.292 5.424 1.00 . A A . 9 ALA N 1 1 22 4082 1 1 10 ALA O O -0.495 10.600 5.911 1.00 . A A . 9 ALA O 1 1 22 4083 1 1 11 LEU C C -3.940 9.159 4.378 1.00 . A A . 10 LEU C 1 1 22 4084 1 1 11 LEU CA C -2.553 9.808 4.369 1.00 . A A . 10 LEU CA 1 1 22 4085 1 1 11 LEU CB C -2.061 9.998 2.933 1.00 . A A . 10 LEU CB 1 1 22 4086 1 1 11 LEU CD1 C 0.305 10.758 2.678 1.00 . A A . 10 LEU CD1 1 1 22 4087 1 1 11 LEU CD2 C -1.554 12.100 1.686 1.00 . A A . 10 LEU CD2 1 1 22 4088 1 1 11 LEU CG C -1.142 11.217 2.867 1.00 . A A . 10 LEU CG 1 1 22 4089 1 1 11 LEU H H -1.616 7.933 4.872 1.00 . A A . 10 LEU H 1 1 22 4090 1 1 11 LEU HA H -2.578 10.759 4.877 1.00 . A A . 10 LEU HA 1 1 22 4091 1 1 11 LEU HB2 H -1.516 9.118 2.621 1.00 . A A . 10 LEU HB2 1 1 22 4092 1 1 11 LEU HB3 H -2.906 10.149 2.279 1.00 . A A . 10 LEU HB3 1 1 22 4093 1 1 11 LEU HD11 H 0.350 10.028 1.884 1.00 . A A . 10 LEU HD11 1 1 22 4094 1 1 11 LEU HD12 H 0.921 11.607 2.421 1.00 . A A . 10 LEU HD12 1 1 22 4095 1 1 11 LEU HD13 H 0.664 10.316 3.595 1.00 . A A . 10 LEU HD13 1 1 22 4096 1 1 11 LEU HD21 H -2.631 12.150 1.633 1.00 . A A . 10 LEU HD21 1 1 22 4097 1 1 11 LEU HD22 H -1.154 13.094 1.823 1.00 . A A . 10 LEU HD22 1 1 22 4098 1 1 11 LEU HD23 H -1.168 11.679 0.770 1.00 . A A . 10 LEU HD23 1 1 22 4099 1 1 11 LEU HG H -1.224 11.780 3.786 1.00 . A A . 10 LEU HG 1 1 22 4100 1 1 11 LEU N N -1.553 8.903 5.004 1.00 . A A . 10 LEU N 1 1 22 4101 1 1 11 LEU O O -4.084 7.987 4.660 1.00 . A A . 10 LEU O 1 1 22 4102 1 1 12 ALA C C -6.739 8.956 2.637 1.00 . A A . 11 ALA C 1 1 22 4103 1 1 12 ALA CA C -6.336 9.341 4.063 1.00 . A A . 11 ALA CA 1 1 22 4104 1 1 12 ALA CB C -7.233 10.461 4.590 1.00 . A A . 11 ALA CB 1 1 22 4105 1 1 12 ALA H H -4.820 10.857 3.847 1.00 . A A . 11 ALA H 1 1 22 4106 1 1 12 ALA HA H -6.392 8.484 4.716 1.00 . A A . 11 ALA HA 1 1 22 4107 1 1 12 ALA HB1 H -6.627 11.205 5.085 1.00 . A A . 11 ALA HB1 1 1 22 4108 1 1 12 ALA HB2 H -7.761 10.917 3.765 1.00 . A A . 11 ALA HB2 1 1 22 4109 1 1 12 ALA HB3 H -7.945 10.052 5.291 1.00 . A A . 11 ALA HB3 1 1 22 4110 1 1 12 ALA N N -4.959 9.914 4.072 1.00 . A A . 11 ALA N 1 1 22 4111 1 1 12 ALA O O -5.897 8.717 1.794 1.00 . A A . 11 ALA O 1 1 22 4112 1 1 13 NH2 HN1 H -8.686 9.078 3.007 1.00 . A A . 12 NH2 HN1 1 1 22 4113 1 1 13 NH2 HN2 H -8.275 8.641 1.419 1.00 . A A . 12 NH2 HN2 1 1 22 4114 1 1 13 NH2 N N -8.005 8.886 2.328 1.00 . A A . 12 NH2 N 1 1 23 4115 1 1 2 ILE C C -1.983 -4.981 1.611 1.00 . A A . 1 ILE C 1 1 23 4116 1 1 2 ILE CA C -0.830 -5.201 2.589 1.00 . A A . 1 ILE CA 1 1 23 4117 1 1 2 ILE CB C 0.494 -4.622 2.056 1.00 . A A . 1 ILE CB 1 1 23 4118 1 1 2 ILE CD1 C 1.860 -5.238 4.054 1.00 . A A . 1 ILE CD1 1 1 23 4119 1 1 2 ILE CG1 C 1.300 -4.075 3.236 1.00 . A A . 1 ILE CG1 1 1 23 4120 1 1 2 ILE CG2 C 0.244 -3.480 1.053 1.00 . A A . 1 ILE CG2 1 1 23 4121 1 1 2 ILE H H 0.332 -7.010 2.720 1.00 . A A . 1 ILE H 1 1 23 4122 1 1 2 ILE HA H -1.057 -4.763 3.542 1.00 . A A . 1 ILE HA 1 1 23 4123 1 1 2 ILE HB H 1.054 -5.404 1.573 1.00 . A A . 1 ILE HB 1 1 23 4124 1 1 2 ILE HD11 H 2.203 -6.016 3.387 1.00 . A A . 1 ILE HD11 1 1 23 4125 1 1 2 ILE HD12 H 2.687 -4.890 4.656 1.00 . A A . 1 ILE HD12 1 1 23 4126 1 1 2 ILE HD13 H 1.088 -5.631 4.697 1.00 . A A . 1 ILE HD13 1 1 23 4127 1 1 2 ILE HG12 H 2.113 -3.468 2.865 1.00 . A A . 1 ILE HG12 1 1 23 4128 1 1 2 ILE HG13 H 0.657 -3.474 3.863 1.00 . A A . 1 ILE HG13 1 1 23 4129 1 1 2 ILE HG21 H -0.761 -3.100 1.175 1.00 . A A . 1 ILE HG21 1 1 23 4130 1 1 2 ILE HG22 H 0.950 -2.683 1.230 1.00 . A A . 1 ILE HG22 1 1 23 4131 1 1 2 ILE HG23 H 0.365 -3.849 0.046 1.00 . A A . 1 ILE HG23 1 1 23 4132 1 1 2 ILE N N -0.583 -6.659 2.744 1.00 . A A . 1 ILE N 1 1 23 4133 1 1 2 ILE O O -3.100 -4.717 2.003 1.00 . A A . 1 ILE O 1 1 23 4134 1 1 3 ASP C C -3.331 -3.460 -0.575 1.00 . A A . 2 ASP C 1 1 23 4135 1 1 3 ASP CA C -2.768 -4.875 -0.682 1.00 . A A . 2 ASP CA 1 1 23 4136 1 1 3 ASP CB C -3.845 -5.914 -0.365 1.00 . A A . 2 ASP CB 1 1 23 4137 1 1 3 ASP CG C -3.985 -6.878 -1.545 1.00 . A A . 2 ASP CG 1 1 23 4138 1 1 3 ASP H H -0.796 -5.299 0.064 1.00 . A A . 2 ASP H 1 1 23 4139 1 1 3 ASP HA H -2.375 -5.039 -1.671 1.00 . A A . 2 ASP HA 1 1 23 4140 1 1 3 ASP HB2 H -3.563 -6.465 0.520 1.00 . A A . 2 ASP HB2 1 1 23 4141 1 1 3 ASP HB3 H -4.787 -5.416 -0.196 1.00 . A A . 2 ASP HB3 1 1 23 4142 1 1 3 ASP N N -1.709 -5.086 0.343 1.00 . A A . 2 ASP N 1 1 23 4143 1 1 3 ASP O O -3.106 -2.626 -1.428 1.00 . A A . 2 ASP O 1 1 23 4144 1 1 3 ASP OD1 O -3.992 -6.409 -2.671 1.00 . A A . 2 ASP OD1 1 1 23 4145 1 1 3 ASP OD2 O -4.085 -8.070 -1.302 1.00 . A A . 2 ASP OD2 1 1 23 4146 1 1 4 TYR C C -3.586 -0.802 1.045 1.00 . A A . 3 TYR C 1 1 23 4147 1 1 4 TYR CA C -4.648 -1.824 0.604 1.00 . A A . 3 TYR CA 1 1 23 4148 1 1 4 TYR CB C -5.792 -1.958 1.622 1.00 . A A . 3 TYR CB 1 1 23 4149 1 1 4 TYR CD1 C -5.080 -3.704 3.298 1.00 . A A . 3 TYR CD1 1 1 23 4150 1 1 4 TYR CD2 C -4.983 -1.365 3.930 1.00 . A A . 3 TYR CD2 1 1 23 4151 1 1 4 TYR CE1 C -4.604 -4.064 4.563 1.00 . A A . 3 TYR CE1 1 1 23 4152 1 1 4 TYR CE2 C -4.511 -1.726 5.195 1.00 . A A . 3 TYR CE2 1 1 23 4153 1 1 4 TYR CG C -5.267 -2.355 2.980 1.00 . A A . 3 TYR CG 1 1 23 4154 1 1 4 TYR CZ C -4.321 -3.075 5.512 1.00 . A A . 3 TYR CZ 1 1 23 4155 1 1 4 TYR H H -4.245 -3.873 1.133 1.00 . A A . 3 TYR H 1 1 23 4156 1 1 4 TYR HA H -5.055 -1.513 -0.341 1.00 . A A . 3 TYR HA 1 1 23 4157 1 1 4 TYR HB2 H -6.307 -1.014 1.705 1.00 . A A . 3 TYR HB2 1 1 23 4158 1 1 4 TYR HB3 H -6.485 -2.711 1.276 1.00 . A A . 3 TYR HB3 1 1 23 4159 1 1 4 TYR HD1 H -5.300 -4.467 2.565 1.00 . A A . 3 TYR HD1 1 1 23 4160 1 1 4 TYR HD2 H -5.128 -0.324 3.684 1.00 . A A . 3 TYR HD2 1 1 23 4161 1 1 4 TYR HE1 H -4.458 -5.106 4.808 1.00 . A A . 3 TYR HE1 1 1 23 4162 1 1 4 TYR HE2 H -4.292 -0.964 5.928 1.00 . A A . 3 TYR HE2 1 1 23 4163 1 1 4 TYR HH H -4.288 -2.871 7.409 1.00 . A A . 3 TYR HH 1 1 23 4164 1 1 4 TYR N N -4.068 -3.184 0.459 1.00 . A A . 3 TYR N 1 1 23 4165 1 1 4 TYR O O -3.392 0.182 0.367 1.00 . A A . 3 TYR O 1 1 23 4166 1 1 4 TYR OH O -3.856 -3.432 6.761 1.00 . A A . 3 TYR OH 1 1 23 4167 1 1 5 TRP C C -1.427 0.926 1.595 1.00 . A A . 4 TRP C 1 1 23 4168 1 1 5 TRP CA C -1.850 -0.080 2.667 1.00 . A A . 4 TRP CA 1 1 23 4169 1 1 5 TRP CB C -0.646 -0.954 3.022 1.00 . A A . 4 TRP CB 1 1 23 4170 1 1 5 TRP CD1 C -1.751 -2.792 4.369 1.00 . A A . 4 TRP CD1 1 1 23 4171 1 1 5 TRP CD2 C -0.295 -1.587 5.577 1.00 . A A . 4 TRP CD2 1 1 23 4172 1 1 5 TRP CE2 C -0.825 -2.568 6.443 1.00 . A A . 4 TRP CE2 1 1 23 4173 1 1 5 TRP CE3 C 0.650 -0.690 6.092 1.00 . A A . 4 TRP CE3 1 1 23 4174 1 1 5 TRP CG C -0.902 -1.747 4.265 1.00 . A A . 4 TRP CG 1 1 23 4175 1 1 5 TRP CH2 C 0.515 -1.760 8.275 1.00 . A A . 4 TRP CH2 1 1 23 4176 1 1 5 TRP CZ2 C -0.428 -2.660 7.774 1.00 . A A . 4 TRP CZ2 1 1 23 4177 1 1 5 TRP CZ3 C 1.055 -0.775 7.435 1.00 . A A . 4 TRP CZ3 1 1 23 4178 1 1 5 TRP H H -3.092 -1.845 2.661 1.00 . A A . 4 TRP H 1 1 23 4179 1 1 5 TRP HA H -2.201 0.433 3.547 1.00 . A A . 4 TRP HA 1 1 23 4180 1 1 5 TRP HB2 H -0.447 -1.625 2.208 1.00 . A A . 4 TRP HB2 1 1 23 4181 1 1 5 TRP HB3 H 0.216 -0.321 3.176 1.00 . A A . 4 TRP HB3 1 1 23 4182 1 1 5 TRP HD1 H -2.358 -3.192 3.572 1.00 . A A . 4 TRP HD1 1 1 23 4183 1 1 5 TRP HE1 H -2.223 -4.040 5.997 1.00 . A A . 4 TRP HE1 1 1 23 4184 1 1 5 TRP HE3 H 1.070 0.067 5.450 1.00 . A A . 4 TRP HE3 1 1 23 4185 1 1 5 TRP HH2 H 0.827 -1.821 9.306 1.00 . A A . 4 TRP HH2 1 1 23 4186 1 1 5 TRP HZ2 H -0.848 -3.422 8.413 1.00 . A A . 4 TRP HZ2 1 1 23 4187 1 1 5 TRP HZ3 H 1.784 -0.080 7.823 1.00 . A A . 4 TRP HZ3 1 1 23 4188 1 1 5 TRP N N -2.908 -1.035 2.156 1.00 . A A . 4 TRP N 1 1 23 4189 1 1 5 TRP NE1 N -1.700 -3.283 5.659 1.00 . A A . 4 TRP NE1 1 1 23 4190 1 1 5 TRP O O -1.489 2.123 1.785 1.00 . A A . 4 TRP O 1 1 23 4191 1 1 6 LEU C C -1.436 2.568 -0.733 1.00 . A A . 5 LEU C 1 1 23 4192 1 1 6 LEU CA C -0.548 1.316 -0.642 1.00 . A A . 5 LEU CA 1 1 23 4193 1 1 6 LEU CB C -0.687 0.414 -1.879 1.00 . A A . 5 LEU CB 1 1 23 4194 1 1 6 LEU CD1 C 0.287 1.069 -4.085 1.00 . A A . 5 LEU CD1 1 1 23 4195 1 1 6 LEU CD2 C -2.172 0.702 -3.854 1.00 . A A . 5 LEU CD2 1 1 23 4196 1 1 6 LEU CG C -0.917 1.230 -3.155 1.00 . A A . 5 LEU CG 1 1 23 4197 1 1 6 LEU H H -0.951 -0.542 0.359 1.00 . A A . 5 LEU H 1 1 23 4198 1 1 6 LEU HA H 0.484 1.596 -0.509 1.00 . A A . 5 LEU HA 1 1 23 4199 1 1 6 LEU HB2 H 0.213 -0.171 -1.992 1.00 . A A . 5 LEU HB2 1 1 23 4200 1 1 6 LEU HB3 H -1.524 -0.254 -1.733 1.00 . A A . 5 LEU HB3 1 1 23 4201 1 1 6 LEU HD11 H 1.196 1.081 -3.503 1.00 . A A . 5 LEU HD11 1 1 23 4202 1 1 6 LEU HD12 H 0.209 0.129 -4.613 1.00 . A A . 5 LEU HD12 1 1 23 4203 1 1 6 LEU HD13 H 0.304 1.881 -4.796 1.00 . A A . 5 LEU HD13 1 1 23 4204 1 1 6 LEU HD21 H -2.725 0.074 -3.170 1.00 . A A . 5 LEU HD21 1 1 23 4205 1 1 6 LEU HD22 H -2.790 1.531 -4.163 1.00 . A A . 5 LEU HD22 1 1 23 4206 1 1 6 LEU HD23 H -1.885 0.123 -4.719 1.00 . A A . 5 LEU HD23 1 1 23 4207 1 1 6 LEU HG H -1.045 2.274 -2.917 1.00 . A A . 5 LEU HG 1 1 23 4208 1 1 6 LEU N N -0.991 0.431 0.473 1.00 . A A . 5 LEU N 1 1 23 4209 1 1 6 LEU O O -0.950 3.664 -0.933 1.00 . A A . 5 LEU O 1 1 23 4210 1 1 7 ALA C C -3.859 4.258 0.676 1.00 . A A . 6 ALA C 1 1 23 4211 1 1 7 ALA CA C -3.627 3.611 -0.700 1.00 . A A . 6 ALA CA 1 1 23 4212 1 1 7 ALA CB C -4.940 3.060 -1.256 1.00 . A A . 6 ALA CB 1 1 23 4213 1 1 7 ALA H H -3.105 1.529 -0.452 1.00 . A A . 6 ALA H 1 1 23 4214 1 1 7 ALA HA H -3.218 4.335 -1.388 1.00 . A A . 6 ALA HA 1 1 23 4215 1 1 7 ALA HB1 H -5.065 2.036 -0.936 1.00 . A A . 6 ALA HB1 1 1 23 4216 1 1 7 ALA HB2 H -5.764 3.654 -0.889 1.00 . A A . 6 ALA HB2 1 1 23 4217 1 1 7 ALA HB3 H -4.920 3.101 -2.335 1.00 . A A . 6 ALA HB3 1 1 23 4218 1 1 7 ALA N N -2.726 2.421 -0.603 1.00 . A A . 6 ALA N 1 1 23 4219 1 1 7 ALA O O -4.824 4.970 0.874 1.00 . A A . 6 ALA O 1 1 23 4220 1 1 8 HIS C C -1.873 5.186 3.509 1.00 . A A . 7 HIS C 1 1 23 4221 1 1 8 HIS CA C -3.197 4.626 2.984 1.00 . A A . 7 HIS CA 1 1 23 4222 1 1 8 HIS CB C -3.690 3.487 3.898 1.00 . A A . 7 HIS CB 1 1 23 4223 1 1 8 HIS CD2 C -4.420 1.863 1.974 1.00 . A A . 7 HIS CD2 1 1 23 4224 1 1 8 HIS CE1 C -6.400 1.363 2.683 1.00 . A A . 7 HIS CE1 1 1 23 4225 1 1 8 HIS CG C -4.598 2.552 3.140 1.00 . A A . 7 HIS CG 1 1 23 4226 1 1 8 HIS H H -2.224 3.438 1.460 1.00 . A A . 7 HIS H 1 1 23 4227 1 1 8 HIS HA H -3.940 5.406 2.937 1.00 . A A . 7 HIS HA 1 1 23 4228 1 1 8 HIS HB2 H -2.839 2.933 4.266 1.00 . A A . 7 HIS HB2 1 1 23 4229 1 1 8 HIS HB3 H -4.228 3.907 4.735 1.00 . A A . 7 HIS HB3 1 1 23 4230 1 1 8 HIS HD1 H -6.310 2.551 4.394 1.00 . A A . 7 HIS HD1 1 1 23 4231 1 1 8 HIS HD2 H -3.534 1.907 1.366 1.00 . A A . 7 HIS HD2 1 1 23 4232 1 1 8 HIS HE1 H -7.382 0.924 2.762 1.00 . A A . 7 HIS HE1 1 1 23 4233 1 1 8 HIS HE2 H -5.701 0.539 0.910 1.00 . A A . 7 HIS HE2 1 1 23 4234 1 1 8 HIS N N -2.996 4.018 1.630 1.00 . A A . 7 HIS N 1 1 23 4235 1 1 8 HIS ND1 N -5.873 2.222 3.581 1.00 . A A . 7 HIS ND1 1 1 23 4236 1 1 8 HIS NE2 N -5.553 1.117 1.687 1.00 . A A . 7 HIS NE2 1 1 23 4237 1 1 8 HIS O O -1.840 6.201 4.175 1.00 . A A . 7 HIS O 1 1 23 4238 1 1 9 LYS C C 1.120 6.040 2.706 1.00 . A A . 8 LYS C 1 1 23 4239 1 1 9 LYS CA C 0.537 5.036 3.701 1.00 . A A . 8 LYS CA 1 1 23 4240 1 1 9 LYS CB C 1.426 3.797 3.798 1.00 . A A . 8 LYS CB 1 1 23 4241 1 1 9 LYS CD C 1.851 3.342 6.219 1.00 . A A . 8 LYS CD 1 1 23 4242 1 1 9 LYS CE C 2.165 2.089 7.040 1.00 . A A . 8 LYS CE 1 1 23 4243 1 1 9 LYS CG C 1.004 2.957 5.004 1.00 . A A . 8 LYS CG 1 1 23 4244 1 1 9 LYS H H -0.827 3.716 2.676 1.00 . A A . 8 LYS H 1 1 23 4245 1 1 9 LYS HA H 0.428 5.490 4.669 1.00 . A A . 8 LYS HA 1 1 23 4246 1 1 9 LYS HB2 H 1.326 3.210 2.897 1.00 . A A . 8 LYS HB2 1 1 23 4247 1 1 9 LYS HB3 H 2.455 4.101 3.918 1.00 . A A . 8 LYS HB3 1 1 23 4248 1 1 9 LYS HD2 H 2.773 3.795 5.885 1.00 . A A . 8 LYS HD2 1 1 23 4249 1 1 9 LYS HD3 H 1.305 4.044 6.832 1.00 . A A . 8 LYS HD3 1 1 23 4250 1 1 9 LYS HE2 H 1.265 1.713 7.507 1.00 . A A . 8 LYS HE2 1 1 23 4251 1 1 9 LYS HE3 H 2.611 1.331 6.416 1.00 . A A . 8 LYS HE3 1 1 23 4252 1 1 9 LYS HG2 H -0.040 3.137 5.220 1.00 . A A . 8 LYS HG2 1 1 23 4253 1 1 9 LYS HG3 H 1.150 1.910 4.784 1.00 . A A . 8 LYS HG3 1 1 23 4254 1 1 9 LYS HZ1 H 3.942 3.012 7.610 1.00 . A A . 8 LYS HZ1 1 1 23 4255 1 1 9 LYS HZ2 H 2.672 3.206 8.723 1.00 . A A . 8 LYS HZ2 1 1 23 4256 1 1 9 LYS HZ3 H 3.484 1.718 8.607 1.00 . A A . 8 LYS HZ3 1 1 23 4257 1 1 9 LYS N N -0.780 4.534 3.215 1.00 . A A . 8 LYS N 1 1 23 4258 1 1 9 LYS NZ N 3.139 2.540 8.073 1.00 . A A . 8 LYS NZ 1 1 23 4259 1 1 9 LYS O O 2.306 6.300 2.689 1.00 . A A . 8 LYS O 1 1 23 4260 1 1 10 ALA C C 0.727 9.012 1.483 1.00 . A A . 9 ALA C 1 1 23 4261 1 1 10 ALA CA C 0.781 7.604 0.886 1.00 . A A . 9 ALA CA 1 1 23 4262 1 1 10 ALA CB C -0.178 7.485 -0.299 1.00 . A A . 9 ALA CB 1 1 23 4263 1 1 10 ALA H H -0.663 6.386 1.921 1.00 . A A . 9 ALA H 1 1 23 4264 1 1 10 ALA HA H 1.784 7.363 0.576 1.00 . A A . 9 ALA HA 1 1 23 4265 1 1 10 ALA HB1 H -0.835 6.643 -0.147 1.00 . A A . 9 ALA HB1 1 1 23 4266 1 1 10 ALA HB2 H -0.764 8.389 -0.380 1.00 . A A . 9 ALA HB2 1 1 23 4267 1 1 10 ALA HB3 H 0.388 7.341 -1.207 1.00 . A A . 9 ALA HB3 1 1 23 4268 1 1 10 ALA N N 0.289 6.609 1.882 1.00 . A A . 9 ALA N 1 1 23 4269 1 1 10 ALA O O 1.742 9.635 1.728 1.00 . A A . 9 ALA O 1 1 23 4270 1 1 11 LEU C C -0.031 10.908 3.729 1.00 . A A . 10 LEU C 1 1 23 4271 1 1 11 LEU CA C -0.579 10.885 2.299 1.00 . A A . 10 LEU CA 1 1 23 4272 1 1 11 LEU CB C -2.080 11.177 2.295 1.00 . A A . 10 LEU CB 1 1 23 4273 1 1 11 LEU CD1 C -2.136 13.227 0.868 1.00 . A A . 10 LEU CD1 1 1 23 4274 1 1 11 LEU CD2 C -3.724 12.995 2.781 1.00 . A A . 10 LEU CD2 1 1 23 4275 1 1 11 LEU CG C -2.307 12.689 2.290 1.00 . A A . 10 LEU CG 1 1 23 4276 1 1 11 LEU H H -1.256 8.997 1.514 1.00 . A A . 10 LEU H 1 1 23 4277 1 1 11 LEU HA H -0.062 11.605 1.685 1.00 . A A . 10 LEU HA 1 1 23 4278 1 1 11 LEU HB2 H -2.528 10.742 1.413 1.00 . A A . 10 LEU HB2 1 1 23 4279 1 1 11 LEU HB3 H -2.533 10.748 3.177 1.00 . A A . 10 LEU HB3 1 1 23 4280 1 1 11 LEU HD11 H -2.350 12.442 0.159 1.00 . A A . 10 LEU HD11 1 1 23 4281 1 1 11 LEU HD12 H -2.815 14.051 0.709 1.00 . A A . 10 LEU HD12 1 1 23 4282 1 1 11 LEU HD13 H -1.119 13.566 0.732 1.00 . A A . 10 LEU HD13 1 1 23 4283 1 1 11 LEU HD21 H -4.244 12.068 2.980 1.00 . A A . 10 LEU HD21 1 1 23 4284 1 1 11 LEU HD22 H -3.673 13.581 3.686 1.00 . A A . 10 LEU HD22 1 1 23 4285 1 1 11 LEU HD23 H -4.257 13.550 2.022 1.00 . A A . 10 LEU HD23 1 1 23 4286 1 1 11 LEU HG H -1.588 13.163 2.943 1.00 . A A . 10 LEU HG 1 1 23 4287 1 1 11 LEU N N -0.452 9.517 1.719 1.00 . A A . 10 LEU N 1 1 23 4288 1 1 11 LEU O O -0.768 10.790 4.688 1.00 . A A . 10 LEU O 1 1 23 4289 1 1 12 ALA C C 3.289 11.609 5.191 1.00 . A A . 11 ALA C 1 1 23 4290 1 1 12 ALA CA C 1.848 11.095 5.249 1.00 . A A . 11 ALA CA 1 1 23 4291 1 1 12 ALA CB C 1.816 9.643 5.731 1.00 . A A . 11 ALA CB 1 1 23 4292 1 1 12 ALA H H 1.833 11.157 3.094 1.00 . A A . 11 ALA H 1 1 23 4293 1 1 12 ALA HA H 1.253 11.712 5.902 1.00 . A A . 11 ALA HA 1 1 23 4294 1 1 12 ALA HB1 H 1.162 9.067 5.094 1.00 . A A . 11 ALA HB1 1 1 23 4295 1 1 12 ALA HB2 H 2.813 9.230 5.694 1.00 . A A . 11 ALA HB2 1 1 23 4296 1 1 12 ALA HB3 H 1.450 9.610 6.747 1.00 . A A . 11 ALA HB3 1 1 23 4297 1 1 12 ALA N N 1.256 11.062 3.880 1.00 . A A . 11 ALA N 1 1 23 4298 1 1 12 ALA O O 4.173 10.934 4.702 1.00 . A A . 11 ALA O 1 1 23 4299 1 1 13 NH2 HN1 H 2.852 13.336 6.069 1.00 . A A . 12 NH2 HN1 1 1 23 4300 1 1 13 NH2 HN2 H 4.482 13.131 5.642 1.00 . A A . 12 NH2 HN2 1 1 23 4301 1 1 13 NH2 N N 3.563 12.790 5.673 1.00 . A A . 12 NH2 N 1 1 24 4302 1 1 2 ILE C C -1.995 -4.951 1.682 1.00 . A A . 1 ILE C 1 1 24 4303 1 1 2 ILE CA C -0.822 -5.163 2.640 1.00 . A A . 1 ILE CA 1 1 24 4304 1 1 2 ILE CB C 0.500 -4.641 2.046 1.00 . A A . 1 ILE CB 1 1 24 4305 1 1 2 ILE CD1 C 1.904 -5.278 4.012 1.00 . A A . 1 ILE CD1 1 1 24 4306 1 1 2 ILE CG1 C 1.372 -4.109 3.184 1.00 . A A . 1 ILE CG1 1 1 24 4307 1 1 2 ILE CG2 C 0.249 -3.505 1.039 1.00 . A A . 1 ILE CG2 1 1 24 4308 1 1 2 ILE H H 0.296 -6.995 2.824 1.00 . A A . 1 ILE H 1 1 24 4309 1 1 2 ILE HA H -1.012 -4.677 3.577 1.00 . A A . 1 ILE HA 1 1 24 4310 1 1 2 ILE HB H 1.010 -5.450 1.554 1.00 . A A . 1 ILE HB 1 1 24 4311 1 1 2 ILE HD11 H 1.976 -6.158 3.389 1.00 . A A . 1 ILE HD11 1 1 24 4312 1 1 2 ILE HD12 H 2.882 -5.031 4.399 1.00 . A A . 1 ILE HD12 1 1 24 4313 1 1 2 ILE HD13 H 1.231 -5.473 4.834 1.00 . A A . 1 ILE HD13 1 1 24 4314 1 1 2 ILE HG12 H 2.201 -3.551 2.771 1.00 . A A . 1 ILE HG12 1 1 24 4315 1 1 2 ILE HG13 H 0.782 -3.461 3.818 1.00 . A A . 1 ILE HG13 1 1 24 4316 1 1 2 ILE HG21 H -0.746 -3.108 1.177 1.00 . A A . 1 ILE HG21 1 1 24 4317 1 1 2 ILE HG22 H 0.972 -2.718 1.194 1.00 . A A . 1 ILE HG22 1 1 24 4318 1 1 2 ILE HG23 H 0.343 -3.886 0.034 1.00 . A A . 1 ILE HG23 1 1 24 4319 1 1 2 ILE N N -0.609 -6.619 2.853 1.00 . A A . 1 ILE N 1 1 24 4320 1 1 2 ILE O O -3.101 -4.664 2.095 1.00 . A A . 1 ILE O 1 1 24 4321 1 1 3 ASP C C -3.364 -3.453 -0.510 1.00 . A A . 2 ASP C 1 1 24 4322 1 1 3 ASP CA C -2.832 -4.883 -0.593 1.00 . A A . 2 ASP CA 1 1 24 4323 1 1 3 ASP CB C -3.922 -5.887 -0.216 1.00 . A A . 2 ASP CB 1 1 24 4324 1 1 3 ASP CG C -4.348 -6.670 -1.460 1.00 . A A . 2 ASP CG 1 1 24 4325 1 1 3 ASP H H -0.850 -5.315 0.115 1.00 . A A . 2 ASP H 1 1 24 4326 1 1 3 ASP HA H -2.469 -5.085 -1.586 1.00 . A A . 2 ASP HA 1 1 24 4327 1 1 3 ASP HB2 H -3.540 -6.572 0.528 1.00 . A A . 2 ASP HB2 1 1 24 4328 1 1 3 ASP HB3 H -4.775 -5.361 0.184 1.00 . A A . 2 ASP HB3 1 1 24 4329 1 1 3 ASP N N -1.751 -5.085 0.410 1.00 . A A . 2 ASP N 1 1 24 4330 1 1 3 ASP O O -3.149 -2.648 -1.394 1.00 . A A . 2 ASP O 1 1 24 4331 1 1 3 ASP OD1 O -3.504 -7.344 -2.029 1.00 . A A . 2 ASP OD1 1 1 24 4332 1 1 3 ASP OD2 O -5.509 -6.582 -1.822 1.00 . A A . 2 ASP OD2 1 1 24 4333 1 1 4 TYR C C -3.533 -0.741 1.054 1.00 . A A . 3 TYR C 1 1 24 4334 1 1 4 TYR CA C -4.618 -1.761 0.667 1.00 . A A . 3 TYR CA 1 1 24 4335 1 1 4 TYR CB C -5.725 -1.864 1.724 1.00 . A A . 3 TYR CB 1 1 24 4336 1 1 4 TYR CD1 C -4.928 -3.474 3.492 1.00 . A A . 3 TYR CD1 1 1 24 4337 1 1 4 TYR CD2 C -4.816 -1.093 3.937 1.00 . A A . 3 TYR CD2 1 1 24 4338 1 1 4 TYR CE1 C -4.392 -3.733 4.757 1.00 . A A . 3 TYR CE1 1 1 24 4339 1 1 4 TYR CE2 C -4.282 -1.353 5.203 1.00 . A A . 3 TYR CE2 1 1 24 4340 1 1 4 TYR CG C -5.140 -2.153 3.083 1.00 . A A . 3 TYR CG 1 1 24 4341 1 1 4 TYR CZ C -4.070 -2.673 5.612 1.00 . A A . 3 TYR CZ 1 1 24 4342 1 1 4 TYR H H -4.232 -3.802 1.235 1.00 . A A . 3 TYR H 1 1 24 4343 1 1 4 TYR HA H -5.055 -1.468 -0.270 1.00 . A A . 3 TYR HA 1 1 24 4344 1 1 4 TYR HB2 H -6.270 -0.934 1.762 1.00 . A A . 3 TYR HB2 1 1 24 4345 1 1 4 TYR HB3 H -6.402 -2.661 1.453 1.00 . A A . 3 TYR HB3 1 1 24 4346 1 1 4 TYR HD1 H -5.178 -4.291 2.832 1.00 . A A . 3 TYR HD1 1 1 24 4347 1 1 4 TYR HD2 H -4.979 -0.074 3.620 1.00 . A A . 3 TYR HD2 1 1 24 4348 1 1 4 TYR HE1 H -4.227 -4.752 5.076 1.00 . A A . 3 TYR HE1 1 1 24 4349 1 1 4 TYR HE2 H -4.033 -0.535 5.863 1.00 . A A . 3 TYR HE2 1 1 24 4350 1 1 4 TYR HH H -3.945 -2.315 7.484 1.00 . A A . 3 TYR HH 1 1 24 4351 1 1 4 TYR N N -4.064 -3.135 0.538 1.00 . A A . 3 TYR N 1 1 24 4352 1 1 4 TYR O O -3.371 0.240 0.367 1.00 . A A . 3 TYR O 1 1 24 4353 1 1 4 TYR OH O -3.546 -2.930 6.863 1.00 . A A . 3 TYR OH 1 1 24 4354 1 1 5 TRP C C -1.348 0.982 1.486 1.00 . A A . 4 TRP C 1 1 24 4355 1 1 5 TRP CA C -1.724 -0.010 2.588 1.00 . A A . 4 TRP CA 1 1 24 4356 1 1 5 TRP CB C -0.507 -0.883 2.903 1.00 . A A . 4 TRP CB 1 1 24 4357 1 1 5 TRP CD1 C -1.568 -2.659 4.364 1.00 . A A . 4 TRP CD1 1 1 24 4358 1 1 5 TRP CD2 C -0.013 -1.463 5.449 1.00 . A A . 4 TRP CD2 1 1 24 4359 1 1 5 TRP CE2 C -0.515 -2.405 6.373 1.00 . A A . 4 TRP CE2 1 1 24 4360 1 1 5 TRP CE3 C 0.985 -0.579 5.881 1.00 . A A . 4 TRP CE3 1 1 24 4361 1 1 5 TRP CG C -0.703 -1.639 4.181 1.00 . A A . 4 TRP CG 1 1 24 4362 1 1 5 TRP CH2 C 0.954 -1.585 8.098 1.00 . A A . 4 TRP CH2 1 1 24 4363 1 1 5 TRP CZ2 C -0.041 -2.472 7.681 1.00 . A A . 4 TRP CZ2 1 1 24 4364 1 1 5 TRP CZ3 C 1.467 -0.639 7.199 1.00 . A A . 4 TRP CZ3 1 1 24 4365 1 1 5 TRP H H -2.967 -1.774 2.653 1.00 . A A . 4 TRP H 1 1 24 4366 1 1 5 TRP HA H -2.035 0.514 3.476 1.00 . A A . 4 TRP HA 1 1 24 4367 1 1 5 TRP HB2 H -0.357 -1.577 2.099 1.00 . A A . 4 TRP HB2 1 1 24 4368 1 1 5 TRP HB3 H 0.365 -0.253 2.993 1.00 . A A . 4 TRP HB3 1 1 24 4369 1 1 5 TRP HD1 H -2.231 -3.064 3.618 1.00 . A A . 4 TRP HD1 1 1 24 4370 1 1 5 TRP HE1 H -1.977 -3.849 6.052 1.00 . A A . 4 TRP HE1 1 1 24 4371 1 1 5 TRP HE3 H 1.384 0.146 5.193 1.00 . A A . 4 TRP HE3 1 1 24 4372 1 1 5 TRP HH2 H 1.326 -1.627 9.110 1.00 . A A . 4 TRP HH2 1 1 24 4373 1 1 5 TRP HZ2 H -0.442 -3.203 8.365 1.00 . A A . 4 TRP HZ2 1 1 24 4374 1 1 5 TRP HZ3 H 2.237 0.046 7.521 1.00 . A A . 4 TRP HZ3 1 1 24 4375 1 1 5 TRP N N -2.804 -0.969 2.134 1.00 . A A . 4 TRP N 1 1 24 4376 1 1 5 TRP NE1 N -1.455 -3.116 5.662 1.00 . A A . 4 TRP NE1 1 1 24 4377 1 1 5 TRP O O -1.380 2.181 1.670 1.00 . A A . 4 TRP O 1 1 24 4378 1 1 6 LEU C C -1.435 2.628 -0.837 1.00 . A A . 5 LEU C 1 1 24 4379 1 1 6 LEU CA C -0.603 1.334 -0.808 1.00 . A A . 5 LEU CA 1 1 24 4380 1 1 6 LEU CB C -0.894 0.445 -2.025 1.00 . A A . 5 LEU CB 1 1 24 4381 1 1 6 LEU CD1 C 0.087 1.966 -3.749 1.00 . A A . 5 LEU CD1 1 1 24 4382 1 1 6 LEU CD2 C -1.733 0.364 -4.363 1.00 . A A . 5 LEU CD2 1 1 24 4383 1 1 6 LEU CG C -1.195 1.286 -3.265 1.00 . A A . 5 LEU CG 1 1 24 4384 1 1 6 LEU H H -0.976 -0.505 0.237 1.00 . A A . 5 LEU H 1 1 24 4385 1 1 6 LEU HA H 0.449 1.563 -0.769 1.00 . A A . 5 LEU HA 1 1 24 4386 1 1 6 LEU HB2 H -0.035 -0.180 -2.220 1.00 . A A . 5 LEU HB2 1 1 24 4387 1 1 6 LEU HB3 H -1.746 -0.184 -1.807 1.00 . A A . 5 LEU HB3 1 1 24 4388 1 1 6 LEU HD11 H 0.929 1.581 -3.194 1.00 . A A . 5 LEU HD11 1 1 24 4389 1 1 6 LEU HD12 H 0.226 1.766 -4.801 1.00 . A A . 5 LEU HD12 1 1 24 4390 1 1 6 LEU HD13 H 0.008 3.032 -3.593 1.00 . A A . 5 LEU HD13 1 1 24 4391 1 1 6 LEU HD21 H -1.350 -0.635 -4.214 1.00 . A A . 5 LEU HD21 1 1 24 4392 1 1 6 LEU HD22 H -2.812 0.344 -4.320 1.00 . A A . 5 LEU HD22 1 1 24 4393 1 1 6 LEU HD23 H -1.417 0.729 -5.328 1.00 . A A . 5 LEU HD23 1 1 24 4394 1 1 6 LEU HG H -1.935 2.035 -3.026 1.00 . A A . 5 LEU HG 1 1 24 4395 1 1 6 LEU N N -0.990 0.469 0.344 1.00 . A A . 5 LEU N 1 1 24 4396 1 1 6 LEU O O -0.897 3.714 -0.934 1.00 . A A . 5 LEU O 1 1 24 4397 1 1 7 ALA C C -3.847 4.305 0.602 1.00 . A A . 6 ALA C 1 1 24 4398 1 1 7 ALA CA C -3.586 3.757 -0.808 1.00 . A A . 6 ALA CA 1 1 24 4399 1 1 7 ALA CB C -4.897 3.303 -1.448 1.00 . A A . 6 ALA CB 1 1 24 4400 1 1 7 ALA H H -3.155 1.643 -0.700 1.00 . A A . 6 ALA H 1 1 24 4401 1 1 7 ALA HA H -3.123 4.512 -1.424 1.00 . A A . 6 ALA HA 1 1 24 4402 1 1 7 ALA HB1 H -5.221 2.380 -0.988 1.00 . A A . 6 ALA HB1 1 1 24 4403 1 1 7 ALA HB2 H -5.652 4.062 -1.302 1.00 . A A . 6 ALA HB2 1 1 24 4404 1 1 7 ALA HB3 H -4.747 3.144 -2.505 1.00 . A A . 6 ALA HB3 1 1 24 4405 1 1 7 ALA N N -2.735 2.526 -0.769 1.00 . A A . 6 ALA N 1 1 24 4406 1 1 7 ALA O O -4.768 5.070 0.814 1.00 . A A . 6 ALA O 1 1 24 4407 1 1 8 HIS C C -2.005 5.029 3.523 1.00 . A A . 7 HIS C 1 1 24 4408 1 1 8 HIS CA C -3.292 4.424 2.956 1.00 . A A . 7 HIS CA 1 1 24 4409 1 1 8 HIS CB C -3.712 3.193 3.772 1.00 . A A . 7 HIS CB 1 1 24 4410 1 1 8 HIS CD2 C -4.747 1.902 1.731 1.00 . A A . 7 HIS CD2 1 1 24 4411 1 1 8 HIS CE1 C -6.610 1.286 2.640 1.00 . A A . 7 HIS CE1 1 1 24 4412 1 1 8 HIS CG C -4.736 2.392 3.011 1.00 . A A . 7 HIS CG 1 1 24 4413 1 1 8 HIS H H -2.325 3.298 1.389 1.00 . A A . 7 HIS H 1 1 24 4414 1 1 8 HIS HA H -4.084 5.155 2.961 1.00 . A A . 7 HIS HA 1 1 24 4415 1 1 8 HIS HB2 H -2.845 2.578 3.963 1.00 . A A . 7 HIS HB2 1 1 24 4416 1 1 8 HIS HB3 H -4.134 3.516 4.713 1.00 . A A . 7 HIS HB3 1 1 24 4417 1 1 8 HIS HD1 H -6.243 2.176 4.489 1.00 . A A . 7 HIS HD1 1 1 24 4418 1 1 8 HIS HD2 H -3.958 2.031 1.015 1.00 . A A . 7 HIS HD2 1 1 24 4419 1 1 8 HIS HE1 H -7.576 0.833 2.793 1.00 . A A . 7 HIS HE1 1 1 24 4420 1 1 8 HIS HE2 H -6.198 0.757 0.676 1.00 . A A . 7 HIS HE2 1 1 24 4421 1 1 8 HIS N N -3.059 3.922 1.569 1.00 . A A . 7 HIS N 1 1 24 4422 1 1 8 HIS ND1 N -5.939 1.987 3.577 1.00 . A A . 7 HIS ND1 1 1 24 4423 1 1 8 HIS NE2 N -5.926 1.209 1.503 1.00 . A A . 7 HIS NE2 1 1 24 4424 1 1 8 HIS O O -1.962 5.472 4.654 1.00 . A A . 7 HIS O 1 1 24 4425 1 1 9 LYS C C 0.369 7.136 2.958 1.00 . A A . 8 LYS C 1 1 24 4426 1 1 9 LYS CA C 0.324 5.636 3.249 1.00 . A A . 8 LYS CA 1 1 24 4427 1 1 9 LYS CB C 1.424 4.904 2.480 1.00 . A A . 8 LYS CB 1 1 24 4428 1 1 9 LYS CD C 2.255 2.649 1.797 1.00 . A A . 8 LYS CD 1 1 24 4429 1 1 9 LYS CE C 3.711 2.976 2.139 1.00 . A A . 8 LYS CE 1 1 24 4430 1 1 9 LYS CG C 1.325 3.402 2.751 1.00 . A A . 8 LYS CG 1 1 24 4431 1 1 9 LYS H H -1.008 4.694 1.838 1.00 . A A . 8 LYS H 1 1 24 4432 1 1 9 LYS HA H 0.427 5.456 4.304 1.00 . A A . 8 LYS HA 1 1 24 4433 1 1 9 LYS HB2 H 1.306 5.088 1.421 1.00 . A A . 8 LYS HB2 1 1 24 4434 1 1 9 LYS HB3 H 2.388 5.263 2.803 1.00 . A A . 8 LYS HB3 1 1 24 4435 1 1 9 LYS HD2 H 2.090 1.586 1.897 1.00 . A A . 8 LYS HD2 1 1 24 4436 1 1 9 LYS HD3 H 2.050 2.951 0.781 1.00 . A A . 8 LYS HD3 1 1 24 4437 1 1 9 LYS HE2 H 4.307 3.018 1.238 1.00 . A A . 8 LYS HE2 1 1 24 4438 1 1 9 LYS HE3 H 3.770 3.909 2.676 1.00 . A A . 8 LYS HE3 1 1 24 4439 1 1 9 LYS HG2 H 1.615 3.200 3.772 1.00 . A A . 8 LYS HG2 1 1 24 4440 1 1 9 LYS HG3 H 0.309 3.072 2.592 1.00 . A A . 8 LYS HG3 1 1 24 4441 1 1 9 LYS HZ1 H 3.886 0.949 2.580 1.00 . A A . 8 LYS HZ1 1 1 24 4442 1 1 9 LYS HZ2 H 5.194 1.891 3.116 1.00 . A A . 8 LYS HZ2 1 1 24 4443 1 1 9 LYS HZ3 H 3.717 1.943 3.947 1.00 . A A . 8 LYS HZ3 1 1 24 4444 1 1 9 LYS N N -0.955 5.055 2.748 1.00 . A A . 8 LYS N 1 1 24 4445 1 1 9 LYS NZ N 4.161 1.856 3.011 1.00 . A A . 8 LYS NZ 1 1 24 4446 1 1 9 LYS O O 1.422 7.738 2.897 1.00 . A A . 8 LYS O 1 1 24 4447 1 1 10 ALA C C -0.900 9.991 3.807 1.00 . A A . 9 ALA C 1 1 24 4448 1 1 10 ALA CA C -0.806 9.204 2.498 1.00 . A A . 9 ALA CA 1 1 24 4449 1 1 10 ALA CB C -2.065 9.413 1.655 1.00 . A A . 9 ALA CB 1 1 24 4450 1 1 10 ALA H H -1.605 7.231 2.840 1.00 . A A . 9 ALA H 1 1 24 4451 1 1 10 ALA HA H 0.066 9.502 1.939 1.00 . A A . 9 ALA HA 1 1 24 4452 1 1 10 ALA HB1 H -2.595 8.477 1.561 1.00 . A A . 9 ALA HB1 1 1 24 4453 1 1 10 ALA HB2 H -2.703 10.140 2.135 1.00 . A A . 9 ALA HB2 1 1 24 4454 1 1 10 ALA HB3 H -1.787 9.769 0.674 1.00 . A A . 9 ALA HB3 1 1 24 4455 1 1 10 ALA N N -0.770 7.740 2.781 1.00 . A A . 9 ALA N 1 1 24 4456 1 1 10 ALA O O -0.013 10.746 4.154 1.00 . A A . 9 ALA O 1 1 24 4457 1 1 11 LEU C C -1.592 9.711 6.981 1.00 . A A . 10 LEU C 1 1 24 4458 1 1 11 LEU CA C -2.125 10.556 5.822 1.00 . A A . 10 LEU CA 1 1 24 4459 1 1 11 LEU CB C -3.632 10.778 5.967 1.00 . A A . 10 LEU CB 1 1 24 4460 1 1 11 LEU CD1 C -3.720 12.865 7.337 1.00 . A A . 10 LEU CD1 1 1 24 4461 1 1 11 LEU CD2 C -5.389 11.047 7.719 1.00 . A A . 10 LEU CD2 1 1 24 4462 1 1 11 LEU CG C -3.936 11.352 7.352 1.00 . A A . 10 LEU CG 1 1 24 4463 1 1 11 LEU H H -2.672 9.206 4.234 1.00 . A A . 10 LEU H 1 1 24 4464 1 1 11 LEU HA H -1.615 11.505 5.779 1.00 . A A . 10 LEU HA 1 1 24 4465 1 1 11 LEU HB2 H -3.967 11.471 5.209 1.00 . A A . 10 LEU HB2 1 1 24 4466 1 1 11 LEU HB3 H -4.147 9.837 5.848 1.00 . A A . 10 LEU HB3 1 1 24 4467 1 1 11 LEU HD11 H -2.903 13.107 6.675 1.00 . A A . 10 LEU HD11 1 1 24 4468 1 1 11 LEU HD12 H -4.620 13.354 6.992 1.00 . A A . 10 LEU HD12 1 1 24 4469 1 1 11 LEU HD13 H -3.487 13.206 8.336 1.00 . A A . 10 LEU HD13 1 1 24 4470 1 1 11 LEU HD21 H -5.892 10.612 6.868 1.00 . A A . 10 LEU HD21 1 1 24 4471 1 1 11 LEU HD22 H -5.415 10.354 8.547 1.00 . A A . 10 LEU HD22 1 1 24 4472 1 1 11 LEU HD23 H -5.888 11.963 8.002 1.00 . A A . 10 LEU HD23 1 1 24 4473 1 1 11 LEU HG H -3.276 10.902 8.080 1.00 . A A . 10 LEU HG 1 1 24 4474 1 1 11 LEU N N -1.970 9.820 4.535 1.00 . A A . 10 LEU N 1 1 24 4475 1 1 11 LEU O O -0.774 10.156 7.761 1.00 . A A . 10 LEU O 1 1 24 4476 1 1 12 ALA C C -0.505 6.648 7.691 1.00 . A A . 11 ALA C 1 1 24 4477 1 1 12 ALA CA C -1.567 7.622 8.209 1.00 . A A . 11 ALA CA 1 1 24 4478 1 1 12 ALA CB C -2.807 6.862 8.682 1.00 . A A . 11 ALA CB 1 1 24 4479 1 1 12 ALA H H -2.709 8.153 6.460 1.00 . A A . 11 ALA H 1 1 24 4480 1 1 12 ALA HA H -1.172 8.220 9.014 1.00 . A A . 11 ALA HA 1 1 24 4481 1 1 12 ALA HB1 H -3.602 6.986 7.963 1.00 . A A . 11 ALA HB1 1 1 24 4482 1 1 12 ALA HB2 H -2.570 5.813 8.781 1.00 . A A . 11 ALA HB2 1 1 24 4483 1 1 12 ALA HB3 H -3.123 7.250 9.639 1.00 . A A . 11 ALA HB3 1 1 24 4484 1 1 12 ALA N N -2.049 8.495 7.100 1.00 . A A . 11 ALA N 1 1 24 4485 1 1 12 ALA O O -0.605 5.453 7.891 1.00 . A A . 11 ALA O 1 1 24 4486 1 1 13 NH2 HN1 H 0.601 8.077 6.869 1.00 . A A . 12 NH2 HN1 1 1 24 4487 1 1 13 NH2 HN2 H 1.205 6.500 6.694 1.00 . A A . 12 NH2 HN2 1 1 24 4488 1 1 13 NH2 N N 0.519 7.114 7.030 1.00 . A A . 12 NH2 N 1 1 25 4489 1 1 2 ILE C C -2.049 -4.826 1.732 1.00 . A A . 1 ILE C 1 1 25 4490 1 1 2 ILE CA C -0.855 -5.091 2.651 1.00 . A A . 1 ILE CA 1 1 25 4491 1 1 2 ILE CB C 0.468 -4.641 2.011 1.00 . A A . 1 ILE CB 1 1 25 4492 1 1 2 ILE CD1 C 2.648 -3.518 2.531 1.00 . A A . 1 ILE CD1 1 1 25 4493 1 1 2 ILE CG1 C 1.421 -4.203 3.129 1.00 . A A . 1 ILE CG1 1 1 25 4494 1 1 2 ILE CG2 C 0.237 -3.469 1.037 1.00 . A A . 1 ILE CG2 1 1 25 4495 1 1 2 ILE H H 0.174 -6.977 2.800 1.00 . A A . 1 ILE H 1 1 25 4496 1 1 2 ILE HA H -0.988 -4.589 3.590 1.00 . A A . 1 ILE HA 1 1 25 4497 1 1 2 ILE HB H 0.902 -5.469 1.476 1.00 . A A . 1 ILE HB 1 1 25 4498 1 1 2 ILE HD11 H 2.755 -3.813 1.497 1.00 . A A . 1 ILE HD11 1 1 25 4499 1 1 2 ILE HD12 H 2.524 -2.447 2.588 1.00 . A A . 1 ILE HD12 1 1 25 4500 1 1 2 ILE HD13 H 3.528 -3.810 3.082 1.00 . A A . 1 ILE HD13 1 1 25 4501 1 1 2 ILE HG12 H 0.910 -3.512 3.785 1.00 . A A . 1 ILE HG12 1 1 25 4502 1 1 2 ILE HG13 H 1.735 -5.070 3.692 1.00 . A A . 1 ILE HG13 1 1 25 4503 1 1 2 ILE HG21 H -0.741 -3.040 1.208 1.00 . A A . 1 ILE HG21 1 1 25 4504 1 1 2 ILE HG22 H 0.986 -2.708 1.189 1.00 . A A . 1 ILE HG22 1 1 25 4505 1 1 2 ILE HG23 H 0.294 -3.828 0.020 1.00 . A A . 1 ILE HG23 1 1 25 4506 1 1 2 ILE N N -0.707 -6.555 2.872 1.00 . A A . 1 ILE N 1 1 25 4507 1 1 2 ILE O O -3.131 -4.506 2.180 1.00 . A A . 1 ILE O 1 1 25 4508 1 1 3 ASP C C -3.415 -3.239 -0.407 1.00 . A A . 2 ASP C 1 1 25 4509 1 1 3 ASP CA C -2.948 -4.692 -0.517 1.00 . A A . 2 ASP CA 1 1 25 4510 1 1 3 ASP CB C -4.068 -5.651 -0.112 1.00 . A A . 2 ASP CB 1 1 25 4511 1 1 3 ASP CG C -4.738 -6.213 -1.367 1.00 . A A . 2 ASP CG 1 1 25 4512 1 1 3 ASP H H -0.962 -5.205 0.124 1.00 . A A . 2 ASP H 1 1 25 4513 1 1 3 ASP HA H -2.625 -4.903 -1.522 1.00 . A A . 2 ASP HA 1 1 25 4514 1 1 3 ASP HB2 H -3.655 -6.461 0.470 1.00 . A A . 2 ASP HB2 1 1 25 4515 1 1 3 ASP HB3 H -4.801 -5.121 0.478 1.00 . A A . 2 ASP HB3 1 1 25 4516 1 1 3 ASP N N -1.847 -4.949 0.451 1.00 . A A . 2 ASP N 1 1 25 4517 1 1 3 ASP O O -3.213 -2.442 -1.301 1.00 . A A . 2 ASP O 1 1 25 4518 1 1 3 ASP OD1 O -4.021 -6.616 -2.268 1.00 . A A . 2 ASP OD1 1 1 25 4519 1 1 3 ASP OD2 O -5.958 -6.231 -1.405 1.00 . A A . 2 ASP OD2 1 1 25 4520 1 1 4 TYR C C -3.407 -0.521 1.181 1.00 . A A . 3 TYR C 1 1 25 4521 1 1 4 TYR CA C -4.543 -1.503 0.842 1.00 . A A . 3 TYR CA 1 1 25 4522 1 1 4 TYR CB C -5.585 -1.584 1.962 1.00 . A A . 3 TYR CB 1 1 25 4523 1 1 4 TYR CD1 C -4.492 -0.740 4.062 1.00 . A A . 3 TYR CD1 1 1 25 4524 1 1 4 TYR CD2 C -4.739 -3.132 3.758 1.00 . A A . 3 TYR CD2 1 1 25 4525 1 1 4 TYR CE1 C -3.884 -0.956 5.300 1.00 . A A . 3 TYR CE1 1 1 25 4526 1 1 4 TYR CE2 C -4.133 -3.349 5.000 1.00 . A A . 3 TYR CE2 1 1 25 4527 1 1 4 TYR CG C -4.918 -1.827 3.291 1.00 . A A . 3 TYR CG 1 1 25 4528 1 1 4 TYR CZ C -3.706 -2.260 5.768 1.00 . A A . 3 TYR CZ 1 1 25 4529 1 1 4 TYR H H -4.206 -3.562 1.377 1.00 . A A . 3 TYR H 1 1 25 4530 1 1 4 TYR HA H -5.026 -1.185 -0.063 1.00 . A A . 3 TYR HA 1 1 25 4531 1 1 4 TYR HB2 H -6.134 -0.657 2.006 1.00 . A A . 3 TYR HB2 1 1 25 4532 1 1 4 TYR HB3 H -6.269 -2.393 1.754 1.00 . A A . 3 TYR HB3 1 1 25 4533 1 1 4 TYR HD1 H -4.630 0.265 3.699 1.00 . A A . 3 TYR HD1 1 1 25 4534 1 1 4 TYR HD2 H -5.068 -3.970 3.162 1.00 . A A . 3 TYR HD2 1 1 25 4535 1 1 4 TYR HE1 H -3.555 -0.118 5.895 1.00 . A A . 3 TYR HE1 1 1 25 4536 1 1 4 TYR HE2 H -3.993 -4.356 5.364 1.00 . A A . 3 TYR HE2 1 1 25 4537 1 1 4 TYR HH H -2.509 -1.747 7.163 1.00 . A A . 3 TYR HH 1 1 25 4538 1 1 4 TYR N N -4.048 -2.897 0.675 1.00 . A A . 3 TYR N 1 1 25 4539 1 1 4 TYR O O -3.275 0.491 0.533 1.00 . A A . 3 TYR O 1 1 25 4540 1 1 4 TYR OH O -3.111 -2.474 6.995 1.00 . A A . 3 TYR OH 1 1 25 4541 1 1 5 TRP C C -1.120 1.080 1.453 1.00 . A A . 4 TRP C 1 1 25 4542 1 1 5 TRP CA C -1.470 0.110 2.584 1.00 . A A . 4 TRP CA 1 1 25 4543 1 1 5 TRP CB C -0.268 -0.800 2.843 1.00 . A A . 4 TRP CB 1 1 25 4544 1 1 5 TRP CD1 C -1.321 -2.521 4.383 1.00 . A A . 4 TRP CD1 1 1 25 4545 1 1 5 TRP CD2 C 0.368 -1.409 5.349 1.00 . A A . 4 TRP CD2 1 1 25 4546 1 1 5 TRP CE2 C -0.117 -2.321 6.312 1.00 . A A . 4 TRP CE2 1 1 25 4547 1 1 5 TRP CE3 C 1.441 -0.583 5.702 1.00 . A A . 4 TRP CE3 1 1 25 4548 1 1 5 TRP CG C -0.418 -1.547 4.134 1.00 . A A . 4 TRP CG 1 1 25 4549 1 1 5 TRP CH2 C 1.515 -1.578 7.922 1.00 . A A . 4 TRP CH2 1 1 25 4550 1 1 5 TRP CZ2 C 0.445 -2.410 7.584 1.00 . A A . 4 TRP CZ2 1 1 25 4551 1 1 5 TRP CZ3 C 2.014 -0.665 6.982 1.00 . A A . 4 TRP CZ3 1 1 25 4552 1 1 5 TRP H H -2.739 -1.634 2.680 1.00 . A A . 4 TRP H 1 1 25 4553 1 1 5 TRP HA H -1.722 0.650 3.483 1.00 . A A . 4 TRP HA 1 1 25 4554 1 1 5 TRP HB2 H -0.180 -1.500 2.037 1.00 . A A . 4 TRP HB2 1 1 25 4555 1 1 5 TRP HB3 H 0.628 -0.197 2.885 1.00 . A A . 4 TRP HB3 1 1 25 4556 1 1 5 TRP HD1 H -2.058 -2.890 3.691 1.00 . A A . 4 TRP HD1 1 1 25 4557 1 1 5 TRP HE1 H -1.677 -3.680 6.104 1.00 . A A . 4 TRP HE1 1 1 25 4558 1 1 5 TRP HE3 H 1.828 0.116 4.982 1.00 . A A . 4 TRP HE3 1 1 25 4559 1 1 5 TRP HH2 H 1.958 -1.639 8.906 1.00 . A A . 4 TRP HH2 1 1 25 4560 1 1 5 TRP HZ2 H 0.054 -3.116 8.300 1.00 . A A . 4 TRP HZ2 1 1 25 4561 1 1 5 TRP HZ3 H 2.841 -0.022 7.244 1.00 . A A . 4 TRP HZ3 1 1 25 4562 1 1 5 TRP N N -2.600 -0.812 2.185 1.00 . A A . 4 TRP N 1 1 25 4563 1 1 5 TRP NE1 N -1.145 -2.979 5.675 1.00 . A A . 4 TRP NE1 1 1 25 4564 1 1 5 TRP O O -1.085 2.282 1.630 1.00 . A A . 4 TRP O 1 1 25 4565 1 1 6 LEU C C -1.417 2.648 -0.932 1.00 . A A . 5 LEU C 1 1 25 4566 1 1 6 LEU CA C -0.520 1.402 -0.880 1.00 . A A . 5 LEU CA 1 1 25 4567 1 1 6 LEU CB C -0.771 0.483 -2.080 1.00 . A A . 5 LEU CB 1 1 25 4568 1 1 6 LEU CD1 C 0.308 1.955 -3.788 1.00 . A A . 5 LEU CD1 1 1 25 4569 1 1 6 LEU CD2 C -1.506 0.371 -4.455 1.00 . A A . 5 LEU CD2 1 1 25 4570 1 1 6 LEU CG C -1.004 1.303 -3.350 1.00 . A A . 5 LEU CG 1 1 25 4571 1 1 6 LEU H H -0.908 -0.423 0.185 1.00 . A A . 5 LEU H 1 1 25 4572 1 1 6 LEU HA H 0.519 1.686 -0.845 1.00 . A A . 5 LEU HA 1 1 25 4573 1 1 6 LEU HB2 H 0.086 -0.158 -2.222 1.00 . A A . 5 LEU HB2 1 1 25 4574 1 1 6 LEU HB3 H -1.642 -0.125 -1.886 1.00 . A A . 5 LEU HB3 1 1 25 4575 1 1 6 LEU HD11 H 0.942 2.106 -2.926 1.00 . A A . 5 LEU HD11 1 1 25 4576 1 1 6 LEU HD12 H 0.811 1.313 -4.495 1.00 . A A . 5 LEU HD12 1 1 25 4577 1 1 6 LEU HD13 H 0.100 2.908 -4.252 1.00 . A A . 5 LEU HD13 1 1 25 4578 1 1 6 LEU HD21 H -2.403 -0.132 -4.121 1.00 . A A . 5 LEU HD21 1 1 25 4579 1 1 6 LEU HD22 H -1.725 0.946 -5.341 1.00 . A A . 5 LEU HD22 1 1 25 4580 1 1 6 LEU HD23 H -0.746 -0.364 -4.681 1.00 . A A . 5 LEU HD23 1 1 25 4581 1 1 6 LEU HG H -1.742 2.068 -3.159 1.00 . A A . 5 LEU HG 1 1 25 4582 1 1 6 LEU N N -0.867 0.551 0.292 1.00 . A A . 5 LEU N 1 1 25 4583 1 1 6 LEU O O -0.941 3.760 -1.043 1.00 . A A . 5 LEU O 1 1 25 4584 1 1 7 ALA C C -3.919 4.197 0.473 1.00 . A A . 6 ALA C 1 1 25 4585 1 1 7 ALA CA C -3.630 3.648 -0.928 1.00 . A A . 6 ALA CA 1 1 25 4586 1 1 7 ALA CB C -4.913 3.107 -1.558 1.00 . A A . 6 ALA CB 1 1 25 4587 1 1 7 ALA H H -3.077 1.566 -0.787 1.00 . A A . 6 ALA H 1 1 25 4588 1 1 7 ALA HA H -3.211 4.419 -1.556 1.00 . A A . 6 ALA HA 1 1 25 4589 1 1 7 ALA HB1 H -4.684 2.232 -2.148 1.00 . A A . 6 ALA HB1 1 1 25 4590 1 1 7 ALA HB2 H -5.613 2.841 -0.779 1.00 . A A . 6 ALA HB2 1 1 25 4591 1 1 7 ALA HB3 H -5.351 3.865 -2.191 1.00 . A A . 6 ALA HB3 1 1 25 4592 1 1 7 ALA N N -2.710 2.471 -0.867 1.00 . A A . 6 ALA N 1 1 25 4593 1 1 7 ALA O O -4.652 5.153 0.633 1.00 . A A . 6 ALA O 1 1 25 4594 1 1 8 HIS C C -2.322 4.512 3.544 1.00 . A A . 7 HIS C 1 1 25 4595 1 1 8 HIS CA C -3.631 4.091 2.873 1.00 . A A . 7 HIS CA 1 1 25 4596 1 1 8 HIS CB C -4.256 2.901 3.613 1.00 . A A . 7 HIS CB 1 1 25 4597 1 1 8 HIS CD2 C -5.370 1.878 1.454 1.00 . A A . 7 HIS CD2 1 1 25 4598 1 1 8 HIS CE1 C -7.286 1.345 2.303 1.00 . A A . 7 HIS CE1 1 1 25 4599 1 1 8 HIS CG C -5.335 2.263 2.771 1.00 . A A . 7 HIS CG 1 1 25 4600 1 1 8 HIS H H -2.783 2.823 1.350 1.00 . A A . 7 HIS H 1 1 25 4601 1 1 8 HIS HA H -4.326 4.915 2.852 1.00 . A A . 7 HIS HA 1 1 25 4602 1 1 8 HIS HB2 H -3.489 2.170 3.824 1.00 . A A . 7 HIS HB2 1 1 25 4603 1 1 8 HIS HB3 H -4.684 3.245 4.544 1.00 . A A . 7 HIS HB3 1 1 25 4604 1 1 8 HIS HD1 H -6.874 2.057 4.217 1.00 . A A . 7 HIS HD1 1 1 25 4605 1 1 8 HIS HD2 H -4.566 1.988 0.755 1.00 . A A . 7 HIS HD2 1 1 25 4606 1 1 8 HIS HE1 H -8.280 0.950 2.419 1.00 . A A . 7 HIS HE1 1 1 25 4607 1 1 8 HIS HE2 H -6.898 0.942 0.305 1.00 . A A . 7 HIS HE2 1 1 25 4608 1 1 8 HIS N N -3.365 3.599 1.492 1.00 . A A . 7 HIS N 1 1 25 4609 1 1 8 HIS ND1 N -6.573 1.915 3.295 1.00 . A A . 7 HIS ND1 1 1 25 4610 1 1 8 HIS NE2 N -6.599 1.304 1.166 1.00 . A A . 7 HIS NE2 1 1 25 4611 1 1 8 HIS O O -1.960 4.011 4.591 1.00 . A A . 7 HIS O 1 1 25 4612 1 1 9 LYS C C -0.476 7.291 4.131 1.00 . A A . 8 LYS C 1 1 25 4613 1 1 9 LYS CA C -0.322 5.881 3.555 1.00 . A A . 8 LYS CA 1 1 25 4614 1 1 9 LYS CB C 0.680 5.880 2.400 1.00 . A A . 8 LYS CB 1 1 25 4615 1 1 9 LYS CD C 1.291 3.459 2.501 1.00 . A A . 8 LYS CD 1 1 25 4616 1 1 9 LYS CE C 2.783 3.771 2.625 1.00 . A A . 8 LYS CE 1 1 25 4617 1 1 9 LYS CG C 0.609 4.542 1.663 1.00 . A A . 8 LYS CG 1 1 25 4618 1 1 9 LYS H H -1.917 5.821 2.108 1.00 . A A . 8 LYS H 1 1 25 4619 1 1 9 LYS HA H -0.003 5.193 4.321 1.00 . A A . 8 LYS HA 1 1 25 4620 1 1 9 LYS HB2 H 0.442 6.682 1.716 1.00 . A A . 8 LYS HB2 1 1 25 4621 1 1 9 LYS HB3 H 1.678 6.021 2.789 1.00 . A A . 8 LYS HB3 1 1 25 4622 1 1 9 LYS HD2 H 0.845 3.432 3.485 1.00 . A A . 8 LYS HD2 1 1 25 4623 1 1 9 LYS HD3 H 1.165 2.500 2.023 1.00 . A A . 8 LYS HD3 1 1 25 4624 1 1 9 LYS HE2 H 3.218 3.916 1.645 1.00 . A A . 8 LYS HE2 1 1 25 4625 1 1 9 LYS HE3 H 2.936 4.646 3.238 1.00 . A A . 8 LYS HE3 1 1 25 4626 1 1 9 LYS HG2 H -0.426 4.274 1.500 1.00 . A A . 8 LYS HG2 1 1 25 4627 1 1 9 LYS HG3 H 1.113 4.627 0.712 1.00 . A A . 8 LYS HG3 1 1 25 4628 1 1 9 LYS HZ1 H 2.873 2.393 4.181 1.00 . A A . 8 LYS HZ1 1 1 25 4629 1 1 9 LYS HZ2 H 3.279 1.751 2.662 1.00 . A A . 8 LYS HZ2 1 1 25 4630 1 1 9 LYS HZ3 H 4.380 2.748 3.481 1.00 . A A . 8 LYS HZ3 1 1 25 4631 1 1 9 LYS N N -1.608 5.429 2.951 1.00 . A A . 8 LYS N 1 1 25 4632 1 1 9 LYS NZ N 3.373 2.575 3.287 1.00 . A A . 8 LYS NZ 1 1 25 4633 1 1 9 LYS O O -1.525 7.662 4.619 1.00 . A A . 8 LYS O 1 1 25 4634 1 1 10 ALA C C -0.841 10.118 4.193 1.00 . A A . 9 ALA C 1 1 25 4635 1 1 10 ALA CA C 0.475 9.466 4.623 1.00 . A A . 9 ALA CA 1 1 25 4636 1 1 10 ALA CB C 1.665 10.206 4.014 1.00 . A A . 9 ALA CB 1 1 25 4637 1 1 10 ALA H H 1.400 7.762 3.681 1.00 . A A . 9 ALA H 1 1 25 4638 1 1 10 ALA HA H 0.557 9.455 5.698 1.00 . A A . 9 ALA HA 1 1 25 4639 1 1 10 ALA HB1 H 1.824 9.863 3.003 1.00 . A A . 9 ALA HB1 1 1 25 4640 1 1 10 ALA HB2 H 1.464 11.267 4.007 1.00 . A A . 9 ALA HB2 1 1 25 4641 1 1 10 ALA HB3 H 2.549 10.012 4.604 1.00 . A A . 9 ALA HB3 1 1 25 4642 1 1 10 ALA N N 0.563 8.081 4.079 1.00 . A A . 9 ALA N 1 1 25 4643 1 1 10 ALA O O -1.351 11.004 4.851 1.00 . A A . 9 ALA O 1 1 25 4644 1 1 11 LEU C C -3.790 10.024 3.643 1.00 . A A . 10 LEU C 1 1 25 4645 1 1 11 LEU CA C -2.680 10.284 2.621 1.00 . A A . 10 LEU CA 1 1 25 4646 1 1 11 LEU CB C -2.985 9.572 1.303 1.00 . A A . 10 LEU CB 1 1 25 4647 1 1 11 LEU CD1 C -4.377 11.339 0.215 1.00 . A A . 10 LEU CD1 1 1 25 4648 1 1 11 LEU CD2 C -4.867 8.927 -0.207 1.00 . A A . 10 LEU CD2 1 1 25 4649 1 1 11 LEU CG C -4.394 9.941 0.837 1.00 . A A . 10 LEU CG 1 1 25 4650 1 1 11 LEU H H -0.970 8.973 2.576 1.00 . A A . 10 LEU H 1 1 25 4651 1 1 11 LEU HA H -2.563 11.342 2.450 1.00 . A A . 10 LEU HA 1 1 25 4652 1 1 11 LEU HB2 H -2.267 9.874 0.555 1.00 . A A . 10 LEU HB2 1 1 25 4653 1 1 11 LEU HB3 H -2.925 8.504 1.448 1.00 . A A . 10 LEU HB3 1 1 25 4654 1 1 11 LEU HD11 H -3.564 11.409 -0.492 1.00 . A A . 10 LEU HD11 1 1 25 4655 1 1 11 LEU HD12 H -5.313 11.519 -0.293 1.00 . A A . 10 LEU HD12 1 1 25 4656 1 1 11 LEU HD13 H -4.241 12.077 0.993 1.00 . A A . 10 LEU HD13 1 1 25 4657 1 1 11 LEU HD21 H -4.613 7.929 0.120 1.00 . A A . 10 LEU HD21 1 1 25 4658 1 1 11 LEU HD22 H -5.938 9.004 -0.326 1.00 . A A . 10 LEU HD22 1 1 25 4659 1 1 11 LEU HD23 H -4.385 9.130 -1.151 1.00 . A A . 10 LEU HD23 1 1 25 4660 1 1 11 LEU HG H -5.067 9.932 1.682 1.00 . A A . 10 LEU HG 1 1 25 4661 1 1 11 LEU N N -1.396 9.688 3.092 1.00 . A A . 10 LEU N 1 1 25 4662 1 1 11 LEU O O -4.452 10.936 4.099 1.00 . A A . 10 LEU O 1 1 25 4663 1 1 12 ALA C C -4.634 7.298 5.884 1.00 . A A . 11 ALA C 1 1 25 4664 1 1 12 ALA CA C -5.065 8.472 4.999 1.00 . A A . 11 ALA CA 1 1 25 4665 1 1 12 ALA CB C -6.285 8.092 4.161 1.00 . A A . 11 ALA CB 1 1 25 4666 1 1 12 ALA H H -3.452 8.068 3.628 1.00 . A A . 11 ALA H 1 1 25 4667 1 1 12 ALA HA H -5.287 9.337 5.602 1.00 . A A . 11 ALA HA 1 1 25 4668 1 1 12 ALA HB1 H -5.979 7.442 3.354 1.00 . A A . 11 ALA HB1 1 1 25 4669 1 1 12 ALA HB2 H -7.004 7.580 4.782 1.00 . A A . 11 ALA HB2 1 1 25 4670 1 1 12 ALA HB3 H -6.734 8.985 3.752 1.00 . A A . 11 ALA HB3 1 1 25 4671 1 1 12 ALA N N -3.997 8.788 4.007 1.00 . A A . 11 ALA N 1 1 25 4672 1 1 12 ALA O O -5.424 6.428 6.193 1.00 . A A . 11 ALA O 1 1 25 4673 1 1 13 NH2 HN1 H -2.763 7.939 6.058 1.00 . A A . 12 NH2 HN1 1 1 25 4674 1 1 13 NH2 HN2 H -3.113 6.491 6.873 1.00 . A A . 12 NH2 HN2 1 1 25 4675 1 1 13 NH2 N N -3.401 7.238 6.307 1.00 . A A . 12 NH2 N 1 1 26 4676 1 1 2 ILE C C -2.043 -4.881 1.707 1.00 . A A . 1 ILE C 1 1 26 4677 1 1 2 ILE CA C -0.847 -5.136 2.626 1.00 . A A . 1 ILE CA 1 1 26 4678 1 1 2 ILE CB C 0.472 -4.679 1.983 1.00 . A A . 1 ILE CB 1 1 26 4679 1 1 2 ILE CD1 C 2.650 -3.552 2.503 1.00 . A A . 1 ILE CD1 1 1 26 4680 1 1 2 ILE CG1 C 1.435 -4.260 3.100 1.00 . A A . 1 ILE CG1 1 1 26 4681 1 1 2 ILE CG2 C 0.233 -3.492 1.029 1.00 . A A . 1 ILE CG2 1 1 26 4682 1 1 2 ILE H H 0.195 -7.016 2.779 1.00 . A A . 1 ILE H 1 1 26 4683 1 1 2 ILE HA H -0.982 -4.629 3.563 1.00 . A A . 1 ILE HA 1 1 26 4684 1 1 2 ILE HB H 0.899 -5.499 1.430 1.00 . A A . 1 ILE HB 1 1 26 4685 1 1 2 ILE HD11 H 2.579 -3.563 1.425 1.00 . A A . 1 ILE HD11 1 1 26 4686 1 1 2 ILE HD12 H 2.675 -2.529 2.852 1.00 . A A . 1 ILE HD12 1 1 26 4687 1 1 2 ILE HD13 H 3.550 -4.061 2.811 1.00 . A A . 1 ILE HD13 1 1 26 4688 1 1 2 ILE HG12 H 0.926 -3.590 3.779 1.00 . A A . 1 ILE HG12 1 1 26 4689 1 1 2 ILE HG13 H 1.763 -5.138 3.638 1.00 . A A . 1 ILE HG13 1 1 26 4690 1 1 2 ILE HG21 H -0.749 -3.075 1.207 1.00 . A A . 1 ILE HG21 1 1 26 4691 1 1 2 ILE HG22 H 0.975 -2.728 1.196 1.00 . A A . 1 ILE HG22 1 1 26 4692 1 1 2 ILE HG23 H 0.291 -3.833 0.006 1.00 . A A . 1 ILE HG23 1 1 26 4693 1 1 2 ILE N N -0.689 -6.598 2.854 1.00 . A A . 1 ILE N 1 1 26 4694 1 1 2 ILE O O -3.129 -4.579 2.155 1.00 . A A . 1 ILE O 1 1 26 4695 1 1 3 ASP C C -3.421 -3.294 -0.426 1.00 . A A . 2 ASP C 1 1 26 4696 1 1 3 ASP CA C -2.941 -4.741 -0.541 1.00 . A A . 2 ASP CA 1 1 26 4697 1 1 3 ASP CB C -4.051 -5.713 -0.143 1.00 . A A . 2 ASP CB 1 1 26 4698 1 1 3 ASP CG C -5.114 -5.752 -1.241 1.00 . A A . 2 ASP CG 1 1 26 4699 1 1 3 ASP H H -0.947 -5.231 0.099 1.00 . A A . 2 ASP H 1 1 26 4700 1 1 3 ASP HA H -2.614 -4.943 -1.547 1.00 . A A . 2 ASP HA 1 1 26 4701 1 1 3 ASP HB2 H -3.634 -6.701 -0.011 1.00 . A A . 2 ASP HB2 1 1 26 4702 1 1 3 ASP HB3 H -4.502 -5.386 0.781 1.00 . A A . 2 ASP HB3 1 1 26 4703 1 1 3 ASP N N -1.836 -4.991 0.425 1.00 . A A . 2 ASP N 1 1 26 4704 1 1 3 ASP O O -3.232 -2.492 -1.319 1.00 . A A . 2 ASP O 1 1 26 4705 1 1 3 ASP OD1 O -4.889 -5.149 -2.278 1.00 . A A . 2 ASP OD1 1 1 26 4706 1 1 3 ASP OD2 O -6.137 -6.383 -1.027 1.00 . A A . 2 ASP OD2 1 1 26 4707 1 1 4 TYR C C -3.422 -0.580 1.163 1.00 . A A . 3 TYR C 1 1 26 4708 1 1 4 TYR CA C -4.555 -1.569 0.831 1.00 . A A . 3 TYR CA 1 1 26 4709 1 1 4 TYR CB C -5.597 -1.655 1.954 1.00 . A A . 3 TYR CB 1 1 26 4710 1 1 4 TYR CD1 C -4.675 -3.207 3.709 1.00 . A A . 3 TYR CD1 1 1 26 4711 1 1 4 TYR CD2 C -4.574 -0.815 4.089 1.00 . A A . 3 TYR CD2 1 1 26 4712 1 1 4 TYR CE1 C -4.063 -3.428 4.947 1.00 . A A . 3 TYR CE1 1 1 26 4713 1 1 4 TYR CE2 C -3.964 -1.035 5.327 1.00 . A A . 3 TYR CE2 1 1 26 4714 1 1 4 TYR CG C -4.929 -1.901 3.281 1.00 . A A . 3 TYR CG 1 1 26 4715 1 1 4 TYR CZ C -3.709 -2.341 5.754 1.00 . A A . 3 TYR CZ 1 1 26 4716 1 1 4 TYR H H -4.198 -3.625 1.363 1.00 . A A . 3 TYR H 1 1 26 4717 1 1 4 TYR HA H -5.043 -1.254 -0.074 1.00 . A A . 3 TYR HA 1 1 26 4718 1 1 4 TYR HB2 H -6.148 -0.729 2.000 1.00 . A A . 3 TYR HB2 1 1 26 4719 1 1 4 TYR HB3 H -6.279 -2.465 1.743 1.00 . A A . 3 TYR HB3 1 1 26 4720 1 1 4 TYR HD1 H -4.949 -4.044 3.084 1.00 . A A . 3 TYR HD1 1 1 26 4721 1 1 4 TYR HD2 H -4.770 0.192 3.757 1.00 . A A . 3 TYR HD2 1 1 26 4722 1 1 4 TYR HE1 H -3.865 -4.436 5.280 1.00 . A A . 3 TYR HE1 1 1 26 4723 1 1 4 TYR HE2 H -3.690 -0.199 5.951 1.00 . A A . 3 TYR HE2 1 1 26 4724 1 1 4 TYR HH H -3.188 -3.493 7.185 1.00 . A A . 3 TYR HH 1 1 26 4725 1 1 4 TYR N N -4.050 -2.959 0.661 1.00 . A A . 3 TYR N 1 1 26 4726 1 1 4 TYR O O -3.279 0.413 0.489 1.00 . A A . 3 TYR O 1 1 26 4727 1 1 4 TYR OH O -3.109 -2.559 6.978 1.00 . A A . 3 TYR OH 1 1 26 4728 1 1 5 TRP C C -1.166 1.060 1.452 1.00 . A A . 4 TRP C 1 1 26 4729 1 1 5 TRP CA C -1.502 0.083 2.580 1.00 . A A . 4 TRP CA 1 1 26 4730 1 1 5 TRP CB C -0.293 -0.823 2.827 1.00 . A A . 4 TRP CB 1 1 26 4731 1 1 5 TRP CD1 C -1.327 -2.563 4.356 1.00 . A A . 4 TRP CD1 1 1 26 4732 1 1 5 TRP CD2 C 0.359 -1.448 5.325 1.00 . A A . 4 TRP CD2 1 1 26 4733 1 1 5 TRP CE2 C -0.116 -2.372 6.283 1.00 . A A . 4 TRP CE2 1 1 26 4734 1 1 5 TRP CE3 C 1.427 -0.618 5.681 1.00 . A A . 4 TRP CE3 1 1 26 4735 1 1 5 TRP CG C -0.432 -1.581 4.112 1.00 . A A . 4 TRP CG 1 1 26 4736 1 1 5 TRP CH2 C 1.518 -1.630 7.892 1.00 . A A . 4 TRP CH2 1 1 26 4737 1 1 5 TRP CZ2 C 0.453 -2.468 7.552 1.00 . A A . 4 TRP CZ2 1 1 26 4738 1 1 5 TRP CZ3 C 2.007 -0.706 6.958 1.00 . A A . 4 TRP CZ3 1 1 26 4739 1 1 5 TRP H H -2.776 -1.654 2.700 1.00 . A A . 4 TRP H 1 1 26 4740 1 1 5 TRP HA H -1.751 0.618 3.483 1.00 . A A . 4 TRP HA 1 1 26 4741 1 1 5 TRP HB2 H -0.203 -1.514 2.014 1.00 . A A . 4 TRP HB2 1 1 26 4742 1 1 5 TRP HB3 H 0.599 -0.213 2.870 1.00 . A A . 4 TRP HB3 1 1 26 4743 1 1 5 TRP HD1 H -2.064 -2.932 3.664 1.00 . A A . 4 TRP HD1 1 1 26 4744 1 1 5 TRP HE1 H -1.667 -3.741 6.069 1.00 . A A . 4 TRP HE1 1 1 26 4745 1 1 5 TRP HE3 H 1.807 0.089 4.964 1.00 . A A . 4 TRP HE3 1 1 26 4746 1 1 5 TRP HH2 H 1.965 -1.697 8.873 1.00 . A A . 4 TRP HH2 1 1 26 4747 1 1 5 TRP HZ2 H 0.071 -3.183 8.265 1.00 . A A . 4 TRP HZ2 1 1 26 4748 1 1 5 TRP HZ3 H 2.830 -0.059 7.221 1.00 . A A . 4 TRP HZ3 1 1 26 4749 1 1 5 TRP N N -2.630 -0.845 2.186 1.00 . A A . 4 TRP N 1 1 26 4750 1 1 5 TRP NE1 N -1.141 -3.031 5.643 1.00 . A A . 4 TRP NE1 1 1 26 4751 1 1 5 TRP O O -1.180 2.263 1.620 1.00 . A A . 4 TRP O 1 1 26 4752 1 1 6 LEU C C -1.411 2.639 -0.917 1.00 . A A . 5 LEU C 1 1 26 4753 1 1 6 LEU CA C -0.524 1.385 -0.871 1.00 . A A . 5 LEU CA 1 1 26 4754 1 1 6 LEU CB C -0.791 0.470 -2.071 1.00 . A A . 5 LEU CB 1 1 26 4755 1 1 6 LEU CD1 C 0.279 1.951 -3.776 1.00 . A A . 5 LEU CD1 1 1 26 4756 1 1 6 LEU CD2 C -1.533 0.364 -4.444 1.00 . A A . 5 LEU CD2 1 1 26 4757 1 1 6 LEU CG C -1.030 1.294 -3.337 1.00 . A A . 5 LEU CG 1 1 26 4758 1 1 6 LEU H H -0.867 -0.443 0.203 1.00 . A A . 5 LEU H 1 1 26 4759 1 1 6 LEU HA H 0.518 1.661 -0.846 1.00 . A A . 5 LEU HA 1 1 26 4760 1 1 6 LEU HB2 H 0.061 -0.177 -2.223 1.00 . A A . 5 LEU HB2 1 1 26 4761 1 1 6 LEU HB3 H -1.663 -0.133 -1.870 1.00 . A A . 5 LEU HB3 1 1 26 4762 1 1 6 LEU HD11 H 1.076 1.643 -3.115 1.00 . A A . 5 LEU HD11 1 1 26 4763 1 1 6 LEU HD12 H 0.512 1.649 -4.786 1.00 . A A . 5 LEU HD12 1 1 26 4764 1 1 6 LEU HD13 H 0.174 3.026 -3.737 1.00 . A A . 5 LEU HD13 1 1 26 4765 1 1 6 LEU HD21 H -0.931 -0.534 -4.461 1.00 . A A . 5 LEU HD21 1 1 26 4766 1 1 6 LEU HD22 H -2.564 0.101 -4.253 1.00 . A A . 5 LEU HD22 1 1 26 4767 1 1 6 LEU HD23 H -1.460 0.864 -5.397 1.00 . A A . 5 LEU HD23 1 1 26 4768 1 1 6 LEU HG H -1.769 2.056 -3.140 1.00 . A A . 5 LEU HG 1 1 26 4769 1 1 6 LEU N N -0.866 0.532 0.300 1.00 . A A . 5 LEU N 1 1 26 4770 1 1 6 LEU O O -0.925 3.747 -1.026 1.00 . A A . 5 LEU O 1 1 26 4771 1 1 7 ALA C C -3.894 4.214 0.494 1.00 . A A . 6 ALA C 1 1 26 4772 1 1 7 ALA CA C -3.613 3.661 -0.908 1.00 . A A . 6 ALA CA 1 1 26 4773 1 1 7 ALA CB C -4.903 3.135 -1.536 1.00 . A A . 6 ALA CB 1 1 26 4774 1 1 7 ALA H H -3.081 1.573 -0.773 1.00 . A A . 6 ALA H 1 1 26 4775 1 1 7 ALA HA H -3.188 4.429 -1.535 1.00 . A A . 6 ALA HA 1 1 26 4776 1 1 7 ALA HB1 H -4.662 2.427 -2.316 1.00 . A A . 6 ALA HB1 1 1 26 4777 1 1 7 ALA HB2 H -5.498 2.645 -0.778 1.00 . A A . 6 ALA HB2 1 1 26 4778 1 1 7 ALA HB3 H -5.462 3.958 -1.956 1.00 . A A . 6 ALA HB3 1 1 26 4779 1 1 7 ALA N N -2.705 2.475 -0.849 1.00 . A A . 6 ALA N 1 1 26 4780 1 1 7 ALA O O -4.674 5.130 0.661 1.00 . A A . 6 ALA O 1 1 26 4781 1 1 8 HIS C C -2.233 4.638 3.526 1.00 . A A . 7 HIS C 1 1 26 4782 1 1 8 HIS CA C -3.539 4.160 2.886 1.00 . A A . 7 HIS CA 1 1 26 4783 1 1 8 HIS CB C -4.107 2.956 3.650 1.00 . A A . 7 HIS CB 1 1 26 4784 1 1 8 HIS CD2 C -5.236 1.881 1.523 1.00 . A A . 7 HIS CD2 1 1 26 4785 1 1 8 HIS CE1 C -7.139 1.350 2.402 1.00 . A A . 7 HIS CE1 1 1 26 4786 1 1 8 HIS CG C -5.189 2.288 2.835 1.00 . A A . 7 HIS CG 1 1 26 4787 1 1 8 HIS H H -2.662 2.917 1.357 1.00 . A A . 7 HIS H 1 1 26 4788 1 1 8 HIS HA H -4.263 4.958 2.868 1.00 . A A . 7 HIS HA 1 1 26 4789 1 1 8 HIS HB2 H -3.314 2.248 3.841 1.00 . A A . 7 HIS HB2 1 1 26 4790 1 1 8 HIS HB3 H -4.521 3.292 4.588 1.00 . A A . 7 HIS HB3 1 1 26 4791 1 1 8 HIS HD1 H -6.709 2.091 4.301 1.00 . A A . 7 HIS HD1 1 1 26 4792 1 1 8 HIS HD2 H -4.440 1.989 0.814 1.00 . A A . 7 HIS HD2 1 1 26 4793 1 1 8 HIS HE1 H -8.132 0.956 2.531 1.00 . A A . 7 HIS HE1 1 1 26 4794 1 1 8 HIS HE2 H -6.769 0.920 0.405 1.00 . A A . 7 HIS HE2 1 1 26 4795 1 1 8 HIS N N -3.282 3.662 1.505 1.00 . A A . 7 HIS N 1 1 26 4796 1 1 8 HIS ND1 N -6.418 1.938 3.378 1.00 . A A . 7 HIS ND1 1 1 26 4797 1 1 8 HIS NE2 N -6.464 1.295 1.258 1.00 . A A . 7 HIS NE2 1 1 26 4798 1 1 8 HIS O O -2.058 4.575 4.727 1.00 . A A . 7 HIS O 1 1 26 4799 1 1 9 LYS C C -0.085 7.114 3.534 1.00 . A A . 8 LYS C 1 1 26 4800 1 1 9 LYS CA C -0.022 5.604 3.292 1.00 . A A . 8 LYS CA 1 1 26 4801 1 1 9 LYS CB C 1.022 5.275 2.223 1.00 . A A . 8 LYS CB 1 1 26 4802 1 1 9 LYS CD C 2.367 3.279 1.553 1.00 . A A . 8 LYS CD 1 1 26 4803 1 1 9 LYS CE C 2.878 2.388 2.689 1.00 . A A . 8 LYS CE 1 1 26 4804 1 1 9 LYS CG C 0.963 3.783 1.892 1.00 . A A . 8 LYS CG 1 1 26 4805 1 1 9 LYS H H -1.478 5.162 1.766 1.00 . A A . 8 LYS H 1 1 26 4806 1 1 9 LYS HA H 0.213 5.084 4.207 1.00 . A A . 8 LYS HA 1 1 26 4807 1 1 9 LYS HB2 H 0.817 5.852 1.332 1.00 . A A . 8 LYS HB2 1 1 26 4808 1 1 9 LYS HB3 H 2.006 5.521 2.592 1.00 . A A . 8 LYS HB3 1 1 26 4809 1 1 9 LYS HD2 H 2.333 2.709 0.636 1.00 . A A . 8 LYS HD2 1 1 26 4810 1 1 9 LYS HD3 H 3.033 4.120 1.431 1.00 . A A . 8 LYS HD3 1 1 26 4811 1 1 9 LYS HE2 H 2.832 2.919 3.631 1.00 . A A . 8 LYS HE2 1 1 26 4812 1 1 9 LYS HE3 H 2.303 1.477 2.742 1.00 . A A . 8 LYS HE3 1 1 26 4813 1 1 9 LYS HG2 H 0.579 3.241 2.744 1.00 . A A . 8 LYS HG2 1 1 26 4814 1 1 9 LYS HG3 H 0.313 3.628 1.044 1.00 . A A . 8 LYS HG3 1 1 26 4815 1 1 9 LYS HZ1 H 4.779 2.960 2.066 1.00 . A A . 8 LYS HZ1 1 1 26 4816 1 1 9 LYS HZ2 H 4.769 1.649 3.146 1.00 . A A . 8 LYS HZ2 1 1 26 4817 1 1 9 LYS HZ3 H 4.308 1.419 1.530 1.00 . A A . 8 LYS HZ3 1 1 26 4818 1 1 9 LYS N N -1.315 5.118 2.732 1.00 . A A . 8 LYS N 1 1 26 4819 1 1 9 LYS NZ N 4.291 2.081 2.331 1.00 . A A . 8 LYS NZ 1 1 26 4820 1 1 9 LYS O O -1.112 7.652 3.896 1.00 . A A . 8 LYS O 1 1 26 4821 1 1 10 ALA C C 0.390 9.993 2.355 1.00 . A A . 9 ALA C 1 1 26 4822 1 1 10 ALA CA C 1.010 9.276 3.558 1.00 . A A . 9 ALA CA 1 1 26 4823 1 1 10 ALA CB C 2.484 9.651 3.703 1.00 . A A . 9 ALA CB 1 1 26 4824 1 1 10 ALA H H 1.825 7.348 3.047 1.00 . A A . 9 ALA H 1 1 26 4825 1 1 10 ALA HA H 0.475 9.524 4.461 1.00 . A A . 9 ALA HA 1 1 26 4826 1 1 10 ALA HB1 H 3.027 9.324 2.829 1.00 . A A . 9 ALA HB1 1 1 26 4827 1 1 10 ALA HB2 H 2.576 10.723 3.804 1.00 . A A . 9 ALA HB2 1 1 26 4828 1 1 10 ALA HB3 H 2.893 9.171 4.581 1.00 . A A . 9 ALA HB3 1 1 26 4829 1 1 10 ALA N N 1.007 7.801 3.338 1.00 . A A . 9 ALA N 1 1 26 4830 1 1 10 ALA O O 1.019 10.813 1.717 1.00 . A A . 9 ALA O 1 1 26 4831 1 1 11 LEU C C -2.642 11.253 1.362 1.00 . A A . 10 LEU C 1 1 26 4832 1 1 11 LEU CA C -1.499 10.357 0.879 1.00 . A A . 10 LEU CA 1 1 26 4833 1 1 11 LEU CB C -2.039 9.213 0.020 1.00 . A A . 10 LEU CB 1 1 26 4834 1 1 11 LEU CD1 C -1.794 10.777 -1.913 1.00 . A A . 10 LEU CD1 1 1 26 4835 1 1 11 LEU CD2 C -0.010 9.097 -1.433 1.00 . A A . 10 LEU CD2 1 1 26 4836 1 1 11 LEU CG C -1.518 9.360 -1.411 1.00 . A A . 10 LEU CG 1 1 26 4837 1 1 11 LEU H H -1.332 9.027 2.567 1.00 . A A . 10 LEU H 1 1 26 4838 1 1 11 LEU HA H -0.779 10.932 0.318 1.00 . A A . 10 LEU HA 1 1 26 4839 1 1 11 LEU HB2 H -1.710 8.270 0.429 1.00 . A A . 10 LEU HB2 1 1 26 4840 1 1 11 LEU HB3 H -3.117 9.248 0.012 1.00 . A A . 10 LEU HB3 1 1 26 4841 1 1 11 LEU HD11 H -2.582 11.221 -1.325 1.00 . A A . 10 LEU HD11 1 1 26 4842 1 1 11 LEU HD12 H -0.897 11.372 -1.821 1.00 . A A . 10 LEU HD12 1 1 26 4843 1 1 11 LEU HD13 H -2.096 10.739 -2.950 1.00 . A A . 10 LEU HD13 1 1 26 4844 1 1 11 LEU HD21 H 0.488 9.804 -0.785 1.00 . A A . 10 LEU HD21 1 1 26 4845 1 1 11 LEU HD22 H 0.185 8.092 -1.085 1.00 . A A . 10 LEU HD22 1 1 26 4846 1 1 11 LEU HD23 H 0.360 9.207 -2.440 1.00 . A A . 10 LEU HD23 1 1 26 4847 1 1 11 LEU HG H -2.019 8.647 -2.050 1.00 . A A . 10 LEU HG 1 1 26 4848 1 1 11 LEU N N -0.840 9.691 2.040 1.00 . A A . 10 LEU N 1 1 26 4849 1 1 11 LEU O O -2.878 12.318 0.824 1.00 . A A . 10 LEU O 1 1 26 4850 1 1 12 ALA C C -4.329 11.883 4.393 1.00 . A A . 11 ALA C 1 1 26 4851 1 1 12 ALA CA C -4.481 11.660 2.885 1.00 . A A . 11 ALA CA 1 1 26 4852 1 1 12 ALA CB C -5.740 10.845 2.589 1.00 . A A . 11 ALA CB 1 1 26 4853 1 1 12 ALA H H -3.148 9.970 2.790 1.00 . A A . 11 ALA H 1 1 26 4854 1 1 12 ALA HA H -4.524 12.605 2.367 1.00 . A A . 11 ALA HA 1 1 26 4855 1 1 12 ALA HB1 H -5.462 9.832 2.338 1.00 . A A . 11 ALA HB1 1 1 26 4856 1 1 12 ALA HB2 H -6.378 10.837 3.460 1.00 . A A . 11 ALA HB2 1 1 26 4857 1 1 12 ALA HB3 H -6.269 11.289 1.759 1.00 . A A . 11 ALA HB3 1 1 26 4858 1 1 12 ALA N N -3.354 10.831 2.370 1.00 . A A . 11 ALA N 1 1 26 4859 1 1 12 ALA O O -4.996 11.251 5.188 1.00 . A A . 11 ALA O 1 1 26 4860 1 1 13 NH2 HN1 H -2.929 13.275 4.183 1.00 . A A . 12 NH2 HN1 1 1 26 4861 1 1 13 NH2 HN2 H -3.361 12.916 5.785 1.00 . A A . 12 NH2 HN2 1 1 26 4862 1 1 13 NH2 N N -3.468 12.765 4.823 1.00 . A A . 12 NH2 N 1 1 27 4863 1 1 2 ILE C C -2.068 -4.879 1.609 1.00 . A A . 1 ILE C 1 1 27 4864 1 1 2 ILE CA C -0.862 -5.198 2.494 1.00 . A A . 1 ILE CA 1 1 27 4865 1 1 2 ILE CB C 0.456 -4.738 1.846 1.00 . A A . 1 ILE CB 1 1 27 4866 1 1 2 ILE CD1 C 1.939 -5.560 3.678 1.00 . A A . 1 ILE CD1 1 1 27 4867 1 1 2 ILE CG1 C 1.428 -4.318 2.948 1.00 . A A . 1 ILE CG1 1 1 27 4868 1 1 2 ILE CG2 C 0.229 -3.545 0.899 1.00 . A A . 1 ILE CG2 1 1 27 4869 1 1 2 ILE H H 0.110 -7.119 2.433 1.00 . A A . 1 ILE H 1 1 27 4870 1 1 2 ILE HA H -0.971 -4.735 3.456 1.00 . A A . 1 ILE HA 1 1 27 4871 1 1 2 ILE HB H 0.879 -5.558 1.292 1.00 . A A . 1 ILE HB 1 1 27 4872 1 1 2 ILE HD11 H 1.911 -6.407 3.009 1.00 . A A . 1 ILE HD11 1 1 27 4873 1 1 2 ILE HD12 H 2.955 -5.393 4.005 1.00 . A A . 1 ILE HD12 1 1 27 4874 1 1 2 ILE HD13 H 1.311 -5.757 4.535 1.00 . A A . 1 ILE HD13 1 1 27 4875 1 1 2 ILE HG12 H 2.261 -3.787 2.509 1.00 . A A . 1 ILE HG12 1 1 27 4876 1 1 2 ILE HG13 H 0.919 -3.674 3.651 1.00 . A A . 1 ILE HG13 1 1 27 4877 1 1 2 ILE HG21 H -0.733 -3.096 1.104 1.00 . A A . 1 ILE HG21 1 1 27 4878 1 1 2 ILE HG22 H 1.005 -2.812 1.051 1.00 . A A . 1 ILE HG22 1 1 27 4879 1 1 2 ILE HG23 H 0.250 -3.887 -0.124 1.00 . A A . 1 ILE HG23 1 1 27 4880 1 1 2 ILE N N -0.735 -6.672 2.648 1.00 . A A . 1 ILE N 1 1 27 4881 1 1 2 ILE O O -3.130 -4.546 2.089 1.00 . A A . 1 ILE O 1 1 27 4882 1 1 3 ASP C C -3.450 -3.212 -0.449 1.00 . A A . 2 ASP C 1 1 27 4883 1 1 3 ASP CA C -3.007 -4.665 -0.619 1.00 . A A . 2 ASP CA 1 1 27 4884 1 1 3 ASP CB C -4.136 -5.624 -0.234 1.00 . A A . 2 ASP CB 1 1 27 4885 1 1 3 ASP CG C -5.256 -5.539 -1.272 1.00 . A A . 2 ASP CG 1 1 27 4886 1 1 3 ASP H H -1.022 -5.243 -0.029 1.00 . A A . 2 ASP H 1 1 27 4887 1 1 3 ASP HA H -2.702 -4.842 -1.637 1.00 . A A . 2 ASP HA 1 1 27 4888 1 1 3 ASP HB2 H -3.752 -6.634 -0.198 1.00 . A A . 2 ASP HB2 1 1 27 4889 1 1 3 ASP HB3 H -4.524 -5.352 0.736 1.00 . A A . 2 ASP HB3 1 1 27 4890 1 1 3 ASP N N -1.894 -4.973 0.320 1.00 . A A . 2 ASP N 1 1 27 4891 1 1 3 ASP O O -3.240 -2.381 -1.310 1.00 . A A . 2 ASP O 1 1 27 4892 1 1 3 ASP OD1 O -4.955 -5.245 -2.417 1.00 . A A . 2 ASP OD1 1 1 27 4893 1 1 3 ASP OD2 O -6.396 -5.769 -0.903 1.00 . A A . 2 ASP OD2 1 1 27 4894 1 1 4 TYR C C -3.384 -0.568 1.256 1.00 . A A . 3 TYR C 1 1 27 4895 1 1 4 TYR CA C -4.541 -1.514 0.880 1.00 . A A . 3 TYR CA 1 1 27 4896 1 1 4 TYR CB C -5.582 -1.629 1.998 1.00 . A A . 3 TYR CB 1 1 27 4897 1 1 4 TYR CD1 C -4.464 -0.858 4.110 1.00 . A A . 3 TYR CD1 1 1 27 4898 1 1 4 TYR CD2 C -4.746 -3.237 3.742 1.00 . A A . 3 TYR CD2 1 1 27 4899 1 1 4 TYR CE1 C -3.852 -1.118 5.336 1.00 . A A . 3 TYR CE1 1 1 27 4900 1 1 4 TYR CE2 C -4.131 -3.497 4.969 1.00 . A A . 3 TYR CE2 1 1 27 4901 1 1 4 TYR CG C -4.911 -1.916 3.314 1.00 . A A . 3 TYR CG 1 1 27 4902 1 1 4 TYR CZ C -3.685 -2.436 5.765 1.00 . A A . 3 TYR CZ 1 1 27 4903 1 1 4 TYR H H -4.233 -3.597 1.325 1.00 . A A . 3 TYR H 1 1 27 4904 1 1 4 TYR HA H -5.021 -1.148 -0.008 1.00 . A A . 3 TYR HA 1 1 27 4905 1 1 4 TYR HB2 H -6.128 -0.705 2.075 1.00 . A A . 3 TYR HB2 1 1 27 4906 1 1 4 TYR HB3 H -6.267 -2.429 1.765 1.00 . A A . 3 TYR HB3 1 1 27 4907 1 1 4 TYR HD1 H -4.593 0.160 3.776 1.00 . A A . 3 TYR HD1 1 1 27 4908 1 1 4 TYR HD2 H -5.091 -4.054 3.125 1.00 . A A . 3 TYR HD2 1 1 27 4909 1 1 4 TYR HE1 H -3.506 -0.300 5.952 1.00 . A A . 3 TYR HE1 1 1 27 4910 1 1 4 TYR HE2 H -4.000 -4.516 5.303 1.00 . A A . 3 TYR HE2 1 1 27 4911 1 1 4 TYR HH H -3.606 -3.354 7.436 1.00 . A A . 3 TYR HH 1 1 27 4912 1 1 4 TYR N N -4.070 -2.906 0.651 1.00 . A A . 3 TYR N 1 1 27 4913 1 1 4 TYR O O -3.238 0.472 0.654 1.00 . A A . 3 TYR O 1 1 27 4914 1 1 4 TYR OH O -3.082 -2.693 6.979 1.00 . A A . 3 TYR OH 1 1 27 4915 1 1 5 TRP C C -1.060 0.969 1.567 1.00 . A A . 4 TRP C 1 1 27 4916 1 1 5 TRP CA C -1.425 -0.030 2.666 1.00 . A A . 4 TRP CA 1 1 27 4917 1 1 5 TRP CB C -0.236 -0.968 2.889 1.00 . A A . 4 TRP CB 1 1 27 4918 1 1 5 TRP CD1 C -1.309 -2.727 4.364 1.00 . A A . 4 TRP CD1 1 1 27 4919 1 1 5 TRP CD2 C 0.399 -1.679 5.369 1.00 . A A . 4 TRP CD2 1 1 27 4920 1 1 5 TRP CE2 C -0.099 -2.620 6.296 1.00 . A A . 4 TRP CE2 1 1 27 4921 1 1 5 TRP CE3 C 1.485 -0.883 5.753 1.00 . A A . 4 TRP CE3 1 1 27 4922 1 1 5 TRP CG C -0.393 -1.758 4.151 1.00 . A A . 4 TRP CG 1 1 27 4923 1 1 5 TRP CH2 C 1.547 -1.966 7.931 1.00 . A A . 4 TRP CH2 1 1 27 4924 1 1 5 TRP CZ2 C 0.463 -2.767 7.562 1.00 . A A . 4 TRP CZ2 1 1 27 4925 1 1 5 TRP CZ3 C 2.059 -1.025 7.026 1.00 . A A . 4 TRP CZ3 1 1 27 4926 1 1 5 TRP H H -2.723 -1.758 2.699 1.00 . A A . 4 TRP H 1 1 27 4927 1 1 5 TRP HA H -1.664 0.484 3.584 1.00 . A A . 4 TRP HA 1 1 27 4928 1 1 5 TRP HB2 H -0.161 -1.640 2.058 1.00 . A A . 4 TRP HB2 1 1 27 4929 1 1 5 TRP HB3 H 0.669 -0.381 2.949 1.00 . A A . 4 TRP HB3 1 1 27 4930 1 1 5 TRP HD1 H -2.052 -3.059 3.660 1.00 . A A . 4 TRP HD1 1 1 27 4931 1 1 5 TRP HE1 H -1.681 -3.945 6.040 1.00 . A A . 4 TRP HE1 1 1 27 4932 1 1 5 TRP HE3 H 1.883 -0.162 5.060 1.00 . A A . 4 TRP HE3 1 1 27 4933 1 1 5 TRP HH2 H 1.990 -2.073 8.910 1.00 . A A . 4 TRP HH2 1 1 27 4934 1 1 5 TRP HZ2 H 0.062 -3.496 8.250 1.00 . A A . 4 TRP HZ2 1 1 27 4935 1 1 5 TRP HZ3 H 2.896 -0.407 7.311 1.00 . A A . 4 TRP HZ3 1 1 27 4936 1 1 5 TRP N N -2.574 -0.916 2.238 1.00 . A A . 4 TRP N 1 1 27 4937 1 1 5 TRP NE1 N -1.138 -3.236 5.637 1.00 . A A . 4 TRP NE1 1 1 27 4938 1 1 5 TRP O O -0.997 2.163 1.781 1.00 . A A . 4 TRP O 1 1 27 4939 1 1 6 LEU C C -1.374 2.574 -0.823 1.00 . A A . 5 LEU C 1 1 27 4940 1 1 6 LEU CA C -0.461 1.341 -0.759 1.00 . A A . 5 LEU CA 1 1 27 4941 1 1 6 LEU CB C -0.677 0.438 -1.974 1.00 . A A . 5 LEU CB 1 1 27 4942 1 1 6 LEU CD1 C 0.886 1.702 -3.455 1.00 . A A . 5 LEU CD1 1 1 27 4943 1 1 6 LEU CD2 C -0.980 0.357 -4.439 1.00 . A A . 5 LEU CD2 1 1 27 4944 1 1 6 LEU CG C -0.562 1.245 -3.264 1.00 . A A . 5 LEU CG 1 1 27 4945 1 1 6 LEU H H -0.886 -0.501 0.258 1.00 . A A . 5 LEU H 1 1 27 4946 1 1 6 LEU HA H 0.573 1.637 -0.700 1.00 . A A . 5 LEU HA 1 1 27 4947 1 1 6 LEU HB2 H 0.067 -0.344 -1.974 1.00 . A A . 5 LEU HB2 1 1 27 4948 1 1 6 LEU HB3 H -1.661 -0.005 -1.918 1.00 . A A . 5 LEU HB3 1 1 27 4949 1 1 6 LEU HD11 H 1.542 1.070 -2.874 1.00 . A A . 5 LEU HD11 1 1 27 4950 1 1 6 LEU HD12 H 1.152 1.632 -4.500 1.00 . A A . 5 LEU HD12 1 1 27 4951 1 1 6 LEU HD13 H 0.988 2.725 -3.125 1.00 . A A . 5 LEU HD13 1 1 27 4952 1 1 6 LEU HD21 H -1.415 -0.557 -4.061 1.00 . A A . 5 LEU HD21 1 1 27 4953 1 1 6 LEU HD22 H -1.707 0.878 -5.044 1.00 . A A . 5 LEU HD22 1 1 27 4954 1 1 6 LEU HD23 H -0.114 0.121 -5.039 1.00 . A A . 5 LEU HD23 1 1 27 4955 1 1 6 LEU HG H -1.210 2.108 -3.212 1.00 . A A . 5 LEU HG 1 1 27 4956 1 1 6 LEU N N -0.823 0.467 0.390 1.00 . A A . 5 LEU N 1 1 27 4957 1 1 6 LEU O O -0.912 3.692 -0.936 1.00 . A A . 5 LEU O 1 1 27 4958 1 1 7 ALA C C -3.910 4.096 0.560 1.00 . A A . 6 ALA C 1 1 27 4959 1 1 7 ALA CA C -3.601 3.542 -0.836 1.00 . A A . 6 ALA CA 1 1 27 4960 1 1 7 ALA CB C -4.873 2.976 -1.468 1.00 . A A . 6 ALA CB 1 1 27 4961 1 1 7 ALA H H -3.018 1.470 -0.682 1.00 . A A . 6 ALA H 1 1 27 4962 1 1 7 ALA HA H -3.194 4.316 -1.467 1.00 . A A . 6 ALA HA 1 1 27 4963 1 1 7 ALA HB1 H -5.096 2.013 -1.029 1.00 . A A . 6 ALA HB1 1 1 27 4964 1 1 7 ALA HB2 H -5.697 3.651 -1.286 1.00 . A A . 6 ALA HB2 1 1 27 4965 1 1 7 ALA HB3 H -4.728 2.862 -2.531 1.00 . A A . 6 ALA HB3 1 1 27 4966 1 1 7 ALA N N -2.664 2.380 -0.764 1.00 . A A . 6 ALA N 1 1 27 4967 1 1 7 ALA O O -4.660 5.040 0.706 1.00 . A A . 6 ALA O 1 1 27 4968 1 1 8 HIS C C -2.384 4.497 3.649 1.00 . A A . 7 HIS C 1 1 27 4969 1 1 8 HIS CA C -3.661 4.005 2.962 1.00 . A A . 7 HIS CA 1 1 27 4970 1 1 8 HIS CB C -4.251 2.799 3.702 1.00 . A A . 7 HIS CB 1 1 27 4971 1 1 8 HIS CD2 C -5.396 1.802 1.550 1.00 . A A . 7 HIS CD2 1 1 27 4972 1 1 8 HIS CE1 C -7.303 1.273 2.413 1.00 . A A . 7 HIS CE1 1 1 27 4973 1 1 8 HIS CG C -5.342 2.169 2.872 1.00 . A A . 7 HIS CG 1 1 27 4974 1 1 8 HIS H H -2.771 2.737 1.461 1.00 . A A . 7 HIS H 1 1 27 4975 1 1 8 HIS HA H -4.391 4.799 2.920 1.00 . A A . 7 HIS HA 1 1 27 4976 1 1 8 HIS HB2 H -3.476 2.072 3.882 1.00 . A A . 7 HIS HB2 1 1 27 4977 1 1 8 HIS HB3 H -4.663 3.124 4.647 1.00 . A A . 7 HIS HB3 1 1 27 4978 1 1 8 HIS HD1 H -6.863 1.950 4.334 1.00 . A A . 7 HIS HD1 1 1 27 4979 1 1 8 HIS HD2 H -4.596 1.910 0.846 1.00 . A A . 7 HIS HD2 1 1 27 4980 1 1 8 HIS HE1 H -8.296 0.881 2.534 1.00 . A A . 7 HIS HE1 1 1 27 4981 1 1 8 HIS HE2 H -6.943 0.902 0.405 1.00 . A A . 7 HIS HE2 1 1 27 4982 1 1 8 HIS N N -3.363 3.509 1.588 1.00 . A A . 7 HIS N 1 1 27 4983 1 1 8 HIS ND1 N -6.574 1.821 3.406 1.00 . A A . 7 HIS ND1 1 1 27 4984 1 1 8 HIS NE2 N -6.631 1.244 1.268 1.00 . A A . 7 HIS NE2 1 1 27 4985 1 1 8 HIS O O -2.158 5.684 3.778 1.00 . A A . 7 HIS O 1 1 27 4986 1 1 9 LYS C C -0.617 4.968 5.934 1.00 . A A . 8 LYS C 1 1 27 4987 1 1 9 LYS CA C -0.292 4.025 4.772 1.00 . A A . 8 LYS CA 1 1 27 4988 1 1 9 LYS CB C 0.512 4.754 3.696 1.00 . A A . 8 LYS CB 1 1 27 4989 1 1 9 LYS CD C 2.331 3.935 2.192 1.00 . A A . 8 LYS CD 1 1 27 4990 1 1 9 LYS CE C 2.578 3.291 0.826 1.00 . A A . 8 LYS CE 1 1 27 4991 1 1 9 LYS CG C 0.857 3.778 2.570 1.00 . A A . 8 LYS CG 1 1 27 4992 1 1 9 LYS H H -1.739 2.649 3.984 1.00 . A A . 8 LYS H 1 1 27 4993 1 1 9 LYS HA H 0.256 3.166 5.125 1.00 . A A . 8 LYS HA 1 1 27 4994 1 1 9 LYS HB2 H -0.074 5.571 3.302 1.00 . A A . 8 LYS HB2 1 1 27 4995 1 1 9 LYS HB3 H 1.422 5.138 4.128 1.00 . A A . 8 LYS HB3 1 1 27 4996 1 1 9 LYS HD2 H 2.581 4.986 2.145 1.00 . A A . 8 LYS HD2 1 1 27 4997 1 1 9 LYS HD3 H 2.947 3.451 2.934 1.00 . A A . 8 LYS HD3 1 1 27 4998 1 1 9 LYS HE2 H 2.670 2.218 0.930 1.00 . A A . 8 LYS HE2 1 1 27 4999 1 1 9 LYS HE3 H 1.781 3.537 0.143 1.00 . A A . 8 LYS HE3 1 1 27 5000 1 1 9 LYS HG2 H 0.676 2.766 2.903 1.00 . A A . 8 LYS HG2 1 1 27 5001 1 1 9 LYS HG3 H 0.241 3.991 1.708 1.00 . A A . 8 LYS HG3 1 1 27 5002 1 1 9 LYS HZ1 H 4.428 4.184 1.165 1.00 . A A . 8 LYS HZ1 1 1 27 5003 1 1 9 LYS HZ2 H 4.388 3.169 -0.197 1.00 . A A . 8 LYS HZ2 1 1 27 5004 1 1 9 LYS HZ3 H 3.660 4.700 -0.260 1.00 . A A . 8 LYS HZ3 1 1 27 5005 1 1 9 LYS N N -1.545 3.599 4.094 1.00 . A A . 8 LYS N 1 1 27 5006 1 1 9 LYS NZ N 3.860 3.880 0.347 1.00 . A A . 8 LYS NZ 1 1 27 5007 1 1 9 LYS O O -1.718 5.467 6.054 1.00 . A A . 8 LYS O 1 1 27 5008 1 1 10 ALA C C -0.545 7.433 7.459 1.00 . A A . 9 ALA C 1 1 27 5009 1 1 10 ALA CA C 0.081 6.123 7.945 1.00 . A A . 9 ALA CA 1 1 27 5010 1 1 10 ALA CB C 1.459 6.380 8.554 1.00 . A A . 9 ALA CB 1 1 27 5011 1 1 10 ALA H H 1.213 4.798 6.676 1.00 . A A . 9 ALA H 1 1 27 5012 1 1 10 ALA HA H -0.559 5.645 8.669 1.00 . A A . 9 ALA HA 1 1 27 5013 1 1 10 ALA HB1 H 2.140 6.700 7.781 1.00 . A A . 9 ALA HB1 1 1 27 5014 1 1 10 ALA HB2 H 1.381 7.150 9.308 1.00 . A A . 9 ALA HB2 1 1 27 5015 1 1 10 ALA HB3 H 1.828 5.472 9.006 1.00 . A A . 9 ALA HB3 1 1 27 5016 1 1 10 ALA N N 0.333 5.214 6.791 1.00 . A A . 9 ALA N 1 1 27 5017 1 1 10 ALA O O 0.145 8.375 7.123 1.00 . A A . 9 ALA O 1 1 27 5018 1 1 11 LEU C C -3.487 9.267 8.015 1.00 . A A . 10 LEU C 1 1 27 5019 1 1 11 LEU CA C -2.517 8.751 6.949 1.00 . A A . 10 LEU CA 1 1 27 5020 1 1 11 LEU CB C -3.276 8.344 5.685 1.00 . A A . 10 LEU CB 1 1 27 5021 1 1 11 LEU CD1 C -3.778 9.957 3.844 1.00 . A A . 10 LEU CD1 1 1 27 5022 1 1 11 LEU CD2 C -5.636 9.011 5.220 1.00 . A A . 10 LEU CD2 1 1 27 5023 1 1 11 LEU CG C -4.183 9.493 5.244 1.00 . A A . 10 LEU CG 1 1 27 5024 1 1 11 LEU H H -2.388 6.730 7.690 1.00 . A A . 10 LEU H 1 1 27 5025 1 1 11 LEU HA H -1.782 9.504 6.711 1.00 . A A . 10 LEU HA 1 1 27 5026 1 1 11 LEU HB2 H -2.569 8.119 4.898 1.00 . A A . 10 LEU HB2 1 1 27 5027 1 1 11 LEU HB3 H -3.876 7.472 5.890 1.00 . A A . 10 LEU HB3 1 1 27 5028 1 1 11 LEU HD11 H -3.278 9.149 3.327 1.00 . A A . 10 LEU HD11 1 1 27 5029 1 1 11 LEU HD12 H -4.659 10.247 3.291 1.00 . A A . 10 LEU HD12 1 1 27 5030 1 1 11 LEU HD13 H -3.108 10.800 3.924 1.00 . A A . 10 LEU HD13 1 1 27 5031 1 1 11 LEU HD21 H -5.662 7.956 4.989 1.00 . A A . 10 LEU HD21 1 1 27 5032 1 1 11 LEU HD22 H -6.087 9.180 6.186 1.00 . A A . 10 LEU HD22 1 1 27 5033 1 1 11 LEU HD23 H -6.183 9.558 4.465 1.00 . A A . 10 LEU HD23 1 1 27 5034 1 1 11 LEU HG H -4.086 10.315 5.937 1.00 . A A . 10 LEU HG 1 1 27 5035 1 1 11 LEU N N -1.849 7.501 7.416 1.00 . A A . 10 LEU N 1 1 27 5036 1 1 11 LEU O O -4.476 8.633 8.328 1.00 . A A . 10 LEU O 1 1 27 5037 1 1 12 ALA C C -4.409 9.914 10.688 1.00 . A A . 11 ALA C 1 1 27 5038 1 1 12 ALA CA C -4.122 10.971 9.619 1.00 . A A . 11 ALA CA 1 1 27 5039 1 1 12 ALA CB C -5.405 11.344 8.874 1.00 . A A . 11 ALA CB 1 1 27 5040 1 1 12 ALA H H -2.413 10.910 8.307 1.00 . A A . 11 ALA H 1 1 27 5041 1 1 12 ALA HA H -3.687 11.852 10.066 1.00 . A A . 11 ALA HA 1 1 27 5042 1 1 12 ALA HB1 H -5.724 10.509 8.268 1.00 . A A . 11 ALA HB1 1 1 27 5043 1 1 12 ALA HB2 H -6.178 11.586 9.588 1.00 . A A . 11 ALA HB2 1 1 27 5044 1 1 12 ALA HB3 H -5.218 12.198 8.241 1.00 . A A . 11 ALA HB3 1 1 27 5045 1 1 12 ALA N N -3.214 10.414 8.574 1.00 . A A . 11 ALA N 1 1 27 5046 1 1 12 ALA O O -5.529 9.464 10.834 1.00 . A A . 11 ALA O 1 1 27 5047 1 1 13 NH2 HN1 H -2.532 9.856 11.334 1.00 . A A . 12 NH2 HN1 1 1 27 5048 1 1 13 NH2 HN2 H -3.609 8.818 12.137 1.00 . A A . 12 NH2 HN2 1 1 27 5049 1 1 13 NH2 N N -3.436 9.495 11.450 1.00 . A A . 12 NH2 N 1 1 28 5050 1 1 2 ILE C C -2.025 -4.893 1.686 1.00 . A A . 1 ILE C 1 1 28 5051 1 1 2 ILE CA C -0.825 -5.146 2.601 1.00 . A A . 1 ILE CA 1 1 28 5052 1 1 2 ILE CB C 0.490 -4.666 1.963 1.00 . A A . 1 ILE CB 1 1 28 5053 1 1 2 ILE CD1 C 1.941 -5.358 3.876 1.00 . A A . 1 ILE CD1 1 1 28 5054 1 1 2 ILE CG1 C 1.422 -4.169 3.069 1.00 . A A . 1 ILE CG1 1 1 28 5055 1 1 2 ILE CG2 C 0.242 -3.520 0.966 1.00 . A A . 1 ILE CG2 1 1 28 5056 1 1 2 ILE H H 0.235 -7.016 2.736 1.00 . A A . 1 ILE H 1 1 28 5057 1 1 2 ILE HA H -0.967 -4.657 3.546 1.00 . A A . 1 ILE HA 1 1 28 5058 1 1 2 ILE HB H 0.954 -5.491 1.450 1.00 . A A . 1 ILE HB 1 1 28 5059 1 1 2 ILE HD11 H 1.967 -6.236 3.246 1.00 . A A . 1 ILE HD11 1 1 28 5060 1 1 2 ILE HD12 H 2.937 -5.143 4.234 1.00 . A A . 1 ILE HD12 1 1 28 5061 1 1 2 ILE HD13 H 1.286 -5.536 4.716 1.00 . A A . 1 ILE HD13 1 1 28 5062 1 1 2 ILE HG12 H 2.254 -3.640 2.626 1.00 . A A . 1 ILE HG12 1 1 28 5063 1 1 2 ILE HG13 H 0.878 -3.502 3.724 1.00 . A A . 1 ILE HG13 1 1 28 5064 1 1 2 ILE HG21 H -0.736 -3.092 1.139 1.00 . A A . 1 ILE HG21 1 1 28 5065 1 1 2 ILE HG22 H 0.994 -2.758 1.098 1.00 . A A . 1 ILE HG22 1 1 28 5066 1 1 2 ILE HG23 H 0.289 -3.901 -0.043 1.00 . A A . 1 ILE HG23 1 1 28 5067 1 1 2 ILE N N -0.654 -6.609 2.806 1.00 . A A . 1 ILE N 1 1 28 5068 1 1 2 ILE O O -3.104 -4.570 2.136 1.00 . A A . 1 ILE O 1 1 28 5069 1 1 3 ASP C C -3.420 -3.348 -0.457 1.00 . A A . 2 ASP C 1 1 28 5070 1 1 3 ASP CA C -2.934 -4.793 -0.561 1.00 . A A . 2 ASP CA 1 1 28 5071 1 1 3 ASP CB C -4.042 -5.767 -0.155 1.00 . A A . 2 ASP CB 1 1 28 5072 1 1 3 ASP CG C -3.463 -7.178 -0.034 1.00 . A A . 2 ASP CG 1 1 28 5073 1 1 3 ASP H H -0.945 -5.293 0.081 1.00 . A A . 2 ASP H 1 1 28 5074 1 1 3 ASP HA H -2.609 -5.001 -1.566 1.00 . A A . 2 ASP HA 1 1 28 5075 1 1 3 ASP HB2 H -4.456 -5.464 0.795 1.00 . A A . 2 ASP HB2 1 1 28 5076 1 1 3 ASP HB3 H -4.818 -5.763 -0.906 1.00 . A A . 2 ASP HB3 1 1 28 5077 1 1 3 ASP N N -1.828 -5.034 0.405 1.00 . A A . 2 ASP N 1 1 28 5078 1 1 3 ASP O O -3.210 -2.545 -1.345 1.00 . A A . 2 ASP O 1 1 28 5079 1 1 3 ASP OD1 O -2.587 -7.507 -0.817 1.00 . A A . 2 ASP OD1 1 1 28 5080 1 1 3 ASP OD2 O -3.903 -7.905 0.841 1.00 . A A . 2 ASP OD2 1 1 28 5081 1 1 4 TYR C C -3.463 -0.639 1.129 1.00 . A A . 3 TYR C 1 1 28 5082 1 1 4 TYR CA C -4.588 -1.626 0.770 1.00 . A A . 3 TYR CA 1 1 28 5083 1 1 4 TYR CB C -5.655 -1.712 1.868 1.00 . A A . 3 TYR CB 1 1 28 5084 1 1 4 TYR CD1 C -4.795 -3.299 3.623 1.00 . A A . 3 TYR CD1 1 1 28 5085 1 1 4 TYR CD2 C -4.657 -0.913 4.029 1.00 . A A . 3 TYR CD2 1 1 28 5086 1 1 4 TYR CE1 C -4.212 -3.544 4.870 1.00 . A A . 3 TYR CE1 1 1 28 5087 1 1 4 TYR CE2 C -4.072 -1.158 5.274 1.00 . A A . 3 TYR CE2 1 1 28 5088 1 1 4 TYR CG C -5.017 -1.984 3.204 1.00 . A A . 3 TYR CG 1 1 28 5089 1 1 4 TYR CZ C -3.850 -2.472 5.694 1.00 . A A . 3 TYR CZ 1 1 28 5090 1 1 4 TYR H H -4.242 -3.681 1.313 1.00 . A A . 3 TYR H 1 1 28 5091 1 1 4 TYR HA H -5.051 -1.312 -0.146 1.00 . A A . 3 TYR HA 1 1 28 5092 1 1 4 TYR HB2 H -6.195 -0.780 1.914 1.00 . A A . 3 TYR HB2 1 1 28 5093 1 1 4 TYR HB3 H -6.343 -2.510 1.632 1.00 . A A . 3 TYR HB3 1 1 28 5094 1 1 4 TYR HD1 H -5.075 -4.125 2.985 1.00 . A A . 3 TYR HD1 1 1 28 5095 1 1 4 TYR HD2 H -4.828 0.100 3.704 1.00 . A A . 3 TYR HD2 1 1 28 5096 1 1 4 TYR HE1 H -4.039 -4.558 5.196 1.00 . A A . 3 TYR HE1 1 1 28 5097 1 1 4 TYR HE2 H -3.791 -0.332 5.911 1.00 . A A . 3 TYR HE2 1 1 28 5098 1 1 4 TYR HH H -2.712 -1.967 7.143 1.00 . A A . 3 TYR HH 1 1 28 5099 1 1 4 TYR N N -4.076 -3.014 0.614 1.00 . A A . 3 TYR N 1 1 28 5100 1 1 4 TYR O O -3.316 0.362 0.468 1.00 . A A . 3 TYR O 1 1 28 5101 1 1 4 TYR OH O -3.277 -2.713 6.927 1.00 . A A . 3 TYR OH 1 1 28 5102 1 1 5 TRP C C -1.208 0.997 1.458 1.00 . A A . 4 TRP C 1 1 28 5103 1 1 5 TRP CA C -1.565 0.017 2.579 1.00 . A A . 4 TRP CA 1 1 28 5104 1 1 5 TRP CB C -0.358 -0.883 2.851 1.00 . A A . 4 TRP CB 1 1 28 5105 1 1 5 TRP CD1 C -1.411 -2.626 4.356 1.00 . A A . 4 TRP CD1 1 1 28 5106 1 1 5 TRP CD2 C 0.226 -1.480 5.374 1.00 . A A . 4 TRP CD2 1 1 28 5107 1 1 5 TRP CE2 C -0.267 -2.407 6.320 1.00 . A A . 4 TRP CE2 1 1 28 5108 1 1 5 TRP CE3 C 1.268 -0.629 5.762 1.00 . A A . 4 TRP CE3 1 1 28 5109 1 1 5 TRP CG C -0.524 -1.634 4.136 1.00 . A A . 4 TRP CG 1 1 28 5110 1 1 5 TRP CH2 C 1.299 -1.633 7.980 1.00 . A A . 4 TRP CH2 1 1 28 5111 1 1 5 TRP CZ2 C 0.260 -2.488 7.607 1.00 . A A . 4 TRP CZ2 1 1 28 5112 1 1 5 TRP CZ3 C 1.804 -0.705 7.059 1.00 . A A . 4 TRP CZ3 1 1 28 5113 1 1 5 TRP H H -2.833 -1.729 2.665 1.00 . A A . 4 TRP H 1 1 28 5114 1 1 5 TRP HA H -1.834 0.551 3.475 1.00 . A A . 4 TRP HA 1 1 28 5115 1 1 5 TRP HB2 H -0.250 -1.580 2.044 1.00 . A A . 4 TRP HB2 1 1 28 5116 1 1 5 TRP HB3 H 0.532 -0.272 2.910 1.00 . A A . 4 TRP HB3 1 1 28 5117 1 1 5 TRP HD1 H -2.117 -3.010 3.641 1.00 . A A . 4 TRP HD1 1 1 28 5118 1 1 5 TRP HE1 H -1.787 -3.802 6.062 1.00 . A A . 4 TRP HE1 1 1 28 5119 1 1 5 TRP HE3 H 1.661 0.083 5.057 1.00 . A A . 4 TRP HE3 1 1 28 5120 1 1 5 TRP HH2 H 1.714 -1.688 8.975 1.00 . A A . 4 TRP HH2 1 1 28 5121 1 1 5 TRP HZ2 H -0.134 -3.207 8.308 1.00 . A A . 4 TRP HZ2 1 1 28 5122 1 1 5 TRP HZ3 H 2.609 -0.044 7.346 1.00 . A A . 4 TRP HZ3 1 1 28 5123 1 1 5 TRP N N -2.684 -0.913 2.161 1.00 . A A . 4 TRP N 1 1 28 5124 1 1 5 TRP NE1 N -1.259 -3.086 5.651 1.00 . A A . 4 TRP NE1 1 1 28 5125 1 1 5 TRP O O -1.204 2.197 1.637 1.00 . A A . 4 TRP O 1 1 28 5126 1 1 6 LEU C C -1.399 2.616 -0.876 1.00 . A A . 5 LEU C 1 1 28 5127 1 1 6 LEU CA C -0.553 1.334 -0.861 1.00 . A A . 5 LEU CA 1 1 28 5128 1 1 6 LEU CB C -0.861 0.441 -2.069 1.00 . A A . 5 LEU CB 1 1 28 5129 1 1 6 LEU CD1 C 0.128 1.965 -3.788 1.00 . A A . 5 LEU CD1 1 1 28 5130 1 1 6 LEU CD2 C -1.691 0.368 -4.414 1.00 . A A . 5 LEU CD2 1 1 28 5131 1 1 6 LEU CG C -1.157 1.285 -3.311 1.00 . A A . 5 LEU CG 1 1 28 5132 1 1 6 LEU H H -0.928 -0.500 0.195 1.00 . A A . 5 LEU H 1 1 28 5133 1 1 6 LEU HA H 0.497 1.574 -0.842 1.00 . A A . 5 LEU HA 1 1 28 5134 1 1 6 LEU HB2 H -0.011 -0.195 -2.267 1.00 . A A . 5 LEU HB2 1 1 28 5135 1 1 6 LEU HB3 H -1.719 -0.175 -1.847 1.00 . A A . 5 LEU HB3 1 1 28 5136 1 1 6 LEU HD11 H 0.920 1.234 -3.855 1.00 . A A . 5 LEU HD11 1 1 28 5137 1 1 6 LEU HD12 H -0.038 2.406 -4.760 1.00 . A A . 5 LEU HD12 1 1 28 5138 1 1 6 LEU HD13 H 0.408 2.737 -3.086 1.00 . A A . 5 LEU HD13 1 1 28 5139 1 1 6 LEU HD21 H -2.357 -0.365 -3.981 1.00 . A A . 5 LEU HD21 1 1 28 5140 1 1 6 LEU HD22 H -2.227 0.955 -5.144 1.00 . A A . 5 LEU HD22 1 1 28 5141 1 1 6 LEU HD23 H -0.866 -0.138 -4.894 1.00 . A A . 5 LEU HD23 1 1 28 5142 1 1 6 LEU HG H -1.897 2.034 -3.073 1.00 . A A . 5 LEU HG 1 1 28 5143 1 1 6 LEU N N -0.911 0.475 0.303 1.00 . A A . 5 LEU N 1 1 28 5144 1 1 6 LEU O O -0.876 3.711 -0.949 1.00 . A A . 5 LEU O 1 1 28 5145 1 1 7 ALA C C -3.845 4.226 0.576 1.00 . A A . 6 ALA C 1 1 28 5146 1 1 7 ALA CA C -3.568 3.709 -0.843 1.00 . A A . 6 ALA CA 1 1 28 5147 1 1 7 ALA CB C -4.869 3.244 -1.498 1.00 . A A . 6 ALA CB 1 1 28 5148 1 1 7 ALA H H -3.103 1.602 -0.767 1.00 . A A . 6 ALA H 1 1 28 5149 1 1 7 ALA HA H -3.115 4.482 -1.442 1.00 . A A . 6 ALA HA 1 1 28 5150 1 1 7 ALA HB1 H -5.183 2.312 -1.051 1.00 . A A . 6 ALA HB1 1 1 28 5151 1 1 7 ALA HB2 H -5.634 3.990 -1.347 1.00 . A A . 6 ALA HB2 1 1 28 5152 1 1 7 ALA HB3 H -4.708 3.100 -2.556 1.00 . A A . 6 ALA HB3 1 1 28 5153 1 1 7 ALA N N -2.698 2.493 -0.818 1.00 . A A . 6 ALA N 1 1 28 5154 1 1 7 ALA O O -4.636 5.129 0.767 1.00 . A A . 6 ALA O 1 1 28 5155 1 1 8 HIS C C -2.181 4.575 3.630 1.00 . A A . 7 HIS C 1 1 28 5156 1 1 8 HIS CA C -3.483 4.121 2.965 1.00 . A A . 7 HIS CA 1 1 28 5157 1 1 8 HIS CB C -4.062 2.902 3.695 1.00 . A A . 7 HIS CB 1 1 28 5158 1 1 8 HIS CD2 C -5.171 1.870 1.541 1.00 . A A . 7 HIS CD2 1 1 28 5159 1 1 8 HIS CE1 C -7.084 1.327 2.389 1.00 . A A . 7 HIS CE1 1 1 28 5160 1 1 8 HIS CG C -5.136 2.252 2.859 1.00 . A A . 7 HIS CG 1 1 28 5161 1 1 8 HIS H H -2.597 2.921 1.406 1.00 . A A . 7 HIS H 1 1 28 5162 1 1 8 HIS HA H -4.203 4.924 2.966 1.00 . A A . 7 HIS HA 1 1 28 5163 1 1 8 HIS HB2 H -3.273 2.188 3.880 1.00 . A A . 7 HIS HB2 1 1 28 5164 1 1 8 HIS HB3 H -4.484 3.217 4.639 1.00 . A A . 7 HIS HB3 1 1 28 5165 1 1 8 HIS HD1 H -6.673 2.034 4.305 1.00 . A A . 7 HIS HD1 1 1 28 5166 1 1 8 HIS HD2 H -4.368 1.992 0.841 1.00 . A A . 7 HIS HD2 1 1 28 5167 1 1 8 HIS HE1 H -8.079 0.931 2.501 1.00 . A A . 7 HIS HE1 1 1 28 5168 1 1 8 HIS HE2 H -6.693 0.930 0.390 1.00 . A A . 7 HIS HE2 1 1 28 5169 1 1 8 HIS N N -3.223 3.657 1.571 1.00 . A A . 7 HIS N 1 1 28 5170 1 1 8 HIS ND1 N -6.372 1.897 3.382 1.00 . A A . 7 HIS ND1 1 1 28 5171 1 1 8 HIS NE2 N -6.396 1.291 1.251 1.00 . A A . 7 HIS NE2 1 1 28 5172 1 1 8 HIS O O -2.169 5.483 4.437 1.00 . A A . 7 HIS O 1 1 28 5173 1 1 9 LYS C C 0.873 5.457 3.090 1.00 . A A . 8 LYS C 1 1 28 5174 1 1 9 LYS CA C 0.214 4.351 3.916 1.00 . A A . 8 LYS CA 1 1 28 5175 1 1 9 LYS CB C 1.070 3.084 3.900 1.00 . A A . 8 LYS CB 1 1 28 5176 1 1 9 LYS CD C 2.791 3.026 2.088 1.00 . A A . 8 LYS CD 1 1 28 5177 1 1 9 LYS CE C 3.617 1.743 1.974 1.00 . A A . 8 LYS CE 1 1 28 5178 1 1 9 LYS CG C 1.347 2.673 2.452 1.00 . A A . 8 LYS CG 1 1 28 5179 1 1 9 LYS H H -1.112 3.221 2.647 1.00 . A A . 8 LYS H 1 1 28 5180 1 1 9 LYS HA H 0.061 4.681 4.929 1.00 . A A . 8 LYS HA 1 1 28 5181 1 1 9 LYS HB2 H 2.006 3.276 4.406 1.00 . A A . 8 LYS HB2 1 1 28 5182 1 1 9 LYS HB3 H 0.544 2.288 4.404 1.00 . A A . 8 LYS HB3 1 1 28 5183 1 1 9 LYS HD2 H 2.805 3.551 1.144 1.00 . A A . 8 LYS HD2 1 1 28 5184 1 1 9 LYS HD3 H 3.212 3.657 2.857 1.00 . A A . 8 LYS HD3 1 1 28 5185 1 1 9 LYS HE2 H 3.045 0.973 1.475 1.00 . A A . 8 LYS HE2 1 1 28 5186 1 1 9 LYS HE3 H 4.537 1.935 1.443 1.00 . A A . 8 LYS HE3 1 1 28 5187 1 1 9 LYS HG2 H 1.198 1.608 2.346 1.00 . A A . 8 LYS HG2 1 1 28 5188 1 1 9 LYS HG3 H 0.672 3.199 1.793 1.00 . A A . 8 LYS HG3 1 1 28 5189 1 1 9 LYS HZ1 H 3.084 1.550 3.977 1.00 . A A . 8 LYS HZ1 1 1 28 5190 1 1 9 LYS HZ2 H 4.127 0.332 3.416 1.00 . A A . 8 LYS HZ2 1 1 28 5191 1 1 9 LYS HZ3 H 4.727 1.891 3.728 1.00 . A A . 8 LYS HZ3 1 1 28 5192 1 1 9 LYS N N -1.083 3.952 3.300 1.00 . A A . 8 LYS N 1 1 28 5193 1 1 9 LYS NZ N 3.911 1.350 3.380 1.00 . A A . 8 LYS NZ 1 1 28 5194 1 1 9 LYS O O 2.075 5.633 3.114 1.00 . A A . 8 LYS O 1 1 28 5195 1 1 10 ALA C C 0.710 8.601 2.354 1.00 . A A . 9 ALA C 1 1 28 5196 1 1 10 ALA CA C 0.667 7.306 1.540 1.00 . A A . 9 ALA CA 1 1 28 5197 1 1 10 ALA CB C -0.282 7.450 0.351 1.00 . A A . 9 ALA CB 1 1 28 5198 1 1 10 ALA H H -0.874 6.047 2.366 1.00 . A A . 9 ALA H 1 1 28 5199 1 1 10 ALA HA H 1.656 7.044 1.195 1.00 . A A . 9 ALA HA 1 1 28 5200 1 1 10 ALA HB1 H -0.423 6.486 -0.115 1.00 . A A . 9 ALA HB1 1 1 28 5201 1 1 10 ALA HB2 H -1.234 7.827 0.693 1.00 . A A . 9 ALA HB2 1 1 28 5202 1 1 10 ALA HB3 H 0.141 8.138 -0.366 1.00 . A A . 9 ALA HB3 1 1 28 5203 1 1 10 ALA N N 0.092 6.206 2.364 1.00 . A A . 9 ALA N 1 1 28 5204 1 1 10 ALA O O 1.336 9.569 1.970 1.00 . A A . 9 ALA O 1 1 28 5205 1 1 11 LEU C C 0.664 9.555 5.688 1.00 . A A . 10 LEU C 1 1 28 5206 1 1 11 LEU CA C 0.045 9.853 4.320 1.00 . A A . 10 LEU CA 1 1 28 5207 1 1 11 LEU CB C -1.430 10.229 4.469 1.00 . A A . 10 LEU CB 1 1 28 5208 1 1 11 LEU CD1 C -1.177 11.457 6.631 1.00 . A A . 10 LEU CD1 1 1 28 5209 1 1 11 LEU CD2 C -0.594 12.584 4.479 1.00 . A A . 10 LEU CD2 1 1 28 5210 1 1 11 LEU CG C -1.546 11.592 5.152 1.00 . A A . 10 LEU CG 1 1 28 5211 1 1 11 LEU H H -0.452 7.832 3.767 1.00 . A A . 10 LEU H 1 1 28 5212 1 1 11 LEU HA H 0.581 10.649 3.828 1.00 . A A . 10 LEU HA 1 1 28 5213 1 1 11 LEU HB2 H -1.889 10.276 3.491 1.00 . A A . 10 LEU HB2 1 1 28 5214 1 1 11 LEU HB3 H -1.934 9.484 5.066 1.00 . A A . 10 LEU HB3 1 1 28 5215 1 1 11 LEU HD11 H -1.204 10.415 6.915 1.00 . A A . 10 LEU HD11 1 1 28 5216 1 1 11 LEU HD12 H -0.182 11.847 6.790 1.00 . A A . 10 LEU HD12 1 1 28 5217 1 1 11 LEU HD13 H -1.882 12.012 7.230 1.00 . A A . 10 LEU HD13 1 1 28 5218 1 1 11 LEU HD21 H -0.659 12.473 3.406 1.00 . A A . 10 LEU HD21 1 1 28 5219 1 1 11 LEU HD22 H -0.869 13.591 4.754 1.00 . A A . 10 LEU HD22 1 1 28 5220 1 1 11 LEU HD23 H 0.418 12.386 4.801 1.00 . A A . 10 LEU HD23 1 1 28 5221 1 1 11 LEU HG H -2.562 11.951 5.068 1.00 . A A . 10 LEU HG 1 1 28 5222 1 1 11 LEU N N 0.046 8.624 3.478 1.00 . A A . 10 LEU N 1 1 28 5223 1 1 11 LEU O O 1.351 10.376 6.262 1.00 . A A . 10 LEU O 1 1 28 5224 1 1 12 ALA C C 1.369 6.548 7.586 1.00 . A A . 11 ALA C 1 1 28 5225 1 1 12 ALA CA C 1.003 8.033 7.545 1.00 . A A . 11 ALA CA 1 1 28 5226 1 1 12 ALA CB C -0.107 8.341 8.550 1.00 . A A . 11 ALA CB 1 1 28 5227 1 1 12 ALA H H -0.130 7.736 5.735 1.00 . A A . 11 ALA H 1 1 28 5228 1 1 12 ALA HA H 1.869 8.642 7.753 1.00 . A A . 11 ALA HA 1 1 28 5229 1 1 12 ALA HB1 H -1.055 8.390 8.036 1.00 . A A . 11 ALA HB1 1 1 28 5230 1 1 12 ALA HB2 H -0.142 7.562 9.296 1.00 . A A . 11 ALA HB2 1 1 28 5231 1 1 12 ALA HB3 H 0.093 9.289 9.028 1.00 . A A . 11 ALA HB3 1 1 28 5232 1 1 12 ALA N N 0.428 8.384 6.215 1.00 . A A . 11 ALA N 1 1 28 5233 1 1 12 ALA O O 0.681 5.719 7.024 1.00 . A A . 11 ALA O 1 1 28 5234 1 1 13 NH2 HN1 H 2.992 6.837 8.692 1.00 . A A . 12 NH2 HN1 1 1 28 5235 1 1 13 NH2 HN2 H 2.680 5.222 8.271 1.00 . A A . 12 NH2 HN2 1 1 28 5236 1 1 13 NH2 N N 2.436 6.171 8.238 1.00 . A A . 12 NH2 N 1 1 29 5237 1 1 2 ILE C C -1.988 -5.063 1.534 1.00 . A A . 1 ILE C 1 1 29 5238 1 1 2 ILE CA C -0.743 -5.358 2.374 1.00 . A A . 1 ILE CA 1 1 29 5239 1 1 2 ILE CB C 0.543 -4.858 1.692 1.00 . A A . 1 ILE CB 1 1 29 5240 1 1 2 ILE CD1 C 2.688 -3.643 2.159 1.00 . A A . 1 ILE CD1 1 1 29 5241 1 1 2 ILE CG1 C 1.514 -4.394 2.784 1.00 . A A . 1 ILE CG1 1 1 29 5242 1 1 2 ILE CG2 C 0.242 -3.689 0.727 1.00 . A A . 1 ILE CG2 1 1 29 5243 1 1 2 ILE H H 0.316 -7.235 2.386 1.00 . A A . 1 ILE H 1 1 29 5244 1 1 2 ILE HA H -0.832 -4.909 3.347 1.00 . A A . 1 ILE HA 1 1 29 5245 1 1 2 ILE HB H 0.989 -5.670 1.140 1.00 . A A . 1 ILE HB 1 1 29 5246 1 1 2 ILE HD11 H 2.864 -4.018 1.162 1.00 . A A . 1 ILE HD11 1 1 29 5247 1 1 2 ILE HD12 H 2.452 -2.589 2.110 1.00 . A A . 1 ILE HD12 1 1 29 5248 1 1 2 ILE HD13 H 3.570 -3.788 2.762 1.00 . A A . 1 ILE HD13 1 1 29 5249 1 1 2 ILE HG12 H 0.994 -3.740 3.470 1.00 . A A . 1 ILE HG12 1 1 29 5250 1 1 2 ILE HG13 H 1.887 -5.256 3.321 1.00 . A A . 1 ILE HG13 1 1 29 5251 1 1 2 ILE HG21 H -0.727 -3.269 0.957 1.00 . A A . 1 ILE HG21 1 1 29 5252 1 1 2 ILE HG22 H 0.991 -2.923 0.830 1.00 . A A . 1 ILE HG22 1 1 29 5253 1 1 2 ILE HG23 H 0.237 -4.053 -0.289 1.00 . A A . 1 ILE HG23 1 1 29 5254 1 1 2 ILE N N -0.568 -6.830 2.508 1.00 . A A . 1 ILE N 1 1 29 5255 1 1 2 ILE O O -3.037 -4.739 2.052 1.00 . A A . 1 ILE O 1 1 29 5256 1 1 3 ASP C C -3.482 -3.439 -0.481 1.00 . A A . 2 ASP C 1 1 29 5257 1 1 3 ASP CA C -3.018 -4.885 -0.656 1.00 . A A . 2 ASP CA 1 1 29 5258 1 1 3 ASP CB C -4.112 -5.859 -0.220 1.00 . A A . 2 ASP CB 1 1 29 5259 1 1 3 ASP CG C -4.211 -7.003 -1.231 1.00 . A A . 2 ASP CG 1 1 29 5260 1 1 3 ASP H H -1.003 -5.430 -0.139 1.00 . A A . 2 ASP H 1 1 29 5261 1 1 3 ASP HA H -2.751 -5.065 -1.683 1.00 . A A . 2 ASP HA 1 1 29 5262 1 1 3 ASP HB2 H -3.871 -6.258 0.754 1.00 . A A . 2 ASP HB2 1 1 29 5263 1 1 3 ASP HB3 H -5.058 -5.341 -0.173 1.00 . A A . 2 ASP HB3 1 1 29 5264 1 1 3 ASP N N -1.865 -5.168 0.241 1.00 . A A . 2 ASP N 1 1 29 5265 1 1 3 ASP O O -3.306 -2.608 -1.350 1.00 . A A . 2 ASP O 1 1 29 5266 1 1 3 ASP OD1 O -4.025 -6.743 -2.409 1.00 . A A . 2 ASP OD1 1 1 29 5267 1 1 3 ASP OD2 O -4.471 -8.119 -0.811 1.00 . A A . 2 ASP OD2 1 1 29 5268 1 1 4 TYR C C -3.457 -0.778 1.206 1.00 . A A . 3 TYR C 1 1 29 5269 1 1 4 TYR CA C -4.589 -1.755 0.856 1.00 . A A . 3 TYR CA 1 1 29 5270 1 1 4 TYR CB C -5.592 -1.880 2.003 1.00 . A A . 3 TYR CB 1 1 29 5271 1 1 4 TYR CD1 C -4.396 -1.201 4.111 1.00 . A A . 3 TYR CD1 1 1 29 5272 1 1 4 TYR CD2 C -4.728 -3.562 3.668 1.00 . A A . 3 TYR CD2 1 1 29 5273 1 1 4 TYR CE1 C -3.759 -1.516 5.314 1.00 . A A . 3 TYR CE1 1 1 29 5274 1 1 4 TYR CE2 C -4.086 -3.876 4.871 1.00 . A A . 3 TYR CE2 1 1 29 5275 1 1 4 TYR CG C -4.881 -2.223 3.288 1.00 . A A . 3 TYR CG 1 1 29 5276 1 1 4 TYR CZ C -3.603 -2.853 5.694 1.00 . A A . 3 TYR CZ 1 1 29 5277 1 1 4 TYR H H -4.233 -3.831 1.306 1.00 . A A . 3 TYR H 1 1 29 5278 1 1 4 TYR HA H -5.097 -1.409 -0.024 1.00 . A A . 3 TYR HA 1 1 29 5279 1 1 4 TYR HB2 H -6.116 -0.945 2.125 1.00 . A A . 3 TYR HB2 1 1 29 5280 1 1 4 TYR HB3 H -6.304 -2.659 1.771 1.00 . A A . 3 TYR HB3 1 1 29 5281 1 1 4 TYR HD1 H -4.514 -0.168 3.816 1.00 . A A . 3 TYR HD1 1 1 29 5282 1 1 4 TYR HD2 H -5.101 -4.350 3.031 1.00 . A A . 3 TYR HD2 1 1 29 5283 1 1 4 TYR HE1 H -3.384 -0.726 5.950 1.00 . A A . 3 TYR HE1 1 1 29 5284 1 1 4 TYR HE2 H -3.966 -4.908 5.164 1.00 . A A . 3 TYR HE2 1 1 29 5285 1 1 4 TYR HH H -3.611 -3.017 7.596 1.00 . A A . 3 TYR HH 1 1 29 5286 1 1 4 TYR N N -4.091 -3.139 0.628 1.00 . A A . 3 TYR N 1 1 29 5287 1 1 4 TYR O O -3.412 0.310 0.674 1.00 . A A . 3 TYR O 1 1 29 5288 1 1 4 TYR OH O -2.981 -3.163 6.886 1.00 . A A . 3 TYR OH 1 1 29 5289 1 1 5 TRP C C -1.100 0.736 1.354 1.00 . A A . 4 TRP C 1 1 29 5290 1 1 5 TRP CA C -1.431 -0.233 2.490 1.00 . A A . 4 TRP CA 1 1 29 5291 1 1 5 TRP CB C -0.219 -1.133 2.726 1.00 . A A . 4 TRP CB 1 1 29 5292 1 1 5 TRP CD1 C -1.218 -2.899 4.243 1.00 . A A . 4 TRP CD1 1 1 29 5293 1 1 5 TRP CD2 C 0.443 -1.753 5.216 1.00 . A A . 4 TRP CD2 1 1 29 5294 1 1 5 TRP CE2 C -0.003 -2.698 6.164 1.00 . A A . 4 TRP CE2 1 1 29 5295 1 1 5 TRP CE3 C 1.490 -0.896 5.576 1.00 . A A . 4 TRP CE3 1 1 29 5296 1 1 5 TRP CG C -0.344 -1.898 4.005 1.00 . A A . 4 TRP CG 1 1 29 5297 1 1 5 TRP CH2 C 1.615 -1.932 7.777 1.00 . A A . 4 TRP CH2 1 1 29 5298 1 1 5 TRP CZ2 C 0.571 -2.794 7.428 1.00 . A A . 4 TRP CZ2 1 1 29 5299 1 1 5 TRP CZ3 C 2.075 -0.983 6.851 1.00 . A A . 4 TRP CZ3 1 1 29 5300 1 1 5 TRP H H -2.636 -2.029 2.507 1.00 . A A . 4 TRP H 1 1 29 5301 1 1 5 TRP HA H -1.674 0.305 3.393 1.00 . A A . 4 TRP HA 1 1 29 5302 1 1 5 TRP HB2 H -0.132 -1.820 1.911 1.00 . A A . 4 TRP HB2 1 1 29 5303 1 1 5 TRP HB3 H 0.670 -0.521 2.766 1.00 . A A . 4 TRP HB3 1 1 29 5304 1 1 5 TRP HD1 H -1.950 -3.279 3.550 1.00 . A A . 4 TRP HD1 1 1 29 5305 1 1 5 TRP HE1 H -1.516 -4.106 5.942 1.00 . A A . 4 TRP HE1 1 1 29 5306 1 1 5 TRP HE3 H 1.846 -0.169 4.866 1.00 . A A . 4 TRP HE3 1 1 29 5307 1 1 5 TRP HH2 H 2.066 -1.997 8.756 1.00 . A A . 4 TRP HH2 1 1 29 5308 1 1 5 TRP HZ2 H 0.210 -3.528 8.130 1.00 . A A . 4 TRP HZ2 1 1 29 5309 1 1 5 TRP HZ3 H 2.881 -0.317 7.120 1.00 . A A . 4 TRP HZ3 1 1 29 5310 1 1 5 TRP N N -2.561 -1.152 2.095 1.00 . A A . 4 TRP N 1 1 29 5311 1 1 5 TRP NE1 N -1.011 -3.379 5.522 1.00 . A A . 4 TRP NE1 1 1 29 5312 1 1 5 TRP O O -0.906 1.916 1.563 1.00 . A A . 4 TRP O 1 1 29 5313 1 1 6 LEU C C -1.385 2.455 -0.865 1.00 . A A . 5 LEU C 1 1 29 5314 1 1 6 LEU CA C -0.733 1.078 -1.030 1.00 . A A . 5 LEU CA 1 1 29 5315 1 1 6 LEU CB C -1.331 0.296 -2.205 1.00 . A A . 5 LEU CB 1 1 29 5316 1 1 6 LEU CD1 C -0.475 1.832 -3.981 1.00 . A A . 5 LEU CD1 1 1 29 5317 1 1 6 LEU CD2 C -2.511 0.440 -4.388 1.00 . A A . 5 LEU CD2 1 1 29 5318 1 1 6 LEU CG C -1.729 1.237 -3.341 1.00 . A A . 5 LEU CG 1 1 29 5319 1 1 6 LEU H H -1.205 -0.733 0.026 1.00 . A A . 5 LEU H 1 1 29 5320 1 1 6 LEU HA H 0.334 1.177 -1.156 1.00 . A A . 5 LEU HA 1 1 29 5321 1 1 6 LEU HB2 H -0.600 -0.411 -2.570 1.00 . A A . 5 LEU HB2 1 1 29 5322 1 1 6 LEU HB3 H -2.205 -0.241 -1.866 1.00 . A A . 5 LEU HB3 1 1 29 5323 1 1 6 LEU HD11 H 0.366 1.703 -3.315 1.00 . A A . 5 LEU HD11 1 1 29 5324 1 1 6 LEU HD12 H -0.273 1.328 -4.916 1.00 . A A . 5 LEU HD12 1 1 29 5325 1 1 6 LEU HD13 H -0.629 2.884 -4.166 1.00 . A A . 5 LEU HD13 1 1 29 5326 1 1 6 LEU HD21 H -3.042 -0.367 -3.903 1.00 . A A . 5 LEU HD21 1 1 29 5327 1 1 6 LEU HD22 H -3.217 1.088 -4.884 1.00 . A A . 5 LEU HD22 1 1 29 5328 1 1 6 LEU HD23 H -1.825 0.030 -5.115 1.00 . A A . 5 LEU HD23 1 1 29 5329 1 1 6 LEU HG H -2.350 2.032 -2.953 1.00 . A A . 5 LEU HG 1 1 29 5330 1 1 6 LEU N N -1.041 0.225 0.153 1.00 . A A . 5 LEU N 1 1 29 5331 1 1 6 LEU O O -0.739 3.476 -0.981 1.00 . A A . 5 LEU O 1 1 29 5332 1 1 7 ALA C C -3.259 4.198 1.103 1.00 . A A . 6 ALA C 1 1 29 5333 1 1 7 ALA CA C -3.340 3.796 -0.378 1.00 . A A . 6 ALA CA 1 1 29 5334 1 1 7 ALA CB C -4.788 3.553 -0.807 1.00 . A A . 6 ALA CB 1 1 29 5335 1 1 7 ALA H H -3.156 1.652 -0.469 1.00 . A A . 6 ALA H 1 1 29 5336 1 1 7 ALA HA H -2.891 4.554 -1.000 1.00 . A A . 6 ALA HA 1 1 29 5337 1 1 7 ALA HB1 H -5.218 2.771 -0.200 1.00 . A A . 6 ALA HB1 1 1 29 5338 1 1 7 ALA HB2 H -5.359 4.461 -0.682 1.00 . A A . 6 ALA HB2 1 1 29 5339 1 1 7 ALA HB3 H -4.810 3.255 -1.845 1.00 . A A . 6 ALA HB3 1 1 29 5340 1 1 7 ALA N N -2.656 2.488 -0.574 1.00 . A A . 6 ALA N 1 1 29 5341 1 1 7 ALA O O -2.214 4.116 1.710 1.00 . A A . 6 ALA O 1 1 29 5342 1 1 8 HIS C C -3.046 5.738 3.510 1.00 . A A . 7 HIS C 1 1 29 5343 1 1 8 HIS CA C -4.358 5.018 3.129 1.00 . A A . 7 HIS CA 1 1 29 5344 1 1 8 HIS CB C -4.555 3.717 3.940 1.00 . A A . 7 HIS CB 1 1 29 5345 1 1 8 HIS CD2 C -5.039 2.010 2.003 1.00 . A A . 7 HIS CD2 1 1 29 5346 1 1 8 HIS CE1 C -7.026 1.392 2.601 1.00 . A A . 7 HIS CE1 1 1 29 5347 1 1 8 HIS CG C -5.342 2.708 3.143 1.00 . A A . 7 HIS CG 1 1 29 5348 1 1 8 HIS H H -5.187 4.666 1.170 1.00 . A A . 7 HIS H 1 1 29 5349 1 1 8 HIS HA H -5.192 5.678 3.314 1.00 . A A . 7 HIS HA 1 1 29 5350 1 1 8 HIS HB2 H -3.602 3.292 4.193 1.00 . A A . 7 HIS HB2 1 1 29 5351 1 1 8 HIS HB3 H -5.091 3.944 4.850 1.00 . A A . 7 HIS HB3 1 1 29 5352 1 1 8 HIS HD1 H -7.127 2.614 4.286 1.00 . A A . 7 HIS HD1 1 1 29 5353 1 1 8 HIS HD2 H -4.113 2.084 1.458 1.00 . A A . 7 HIS HD2 1 1 29 5354 1 1 8 HIS HE1 H -7.979 0.887 2.633 1.00 . A A . 7 HIS HE1 1 1 29 5355 1 1 8 HIS HE2 H -6.161 0.577 0.899 1.00 . A A . 7 HIS HE2 1 1 29 5356 1 1 8 HIS N N -4.355 4.617 1.683 1.00 . A A . 7 HIS N 1 1 29 5357 1 1 8 HIS ND1 N -6.618 2.300 3.509 1.00 . A A . 7 HIS ND1 1 1 29 5358 1 1 8 HIS NE2 N -6.102 1.185 1.664 1.00 . A A . 7 HIS NE2 1 1 29 5359 1 1 8 HIS O O -2.966 6.949 3.444 1.00 . A A . 7 HIS O 1 1 29 5360 1 1 9 LYS C C -1.029 6.882 5.212 1.00 . A A . 8 LYS C 1 1 29 5361 1 1 9 LYS CA C -0.747 5.702 4.275 1.00 . A A . 8 LYS CA 1 1 29 5362 1 1 9 LYS CB C -0.150 6.162 2.942 1.00 . A A . 8 LYS CB 1 1 29 5363 1 1 9 LYS CD C 1.704 4.744 2.048 1.00 . A A . 8 LYS CD 1 1 29 5364 1 1 9 LYS CE C 2.199 4.302 3.426 1.00 . A A . 8 LYS CE 1 1 29 5365 1 1 9 LYS CG C 0.186 4.937 2.090 1.00 . A A . 8 LYS CG 1 1 29 5366 1 1 9 LYS H H -2.076 4.059 3.950 1.00 . A A . 8 LYS H 1 1 29 5367 1 1 9 LYS HA H -0.077 5.008 4.751 1.00 . A A . 8 LYS HA 1 1 29 5368 1 1 9 LYS HB2 H -0.865 6.782 2.421 1.00 . A A . 8 LYS HB2 1 1 29 5369 1 1 9 LYS HB3 H 0.752 6.726 3.125 1.00 . A A . 8 LYS HB3 1 1 29 5370 1 1 9 LYS HD2 H 1.951 3.989 1.316 1.00 . A A . 8 LYS HD2 1 1 29 5371 1 1 9 LYS HD3 H 2.178 5.676 1.779 1.00 . A A . 8 LYS HD3 1 1 29 5372 1 1 9 LYS HE2 H 3.265 4.116 3.400 1.00 . A A . 8 LYS HE2 1 1 29 5373 1 1 9 LYS HE3 H 1.966 5.049 4.169 1.00 . A A . 8 LYS HE3 1 1 29 5374 1 1 9 LYS HG2 H -0.276 4.061 2.519 1.00 . A A . 8 LYS HG2 1 1 29 5375 1 1 9 LYS HG3 H -0.183 5.085 1.086 1.00 . A A . 8 LYS HG3 1 1 29 5376 1 1 9 LYS HZ1 H 1.280 2.533 2.830 1.00 . A A . 8 LYS HZ1 1 1 29 5377 1 1 9 LYS HZ2 H 2.021 2.448 4.356 1.00 . A A . 8 LYS HZ2 1 1 29 5378 1 1 9 LYS HZ3 H 0.548 3.274 4.168 1.00 . A A . 8 LYS HZ3 1 1 29 5379 1 1 9 LYS N N -2.019 5.026 3.904 1.00 . A A . 8 LYS N 1 1 29 5380 1 1 9 LYS NZ N 1.456 3.045 3.717 1.00 . A A . 8 LYS NZ 1 1 29 5381 1 1 9 LYS O O -1.735 6.756 6.192 1.00 . A A . 8 LYS O 1 1 29 5382 1 1 10 ALA C C -2.133 9.294 6.284 1.00 . A A . 9 ALA C 1 1 29 5383 1 1 10 ALA CA C -0.683 9.215 5.795 1.00 . A A . 9 ALA CA 1 1 29 5384 1 1 10 ALA CB C -0.356 10.412 4.904 1.00 . A A . 9 ALA CB 1 1 29 5385 1 1 10 ALA H H 0.098 8.088 4.139 1.00 . A A . 9 ALA H 1 1 29 5386 1 1 10 ALA HA H -0.006 9.191 6.634 1.00 . A A . 9 ALA HA 1 1 29 5387 1 1 10 ALA HB1 H -0.780 10.257 3.922 1.00 . A A . 9 ALA HB1 1 1 29 5388 1 1 10 ALA HB2 H -0.772 11.310 5.338 1.00 . A A . 9 ALA HB2 1 1 29 5389 1 1 10 ALA HB3 H 0.716 10.517 4.820 1.00 . A A . 9 ALA HB3 1 1 29 5390 1 1 10 ALA N N -0.472 8.020 4.924 1.00 . A A . 9 ALA N 1 1 29 5391 1 1 10 ALA O O -2.412 9.857 7.325 1.00 . A A . 9 ALA O 1 1 29 5392 1 1 11 LEU C C -4.598 8.532 7.484 1.00 . A A . 10 LEU C 1 1 29 5393 1 1 11 LEU CA C -4.488 8.802 5.980 1.00 . A A . 10 LEU CA 1 1 29 5394 1 1 11 LEU CB C -5.191 7.699 5.190 1.00 . A A . 10 LEU CB 1 1 29 5395 1 1 11 LEU CD1 C -6.833 9.393 4.367 1.00 . A A . 10 LEU CD1 1 1 29 5396 1 1 11 LEU CD2 C -4.777 8.904 3.038 1.00 . A A . 10 LEU CD2 1 1 29 5397 1 1 11 LEU CG C -5.850 8.300 3.947 1.00 . A A . 10 LEU CG 1 1 29 5398 1 1 11 LEU H H -2.820 8.299 4.707 1.00 . A A . 10 LEU H 1 1 29 5399 1 1 11 LEU HA H -4.918 9.761 5.736 1.00 . A A . 10 LEU HA 1 1 29 5400 1 1 11 LEU HB2 H -4.467 6.956 4.893 1.00 . A A . 10 LEU HB2 1 1 29 5401 1 1 11 LEU HB3 H -5.945 7.240 5.808 1.00 . A A . 10 LEU HB3 1 1 29 5402 1 1 11 LEU HD11 H -7.030 9.313 5.425 1.00 . A A . 10 LEU HD11 1 1 29 5403 1 1 11 LEU HD12 H -6.407 10.362 4.152 1.00 . A A . 10 LEU HD12 1 1 29 5404 1 1 11 LEU HD13 H -7.757 9.277 3.818 1.00 . A A . 10 LEU HD13 1 1 29 5405 1 1 11 LEU HD21 H -3.991 9.330 3.643 1.00 . A A . 10 LEU HD21 1 1 29 5406 1 1 11 LEU HD22 H -4.363 8.131 2.406 1.00 . A A . 10 LEU HD22 1 1 29 5407 1 1 11 LEU HD23 H -5.217 9.674 2.423 1.00 . A A . 10 LEU HD23 1 1 29 5408 1 1 11 LEU HG H -6.382 7.524 3.413 1.00 . A A . 10 LEU HG 1 1 29 5409 1 1 11 LEU N N -3.060 8.745 5.546 1.00 . A A . 10 LEU N 1 1 29 5410 1 1 11 LEU O O -5.088 9.350 8.236 1.00 . A A . 10 LEU O 1 1 29 5411 1 1 12 ALA C C -5.616 7.407 9.921 1.00 . A A . 11 ALA C 1 1 29 5412 1 1 12 ALA CA C -4.224 7.069 9.379 1.00 . A A . 11 ALA CA 1 1 29 5413 1 1 12 ALA CB C -3.164 7.952 10.037 1.00 . A A . 11 ALA CB 1 1 29 5414 1 1 12 ALA H H -3.753 6.744 7.301 1.00 . A A . 11 ALA H 1 1 29 5415 1 1 12 ALA HA H -3.995 6.029 9.549 1.00 . A A . 11 ALA HA 1 1 29 5416 1 1 12 ALA HB1 H -2.222 7.827 9.523 1.00 . A A . 11 ALA HB1 1 1 29 5417 1 1 12 ALA HB2 H -3.470 8.987 9.981 1.00 . A A . 11 ALA HB2 1 1 29 5418 1 1 12 ALA HB3 H -3.050 7.666 11.072 1.00 . A A . 11 ALA HB3 1 1 29 5419 1 1 12 ALA N N -4.146 7.391 7.925 1.00 . A A . 11 ALA N 1 1 29 5420 1 1 12 ALA O O -5.751 8.140 10.881 1.00 . A A . 11 ALA O 1 1 29 5421 1 1 13 NH2 HN1 H -6.561 6.305 8.566 1.00 . A A . 12 NH2 HN1 1 1 29 5422 1 1 13 NH2 HN2 H -7.564 7.105 9.678 1.00 . A A . 12 NH2 HN2 1 1 29 5423 1 1 13 NH2 N N -6.667 6.897 9.340 1.00 . A A . 12 NH2 N 1 1 30 5424 1 1 2 ILE C C -2.015 -4.985 1.674 1.00 . A A . 1 ILE C 1 1 30 5425 1 1 2 ILE CA C -0.859 -5.203 2.653 1.00 . A A . 1 ILE CA 1 1 30 5426 1 1 2 ILE CB C 0.474 -4.690 2.085 1.00 . A A . 1 ILE CB 1 1 30 5427 1 1 2 ILE CD1 C 2.566 -3.467 2.730 1.00 . A A . 1 ILE CD1 1 1 30 5428 1 1 2 ILE CG1 C 1.346 -4.223 3.256 1.00 . A A . 1 ILE CG1 1 1 30 5429 1 1 2 ILE CG2 C 0.240 -3.517 1.110 1.00 . A A . 1 ILE CG2 1 1 30 5430 1 1 2 ILE H H 0.246 -7.040 2.860 1.00 . A A . 1 ILE H 1 1 30 5431 1 1 2 ILE HA H -1.063 -4.713 3.586 1.00 . A A . 1 ILE HA 1 1 30 5432 1 1 2 ILE HB H 0.971 -5.493 1.565 1.00 . A A . 1 ILE HB 1 1 30 5433 1 1 2 ILE HD11 H 2.237 -2.656 2.096 1.00 . A A . 1 ILE HD11 1 1 30 5434 1 1 2 ILE HD12 H 3.126 -3.069 3.562 1.00 . A A . 1 ILE HD12 1 1 30 5435 1 1 2 ILE HD13 H 3.187 -4.140 2.162 1.00 . A A . 1 ILE HD13 1 1 30 5436 1 1 2 ILE HG12 H 0.768 -3.570 3.895 1.00 . A A . 1 ILE HG12 1 1 30 5437 1 1 2 ILE HG13 H 1.676 -5.082 3.822 1.00 . A A . 1 ILE HG13 1 1 30 5438 1 1 2 ILE HG21 H -0.763 -3.136 1.234 1.00 . A A . 1 ILE HG21 1 1 30 5439 1 1 2 ILE HG22 H 0.945 -2.727 1.308 1.00 . A A . 1 ILE HG22 1 1 30 5440 1 1 2 ILE HG23 H 0.365 -3.863 0.095 1.00 . A A . 1 ILE HG23 1 1 30 5441 1 1 2 ILE N N -0.657 -6.659 2.875 1.00 . A A . 1 ILE N 1 1 30 5442 1 1 2 ILE O O -3.133 -4.720 2.069 1.00 . A A . 1 ILE O 1 1 30 5443 1 1 3 ASP C C -3.343 -3.443 -0.521 1.00 . A A . 2 ASP C 1 1 30 5444 1 1 3 ASP CA C -2.808 -4.871 -0.613 1.00 . A A . 2 ASP CA 1 1 30 5445 1 1 3 ASP CB C -3.901 -5.883 -0.269 1.00 . A A . 2 ASP CB 1 1 30 5446 1 1 3 ASP CG C -3.271 -7.257 -0.036 1.00 . A A . 2 ASP CG 1 1 30 5447 1 1 3 ASP H H -0.833 -5.297 0.123 1.00 . A A . 2 ASP H 1 1 30 5448 1 1 3 ASP HA H -2.427 -5.059 -1.603 1.00 . A A . 2 ASP HA 1 1 30 5449 1 1 3 ASP HB2 H -4.416 -5.565 0.626 1.00 . A A . 2 ASP HB2 1 1 30 5450 1 1 3 ASP HB3 H -4.604 -5.946 -1.086 1.00 . A A . 2 ASP HB3 1 1 30 5451 1 1 3 ASP N N -1.744 -5.086 0.405 1.00 . A A . 2 ASP N 1 1 30 5452 1 1 3 ASP O O -3.135 -2.633 -1.402 1.00 . A A . 2 ASP O 1 1 30 5453 1 1 3 ASP OD1 O -2.087 -7.396 -0.296 1.00 . A A . 2 ASP OD1 1 1 30 5454 1 1 3 ASP OD2 O -3.982 -8.147 0.399 1.00 . A A . 2 ASP OD2 1 1 30 5455 1 1 4 TYR C C -3.518 -0.735 1.061 1.00 . A A . 3 TYR C 1 1 30 5456 1 1 4 TYR CA C -4.598 -1.760 0.671 1.00 . A A . 3 TYR CA 1 1 30 5457 1 1 4 TYR CB C -5.698 -1.873 1.734 1.00 . A A . 3 TYR CB 1 1 30 5458 1 1 4 TYR CD1 C -4.763 -1.064 3.923 1.00 . A A . 3 TYR CD1 1 1 30 5459 1 1 4 TYR CD2 C -4.905 -3.451 3.530 1.00 . A A . 3 TYR CD2 1 1 30 5460 1 1 4 TYR CE1 C -4.224 -1.302 5.190 1.00 . A A . 3 TYR CE1 1 1 30 5461 1 1 4 TYR CE2 C -4.363 -3.691 4.798 1.00 . A A . 3 TYR CE2 1 1 30 5462 1 1 4 TYR CG C -5.104 -2.138 3.094 1.00 . A A . 3 TYR CG 1 1 30 5463 1 1 4 TYR CZ C -4.023 -2.615 5.627 1.00 . A A . 3 TYR CZ 1 1 30 5464 1 1 4 TYR H H -4.202 -3.803 1.226 1.00 . A A . 3 TYR H 1 1 30 5465 1 1 4 TYR HA H -5.041 -1.461 -0.260 1.00 . A A . 3 TYR HA 1 1 30 5466 1 1 4 TYR HB2 H -6.260 -0.952 1.765 1.00 . A A . 3 TYR HB2 1 1 30 5467 1 1 4 TYR HB3 H -6.362 -2.684 1.472 1.00 . A A . 3 TYR HB3 1 1 30 5468 1 1 4 TYR HD1 H -4.917 -0.049 3.585 1.00 . A A . 3 TYR HD1 1 1 30 5469 1 1 4 TYR HD2 H -5.168 -4.280 2.889 1.00 . A A . 3 TYR HD2 1 1 30 5470 1 1 4 TYR HE1 H -3.961 -0.474 5.831 1.00 . A A . 3 TYR HE1 1 1 30 5471 1 1 4 TYR HE2 H -4.208 -4.704 5.136 1.00 . A A . 3 TYR HE2 1 1 30 5472 1 1 4 TYR HH H -2.973 -2.085 7.131 1.00 . A A . 3 TYR HH 1 1 30 5473 1 1 4 TYR N N -4.039 -3.130 0.532 1.00 . A A . 3 TYR N 1 1 30 5474 1 1 4 TYR O O -3.370 0.259 0.388 1.00 . A A . 3 TYR O 1 1 30 5475 1 1 4 TYR OH O -3.494 -2.851 6.880 1.00 . A A . 3 TYR OH 1 1 30 5476 1 1 5 TRP C C -1.329 0.984 1.489 1.00 . A A . 4 TRP C 1 1 30 5477 1 1 5 TRP CA C -1.702 -0.013 2.588 1.00 . A A . 4 TRP CA 1 1 30 5478 1 1 5 TRP CB C -0.483 -0.883 2.899 1.00 . A A . 4 TRP CB 1 1 30 5479 1 1 5 TRP CD1 C -1.545 -2.663 4.364 1.00 . A A . 4 TRP CD1 1 1 30 5480 1 1 5 TRP CD2 C 0.034 -1.486 5.434 1.00 . A A . 4 TRP CD2 1 1 30 5481 1 1 5 TRP CE2 C -0.463 -2.428 6.360 1.00 . A A . 4 TRP CE2 1 1 30 5482 1 1 5 TRP CE3 C 1.046 -0.616 5.855 1.00 . A A . 4 TRP CE3 1 1 30 5483 1 1 5 TRP CG C -0.673 -1.648 4.174 1.00 . A A . 4 TRP CG 1 1 30 5484 1 1 5 TRP CH2 C 1.037 -1.628 8.069 1.00 . A A . 4 TRP CH2 1 1 30 5485 1 1 5 TRP CZ2 C 0.027 -2.504 7.662 1.00 . A A . 4 TRP CZ2 1 1 30 5486 1 1 5 TRP CZ3 C 1.547 -0.685 7.166 1.00 . A A . 4 TRP CZ3 1 1 30 5487 1 1 5 TRP H H -2.930 -1.785 2.637 1.00 . A A . 4 TRP H 1 1 30 5488 1 1 5 TRP HA H -2.015 0.508 3.479 1.00 . A A . 4 TRP HA 1 1 30 5489 1 1 5 TRP HB2 H -0.330 -1.571 2.092 1.00 . A A . 4 TRP HB2 1 1 30 5490 1 1 5 TRP HB3 H 0.388 -0.251 2.992 1.00 . A A . 4 TRP HB3 1 1 30 5491 1 1 5 TRP HD1 H -2.224 -3.057 3.626 1.00 . A A . 4 TRP HD1 1 1 30 5492 1 1 5 TRP HE1 H -1.944 -3.855 6.052 1.00 . A A . 4 TRP HE1 1 1 30 5493 1 1 5 TRP HE3 H 1.443 0.106 5.163 1.00 . A A . 4 TRP HE3 1 1 30 5494 1 1 5 TRP HH2 H 1.423 -1.679 9.075 1.00 . A A . 4 TRP HH2 1 1 30 5495 1 1 5 TRP HZ2 H -0.370 -3.234 8.350 1.00 . A A . 4 TRP HZ2 1 1 30 5496 1 1 5 TRP HZ3 H 2.328 -0.007 7.479 1.00 . A A . 4 TRP HZ3 1 1 30 5497 1 1 5 TRP N N -2.778 -0.972 2.130 1.00 . A A . 4 TRP N 1 1 30 5498 1 1 5 TRP NE1 N -1.421 -3.125 5.660 1.00 . A A . 4 TRP NE1 1 1 30 5499 1 1 5 TRP O O -1.347 2.183 1.682 1.00 . A A . 4 TRP O 1 1 30 5500 1 1 6 LEU C C -1.444 2.643 -0.827 1.00 . A A . 5 LEU C 1 1 30 5501 1 1 6 LEU CA C -0.606 1.352 -0.808 1.00 . A A . 5 LEU CA 1 1 30 5502 1 1 6 LEU CB C -0.893 0.470 -2.031 1.00 . A A . 5 LEU CB 1 1 30 5503 1 1 6 LEU CD1 C 0.063 2.021 -3.744 1.00 . A A . 5 LEU CD1 1 1 30 5504 1 1 6 LEU CD2 C -1.736 0.401 -4.369 1.00 . A A . 5 LEU CD2 1 1 30 5505 1 1 6 LEU CG C -1.208 1.318 -3.263 1.00 . A A . 5 LEU CG 1 1 30 5506 1 1 6 LEU H H -0.985 -0.494 0.222 1.00 . A A . 5 LEU H 1 1 30 5507 1 1 6 LEU HA H 0.445 1.587 -0.767 1.00 . A A . 5 LEU HA 1 1 30 5508 1 1 6 LEU HB2 H -0.028 -0.144 -2.236 1.00 . A A . 5 LEU HB2 1 1 30 5509 1 1 6 LEU HB3 H -1.736 -0.169 -1.816 1.00 . A A . 5 LEU HB3 1 1 30 5510 1 1 6 LEU HD11 H 0.815 1.282 -3.981 1.00 . A A . 5 LEU HD11 1 1 30 5511 1 1 6 LEU HD12 H -0.158 2.603 -4.626 1.00 . A A . 5 LEU HD12 1 1 30 5512 1 1 6 LEU HD13 H 0.432 2.672 -2.965 1.00 . A A . 5 LEU HD13 1 1 30 5513 1 1 6 LEU HD21 H -2.267 -0.429 -3.923 1.00 . A A . 5 LEU HD21 1 1 30 5514 1 1 6 LEU HD22 H -2.407 0.954 -5.008 1.00 . A A . 5 LEU HD22 1 1 30 5515 1 1 6 LEU HD23 H -0.908 0.026 -4.952 1.00 . A A . 5 LEU HD23 1 1 30 5516 1 1 6 LEU HG H -1.957 2.056 -3.016 1.00 . A A . 5 LEU HG 1 1 30 5517 1 1 6 LEU N N -0.988 0.479 0.338 1.00 . A A . 5 LEU N 1 1 30 5518 1 1 6 LEU O O -0.913 3.732 -0.920 1.00 . A A . 5 LEU O 1 1 30 5519 1 1 7 ALA C C -3.851 4.297 0.638 1.00 . A A . 6 ALA C 1 1 30 5520 1 1 7 ALA CA C -3.600 3.761 -0.779 1.00 . A A . 6 ALA CA 1 1 30 5521 1 1 7 ALA CB C -4.915 3.304 -1.412 1.00 . A A . 6 ALA CB 1 1 30 5522 1 1 7 ALA H H -3.158 1.648 -0.685 1.00 . A A . 6 ALA H 1 1 30 5523 1 1 7 ALA HA H -3.145 4.521 -1.393 1.00 . A A . 6 ALA HA 1 1 30 5524 1 1 7 ALA HB1 H -4.726 2.474 -2.076 1.00 . A A . 6 ALA HB1 1 1 30 5525 1 1 7 ALA HB2 H -5.600 2.997 -0.635 1.00 . A A . 6 ALA HB2 1 1 30 5526 1 1 7 ALA HB3 H -5.348 4.121 -1.971 1.00 . A A . 6 ALA HB3 1 1 30 5527 1 1 7 ALA N N -2.744 2.534 -0.751 1.00 . A A . 6 ALA N 1 1 30 5528 1 1 7 ALA O O -4.737 5.098 0.856 1.00 . A A . 6 ALA O 1 1 30 5529 1 1 8 HIS C C -1.997 4.877 3.578 1.00 . A A . 7 HIS C 1 1 30 5530 1 1 8 HIS CA C -3.308 4.341 2.998 1.00 . A A . 7 HIS CA 1 1 30 5531 1 1 8 HIS CB C -3.778 3.113 3.791 1.00 . A A . 7 HIS CB 1 1 30 5532 1 1 8 HIS CD2 C -4.833 1.887 1.711 1.00 . A A . 7 HIS CD2 1 1 30 5533 1 1 8 HIS CE1 C -6.689 1.246 2.618 1.00 . A A . 7 HIS CE1 1 1 30 5534 1 1 8 HIS CG C -4.812 2.341 3.006 1.00 . A A . 7 HIS CG 1 1 30 5535 1 1 8 HIS H H -2.386 3.204 1.414 1.00 . A A . 7 HIS H 1 1 30 5536 1 1 8 HIS HA H -4.068 5.106 3.018 1.00 . A A . 7 HIS HA 1 1 30 5537 1 1 8 HIS HB2 H -2.932 2.473 3.991 1.00 . A A . 7 HIS HB2 1 1 30 5538 1 1 8 HIS HB3 H -4.209 3.436 4.727 1.00 . A A . 7 HIS HB3 1 1 30 5539 1 1 8 HIS HD1 H -6.308 2.082 4.488 1.00 . A A . 7 HIS HD1 1 1 30 5540 1 1 8 HIS HD2 H -4.049 2.031 0.992 1.00 . A A . 7 HIS HD2 1 1 30 5541 1 1 8 HIS HE1 H -7.652 0.786 2.767 1.00 . A A . 7 HIS HE1 1 1 30 5542 1 1 8 HIS HE2 H -6.294 0.773 0.636 1.00 . A A . 7 HIS HE2 1 1 30 5543 1 1 8 HIS N N -3.091 3.857 1.604 1.00 . A A . 7 HIS N 1 1 30 5544 1 1 8 HIS ND1 N -6.010 1.919 3.569 1.00 . A A . 7 HIS ND1 1 1 30 5545 1 1 8 HIS NE2 N -6.014 1.201 1.473 1.00 . A A . 7 HIS NE2 1 1 30 5546 1 1 8 HIS O O -1.991 5.786 4.385 1.00 . A A . 7 HIS O 1 1 30 5547 1 1 9 LYS C C 0.943 5.961 2.853 1.00 . A A . 8 LYS C 1 1 30 5548 1 1 9 LYS CA C 0.421 4.806 3.706 1.00 . A A . 8 LYS CA 1 1 30 5549 1 1 9 LYS CB C 1.359 3.602 3.622 1.00 . A A . 8 LYS CB 1 1 30 5550 1 1 9 LYS CD C 2.769 2.276 2.041 1.00 . A A . 8 LYS CD 1 1 30 5551 1 1 9 LYS CE C 4.048 3.094 1.852 1.00 . A A . 8 LYS CE 1 1 30 5552 1 1 9 LYS CG C 1.570 3.221 2.156 1.00 . A A . 8 LYS CG 1 1 30 5553 1 1 9 LYS H H -0.910 3.591 2.523 1.00 . A A . 8 LYS H 1 1 30 5554 1 1 9 LYS HA H 0.312 5.121 4.729 1.00 . A A . 8 LYS HA 1 1 30 5555 1 1 9 LYS HB2 H 2.309 3.855 4.070 1.00 . A A . 8 LYS HB2 1 1 30 5556 1 1 9 LYS HB3 H 0.922 2.767 4.150 1.00 . A A . 8 LYS HB3 1 1 30 5557 1 1 9 LYS HD2 H 2.847 1.685 2.943 1.00 . A A . 8 LYS HD2 1 1 30 5558 1 1 9 LYS HD3 H 2.632 1.623 1.192 1.00 . A A . 8 LYS HD3 1 1 30 5559 1 1 9 LYS HE2 H 3.825 4.030 1.358 1.00 . A A . 8 LYS HE2 1 1 30 5560 1 1 9 LYS HE3 H 4.524 3.273 2.803 1.00 . A A . 8 LYS HE3 1 1 30 5561 1 1 9 LYS HG2 H 0.684 2.728 1.781 1.00 . A A . 8 LYS HG2 1 1 30 5562 1 1 9 LYS HG3 H 1.760 4.111 1.575 1.00 . A A . 8 LYS HG3 1 1 30 5563 1 1 9 LYS HZ1 H 4.841 1.252 1.294 1.00 . A A . 8 LYS HZ1 1 1 30 5564 1 1 9 LYS HZ2 H 4.627 2.335 0.002 1.00 . A A . 8 LYS HZ2 1 1 30 5565 1 1 9 LYS HZ3 H 5.909 2.558 1.089 1.00 . A A . 8 LYS HZ3 1 1 30 5566 1 1 9 LYS N N -0.886 4.323 3.174 1.00 . A A . 8 LYS N 1 1 30 5567 1 1 9 LYS NZ N 4.922 2.246 0.994 1.00 . A A . 8 LYS NZ 1 1 30 5568 1 1 9 LYS O O 2.115 6.284 2.871 1.00 . A A . 8 LYS O 1 1 30 5569 1 1 10 ALA C C 0.385 9.040 2.045 1.00 . A A . 9 ALA C 1 1 30 5570 1 1 10 ALA CA C 0.509 7.732 1.260 1.00 . A A . 9 ALA CA 1 1 30 5571 1 1 10 ALA CB C -0.451 7.726 0.070 1.00 . A A . 9 ALA CB 1 1 30 5572 1 1 10 ALA H H -0.861 6.312 2.126 1.00 . A A . 9 ALA H 1 1 30 5573 1 1 10 ALA HA H 1.523 7.589 0.920 1.00 . A A . 9 ALA HA 1 1 30 5574 1 1 10 ALA HB1 H -1.442 7.462 0.409 1.00 . A A . 9 ALA HB1 1 1 30 5575 1 1 10 ALA HB2 H -0.473 8.707 -0.380 1.00 . A A . 9 ALA HB2 1 1 30 5576 1 1 10 ALA HB3 H -0.116 7.003 -0.659 1.00 . A A . 9 ALA HB3 1 1 30 5577 1 1 10 ALA N N 0.077 6.589 2.113 1.00 . A A . 9 ALA N 1 1 30 5578 1 1 10 ALA O O 1.064 10.009 1.773 1.00 . A A . 9 ALA O 1 1 30 5579 1 1 11 LEU C C 0.183 10.229 5.106 1.00 . A A . 10 LEU C 1 1 30 5580 1 1 11 LEU CA C -0.659 10.308 3.829 1.00 . A A . 10 LEU CA 1 1 30 5581 1 1 11 LEU CB C -2.151 10.342 4.167 1.00 . A A . 10 LEU CB 1 1 30 5582 1 1 11 LEU CD1 C -1.688 12.641 5.034 1.00 . A A . 10 LEU CD1 1 1 30 5583 1 1 11 LEU CD2 C -2.677 12.338 2.762 1.00 . A A . 10 LEU CD2 1 1 30 5584 1 1 11 LEU CG C -2.640 11.792 4.191 1.00 . A A . 10 LEU CG 1 1 30 5585 1 1 11 LEU H H -1.020 8.274 3.220 1.00 . A A . 10 LEU H 1 1 30 5586 1 1 11 LEU HA H -0.391 11.179 3.252 1.00 . A A . 10 LEU HA 1 1 30 5587 1 1 11 LEU HB2 H -2.700 9.789 3.420 1.00 . A A . 10 LEU HB2 1 1 30 5588 1 1 11 LEU HB3 H -2.311 9.894 5.137 1.00 . A A . 10 LEU HB3 1 1 30 5589 1 1 11 LEU HD11 H -0.695 12.598 4.611 1.00 . A A . 10 LEU HD11 1 1 30 5590 1 1 11 LEU HD12 H -2.032 13.665 5.043 1.00 . A A . 10 LEU HD12 1 1 30 5591 1 1 11 LEU HD13 H -1.665 12.261 6.045 1.00 . A A . 10 LEU HD13 1 1 30 5592 1 1 11 LEU HD21 H -2.121 11.681 2.111 1.00 . A A . 10 LEU HD21 1 1 30 5593 1 1 11 LEU HD22 H -3.702 12.395 2.425 1.00 . A A . 10 LEU HD22 1 1 30 5594 1 1 11 LEU HD23 H -2.236 13.324 2.742 1.00 . A A . 10 LEU HD23 1 1 30 5595 1 1 11 LEU HG H -3.631 11.830 4.619 1.00 . A A . 10 LEU HG 1 1 30 5596 1 1 11 LEU N N -0.482 9.070 3.020 1.00 . A A . 10 LEU N 1 1 30 5597 1 1 11 LEU O O 0.205 11.143 5.905 1.00 . A A . 10 LEU O 1 1 30 5598 1 1 12 ALA C C 0.830 8.955 7.775 1.00 . A A . 11 ALA C 1 1 30 5599 1 1 12 ALA CA C 1.716 9.004 6.528 1.00 . A A . 11 ALA CA 1 1 30 5600 1 1 12 ALA CB C 2.598 10.253 6.546 1.00 . A A . 11 ALA CB 1 1 30 5601 1 1 12 ALA H H 0.845 8.414 4.647 1.00 . A A . 11 ALA H 1 1 30 5602 1 1 12 ALA HA H 2.331 8.119 6.467 1.00 . A A . 11 ALA HA 1 1 30 5603 1 1 12 ALA HB1 H 2.391 10.851 5.671 1.00 . A A . 11 ALA HB1 1 1 30 5604 1 1 12 ALA HB2 H 2.389 10.829 7.434 1.00 . A A . 11 ALA HB2 1 1 30 5605 1 1 12 ALA HB3 H 3.638 9.959 6.544 1.00 . A A . 11 ALA HB3 1 1 30 5606 1 1 12 ALA N N 0.876 9.141 5.304 1.00 . A A . 11 ALA N 1 1 30 5607 1 1 12 ALA O O 0.005 9.821 7.988 1.00 . A A . 11 ALA O 1 1 30 5608 1 1 13 NH2 HN1 H 1.632 7.268 8.447 1.00 . A A . 12 NH2 HN1 1 1 30 5609 1 1 13 NH2 HN2 H 0.406 7.926 9.419 1.00 . A A . 12 NH2 HN2 1 1 30 5610 1 1 13 NH2 N N 0.967 7.967 8.618 1.00 . A A . 12 NH2 N 1 1 31 5611 1 1 2 ILE C C -1.945 -4.929 1.620 1.00 . A A . 1 ILE C 1 1 31 5612 1 1 2 ILE CA C -0.814 -5.139 2.629 1.00 . A A . 1 ILE CA 1 1 31 5613 1 1 2 ILE CB C 0.510 -4.515 2.147 1.00 . A A . 1 ILE CB 1 1 31 5614 1 1 2 ILE CD1 C 1.816 -5.096 4.199 1.00 . A A . 1 ILE CD1 1 1 31 5615 1 1 2 ILE CG1 C 1.257 -3.948 3.356 1.00 . A A . 1 ILE CG1 1 1 31 5616 1 1 2 ILE CG2 C 0.263 -3.377 1.138 1.00 . A A . 1 ILE CG2 1 1 31 5617 1 1 2 ILE H H 0.395 -6.916 2.767 1.00 . A A . 1 ILE H 1 1 31 5618 1 1 2 ILE HA H -1.081 -4.727 3.585 1.00 . A A . 1 ILE HA 1 1 31 5619 1 1 2 ILE HB H 1.112 -5.277 1.683 1.00 . A A . 1 ILE HB 1 1 31 5620 1 1 2 ILE HD11 H 1.011 -5.758 4.485 1.00 . A A . 1 ILE HD11 1 1 31 5621 1 1 2 ILE HD12 H 2.545 -5.645 3.622 1.00 . A A . 1 ILE HD12 1 1 31 5622 1 1 2 ILE HD13 H 2.286 -4.695 5.085 1.00 . A A . 1 ILE HD13 1 1 31 5623 1 1 2 ILE HG12 H 2.068 -3.322 3.015 1.00 . A A . 1 ILE HG12 1 1 31 5624 1 1 2 ILE HG13 H 0.575 -3.363 3.958 1.00 . A A . 1 ILE HG13 1 1 31 5625 1 1 2 ILE HG21 H -0.758 -3.030 1.221 1.00 . A A . 1 ILE HG21 1 1 31 5626 1 1 2 ILE HG22 H 0.936 -2.559 1.345 1.00 . A A . 1 ILE HG22 1 1 31 5627 1 1 2 ILE HG23 H 0.434 -3.738 0.135 1.00 . A A . 1 ILE HG23 1 1 31 5628 1 1 2 ILE N N -0.529 -6.593 2.760 1.00 . A A . 1 ILE N 1 1 31 5629 1 1 2 ILE O O -3.079 -4.696 1.983 1.00 . A A . 1 ILE O 1 1 31 5630 1 1 3 ASP C C -3.278 -3.428 -0.588 1.00 . A A . 2 ASP C 1 1 31 5631 1 1 3 ASP CA C -2.659 -4.817 -0.701 1.00 . A A . 2 ASP CA 1 1 31 5632 1 1 3 ASP CB C -3.704 -5.902 -0.451 1.00 . A A . 2 ASP CB 1 1 31 5633 1 1 3 ASP CG C -3.401 -7.115 -1.332 1.00 . A A . 2 ASP CG 1 1 31 5634 1 1 3 ASP H H -0.705 -5.207 0.109 1.00 . A A . 2 ASP H 1 1 31 5635 1 1 3 ASP HA H -2.219 -4.939 -1.674 1.00 . A A . 2 ASP HA 1 1 31 5636 1 1 3 ASP HB2 H -3.677 -6.196 0.589 1.00 . A A . 2 ASP HB2 1 1 31 5637 1 1 3 ASP HB3 H -4.685 -5.521 -0.692 1.00 . A A . 2 ASP HB3 1 1 31 5638 1 1 3 ASP N N -1.630 -5.014 0.359 1.00 . A A . 2 ASP N 1 1 31 5639 1 1 3 ASP O O -3.053 -2.572 -1.420 1.00 . A A . 2 ASP O 1 1 31 5640 1 1 3 ASP OD1 O -2.373 -7.102 -1.989 1.00 . A A . 2 ASP OD1 1 1 31 5641 1 1 3 ASP OD2 O -4.201 -8.035 -1.335 1.00 . A A . 2 ASP OD2 1 1 31 5642 1 1 4 TYR C C -3.660 -0.818 1.035 1.00 . A A . 3 TYR C 1 1 31 5643 1 1 4 TYR CA C -4.682 -1.853 0.557 1.00 . A A . 3 TYR CA 1 1 31 5644 1 1 4 TYR CB C -5.849 -2.022 1.539 1.00 . A A . 3 TYR CB 1 1 31 5645 1 1 4 TYR CD1 C -5.175 -3.770 3.221 1.00 . A A . 3 TYR CD1 1 1 31 5646 1 1 4 TYR CD2 C -5.088 -1.433 3.860 1.00 . A A . 3 TYR CD2 1 1 31 5647 1 1 4 TYR CE1 C -4.730 -4.132 4.496 1.00 . A A . 3 TYR CE1 1 1 31 5648 1 1 4 TYR CE2 C -4.646 -1.796 5.134 1.00 . A A . 3 TYR CE2 1 1 31 5649 1 1 4 TYR CG C -5.352 -2.420 2.904 1.00 . A A . 3 TYR CG 1 1 31 5650 1 1 4 TYR CZ C -4.467 -3.144 5.452 1.00 . A A . 3 TYR CZ 1 1 31 5651 1 1 4 TYR H H -4.234 -3.894 1.082 1.00 . A A . 3 TYR H 1 1 31 5652 1 1 4 TYR HA H -5.069 -1.544 -0.396 1.00 . A A . 3 TYR HA 1 1 31 5653 1 1 4 TYR HB2 H -6.386 -1.089 1.616 1.00 . A A . 3 TYR HB2 1 1 31 5654 1 1 4 TYR HB3 H -6.518 -2.785 1.167 1.00 . A A . 3 TYR HB3 1 1 31 5655 1 1 4 TYR HD1 H -5.379 -4.531 2.482 1.00 . A A . 3 TYR HD1 1 1 31 5656 1 1 4 TYR HD2 H -5.225 -0.391 3.613 1.00 . A A . 3 TYR HD2 1 1 31 5657 1 1 4 TYR HE1 H -4.590 -5.174 4.743 1.00 . A A . 3 TYR HE1 1 1 31 5658 1 1 4 TYR HE2 H -4.442 -1.034 5.873 1.00 . A A . 3 TYR HE2 1 1 31 5659 1 1 4 TYR HH H -4.511 -2.968 7.352 1.00 . A A . 3 TYR HH 1 1 31 5660 1 1 4 TYR N N -4.058 -3.192 0.423 1.00 . A A . 3 TYR N 1 1 31 5661 1 1 4 TYR O O -3.491 0.182 0.379 1.00 . A A . 3 TYR O 1 1 31 5662 1 1 4 TYR OH O -4.035 -3.504 6.713 1.00 . A A . 3 TYR OH 1 1 31 5663 1 1 5 TRP C C -1.503 0.887 1.594 1.00 . A A . 4 TRP C 1 1 31 5664 1 1 5 TRP CA C -1.957 -0.080 2.684 1.00 . A A . 4 TRP CA 1 1 31 5665 1 1 5 TRP CB C -0.754 -0.923 3.108 1.00 . A A . 4 TRP CB 1 1 31 5666 1 1 5 TRP CD1 C -1.865 -2.789 4.410 1.00 . A A . 4 TRP CD1 1 1 31 5667 1 1 5 TRP CD2 C -0.494 -1.544 5.675 1.00 . A A . 4 TRP CD2 1 1 31 5668 1 1 5 TRP CE2 C -1.030 -2.539 6.520 1.00 . A A . 4 TRP CE2 1 1 31 5669 1 1 5 TRP CE3 C 0.404 -0.620 6.227 1.00 . A A . 4 TRP CE3 1 1 31 5670 1 1 5 TRP CG C -1.043 -1.719 4.340 1.00 . A A . 4 TRP CG 1 1 31 5671 1 1 5 TRP CH2 C 0.210 -1.693 8.403 1.00 . A A . 4 TRP CH2 1 1 31 5672 1 1 5 TRP CZ2 C -0.686 -2.621 7.865 1.00 . A A . 4 TRP CZ2 1 1 31 5673 1 1 5 TRP CZ3 C 0.755 -0.694 7.586 1.00 . A A . 4 TRP CZ3 1 1 31 5674 1 1 5 TRP H H -3.149 -1.884 2.638 1.00 . A A . 4 TRP H 1 1 31 5675 1 1 5 TRP HA H -2.348 0.458 3.532 1.00 . A A . 4 TRP HA 1 1 31 5676 1 1 5 TRP HB2 H -0.496 -1.590 2.311 1.00 . A A . 4 TRP HB2 1 1 31 5677 1 1 5 TRP HB3 H 0.083 -0.267 3.300 1.00 . A A . 4 TRP HB3 1 1 31 5678 1 1 5 TRP HD1 H -2.428 -3.205 3.590 1.00 . A A . 4 TRP HD1 1 1 31 5679 1 1 5 TRP HE1 H -2.366 -4.051 6.017 1.00 . A A . 4 TRP HE1 1 1 31 5680 1 1 5 TRP HE3 H 0.828 0.148 5.601 1.00 . A A . 4 TRP HE3 1 1 31 5681 1 1 5 TRP HH2 H 0.480 -1.747 9.447 1.00 . A A . 4 TRP HH2 1 1 31 5682 1 1 5 TRP HZ2 H -1.109 -3.395 8.485 1.00 . A A . 4 TRP HZ2 1 1 31 5683 1 1 5 TRP HZ3 H 1.448 0.023 8.001 1.00 . A A . 4 TRP HZ3 1 1 31 5684 1 1 5 TRP N N -2.984 -1.057 2.151 1.00 . A A . 4 TRP N 1 1 31 5685 1 1 5 TRP NE1 N -1.852 -3.280 5.701 1.00 . A A . 4 TRP NE1 1 1 31 5686 1 1 5 TRP O O -1.496 2.089 1.769 1.00 . A A . 4 TRP O 1 1 31 5687 1 1 6 LEU C C -1.461 2.502 -0.734 1.00 . A A . 5 LEU C 1 1 31 5688 1 1 6 LEU CA C -0.671 1.182 -0.675 1.00 . A A . 5 LEU CA 1 1 31 5689 1 1 6 LEU CB C -0.964 0.290 -1.895 1.00 . A A . 5 LEU CB 1 1 31 5690 1 1 6 LEU CD1 C 0.171 2.288 -3.004 1.00 . A A . 5 LEU CD1 1 1 31 5691 1 1 6 LEU CD2 C 0.707 -0.048 -3.720 1.00 . A A . 5 LEU CD2 1 1 31 5692 1 1 6 LEU CG C -0.399 0.877 -3.207 1.00 . A A . 5 LEU CG 1 1 31 5693 1 1 6 LEU H H -1.151 -0.627 0.372 1.00 . A A . 5 LEU H 1 1 31 5694 1 1 6 LEU HA H 0.387 1.374 -0.602 1.00 . A A . 5 LEU HA 1 1 31 5695 1 1 6 LEU HB2 H -0.513 -0.677 -1.730 1.00 . A A . 5 LEU HB2 1 1 31 5696 1 1 6 LEU HB3 H -2.032 0.160 -1.994 1.00 . A A . 5 LEU HB3 1 1 31 5697 1 1 6 LEU HD11 H 0.802 2.301 -2.128 1.00 . A A . 5 LEU HD11 1 1 31 5698 1 1 6 LEU HD12 H 0.754 2.567 -3.869 1.00 . A A . 5 LEU HD12 1 1 31 5699 1 1 6 LEU HD13 H -0.640 2.989 -2.874 1.00 . A A . 5 LEU HD13 1 1 31 5700 1 1 6 LEU HD21 H 1.343 -0.339 -2.896 1.00 . A A . 5 LEU HD21 1 1 31 5701 1 1 6 LEU HD22 H 0.264 -0.930 -4.158 1.00 . A A . 5 LEU HD22 1 1 31 5702 1 1 6 LEU HD23 H 1.294 0.469 -4.463 1.00 . A A . 5 LEU HD23 1 1 31 5703 1 1 6 LEU HG H -1.190 0.920 -3.942 1.00 . A A . 5 LEU HG 1 1 31 5704 1 1 6 LEU N N -1.127 0.348 0.470 1.00 . A A . 5 LEU N 1 1 31 5705 1 1 6 LEU O O -0.894 3.567 -0.881 1.00 . A A . 5 LEU O 1 1 31 5706 1 1 7 ALA C C -3.812 4.301 0.706 1.00 . A A . 6 ALA C 1 1 31 5707 1 1 7 ALA CA C -3.585 3.691 -0.690 1.00 . A A . 6 ALA CA 1 1 31 5708 1 1 7 ALA CB C -4.919 3.254 -1.297 1.00 . A A . 6 ALA CB 1 1 31 5709 1 1 7 ALA H H -3.204 1.572 -0.516 1.00 . A A . 6 ALA H 1 1 31 5710 1 1 7 ALA HA H -3.115 4.413 -1.339 1.00 . A A . 6 ALA HA 1 1 31 5711 1 1 7 ALA HB1 H -4.862 2.211 -1.576 1.00 . A A . 6 ALA HB1 1 1 31 5712 1 1 7 ALA HB2 H -5.706 3.389 -0.570 1.00 . A A . 6 ALA HB2 1 1 31 5713 1 1 7 ALA HB3 H -5.130 3.850 -2.172 1.00 . A A . 6 ALA HB3 1 1 31 5714 1 1 7 ALA N N -2.764 2.440 -0.629 1.00 . A A . 6 ALA N 1 1 31 5715 1 1 7 ALA O O -4.750 5.045 0.911 1.00 . A A . 6 ALA O 1 1 31 5716 1 1 8 HIS C C -1.852 5.108 3.576 1.00 . A A . 7 HIS C 1 1 31 5717 1 1 8 HIS CA C -3.183 4.579 3.033 1.00 . A A . 7 HIS CA 1 1 31 5718 1 1 8 HIS CB C -3.702 3.433 3.923 1.00 . A A . 7 HIS CB 1 1 31 5719 1 1 8 HIS CD2 C -4.455 1.875 1.958 1.00 . A A . 7 HIS CD2 1 1 31 5720 1 1 8 HIS CE1 C -6.434 1.363 2.661 1.00 . A A . 7 HIS CE1 1 1 31 5721 1 1 8 HIS CG C -4.624 2.532 3.142 1.00 . A A . 7 HIS CG 1 1 31 5722 1 1 8 HIS H H -2.226 3.397 1.495 1.00 . A A . 7 HIS H 1 1 31 5723 1 1 8 HIS HA H -3.912 5.374 2.996 1.00 . A A . 7 HIS HA 1 1 31 5724 1 1 8 HIS HB2 H -2.865 2.857 4.285 1.00 . A A . 7 HIS HB2 1 1 31 5725 1 1 8 HIS HB3 H -4.237 3.848 4.765 1.00 . A A . 7 HIS HB3 1 1 31 5726 1 1 8 HIS HD1 H -6.332 2.505 4.404 1.00 . A A . 7 HIS HD1 1 1 31 5727 1 1 8 HIS HD2 H -3.569 1.923 1.352 1.00 . A A . 7 HIS HD2 1 1 31 5728 1 1 8 HIS HE1 H -7.415 0.923 2.731 1.00 . A A . 7 HIS HE1 1 1 31 5729 1 1 8 HIS HE2 H -5.742 0.577 0.869 1.00 . A A . 7 HIS HE2 1 1 31 5730 1 1 8 HIS N N -2.979 3.999 1.667 1.00 . A A . 7 HIS N 1 1 31 5731 1 1 8 HIS ND1 N -5.900 2.196 3.580 1.00 . A A . 7 HIS ND1 1 1 31 5732 1 1 8 HIS NE2 N -5.591 1.140 1.656 1.00 . A A . 7 HIS NE2 1 1 31 5733 1 1 8 HIS O O -1.749 6.240 4.001 1.00 . A A . 7 HIS O 1 1 31 5734 1 1 9 LYS C C 0.939 6.018 3.365 1.00 . A A . 8 LYS C 1 1 31 5735 1 1 9 LYS CA C 0.492 4.739 4.080 1.00 . A A . 8 LYS CA 1 1 31 5736 1 1 9 LYS CB C 1.450 3.587 3.766 1.00 . A A . 8 LYS CB 1 1 31 5737 1 1 9 LYS CD C 2.319 2.082 1.971 1.00 . A A . 8 LYS CD 1 1 31 5738 1 1 9 LYS CE C 3.626 2.590 1.359 1.00 . A A . 8 LYS CE 1 1 31 5739 1 1 9 LYS CG C 1.402 3.270 2.270 1.00 . A A . 8 LYS CG 1 1 31 5740 1 1 9 LYS H H -0.941 3.380 3.221 1.00 . A A . 8 LYS H 1 1 31 5741 1 1 9 LYS HA H 0.448 4.900 5.146 1.00 . A A . 8 LYS HA 1 1 31 5742 1 1 9 LYS HB2 H 2.454 3.871 4.043 1.00 . A A . 8 LYS HB2 1 1 31 5743 1 1 9 LYS HB3 H 1.155 2.713 4.327 1.00 . A A . 8 LYS HB3 1 1 31 5744 1 1 9 LYS HD2 H 2.530 1.551 2.887 1.00 . A A . 8 LYS HD2 1 1 31 5745 1 1 9 LYS HD3 H 1.831 1.417 1.274 1.00 . A A . 8 LYS HD3 1 1 31 5746 1 1 9 LYS HE2 H 3.474 3.559 0.904 1.00 . A A . 8 LYS HE2 1 1 31 5747 1 1 9 LYS HE3 H 4.397 2.643 2.112 1.00 . A A . 8 LYS HE3 1 1 31 5748 1 1 9 LYS HG2 H 0.389 3.024 1.984 1.00 . A A . 8 LYS HG2 1 1 31 5749 1 1 9 LYS HG3 H 1.735 4.129 1.708 1.00 . A A . 8 LYS HG3 1 1 31 5750 1 1 9 LYS HZ1 H 3.136 1.086 0.001 1.00 . A A . 8 LYS HZ1 1 1 31 5751 1 1 9 LYS HZ2 H 4.443 2.060 -0.481 1.00 . A A . 8 LYS HZ2 1 1 31 5752 1 1 9 LYS HZ3 H 4.653 0.890 0.734 1.00 . A A . 8 LYS HZ3 1 1 31 5753 1 1 9 LYS N N -0.833 4.291 3.566 1.00 . A A . 8 LYS N 1 1 31 5754 1 1 9 LYS NZ N 3.992 1.580 0.325 1.00 . A A . 8 LYS NZ 1 1 31 5755 1 1 9 LYS O O 0.150 6.703 2.743 1.00 . A A . 8 LYS O 1 1 31 5756 1 1 10 ALA C C 2.081 7.712 1.382 1.00 . A A . 9 ALA C 1 1 31 5757 1 1 10 ALA CA C 2.699 7.579 2.776 1.00 . A A . 9 ALA CA 1 1 31 5758 1 1 10 ALA CB C 4.213 7.392 2.675 1.00 . A A . 9 ALA CB 1 1 31 5759 1 1 10 ALA H H 2.818 5.778 3.954 1.00 . A A . 9 ALA H 1 1 31 5760 1 1 10 ALA HA H 2.475 8.449 3.372 1.00 . A A . 9 ALA HA 1 1 31 5761 1 1 10 ALA HB1 H 4.447 6.338 2.693 1.00 . A A . 9 ALA HB1 1 1 31 5762 1 1 10 ALA HB2 H 4.569 7.824 1.752 1.00 . A A . 9 ALA HB2 1 1 31 5763 1 1 10 ALA HB3 H 4.693 7.881 3.510 1.00 . A A . 9 ALA HB3 1 1 31 5764 1 1 10 ALA N N 2.200 6.344 3.448 1.00 . A A . 9 ALA N 1 1 31 5765 1 1 10 ALA O O 1.253 8.567 1.140 1.00 . A A . 9 ALA O 1 1 31 5766 1 1 11 LEU C C 2.136 8.344 -1.504 1.00 . A A . 10 LEU C 1 1 31 5767 1 1 11 LEU CA C 1.910 6.949 -0.913 1.00 . A A . 10 LEU CA 1 1 31 5768 1 1 11 LEU CB C 0.415 6.669 -0.741 1.00 . A A . 10 LEU CB 1 1 31 5769 1 1 11 LEU CD1 C -0.305 5.427 -2.785 1.00 . A A . 10 LEU CD1 1 1 31 5770 1 1 11 LEU CD2 C -1.721 7.276 -1.881 1.00 . A A . 10 LEU CD2 1 1 31 5771 1 1 11 LEU CG C -0.285 6.793 -2.095 1.00 . A A . 10 LEU CG 1 1 31 5772 1 1 11 LEU H H 3.145 6.189 0.683 1.00 . A A . 10 LEU H 1 1 31 5773 1 1 11 LEU HA H 2.355 6.195 -1.544 1.00 . A A . 10 LEU HA 1 1 31 5774 1 1 11 LEU HB2 H 0.279 5.670 -0.355 1.00 . A A . 10 LEU HB2 1 1 31 5775 1 1 11 LEU HB3 H -0.008 7.383 -0.053 1.00 . A A . 10 LEU HB3 1 1 31 5776 1 1 11 LEU HD11 H 0.271 4.722 -2.205 1.00 . A A . 10 LEU HD11 1 1 31 5777 1 1 11 LEU HD12 H -1.325 5.080 -2.864 1.00 . A A . 10 LEU HD12 1 1 31 5778 1 1 11 LEU HD13 H 0.122 5.516 -3.772 1.00 . A A . 10 LEU HD13 1 1 31 5779 1 1 11 LEU HD21 H -1.982 7.177 -0.838 1.00 . A A . 10 LEU HD21 1 1 31 5780 1 1 11 LEU HD22 H -1.800 8.312 -2.174 1.00 . A A . 10 LEU HD22 1 1 31 5781 1 1 11 LEU HD23 H -2.394 6.680 -2.479 1.00 . A A . 10 LEU HD23 1 1 31 5782 1 1 11 LEU HG H 0.247 7.501 -2.713 1.00 . A A . 10 LEU HG 1 1 31 5783 1 1 11 LEU N N 2.476 6.872 0.465 1.00 . A A . 10 LEU N 1 1 31 5784 1 1 11 LEU O O 3.070 8.568 -2.248 1.00 . A A . 10 LEU O 1 1 31 5785 1 1 12 ALA C C 2.743 11.295 -1.170 1.00 . A A . 11 ALA C 1 1 31 5786 1 1 12 ALA CA C 1.462 10.662 -1.723 1.00 . A A . 11 ALA CA 1 1 31 5787 1 1 12 ALA CB C 0.232 11.433 -1.242 1.00 . A A . 11 ALA CB 1 1 31 5788 1 1 12 ALA H H 0.544 9.084 -0.576 1.00 . A A . 11 ALA H 1 1 31 5789 1 1 12 ALA HA H 1.486 10.641 -2.800 1.00 . A A . 11 ALA HA 1 1 31 5790 1 1 12 ALA HB1 H -0.511 10.737 -0.880 1.00 . A A . 11 ALA HB1 1 1 31 5791 1 1 12 ALA HB2 H 0.516 12.104 -0.445 1.00 . A A . 11 ALA HB2 1 1 31 5792 1 1 12 ALA HB3 H -0.179 12.003 -2.063 1.00 . A A . 11 ALA HB3 1 1 31 5793 1 1 12 ALA N N 1.291 9.284 -1.178 1.00 . A A . 11 ALA N 1 1 31 5794 1 1 12 ALA O O 2.881 11.480 0.023 1.00 . A A . 11 ALA O 1 1 31 5795 1 1 13 NH2 HN1 H 3.584 11.488 -2.957 1.00 . A A . 12 NH2 HN1 1 1 31 5796 1 1 13 NH2 HN2 H 4.517 12.042 -1.652 1.00 . A A . 12 NH2 HN2 1 1 31 5797 1 1 13 NH2 N N 3.693 11.637 -1.995 1.00 . A A . 12 NH2 N 1 1 32 5798 1 1 2 ILE C C -1.983 -5.013 1.586 1.00 . A A . 1 ILE C 1 1 32 5799 1 1 2 ILE CA C -0.855 -5.251 2.592 1.00 . A A . 1 ILE CA 1 1 32 5800 1 1 2 ILE CB C 0.481 -4.656 2.110 1.00 . A A . 1 ILE CB 1 1 32 5801 1 1 2 ILE CD1 C 1.773 -5.331 4.140 1.00 . A A . 1 ILE CD1 1 1 32 5802 1 1 2 ILE CG1 C 1.257 -4.144 3.325 1.00 . A A . 1 ILE CG1 1 1 32 5803 1 1 2 ILE CG2 C 0.252 -3.487 1.134 1.00 . A A . 1 ILE CG2 1 1 32 5804 1 1 2 ILE H H 0.309 -7.061 2.712 1.00 . A A . 1 ILE H 1 1 32 5805 1 1 2 ILE HA H -1.112 -4.835 3.546 1.00 . A A . 1 ILE HA 1 1 32 5806 1 1 2 ILE HB H 1.055 -5.425 1.618 1.00 . A A . 1 ILE HB 1 1 32 5807 1 1 2 ILE HD11 H 0.950 -5.991 4.377 1.00 . A A . 1 ILE HD11 1 1 32 5808 1 1 2 ILE HD12 H 2.511 -5.870 3.564 1.00 . A A . 1 ILE HD12 1 1 32 5809 1 1 2 ILE HD13 H 2.221 -4.973 5.054 1.00 . A A . 1 ILE HD13 1 1 32 5810 1 1 2 ILE HG12 H 2.089 -3.544 2.992 1.00 . A A . 1 ILE HG12 1 1 32 5811 1 1 2 ILE HG13 H 0.602 -3.545 3.943 1.00 . A A . 1 ILE HG13 1 1 32 5812 1 1 2 ILE HG21 H -0.761 -3.123 1.232 1.00 . A A . 1 ILE HG21 1 1 32 5813 1 1 2 ILE HG22 H 0.941 -2.688 1.361 1.00 . A A . 1 ILE HG22 1 1 32 5814 1 1 2 ILE HG23 H 0.413 -3.825 0.121 1.00 . A A . 1 ILE HG23 1 1 32 5815 1 1 2 ILE N N -0.607 -6.712 2.722 1.00 . A A . 1 ILE N 1 1 32 5816 1 1 2 ILE O O -3.114 -4.767 1.953 1.00 . A A . 1 ILE O 1 1 32 5817 1 1 3 ASP C C -3.278 -3.447 -0.608 1.00 . A A . 2 ASP C 1 1 32 5818 1 1 3 ASP CA C -2.700 -4.856 -0.728 1.00 . A A . 2 ASP CA 1 1 32 5819 1 1 3 ASP CB C -3.778 -5.910 -0.469 1.00 . A A . 2 ASP CB 1 1 32 5820 1 1 3 ASP CG C -3.137 -7.299 -0.425 1.00 . A A . 2 ASP CG 1 1 32 5821 1 1 3 ASP H H -0.748 -5.283 0.068 1.00 . A A . 2 ASP H 1 1 32 5822 1 1 3 ASP HA H -2.275 -4.998 -1.707 1.00 . A A . 2 ASP HA 1 1 32 5823 1 1 3 ASP HB2 H -4.263 -5.705 0.474 1.00 . A A . 2 ASP HB2 1 1 32 5824 1 1 3 ASP HB3 H -4.509 -5.879 -1.263 1.00 . A A . 2 ASP HB3 1 1 32 5825 1 1 3 ASP N N -1.670 -5.084 0.323 1.00 . A A . 2 ASP N 1 1 32 5826 1 1 3 ASP O O -3.037 -2.595 -1.441 1.00 . A A . 2 ASP O 1 1 32 5827 1 1 3 ASP OD1 O -2.156 -7.457 0.283 1.00 . A A . 2 ASP OD1 1 1 32 5828 1 1 3 ASP OD2 O -3.639 -8.182 -1.100 1.00 . A A . 2 ASP OD2 1 1 32 5829 1 1 4 TYR C C -3.600 -0.818 1.053 1.00 . A A . 3 TYR C 1 1 32 5830 1 1 4 TYR CA C -4.639 -1.839 0.565 1.00 . A A . 3 TYR CA 1 1 32 5831 1 1 4 TYR CB C -5.806 -2.001 1.552 1.00 . A A . 3 TYR CB 1 1 32 5832 1 1 4 TYR CD1 C -5.131 -3.775 3.212 1.00 . A A . 3 TYR CD1 1 1 32 5833 1 1 4 TYR CD2 C -5.048 -1.448 3.888 1.00 . A A . 3 TYR CD2 1 1 32 5834 1 1 4 TYR CE1 C -4.684 -4.157 4.481 1.00 . A A . 3 TYR CE1 1 1 32 5835 1 1 4 TYR CE2 C -4.603 -1.830 5.155 1.00 . A A . 3 TYR CE2 1 1 32 5836 1 1 4 TYR CG C -5.312 -2.420 2.915 1.00 . A A . 3 TYR CG 1 1 32 5837 1 1 4 TYR CZ C -4.420 -3.184 5.451 1.00 . A A . 3 TYR CZ 1 1 32 5838 1 1 4 TYR H H -4.231 -3.896 1.067 1.00 . A A . 3 TYR H 1 1 32 5839 1 1 4 TYR HA H -5.026 -1.514 -0.382 1.00 . A A . 3 TYR HA 1 1 32 5840 1 1 4 TYR HB2 H -6.330 -1.062 1.640 1.00 . A A . 3 TYR HB2 1 1 32 5841 1 1 4 TYR HB3 H -6.487 -2.751 1.175 1.00 . A A . 3 TYR HB3 1 1 32 5842 1 1 4 TYR HD1 H -5.334 -4.525 2.461 1.00 . A A . 3 TYR HD1 1 1 32 5843 1 1 4 TYR HD2 H -5.187 -0.404 3.658 1.00 . A A . 3 TYR HD2 1 1 32 5844 1 1 4 TYR HE1 H -4.542 -5.203 4.711 1.00 . A A . 3 TYR HE1 1 1 32 5845 1 1 4 TYR HE2 H -4.400 -1.081 5.906 1.00 . A A . 3 TYR HE2 1 1 32 5846 1 1 4 TYR HH H -4.730 -3.929 7.181 1.00 . A A . 3 TYR HH 1 1 32 5847 1 1 4 TYR N N -4.044 -3.195 0.412 1.00 . A A . 3 TYR N 1 1 32 5848 1 1 4 TYR O O -3.406 0.185 0.405 1.00 . A A . 3 TYR O 1 1 32 5849 1 1 4 TYR OH O -3.983 -3.562 6.705 1.00 . A A . 3 TYR OH 1 1 32 5850 1 1 5 TRP C C -1.468 0.916 1.687 1.00 . A A . 4 TRP C 1 1 32 5851 1 1 5 TRP CA C -1.906 -0.120 2.726 1.00 . A A . 4 TRP CA 1 1 32 5852 1 1 5 TRP CB C -0.703 -0.993 3.089 1.00 . A A . 4 TRP CB 1 1 32 5853 1 1 5 TRP CD1 C -1.825 -2.870 4.370 1.00 . A A . 4 TRP CD1 1 1 32 5854 1 1 5 TRP CD2 C -0.408 -1.681 5.638 1.00 . A A . 4 TRP CD2 1 1 32 5855 1 1 5 TRP CE2 C -0.951 -2.683 6.472 1.00 . A A . 4 TRP CE2 1 1 32 5856 1 1 5 TRP CE3 C 0.519 -0.790 6.193 1.00 . A A . 4 TRP CE3 1 1 32 5857 1 1 5 TRP CG C -0.982 -1.816 4.309 1.00 . A A . 4 TRP CG 1 1 32 5858 1 1 5 TRP CH2 C 0.340 -1.902 8.351 1.00 . A A . 4 TRP CH2 1 1 32 5859 1 1 5 TRP CZ2 C -0.585 -2.799 7.811 1.00 . A A . 4 TRP CZ2 1 1 32 5860 1 1 5 TRP CZ3 C 0.893 -0.898 7.542 1.00 . A A . 4 TRP CZ3 1 1 32 5861 1 1 5 TRP H H -3.127 -1.896 2.651 1.00 . A A . 4 TRP H 1 1 32 5862 1 1 5 TRP HA H -2.280 0.369 3.611 1.00 . A A . 4 TRP HA 1 1 32 5863 1 1 5 TRP HB2 H -0.482 -1.644 2.266 1.00 . A A . 4 TRP HB2 1 1 32 5864 1 1 5 TRP HB3 H 0.150 -0.359 3.277 1.00 . A A . 4 TRP HB3 1 1 32 5865 1 1 5 TRP HD1 H -2.409 -3.257 3.552 1.00 . A A . 4 TRP HD1 1 1 32 5866 1 1 5 TRP HE1 H -2.329 -4.155 5.961 1.00 . A A . 4 TRP HE1 1 1 32 5867 1 1 5 TRP HE3 H 0.949 -0.020 5.575 1.00 . A A . 4 TRP HE3 1 1 32 5868 1 1 5 TRP HH2 H 0.628 -1.982 9.387 1.00 . A A . 4 TRP HH2 1 1 32 5869 1 1 5 TRP HZ2 H -1.015 -3.575 8.426 1.00 . A A . 4 TRP HZ2 1 1 32 5870 1 1 5 TRP HZ3 H 1.608 -0.205 7.959 1.00 . A A . 4 TRP HZ3 1 1 32 5871 1 1 5 TRP N N -2.941 -1.072 2.171 1.00 . A A . 4 TRP N 1 1 32 5872 1 1 5 TRP NE1 N -1.802 -3.387 5.652 1.00 . A A . 4 TRP NE1 1 1 32 5873 1 1 5 TRP O O -1.532 2.109 1.910 1.00 . A A . 4 TRP O 1 1 32 5874 1 1 6 LEU C C -1.435 2.631 -0.597 1.00 . A A . 5 LEU C 1 1 32 5875 1 1 6 LEU CA C -0.559 1.368 -0.523 1.00 . A A . 5 LEU CA 1 1 32 5876 1 1 6 LEU CB C -0.696 0.516 -1.792 1.00 . A A . 5 LEU CB 1 1 32 5877 1 1 6 LEU CD1 C 0.438 2.153 -3.301 1.00 . A A . 5 LEU CD1 1 1 32 5878 1 1 6 LEU CD2 C -1.214 0.516 -4.224 1.00 . A A . 5 LEU CD2 1 1 32 5879 1 1 6 LEU CG C -0.866 1.402 -3.026 1.00 . A A . 5 LEU CG 1 1 32 5880 1 1 6 LEU H H -0.976 -0.518 0.418 1.00 . A A . 5 LEU H 1 1 32 5881 1 1 6 LEU HA H 0.475 1.636 -0.376 1.00 . A A . 5 LEU HA 1 1 32 5882 1 1 6 LEU HB2 H 0.189 -0.091 -1.910 1.00 . A A . 5 LEU HB2 1 1 32 5883 1 1 6 LEU HB3 H -1.559 -0.126 -1.695 1.00 . A A . 5 LEU HB3 1 1 32 5884 1 1 6 LEU HD11 H 0.970 2.302 -2.373 1.00 . A A . 5 LEU HD11 1 1 32 5885 1 1 6 LEU HD12 H 1.051 1.574 -3.977 1.00 . A A . 5 LEU HD12 1 1 32 5886 1 1 6 LEU HD13 H 0.215 3.110 -3.747 1.00 . A A . 5 LEU HD13 1 1 32 5887 1 1 6 LEU HD21 H -0.498 -0.290 -4.296 1.00 . A A . 5 LEU HD21 1 1 32 5888 1 1 6 LEU HD22 H -2.205 0.104 -4.091 1.00 . A A . 5 LEU HD22 1 1 32 5889 1 1 6 LEU HD23 H -1.187 1.104 -5.129 1.00 . A A . 5 LEU HD23 1 1 32 5890 1 1 6 LEU HG H -1.663 2.112 -2.857 1.00 . A A . 5 LEU HG 1 1 32 5891 1 1 6 LEU N N -1.017 0.452 0.558 1.00 . A A . 5 LEU N 1 1 32 5892 1 1 6 LEU O O -0.936 3.731 -0.732 1.00 . A A . 5 LEU O 1 1 32 5893 1 1 7 ALA C C -3.912 4.280 0.767 1.00 . A A . 6 ALA C 1 1 32 5894 1 1 7 ALA CA C -3.622 3.683 -0.618 1.00 . A A . 6 ALA CA 1 1 32 5895 1 1 7 ALA CB C -4.911 3.163 -1.252 1.00 . A A . 6 ALA CB 1 1 32 5896 1 1 7 ALA H H -3.118 1.590 -0.435 1.00 . A A . 6 ALA H 1 1 32 5897 1 1 7 ALA HA H -3.180 4.429 -1.259 1.00 . A A . 6 ALA HA 1 1 32 5898 1 1 7 ALA HB1 H -4.879 2.084 -1.302 1.00 . A A . 6 ALA HB1 1 1 32 5899 1 1 7 ALA HB2 H -5.756 3.470 -0.654 1.00 . A A . 6 ALA HB2 1 1 32 5900 1 1 7 ALA HB3 H -5.011 3.566 -2.249 1.00 . A A . 6 ALA HB3 1 1 32 5901 1 1 7 ALA N N -2.730 2.485 -0.529 1.00 . A A . 6 ALA N 1 1 32 5902 1 1 7 ALA O O -4.913 4.942 0.963 1.00 . A A . 6 ALA O 1 1 32 5903 1 1 8 HIS C C -2.029 5.277 3.631 1.00 . A A . 7 HIS C 1 1 32 5904 1 1 8 HIS CA C -3.311 4.630 3.091 1.00 . A A . 7 HIS CA 1 1 32 5905 1 1 8 HIS CB C -3.737 3.441 3.972 1.00 . A A . 7 HIS CB 1 1 32 5906 1 1 8 HIS CD2 C -4.443 1.849 2.016 1.00 . A A . 7 HIS CD2 1 1 32 5907 1 1 8 HIS CE1 C -6.422 1.318 2.703 1.00 . A A . 7 HIS CE1 1 1 32 5908 1 1 8 HIS CG C -4.634 2.513 3.195 1.00 . A A . 7 HIS CG 1 1 32 5909 1 1 8 HIS H H -2.253 3.527 1.563 1.00 . A A . 7 HIS H 1 1 32 5910 1 1 8 HIS HA H -4.107 5.358 3.047 1.00 . A A . 7 HIS HA 1 1 32 5911 1 1 8 HIS HB2 H -2.859 2.903 4.294 1.00 . A A . 7 HIS HB2 1 1 32 5912 1 1 8 HIS HB3 H -4.268 3.809 4.838 1.00 . A A . 7 HIS HB3 1 1 32 5913 1 1 8 HIS HD1 H -6.351 2.470 4.440 1.00 . A A . 7 HIS HD1 1 1 32 5914 1 1 8 HIS HD2 H -3.554 1.912 1.415 1.00 . A A . 7 HIS HD2 1 1 32 5915 1 1 8 HIS HE1 H -7.400 0.866 2.768 1.00 . A A . 7 HIS HE1 1 1 32 5916 1 1 8 HIS HE2 H -5.705 0.533 0.921 1.00 . A A . 7 HIS HE2 1 1 32 5917 1 1 8 HIS N N -3.057 4.061 1.730 1.00 . A A . 7 HIS N 1 1 32 5918 1 1 8 HIS ND1 N -5.908 2.161 3.623 1.00 . A A . 7 HIS ND1 1 1 32 5919 1 1 8 HIS NE2 N -5.567 1.099 1.708 1.00 . A A . 7 HIS NE2 1 1 32 5920 1 1 8 HIS O O -1.347 5.991 2.925 1.00 . A A . 7 HIS O 1 1 32 5921 1 1 9 LYS C C -0.580 7.167 5.468 1.00 . A A . 8 LYS C 1 1 32 5922 1 1 9 LYS CA C -0.462 5.642 5.443 1.00 . A A . 8 LYS CA 1 1 32 5923 1 1 9 LYS CB C 0.671 5.210 4.511 1.00 . A A . 8 LYS CB 1 1 32 5924 1 1 9 LYS CD C 1.507 3.365 3.055 1.00 . A A . 8 LYS CD 1 1 32 5925 1 1 9 LYS CE C 1.873 1.883 3.143 1.00 . A A . 8 LYS CE 1 1 32 5926 1 1 9 LYS CG C 0.531 3.723 4.177 1.00 . A A . 8 LYS CG 1 1 32 5927 1 1 9 LYS H H -2.256 4.462 5.429 1.00 . A A . 8 LYS H 1 1 32 5928 1 1 9 LYS HA H -0.285 5.262 6.437 1.00 . A A . 8 LYS HA 1 1 32 5929 1 1 9 LYS HB2 H 0.627 5.789 3.600 1.00 . A A . 8 LYS HB2 1 1 32 5930 1 1 9 LYS HB3 H 1.619 5.379 4.997 1.00 . A A . 8 LYS HB3 1 1 32 5931 1 1 9 LYS HD2 H 1.044 3.565 2.099 1.00 . A A . 8 LYS HD2 1 1 32 5932 1 1 9 LYS HD3 H 2.402 3.961 3.153 1.00 . A A . 8 LYS HD3 1 1 32 5933 1 1 9 LYS HE2 H 1.808 1.541 4.168 1.00 . A A . 8 LYS HE2 1 1 32 5934 1 1 9 LYS HE3 H 1.228 1.296 2.507 1.00 . A A . 8 LYS HE3 1 1 32 5935 1 1 9 LYS HG2 H 0.758 3.134 5.054 1.00 . A A . 8 LYS HG2 1 1 32 5936 1 1 9 LYS HG3 H -0.478 3.517 3.854 1.00 . A A . 8 LYS HG3 1 1 32 5937 1 1 9 LYS HZ1 H 3.330 2.183 1.687 1.00 . A A . 8 LYS HZ1 1 1 32 5938 1 1 9 LYS HZ2 H 3.893 2.369 3.275 1.00 . A A . 8 LYS HZ2 1 1 32 5939 1 1 9 LYS HZ3 H 3.593 0.815 2.659 1.00 . A A . 8 LYS HZ3 1 1 32 5940 1 1 9 LYS N N -1.697 5.037 4.872 1.00 . A A . 8 LYS N 1 1 32 5941 1 1 9 LYS NZ N 3.278 1.807 2.654 1.00 . A A . 8 LYS NZ 1 1 32 5942 1 1 9 LYS O O -1.560 7.734 5.030 1.00 . A A . 8 LYS O 1 1 32 5943 1 1 10 ALA C C 0.267 9.896 4.625 1.00 . A A . 9 ALA C 1 1 32 5944 1 1 10 ALA CA C 0.384 9.318 6.036 1.00 . A A . 9 ALA CA 1 1 32 5945 1 1 10 ALA CB C 1.714 9.724 6.672 1.00 . A A . 9 ALA CB 1 1 32 5946 1 1 10 ALA H H 1.194 7.344 6.320 1.00 . A A . 9 ALA H 1 1 32 5947 1 1 10 ALA HA H -0.436 9.654 6.652 1.00 . A A . 9 ALA HA 1 1 32 5948 1 1 10 ALA HB1 H 1.961 9.031 7.463 1.00 . A A . 9 ALA HB1 1 1 32 5949 1 1 10 ALA HB2 H 2.491 9.705 5.922 1.00 . A A . 9 ALA HB2 1 1 32 5950 1 1 10 ALA HB3 H 1.631 10.720 7.079 1.00 . A A . 9 ALA HB3 1 1 32 5951 1 1 10 ALA N N 0.419 7.829 5.977 1.00 . A A . 9 ALA N 1 1 32 5952 1 1 10 ALA O O 1.230 10.369 4.054 1.00 . A A . 9 ALA O 1 1 32 5953 1 1 11 LEU C C -2.192 11.455 2.671 1.00 . A A . 10 LEU C 1 1 32 5954 1 1 11 LEU CA C -1.085 10.397 2.681 1.00 . A A . 10 LEU CA 1 1 32 5955 1 1 11 LEU CB C -1.486 9.185 1.840 1.00 . A A . 10 LEU CB 1 1 32 5956 1 1 11 LEU CD1 C -0.772 10.322 -0.269 1.00 . A A . 10 LEU CD1 1 1 32 5957 1 1 11 LEU CD2 C 0.882 9.008 1.063 1.00 . A A . 10 LEU CD2 1 1 32 5958 1 1 11 LEU CG C -0.578 9.087 0.612 1.00 . A A . 10 LEU CG 1 1 32 5959 1 1 11 LEU H H -1.667 9.467 4.534 1.00 . A A . 10 LEU H 1 1 32 5960 1 1 11 LEU HA H -0.159 10.812 2.314 1.00 . A A . 10 LEU HA 1 1 32 5961 1 1 11 LEU HB2 H -1.383 8.287 2.435 1.00 . A A . 10 LEU HB2 1 1 32 5962 1 1 11 LEU HB3 H -2.510 9.290 1.522 1.00 . A A . 10 LEU HB3 1 1 32 5963 1 1 11 LEU HD11 H -1.810 10.622 -0.246 1.00 . A A . 10 LEU HD11 1 1 32 5964 1 1 11 LEU HD12 H -0.156 11.129 0.101 1.00 . A A . 10 LEU HD12 1 1 32 5965 1 1 11 LEU HD13 H -0.487 10.088 -1.285 1.00 . A A . 10 LEU HD13 1 1 32 5966 1 1 11 LEU HD21 H 0.927 9.015 2.142 1.00 . A A . 10 LEU HD21 1 1 32 5967 1 1 11 LEU HD22 H 1.325 8.097 0.690 1.00 . A A . 10 LEU HD22 1 1 32 5968 1 1 11 LEU HD23 H 1.426 9.857 0.676 1.00 . A A . 10 LEU HD23 1 1 32 5969 1 1 11 LEU HG H -0.831 8.201 0.048 1.00 . A A . 10 LEU HG 1 1 32 5970 1 1 11 LEU N N -0.904 9.856 4.057 1.00 . A A . 10 LEU N 1 1 32 5971 1 1 11 LEU O O -1.955 12.612 2.382 1.00 . A A . 10 LEU O 1 1 32 5972 1 1 12 ALA C C -4.711 12.666 1.614 1.00 . A A . 11 ALA C 1 1 32 5973 1 1 12 ALA CA C -4.519 12.053 3.004 1.00 . A A . 11 ALA CA 1 1 32 5974 1 1 12 ALA CB C -4.091 13.126 4.005 1.00 . A A . 11 ALA CB 1 1 32 5975 1 1 12 ALA H H -3.565 10.132 3.222 1.00 . A A . 11 ALA H 1 1 32 5976 1 1 12 ALA HA H -5.430 11.582 3.337 1.00 . A A . 11 ALA HA 1 1 32 5977 1 1 12 ALA HB1 H -3.149 12.845 4.452 1.00 . A A . 11 ALA HB1 1 1 32 5978 1 1 12 ALA HB2 H -3.979 14.071 3.494 1.00 . A A . 11 ALA HB2 1 1 32 5979 1 1 12 ALA HB3 H -4.841 13.219 4.775 1.00 . A A . 11 ALA HB3 1 1 32 5980 1 1 12 ALA N N -3.398 11.069 2.990 1.00 . A A . 11 ALA N 1 1 32 5981 1 1 12 ALA O O -3.758 13.043 0.962 1.00 . A A . 11 ALA O 1 1 32 5982 1 1 13 NH2 HN1 H -6.688 12.480 1.655 1.00 . A A . 12 NH2 HN1 1 1 32 5983 1 1 13 NH2 HN2 H -6.055 13.179 0.244 1.00 . A A . 12 NH2 HN2 1 1 32 5984 1 1 13 NH2 N N -5.918 12.784 1.130 1.00 . A A . 12 NH2 N 1 1 33 5985 1 1 2 ILE C C -2.032 -4.937 1.634 1.00 . A A . 1 ILE C 1 1 33 5986 1 1 2 ILE CA C -0.861 -5.199 2.581 1.00 . A A . 1 ILE CA 1 1 33 5987 1 1 2 ILE CB C 0.469 -4.702 1.993 1.00 . A A . 1 ILE CB 1 1 33 5988 1 1 2 ILE CD1 C 1.876 -5.467 3.913 1.00 . A A . 1 ILE CD1 1 1 33 5989 1 1 2 ILE CG1 C 1.375 -4.246 3.139 1.00 . A A . 1 ILE CG1 1 1 33 5990 1 1 2 ILE CG2 C 0.245 -3.519 1.036 1.00 . A A . 1 ILE CG2 1 1 33 5991 1 1 2 ILE H H 0.206 -7.066 2.716 1.00 . A A . 1 ILE H 1 1 33 5992 1 1 2 ILE HA H -1.034 -4.727 3.528 1.00 . A A . 1 ILE HA 1 1 33 5993 1 1 2 ILE HB H 0.944 -5.509 1.461 1.00 . A A . 1 ILE HB 1 1 33 5994 1 1 2 ILE HD11 H 2.235 -6.210 3.219 1.00 . A A . 1 ILE HD11 1 1 33 5995 1 1 2 ILE HD12 H 2.678 -5.169 4.572 1.00 . A A . 1 ILE HD12 1 1 33 5996 1 1 2 ILE HD13 H 1.065 -5.879 4.496 1.00 . A A . 1 ILE HD13 1 1 33 5997 1 1 2 ILE HG12 H 2.218 -3.703 2.735 1.00 . A A . 1 ILE HG12 1 1 33 5998 1 1 2 ILE HG13 H 0.817 -3.605 3.805 1.00 . A A . 1 ILE HG13 1 1 33 5999 1 1 2 ILE HG21 H -0.742 -3.106 1.192 1.00 . A A . 1 ILE HG21 1 1 33 6000 1 1 2 ILE HG22 H 0.984 -2.756 1.224 1.00 . A A . 1 ILE HG22 1 1 33 6001 1 1 2 ILE HG23 H 0.331 -3.859 0.014 1.00 . A A . 1 ILE HG23 1 1 33 6002 1 1 2 ILE N N -0.687 -6.664 2.768 1.00 . A A . 1 ILE N 1 1 33 6003 1 1 2 ILE O O -3.133 -4.648 2.058 1.00 . A A . 1 ILE O 1 1 33 6004 1 1 3 ASP C C -3.375 -3.336 -0.504 1.00 . A A . 2 ASP C 1 1 33 6005 1 1 3 ASP CA C -2.873 -4.774 -0.634 1.00 . A A . 2 ASP CA 1 1 33 6006 1 1 3 ASP CB C -3.982 -5.767 -0.285 1.00 . A A . 2 ASP CB 1 1 33 6007 1 1 3 ASP CG C -5.031 -5.773 -1.399 1.00 . A A . 2 ASP CG 1 1 33 6008 1 1 3 ASP H H -0.895 -5.262 0.052 1.00 . A A . 2 ASP H 1 1 33 6009 1 1 3 ASP HA H -2.516 -4.951 -1.635 1.00 . A A . 2 ASP HA 1 1 33 6010 1 1 3 ASP HB2 H -3.559 -6.757 -0.183 1.00 . A A . 2 ASP HB2 1 1 33 6011 1 1 3 ASP HB3 H -4.448 -5.477 0.643 1.00 . A A . 2 ASP HB3 1 1 33 6012 1 1 3 ASP N N -1.794 -5.029 0.358 1.00 . A A . 2 ASP N 1 1 33 6013 1 1 3 ASP O O -3.158 -2.510 -1.369 1.00 . A A . 2 ASP O 1 1 33 6014 1 1 3 ASP OD1 O -4.733 -5.269 -2.469 1.00 . A A . 2 ASP OD1 1 1 33 6015 1 1 3 ASP OD2 O -6.114 -6.283 -1.162 1.00 . A A . 2 ASP OD2 1 1 33 6016 1 1 4 TYR C C -3.473 -0.665 1.147 1.00 . A A . 3 TYR C 1 1 33 6017 1 1 4 TYR CA C -4.581 -1.656 0.744 1.00 . A A . 3 TYR CA 1 1 33 6018 1 1 4 TYR CB C -5.671 -1.779 1.816 1.00 . A A . 3 TYR CB 1 1 33 6019 1 1 4 TYR CD1 C -4.796 -3.381 3.550 1.00 . A A . 3 TYR CD1 1 1 33 6020 1 1 4 TYR CD2 C -4.766 -1.004 4.028 1.00 . A A . 3 TYR CD2 1 1 33 6021 1 1 4 TYR CE1 C -4.235 -3.638 4.805 1.00 . A A . 3 TYR CE1 1 1 33 6022 1 1 4 TYR CE2 C -4.207 -1.262 5.282 1.00 . A A . 3 TYR CE2 1 1 33 6023 1 1 4 TYR CG C -5.061 -2.063 3.163 1.00 . A A . 3 TYR CG 1 1 33 6024 1 1 4 TYR CZ C -3.940 -2.578 5.670 1.00 . A A . 3 TYR CZ 1 1 33 6025 1 1 4 TYR H H -4.222 -3.718 1.242 1.00 . A A . 3 TYR H 1 1 33 6026 1 1 4 TYR HA H -5.029 -1.324 -0.175 1.00 . A A . 3 TYR HA 1 1 33 6027 1 1 4 TYR HB2 H -6.228 -0.859 1.866 1.00 . A A . 3 TYR HB2 1 1 33 6028 1 1 4 TYR HB3 H -6.340 -2.586 1.551 1.00 . A A . 3 TYR HB3 1 1 33 6029 1 1 4 TYR HD1 H -5.023 -4.197 2.882 1.00 . A A . 3 TYR HD1 1 1 33 6030 1 1 4 TYR HD2 H -4.972 0.012 3.728 1.00 . A A . 3 TYR HD2 1 1 33 6031 1 1 4 TYR HE1 H -4.028 -4.655 5.106 1.00 . A A . 3 TYR HE1 1 1 33 6032 1 1 4 TYR HE2 H -3.978 -0.444 5.951 1.00 . A A . 3 TYR HE2 1 1 33 6033 1 1 4 TYR HH H -3.068 -2.002 7.268 1.00 . A A . 3 TYR HH 1 1 33 6034 1 1 4 TYR N N -4.053 -3.034 0.563 1.00 . A A . 3 TYR N 1 1 33 6035 1 1 4 TYR O O -3.310 0.343 0.500 1.00 . A A . 3 TYR O 1 1 33 6036 1 1 4 TYR OH O -3.390 -2.832 6.909 1.00 . A A . 3 TYR OH 1 1 33 6037 1 1 5 TRP C C -1.252 0.997 1.574 1.00 . A A . 4 TRP C 1 1 33 6038 1 1 5 TRP CA C -1.621 -0.016 2.660 1.00 . A A . 4 TRP CA 1 1 33 6039 1 1 5 TRP CB C -0.411 -0.915 2.932 1.00 . A A . 4 TRP CB 1 1 33 6040 1 1 5 TRP CD1 C -1.485 -2.707 4.369 1.00 . A A . 4 TRP CD1 1 1 33 6041 1 1 5 TRP CD2 C 0.136 -1.591 5.444 1.00 . A A . 4 TRP CD2 1 1 33 6042 1 1 5 TRP CE2 C -0.369 -2.545 6.354 1.00 . A A . 4 TRP CE2 1 1 33 6043 1 1 5 TRP CE3 C 1.173 -0.754 5.872 1.00 . A A . 4 TRP CE3 1 1 33 6044 1 1 5 TRP CG C -0.595 -1.706 4.192 1.00 . A A . 4 TRP CG 1 1 33 6045 1 1 5 TRP CH2 C 1.175 -1.822 8.058 1.00 . A A . 4 TRP CH2 1 1 33 6046 1 1 5 TRP CZ2 C 0.140 -2.665 7.646 1.00 . A A . 4 TRP CZ2 1 1 33 6047 1 1 5 TRP CZ3 C 1.691 -0.867 7.172 1.00 . A A . 4 TRP CZ3 1 1 33 6048 1 1 5 TRP H H -2.883 -1.767 2.688 1.00 . A A . 4 TRP H 1 1 33 6049 1 1 5 TRP HA H -1.912 0.491 3.567 1.00 . A A . 4 TRP HA 1 1 33 6050 1 1 5 TRP HB2 H -0.281 -1.586 2.106 1.00 . A A . 4 TRP HB2 1 1 33 6051 1 1 5 TRP HB3 H 0.471 -0.298 3.027 1.00 . A A . 4 TRP HB3 1 1 33 6052 1 1 5 TRP HD1 H -2.181 -3.070 3.633 1.00 . A A . 4 TRP HD1 1 1 33 6053 1 1 5 TRP HE1 H -1.886 -3.931 6.034 1.00 . A A . 4 TRP HE1 1 1 33 6054 1 1 5 TRP HE3 H 1.576 -0.021 5.193 1.00 . A A . 4 TRP HE3 1 1 33 6055 1 1 5 TRP HH2 H 1.576 -1.906 9.057 1.00 . A A . 4 TRP HH2 1 1 33 6056 1 1 5 TRP HZ2 H -0.264 -3.404 8.322 1.00 . A A . 4 TRP HZ2 1 1 33 6057 1 1 5 TRP HZ3 H 2.492 -0.217 7.490 1.00 . A A . 4 TRP HZ3 1 1 33 6058 1 1 5 TRP N N -2.723 -0.945 2.198 1.00 . A A . 4 TRP N 1 1 33 6059 1 1 5 TRP NE1 N -1.352 -3.204 5.652 1.00 . A A . 4 TRP NE1 1 1 33 6060 1 1 5 TRP O O -1.290 2.194 1.778 1.00 . A A . 4 TRP O 1 1 33 6061 1 1 6 LEU C C -1.394 2.660 -0.740 1.00 . A A . 5 LEU C 1 1 33 6062 1 1 6 LEU CA C -0.522 1.395 -0.715 1.00 . A A . 5 LEU CA 1 1 33 6063 1 1 6 LEU CB C -0.771 0.520 -1.949 1.00 . A A . 5 LEU CB 1 1 33 6064 1 1 6 LEU CD1 C 0.300 2.063 -3.598 1.00 . A A . 5 LEU CD1 1 1 33 6065 1 1 6 LEU CD2 C -1.492 0.480 -4.329 1.00 . A A . 5 LEU CD2 1 1 33 6066 1 1 6 LEU CG C -1.007 1.380 -3.190 1.00 . A A . 5 LEU CG 1 1 33 6067 1 1 6 LEU H H -0.884 -0.466 0.296 1.00 . A A . 5 LEU H 1 1 33 6068 1 1 6 LEU HA H 0.521 1.658 -0.658 1.00 . A A . 5 LEU HA 1 1 33 6069 1 1 6 LEU HB2 H 0.088 -0.115 -2.113 1.00 . A A . 5 LEU HB2 1 1 33 6070 1 1 6 LEU HB3 H -1.640 -0.099 -1.776 1.00 . A A . 5 LEU HB3 1 1 33 6071 1 1 6 LEU HD11 H 1.137 1.487 -3.233 1.00 . A A . 5 LEU HD11 1 1 33 6072 1 1 6 LEU HD12 H 0.350 2.129 -4.675 1.00 . A A . 5 LEU HD12 1 1 33 6073 1 1 6 LEU HD13 H 0.334 3.056 -3.174 1.00 . A A . 5 LEU HD13 1 1 33 6074 1 1 6 LEU HD21 H -1.479 -0.551 -4.003 1.00 . A A . 5 LEU HD21 1 1 33 6075 1 1 6 LEU HD22 H -2.499 0.756 -4.604 1.00 . A A . 5 LEU HD22 1 1 33 6076 1 1 6 LEU HD23 H -0.841 0.594 -5.182 1.00 . A A . 5 LEU HD23 1 1 33 6077 1 1 6 LEU HG H -1.755 2.129 -2.977 1.00 . A A . 5 LEU HG 1 1 33 6078 1 1 6 LEU N N -0.899 0.507 0.420 1.00 . A A . 5 LEU N 1 1 33 6079 1 1 6 LEU O O -0.893 3.766 -0.793 1.00 . A A . 5 LEU O 1 1 33 6080 1 1 7 ALA C C -3.902 4.209 0.661 1.00 . A A . 6 ALA C 1 1 33 6081 1 1 7 ALA CA C -3.584 3.708 -0.754 1.00 . A A . 6 ALA CA 1 1 33 6082 1 1 7 ALA CB C -4.862 3.220 -1.436 1.00 . A A . 6 ALA CB 1 1 33 6083 1 1 7 ALA H H -3.079 1.610 -0.682 1.00 . A A . 6 ALA H 1 1 33 6084 1 1 7 ALA HA H -3.135 4.494 -1.338 1.00 . A A . 6 ALA HA 1 1 33 6085 1 1 7 ALA HB1 H -4.619 2.437 -2.139 1.00 . A A . 6 ALA HB1 1 1 33 6086 1 1 7 ALA HB2 H -5.544 2.836 -0.693 1.00 . A A . 6 ALA HB2 1 1 33 6087 1 1 7 ALA HB3 H -5.327 4.042 -1.960 1.00 . A A . 6 ALA HB3 1 1 33 6088 1 1 7 ALA N N -2.691 2.510 -0.716 1.00 . A A . 6 ALA N 1 1 33 6089 1 1 7 ALA O O -4.733 5.076 0.846 1.00 . A A . 6 ALA O 1 1 33 6090 1 1 8 HIS C C -2.280 4.634 3.724 1.00 . A A . 7 HIS C 1 1 33 6091 1 1 8 HIS CA C -3.559 4.110 3.053 1.00 . A A . 7 HIS CA 1 1 33 6092 1 1 8 HIS CB C -4.093 2.859 3.763 1.00 . A A . 7 HIS CB 1 1 33 6093 1 1 8 HIS CD2 C -5.170 1.827 1.592 1.00 . A A . 7 HIS CD2 1 1 33 6094 1 1 8 HIS CE1 C -7.078 1.243 2.422 1.00 . A A . 7 HIS CE1 1 1 33 6095 1 1 8 HIS CG C -5.150 2.194 2.916 1.00 . A A . 7 HIS CG 1 1 33 6096 1 1 8 HIS H H -2.606 2.957 1.499 1.00 . A A . 7 HIS H 1 1 33 6097 1 1 8 HIS HA H -4.317 4.877 3.045 1.00 . A A . 7 HIS HA 1 1 33 6098 1 1 8 HIS HB2 H -3.281 2.168 3.931 1.00 . A A . 7 HIS HB2 1 1 33 6099 1 1 8 HIS HB3 H -4.522 3.143 4.714 1.00 . A A . 7 HIS HB3 1 1 33 6100 1 1 8 HIS HD1 H -6.690 1.932 4.349 1.00 . A A . 7 HIS HD1 1 1 33 6101 1 1 8 HIS HD2 H -4.363 1.968 0.901 1.00 . A A . 7 HIS HD2 1 1 33 6102 1 1 8 HIS HE1 H -8.068 0.831 2.523 1.00 . A A . 7 HIS HE1 1 1 33 6103 1 1 8 HIS HE2 H -6.669 0.877 0.421 1.00 . A A . 7 HIS HE2 1 1 33 6104 1 1 8 HIS N N -3.265 3.665 1.661 1.00 . A A . 7 HIS N 1 1 33 6105 1 1 8 HIS ND1 N -6.383 1.811 3.426 1.00 . A A . 7 HIS ND1 1 1 33 6106 1 1 8 HIS NE2 N -6.383 1.231 1.289 1.00 . A A . 7 HIS NE2 1 1 33 6107 1 1 8 HIS O O -1.705 5.611 3.288 1.00 . A A . 7 HIS O 1 1 33 6108 1 1 9 LYS C C -0.823 5.888 6.017 1.00 . A A . 8 LYS C 1 1 33 6109 1 1 9 LYS CA C -0.600 4.481 5.463 1.00 . A A . 8 LYS CA 1 1 33 6110 1 1 9 LYS CB C 0.482 4.491 4.382 1.00 . A A . 8 LYS CB 1 1 33 6111 1 1 9 LYS CD C 1.746 2.445 3.704 1.00 . A A . 8 LYS CD 1 1 33 6112 1 1 9 LYS CE C 2.466 2.448 2.354 1.00 . A A . 8 LYS CE 1 1 33 6113 1 1 9 LYS CG C 0.417 3.192 3.575 1.00 . A A . 8 LYS CG 1 1 33 6114 1 1 9 LYS H H -2.300 3.226 5.126 1.00 . A A . 8 LYS H 1 1 33 6115 1 1 9 LYS HA H -0.322 3.805 6.255 1.00 . A A . 8 LYS HA 1 1 33 6116 1 1 9 LYS HB2 H 0.326 5.333 3.722 1.00 . A A . 8 LYS HB2 1 1 33 6117 1 1 9 LYS HB3 H 1.453 4.574 4.846 1.00 . A A . 8 LYS HB3 1 1 33 6118 1 1 9 LYS HD2 H 2.363 2.932 4.444 1.00 . A A . 8 LYS HD2 1 1 33 6119 1 1 9 LYS HD3 H 1.558 1.426 4.007 1.00 . A A . 8 LYS HD3 1 1 33 6120 1 1 9 LYS HE2 H 1.917 1.856 1.634 1.00 . A A . 8 LYS HE2 1 1 33 6121 1 1 9 LYS HE3 H 2.592 3.457 1.996 1.00 . A A . 8 LYS HE3 1 1 33 6122 1 1 9 LYS HG2 H -0.383 2.573 3.954 1.00 . A A . 8 LYS HG2 1 1 33 6123 1 1 9 LYS HG3 H 0.234 3.422 2.537 1.00 . A A . 8 LYS HG3 1 1 33 6124 1 1 9 LYS HZ1 H 4.088 2.059 3.600 1.00 . A A . 8 LYS HZ1 1 1 33 6125 1 1 9 LYS HZ2 H 3.732 0.802 2.513 1.00 . A A . 8 LYS HZ2 1 1 33 6126 1 1 9 LYS HZ3 H 4.498 2.215 1.963 1.00 . A A . 8 LYS HZ3 1 1 33 6127 1 1 9 LYS N N -1.831 4.004 4.780 1.00 . A A . 8 LYS N 1 1 33 6128 1 1 9 LYS NZ N 3.796 1.835 2.628 1.00 . A A . 8 LYS NZ 1 1 33 6129 1 1 9 LYS O O -1.892 6.222 6.489 1.00 . A A . 8 LYS O 1 1 33 6130 1 1 10 ALA C C -0.921 8.904 5.597 1.00 . A A . 9 ALA C 1 1 33 6131 1 1 10 ALA CA C 0.038 8.102 6.481 1.00 . A A . 9 ALA CA 1 1 33 6132 1 1 10 ALA CB C 1.447 8.694 6.416 1.00 . A A . 9 ALA CB 1 1 33 6133 1 1 10 ALA H H 1.026 6.414 5.575 1.00 . A A . 9 ALA H 1 1 33 6134 1 1 10 ALA HA H -0.309 8.089 7.502 1.00 . A A . 9 ALA HA 1 1 33 6135 1 1 10 ALA HB1 H 2.173 7.894 6.425 1.00 . A A . 9 ALA HB1 1 1 33 6136 1 1 10 ALA HB2 H 1.555 9.269 5.509 1.00 . A A . 9 ALA HB2 1 1 33 6137 1 1 10 ALA HB3 H 1.607 9.335 7.270 1.00 . A A . 9 ALA HB3 1 1 33 6138 1 1 10 ALA N N 0.180 6.711 5.961 1.00 . A A . 9 ALA N 1 1 33 6139 1 1 10 ALA O O -1.328 9.997 5.939 1.00 . A A . 9 ALA O 1 1 33 6140 1 1 11 LEU C C -3.657 8.647 3.801 1.00 . A A . 10 LEU C 1 1 33 6141 1 1 11 LEU CA C -2.216 9.105 3.560 1.00 . A A . 10 LEU CA 1 1 33 6142 1 1 11 LEU CB C -1.766 8.739 2.144 1.00 . A A . 10 LEU CB 1 1 33 6143 1 1 11 LEU CD1 C 0.412 9.933 1.875 1.00 . A A . 10 LEU CD1 1 1 33 6144 1 1 11 LEU CD2 C -1.215 9.858 -0.018 1.00 . A A . 10 LEU CD2 1 1 33 6145 1 1 11 LEU CG C -1.072 9.941 1.503 1.00 . A A . 10 LEU CG 1 1 33 6146 1 1 11 LEU H H -0.945 7.489 4.205 1.00 . A A . 10 LEU H 1 1 33 6147 1 1 11 LEU HA H -2.128 10.169 3.710 1.00 . A A . 10 LEU HA 1 1 33 6148 1 1 11 LEU HB2 H -1.078 7.906 2.191 1.00 . A A . 10 LEU HB2 1 1 33 6149 1 1 11 LEU HB3 H -2.626 8.464 1.553 1.00 . A A . 10 LEU HB3 1 1 33 6150 1 1 11 LEU HD11 H 0.667 8.981 2.316 1.00 . A A . 10 LEU HD11 1 1 33 6151 1 1 11 LEU HD12 H 1.007 10.090 0.987 1.00 . A A . 10 LEU HD12 1 1 33 6152 1 1 11 LEU HD13 H 0.609 10.724 2.584 1.00 . A A . 10 LEU HD13 1 1 33 6153 1 1 11 LEU HD21 H -1.442 8.842 -0.304 1.00 . A A . 10 LEU HD21 1 1 33 6154 1 1 11 LEU HD22 H -2.013 10.510 -0.341 1.00 . A A . 10 LEU HD22 1 1 33 6155 1 1 11 LEU HD23 H -0.290 10.165 -0.484 1.00 . A A . 10 LEU HD23 1 1 33 6156 1 1 11 LEU HG H -1.528 10.853 1.860 1.00 . A A . 10 LEU HG 1 1 33 6157 1 1 11 LEU N N -1.284 8.371 4.463 1.00 . A A . 10 LEU N 1 1 33 6158 1 1 11 LEU O O -3.900 7.631 4.420 1.00 . A A . 10 LEU O 1 1 33 6159 1 1 12 ALA C C -6.968 10.078 2.957 1.00 . A A . 11 ALA C 1 1 33 6160 1 1 12 ALA CA C -6.038 8.998 3.517 1.00 . A A . 11 ALA CA 1 1 33 6161 1 1 12 ALA CB C -6.205 8.879 5.033 1.00 . A A . 11 ALA CB 1 1 33 6162 1 1 12 ALA H H -4.396 10.207 2.818 1.00 . A A . 11 ALA H 1 1 33 6163 1 1 12 ALA HA H -6.237 8.048 3.048 1.00 . A A . 11 ALA HA 1 1 33 6164 1 1 12 ALA HB1 H -5.558 9.592 5.523 1.00 . A A . 11 ALA HB1 1 1 33 6165 1 1 12 ALA HB2 H -7.232 9.083 5.299 1.00 . A A . 11 ALA HB2 1 1 33 6166 1 1 12 ALA HB3 H -5.944 7.880 5.347 1.00 . A A . 11 ALA HB3 1 1 33 6167 1 1 12 ALA N N -4.614 9.391 3.315 1.00 . A A . 11 ALA N 1 1 33 6168 1 1 12 ALA O O -6.521 11.037 2.360 1.00 . A A . 11 ALA O 1 1 33 6169 1 1 13 NH2 HN1 H -8.618 9.188 3.608 1.00 . A A . 12 NH2 HN1 1 1 33 6170 1 1 13 NH2 HN2 H -8.862 10.645 2.773 1.00 . A A . 12 NH2 HN2 1 1 33 6171 1 1 13 NH2 N N -8.256 9.961 3.127 1.00 . A A . 12 NH2 N 1 1 34 6172 1 1 2 ILE C C -2.087 -5.010 1.558 1.00 . A A . 1 ILE C 1 1 34 6173 1 1 2 ILE CA C -0.917 -5.344 2.486 1.00 . A A . 1 ILE CA 1 1 34 6174 1 1 2 ILE CB C 0.421 -4.896 1.883 1.00 . A A . 1 ILE CB 1 1 34 6175 1 1 2 ILE CD1 C 2.648 -3.919 2.485 1.00 . A A . 1 ILE CD1 1 1 34 6176 1 1 2 ILE CG1 C 1.405 -4.625 3.025 1.00 . A A . 1 ILE CG1 1 1 34 6177 1 1 2 ILE CG2 C 0.232 -3.618 1.042 1.00 . A A . 1 ILE CG2 1 1 34 6178 1 1 2 ILE H H 0.067 -7.260 2.539 1.00 . A A . 1 ILE H 1 1 34 6179 1 1 2 ILE HA H -1.051 -4.877 3.443 1.00 . A A . 1 ILE HA 1 1 34 6180 1 1 2 ILE HB H 0.805 -5.681 1.256 1.00 . A A . 1 ILE HB 1 1 34 6181 1 1 2 ILE HD11 H 2.928 -4.358 1.539 1.00 . A A . 1 ILE HD11 1 1 34 6182 1 1 2 ILE HD12 H 2.431 -2.870 2.345 1.00 . A A . 1 ILE HD12 1 1 34 6183 1 1 2 ILE HD13 H 3.458 -4.029 3.190 1.00 . A A . 1 ILE HD13 1 1 34 6184 1 1 2 ILE HG12 H 0.929 -3.997 3.767 1.00 . A A . 1 ILE HG12 1 1 34 6185 1 1 2 ILE HG13 H 1.695 -5.562 3.478 1.00 . A A . 1 ILE HG13 1 1 34 6186 1 1 2 ILE HG21 H -0.738 -3.188 1.250 1.00 . A A . 1 ILE HG21 1 1 34 6187 1 1 2 ILE HG22 H 0.996 -2.899 1.287 1.00 . A A . 1 ILE HG22 1 1 34 6188 1 1 2 ILE HG23 H 0.293 -3.864 -0.007 1.00 . A A . 1 ILE HG23 1 1 34 6189 1 1 2 ILE N N -0.801 -6.819 2.647 1.00 . A A . 1 ILE N 1 1 34 6190 1 1 2 ILE O O -3.183 -4.734 2.001 1.00 . A A . 1 ILE O 1 1 34 6191 1 1 3 ASP C C -3.390 -3.250 -0.491 1.00 . A A . 2 ASP C 1 1 34 6192 1 1 3 ASP CA C -2.926 -4.694 -0.695 1.00 . A A . 2 ASP CA 1 1 34 6193 1 1 3 ASP CB C -4.058 -5.674 -0.389 1.00 . A A . 2 ASP CB 1 1 34 6194 1 1 3 ASP CG C -4.191 -6.677 -1.536 1.00 . A A . 2 ASP CG 1 1 34 6195 1 1 3 ASP H H -0.955 -5.250 -0.045 1.00 . A A . 2 ASP H 1 1 34 6196 1 1 3 ASP HA H -2.578 -4.834 -1.704 1.00 . A A . 2 ASP HA 1 1 34 6197 1 1 3 ASP HB2 H -3.840 -6.201 0.530 1.00 . A A . 2 ASP HB2 1 1 34 6198 1 1 3 ASP HB3 H -4.985 -5.130 -0.279 1.00 . A A . 2 ASP HB3 1 1 34 6199 1 1 3 ASP N N -1.850 -5.026 0.277 1.00 . A A . 2 ASP N 1 1 34 6200 1 1 3 ASP O O -3.192 -2.397 -1.334 1.00 . A A . 2 ASP O 1 1 34 6201 1 1 3 ASP OD1 O -3.204 -6.902 -2.217 1.00 . A A . 2 ASP OD1 1 1 34 6202 1 1 3 ASP OD2 O -5.278 -7.203 -1.715 1.00 . A A . 2 ASP OD2 1 1 34 6203 1 1 4 TYR C C -3.377 -0.638 1.273 1.00 . A A . 3 TYR C 1 1 34 6204 1 1 4 TYR CA C -4.513 -1.599 0.874 1.00 . A A . 3 TYR CA 1 1 34 6205 1 1 4 TYR CB C -5.553 -1.757 1.990 1.00 . A A . 3 TYR CB 1 1 34 6206 1 1 4 TYR CD1 C -4.499 -0.929 4.115 1.00 . A A . 3 TYR CD1 1 1 34 6207 1 1 4 TYR CD2 C -4.631 -3.320 3.737 1.00 . A A . 3 TYR CD2 1 1 34 6208 1 1 4 TYR CE1 C -3.879 -1.156 5.346 1.00 . A A . 3 TYR CE1 1 1 34 6209 1 1 4 TYR CE2 C -4.012 -3.548 4.969 1.00 . A A . 3 TYR CE2 1 1 34 6210 1 1 4 TYR CG C -4.875 -2.010 3.311 1.00 . A A . 3 TYR CG 1 1 34 6211 1 1 4 TYR CZ C -3.636 -2.465 5.773 1.00 . A A . 3 TYR CZ 1 1 34 6212 1 1 4 TYR H H -4.172 -3.687 1.271 1.00 . A A . 3 TYR H 1 1 34 6213 1 1 4 TYR HA H -4.999 -1.224 -0.007 1.00 . A A . 3 TYR HA 1 1 34 6214 1 1 4 TYR HB2 H -6.142 -0.857 2.059 1.00 . A A . 3 TYR HB2 1 1 34 6215 1 1 4 TYR HB3 H -6.200 -2.590 1.757 1.00 . A A . 3 TYR HB3 1 1 34 6216 1 1 4 TYR HD1 H -4.687 0.081 3.784 1.00 . A A . 3 TYR HD1 1 1 34 6217 1 1 4 TYR HD2 H -4.922 -4.153 3.115 1.00 . A A . 3 TYR HD2 1 1 34 6218 1 1 4 TYR HE1 H -3.587 -0.322 5.967 1.00 . A A . 3 TYR HE1 1 1 34 6219 1 1 4 TYR HE2 H -3.823 -4.558 5.301 1.00 . A A . 3 TYR HE2 1 1 34 6220 1 1 4 TYR HH H -3.582 -3.283 7.497 1.00 . A A . 3 TYR HH 1 1 34 6221 1 1 4 TYR N N -4.017 -2.978 0.614 1.00 . A A . 3 TYR N 1 1 34 6222 1 1 4 TYR O O -3.246 0.411 0.689 1.00 . A A . 3 TYR O 1 1 34 6223 1 1 4 TYR OH O -3.024 -2.689 6.988 1.00 . A A . 3 TYR OH 1 1 34 6224 1 1 5 TRP C C -1.082 0.947 1.647 1.00 . A A . 4 TRP C 1 1 34 6225 1 1 5 TRP CA C -1.445 -0.093 2.714 1.00 . A A . 4 TRP CA 1 1 34 6226 1 1 5 TRP CB C -0.246 -1.021 2.926 1.00 . A A . 4 TRP CB 1 1 34 6227 1 1 5 TRP CD1 C -1.316 -2.849 4.329 1.00 . A A . 4 TRP CD1 1 1 34 6228 1 1 5 TRP CD2 C 0.363 -1.813 5.389 1.00 . A A . 4 TRP CD2 1 1 34 6229 1 1 5 TRP CE2 C -0.133 -2.788 6.281 1.00 . A A . 4 TRP CE2 1 1 34 6230 1 1 5 TRP CE3 C 1.433 -1.017 5.811 1.00 . A A . 4 TRP CE3 1 1 34 6231 1 1 5 TRP CG C -0.410 -1.860 4.160 1.00 . A A . 4 TRP CG 1 1 34 6232 1 1 5 TRP CH2 C 1.484 -2.164 7.957 1.00 . A A . 4 TRP CH2 1 1 34 6233 1 1 5 TRP CZ2 C 0.416 -2.967 7.550 1.00 . A A . 4 TRP CZ2 1 1 34 6234 1 1 5 TRP CZ3 C 1.994 -1.190 7.086 1.00 . A A . 4 TRP CZ3 1 1 34 6235 1 1 5 TRP H H -2.711 -1.838 2.699 1.00 . A A . 4 TRP H 1 1 34 6236 1 1 5 TRP HA H -1.701 0.392 3.642 1.00 . A A . 4 TRP HA 1 1 34 6237 1 1 5 TRP HB2 H -0.145 -1.658 2.073 1.00 . A A . 4 TRP HB2 1 1 34 6238 1 1 5 TRP HB3 H 0.649 -0.422 3.024 1.00 . A A . 4 TRP HB3 1 1 34 6239 1 1 5 TRP HD1 H -2.046 -3.168 3.605 1.00 . A A . 4 TRP HD1 1 1 34 6240 1 1 5 TRP HE1 H -1.694 -4.124 5.962 1.00 . A A . 4 TRP HE1 1 1 34 6241 1 1 5 TRP HE3 H 1.829 -0.275 5.143 1.00 . A A . 4 TRP HE3 1 1 34 6242 1 1 5 TRP HH2 H 1.918 -2.295 8.937 1.00 . A A . 4 TRP HH2 1 1 34 6243 1 1 5 TRP HZ2 H 0.017 -3.721 8.213 1.00 . A A . 4 TRP HZ2 1 1 34 6244 1 1 5 TRP HZ3 H 2.820 -0.569 7.399 1.00 . A A . 4 TRP HZ3 1 1 34 6245 1 1 5 TRP N N -2.573 -0.988 2.256 1.00 . A A . 4 TRP N 1 1 34 6246 1 1 5 TRP NE1 N -1.156 -3.396 5.589 1.00 . A A . 4 TRP NE1 1 1 34 6247 1 1 5 TRP O O -1.012 2.132 1.907 1.00 . A A . 4 TRP O 1 1 34 6248 1 1 6 LEU C C -1.405 2.634 -0.730 1.00 . A A . 5 LEU C 1 1 34 6249 1 1 6 LEU CA C -0.475 1.412 -0.666 1.00 . A A . 5 LEU CA 1 1 34 6250 1 1 6 LEU CB C -0.630 0.540 -1.915 1.00 . A A . 5 LEU CB 1 1 34 6251 1 1 6 LEU CD1 C 0.622 2.031 -3.482 1.00 . A A . 5 LEU CD1 1 1 34 6252 1 1 6 LEU CD2 C -1.183 0.532 -4.341 1.00 . A A . 5 LEU CD2 1 1 34 6253 1 1 6 LEU CG C -0.739 1.410 -3.168 1.00 . A A . 5 LEU CG 1 1 34 6254 1 1 6 LEU H H -0.908 -0.470 0.280 1.00 . A A . 5 LEU H 1 1 34 6255 1 1 6 LEU HA H 0.551 1.727 -0.567 1.00 . A A . 5 LEU HA 1 1 34 6256 1 1 6 LEU HB2 H 0.230 -0.109 -2.005 1.00 . A A . 5 LEU HB2 1 1 34 6257 1 1 6 LEU HB3 H -1.521 -0.062 -1.821 1.00 . A A . 5 LEU HB3 1 1 34 6258 1 1 6 LEU HD11 H 1.113 2.309 -2.560 1.00 . A A . 5 LEU HD11 1 1 34 6259 1 1 6 LEU HD12 H 1.232 1.314 -4.012 1.00 . A A . 5 LEU HD12 1 1 34 6260 1 1 6 LEU HD13 H 0.485 2.909 -4.096 1.00 . A A . 5 LEU HD13 1 1 34 6261 1 1 6 LEU HD21 H -1.277 -0.492 -4.009 1.00 . A A . 5 LEU HD21 1 1 34 6262 1 1 6 LEU HD22 H -2.138 0.880 -4.709 1.00 . A A . 5 LEU HD22 1 1 34 6263 1 1 6 LEU HD23 H -0.450 0.589 -5.131 1.00 . A A . 5 LEU HD23 1 1 34 6264 1 1 6 LEU HG H -1.465 2.192 -3.006 1.00 . A A . 5 LEU HG 1 1 34 6265 1 1 6 LEU N N -0.847 0.493 0.450 1.00 . A A . 5 LEU N 1 1 34 6266 1 1 6 LEU O O -0.954 3.758 -0.832 1.00 . A A . 5 LEU O 1 1 34 6267 1 1 7 ALA C C -3.960 4.155 0.604 1.00 . A A . 6 ALA C 1 1 34 6268 1 1 7 ALA CA C -3.640 3.587 -0.783 1.00 . A A . 6 ALA CA 1 1 34 6269 1 1 7 ALA CB C -4.906 3.005 -1.412 1.00 . A A . 6 ALA CB 1 1 34 6270 1 1 7 ALA H H -3.044 1.515 -0.630 1.00 . A A . 6 ALA H 1 1 34 6271 1 1 7 ALA HA H -3.235 4.356 -1.421 1.00 . A A . 6 ALA HA 1 1 34 6272 1 1 7 ALA HB1 H -4.641 2.185 -2.063 1.00 . A A . 6 ALA HB1 1 1 34 6273 1 1 7 ALA HB2 H -5.561 2.645 -0.631 1.00 . A A . 6 ALA HB2 1 1 34 6274 1 1 7 ALA HB3 H -5.410 3.770 -1.981 1.00 . A A . 6 ALA HB3 1 1 34 6275 1 1 7 ALA N N -2.694 2.429 -0.695 1.00 . A A . 6 ALA N 1 1 34 6276 1 1 7 ALA O O -4.807 5.014 0.748 1.00 . A A . 6 ALA O 1 1 34 6277 1 1 8 HIS C C -2.365 4.819 3.618 1.00 . A A . 7 HIS C 1 1 34 6278 1 1 8 HIS CA C -3.615 4.180 2.993 1.00 . A A . 7 HIS CA 1 1 34 6279 1 1 8 HIS CB C -4.073 2.940 3.770 1.00 . A A . 7 HIS CB 1 1 34 6280 1 1 8 HIS CD2 C -5.218 1.823 1.679 1.00 . A A . 7 HIS CD2 1 1 34 6281 1 1 8 HIS CE1 C -7.082 1.235 2.599 1.00 . A A . 7 HIS CE1 1 1 34 6282 1 1 8 HIS CG C -5.151 2.229 2.990 1.00 . A A . 7 HIS CG 1 1 34 6283 1 1 8 HIS H H -2.644 2.968 1.499 1.00 . A A . 7 HIS H 1 1 34 6284 1 1 8 HIS HA H -4.418 4.900 2.952 1.00 . A A . 7 HIS HA 1 1 34 6285 1 1 8 HIS HB2 H -3.235 2.274 3.911 1.00 . A A . 7 HIS HB2 1 1 34 6286 1 1 8 HIS HB3 H -4.462 3.240 4.731 1.00 . A A . 7 HIS HB3 1 1 34 6287 1 1 8 HIS HD1 H -6.629 1.983 4.491 1.00 . A A . 7 HIS HD1 1 1 34 6288 1 1 8 HIS HD2 H -4.444 1.955 0.949 1.00 . A A . 7 HIS HD2 1 1 34 6289 1 1 8 HIS HE1 H -8.062 0.817 2.749 1.00 . A A . 7 HIS HE1 1 1 34 6290 1 1 8 HIS HE2 H -6.748 0.820 0.594 1.00 . A A . 7 HIS HE2 1 1 34 6291 1 1 8 HIS N N -3.312 3.672 1.627 1.00 . A A . 7 HIS N 1 1 34 6292 1 1 8 HIS ND1 N -6.356 1.841 3.561 1.00 . A A . 7 HIS ND1 1 1 34 6293 1 1 8 HIS NE2 N -6.433 1.202 1.441 1.00 . A A . 7 HIS NE2 1 1 34 6294 1 1 8 HIS O O -1.960 5.898 3.234 1.00 . A A . 7 HIS O 1 1 34 6295 1 1 9 LYS C C -0.882 6.130 5.813 1.00 . A A . 8 LYS C 1 1 34 6296 1 1 9 LYS CA C -0.544 4.766 5.212 1.00 . A A . 8 LYS CA 1 1 34 6297 1 1 9 LYS CB C 0.471 4.914 4.077 1.00 . A A . 8 LYS CB 1 1 34 6298 1 1 9 LYS CD C 2.114 3.144 3.437 1.00 . A A . 8 LYS CD 1 1 34 6299 1 1 9 LYS CE C 2.224 1.820 4.194 1.00 . A A . 8 LYS CE 1 1 34 6300 1 1 9 LYS CG C 0.646 3.571 3.367 1.00 . A A . 8 LYS CG 1 1 34 6301 1 1 9 LYS H H -2.084 3.316 4.886 1.00 . A A . 8 LYS H 1 1 34 6302 1 1 9 LYS HA H -0.154 4.105 5.970 1.00 . A A . 8 LYS HA 1 1 34 6303 1 1 9 LYS HB2 H 0.118 5.652 3.371 1.00 . A A . 8 LYS HB2 1 1 34 6304 1 1 9 LYS HB3 H 1.420 5.230 4.482 1.00 . A A . 8 LYS HB3 1 1 34 6305 1 1 9 LYS HD2 H 2.502 3.023 2.436 1.00 . A A . 8 LYS HD2 1 1 34 6306 1 1 9 LYS HD3 H 2.684 3.901 3.955 1.00 . A A . 8 LYS HD3 1 1 34 6307 1 1 9 LYS HE2 H 2.128 1.988 5.258 1.00 . A A . 8 LYS HE2 1 1 34 6308 1 1 9 LYS HE3 H 1.471 1.128 3.851 1.00 . A A . 8 LYS HE3 1 1 34 6309 1 1 9 LYS HG2 H 0.030 2.826 3.848 1.00 . A A . 8 LYS HG2 1 1 34 6310 1 1 9 LYS HG3 H 0.352 3.670 2.332 1.00 . A A . 8 LYS HG3 1 1 34 6311 1 1 9 LYS HZ1 H 3.797 1.500 2.870 1.00 . A A . 8 LYS HZ1 1 1 34 6312 1 1 9 LYS HZ2 H 4.285 1.767 4.475 1.00 . A A . 8 LYS HZ2 1 1 34 6313 1 1 9 LYS HZ3 H 3.607 0.275 4.027 1.00 . A A . 8 LYS HZ3 1 1 34 6314 1 1 9 LYS N N -1.753 4.177 4.578 1.00 . A A . 8 LYS N 1 1 34 6315 1 1 9 LYS NZ N 3.580 1.301 3.867 1.00 . A A . 8 LYS NZ 1 1 34 6316 1 1 9 LYS O O -1.957 6.343 6.338 1.00 . A A . 8 LYS O 1 1 34 6317 1 1 10 ALA C C -0.851 9.315 5.234 1.00 . A A . 9 ALA C 1 1 34 6318 1 1 10 ALA CA C -0.227 8.409 6.300 1.00 . A A . 9 ALA CA 1 1 34 6319 1 1 10 ALA CB C 1.148 8.936 6.709 1.00 . A A . 9 ALA CB 1 1 34 6320 1 1 10 ALA H H 0.884 6.852 5.307 1.00 . A A . 9 ALA H 1 1 34 6321 1 1 10 ALA HA H -0.870 8.344 7.163 1.00 . A A . 9 ALA HA 1 1 34 6322 1 1 10 ALA HB1 H 1.804 8.103 6.919 1.00 . A A . 9 ALA HB1 1 1 34 6323 1 1 10 ALA HB2 H 1.562 9.526 5.905 1.00 . A A . 9 ALA HB2 1 1 34 6324 1 1 10 ALA HB3 H 1.050 9.549 7.593 1.00 . A A . 9 ALA HB3 1 1 34 6325 1 1 10 ALA N N 0.029 7.052 5.737 1.00 . A A . 9 ALA N 1 1 34 6326 1 1 10 ALA O O -0.581 9.181 4.057 1.00 . A A . 9 ALA O 1 1 34 6327 1 1 11 LEU C C -3.199 12.181 5.366 1.00 . A A . 10 LEU C 1 1 34 6328 1 1 11 LEU CA C -2.320 11.152 4.647 1.00 . A A . 10 LEU CA 1 1 34 6329 1 1 11 LEU CB C -3.169 10.243 3.756 1.00 . A A . 10 LEU CB 1 1 34 6330 1 1 11 LEU CD1 C -5.653 10.450 3.885 1.00 . A A . 10 LEU CD1 1 1 34 6331 1 1 11 LEU CD2 C -4.550 8.279 4.437 1.00 . A A . 10 LEU CD2 1 1 34 6332 1 1 11 LEU CG C -4.420 9.801 4.515 1.00 . A A . 10 LEU CG 1 1 34 6333 1 1 11 LEU H H -1.885 10.331 6.592 1.00 . A A . 10 LEU H 1 1 34 6334 1 1 11 LEU HA H -1.568 11.648 4.055 1.00 . A A . 10 LEU HA 1 1 34 6335 1 1 11 LEU HB2 H -3.458 10.782 2.865 1.00 . A A . 10 LEU HB2 1 1 34 6336 1 1 11 LEU HB3 H -2.593 9.373 3.478 1.00 . A A . 10 LEU HB3 1 1 34 6337 1 1 11 LEU HD11 H -5.341 11.213 3.187 1.00 . A A . 10 LEU HD11 1 1 34 6338 1 1 11 LEU HD12 H -6.229 9.699 3.365 1.00 . A A . 10 LEU HD12 1 1 34 6339 1 1 11 LEU HD13 H -6.259 10.898 4.659 1.00 . A A . 10 LEU HD13 1 1 34 6340 1 1 11 LEU HD21 H -3.633 7.859 4.049 1.00 . A A . 10 LEU HD21 1 1 34 6341 1 1 11 LEU HD22 H -4.739 7.882 5.423 1.00 . A A . 10 LEU HD22 1 1 34 6342 1 1 11 LEU HD23 H -5.369 8.021 3.782 1.00 . A A . 10 LEU HD23 1 1 34 6343 1 1 11 LEU HG H -4.341 10.106 5.548 1.00 . A A . 10 LEU HG 1 1 34 6344 1 1 11 LEU N N -1.682 10.238 5.637 1.00 . A A . 10 LEU N 1 1 34 6345 1 1 11 LEU O O -4.271 12.524 4.907 1.00 . A A . 10 LEU O 1 1 34 6346 1 1 12 ALA C C -5.038 13.276 7.247 1.00 . A A . 11 ALA C 1 1 34 6347 1 1 12 ALA CA C -3.561 13.680 7.236 1.00 . A A . 11 ALA CA 1 1 34 6348 1 1 12 ALA CB C -3.370 14.990 6.470 1.00 . A A . 11 ALA CB 1 1 34 6349 1 1 12 ALA H H -1.886 12.383 6.840 1.00 . A A . 11 ALA H 1 1 34 6350 1 1 12 ALA HA H -3.193 13.786 8.244 1.00 . A A . 11 ALA HA 1 1 34 6351 1 1 12 ALA HB1 H -2.318 15.225 6.417 1.00 . A A . 11 ALA HB1 1 1 34 6352 1 1 12 ALA HB2 H -3.766 14.883 5.471 1.00 . A A . 11 ALA HB2 1 1 34 6353 1 1 12 ALA HB3 H -3.891 15.785 6.982 1.00 . A A . 11 ALA HB3 1 1 34 6354 1 1 12 ALA N N -2.754 12.674 6.488 1.00 . A A . 11 ALA N 1 1 34 6355 1 1 12 ALA O O -5.367 12.114 7.121 1.00 . A A . 11 ALA O 1 1 34 6356 1 1 13 NH2 HN1 H -5.686 15.136 7.497 1.00 . A A . 12 NH2 HN1 1 1 34 6357 1 1 13 NH2 HN2 H -6.899 13.952 7.406 1.00 . A A . 12 NH2 HN2 1 1 34 6358 1 1 13 NH2 N N -5.950 14.198 7.396 1.00 . A A . 12 NH2 N 1 1 35 6359 1 1 2 ILE C C -2.023 -4.771 1.749 1.00 . A A . 1 ILE C 1 1 35 6360 1 1 2 ILE CA C -0.814 -5.034 2.648 1.00 . A A . 1 ILE CA 1 1 35 6361 1 1 2 ILE CB C 0.496 -4.574 1.986 1.00 . A A . 1 ILE CB 1 1 35 6362 1 1 2 ILE CD1 C 1.966 -5.223 3.899 1.00 . A A . 1 ILE CD1 1 1 35 6363 1 1 2 ILE CG1 C 1.440 -4.051 3.070 1.00 . A A . 1 ILE CG1 1 1 35 6364 1 1 2 ILE CG2 C 0.242 -3.452 0.961 1.00 . A A . 1 ILE CG2 1 1 35 6365 1 1 2 ILE H H 0.226 -6.917 2.763 1.00 . A A . 1 ILE H 1 1 35 6366 1 1 2 ILE HA H -0.935 -4.540 3.592 1.00 . A A . 1 ILE HA 1 1 35 6367 1 1 2 ILE HB H 0.954 -5.413 1.490 1.00 . A A . 1 ILE HB 1 1 35 6368 1 1 2 ILE HD11 H 2.242 -6.033 3.241 1.00 . A A . 1 ILE HD11 1 1 35 6369 1 1 2 ILE HD12 H 2.831 -4.906 4.463 1.00 . A A . 1 ILE HD12 1 1 35 6370 1 1 2 ILE HD13 H 1.196 -5.557 4.579 1.00 . A A . 1 ILE HD13 1 1 35 6371 1 1 2 ILE HG12 H 2.268 -3.533 2.608 1.00 . A A . 1 ILE HG12 1 1 35 6372 1 1 2 ILE HG13 H 0.903 -3.369 3.716 1.00 . A A . 1 ILE HG13 1 1 35 6373 1 1 2 ILE HG21 H -0.720 -2.998 1.148 1.00 . A A . 1 ILE HG21 1 1 35 6374 1 1 2 ILE HG22 H 1.012 -2.701 1.049 1.00 . A A . 1 ILE HG22 1 1 35 6375 1 1 2 ILE HG23 H 0.253 -3.864 -0.036 1.00 . A A . 1 ILE HG23 1 1 35 6376 1 1 2 ILE N N -0.656 -6.498 2.856 1.00 . A A . 1 ILE N 1 1 35 6377 1 1 2 ILE O O -3.082 -4.400 2.211 1.00 . A A . 1 ILE O 1 1 35 6378 1 1 3 ASP C C -3.431 -3.257 -0.405 1.00 . A A . 2 ASP C 1 1 35 6379 1 1 3 ASP CA C -2.962 -4.710 -0.495 1.00 . A A . 2 ASP CA 1 1 35 6380 1 1 3 ASP CB C -4.080 -5.670 -0.083 1.00 . A A . 2 ASP CB 1 1 35 6381 1 1 3 ASP CG C -5.350 -5.341 -0.870 1.00 . A A . 2 ASP CG 1 1 35 6382 1 1 3 ASP H H -0.980 -5.248 0.141 1.00 . A A . 2 ASP H 1 1 35 6383 1 1 3 ASP HA H -2.640 -4.929 -1.498 1.00 . A A . 2 ASP HA 1 1 35 6384 1 1 3 ASP HB2 H -3.778 -6.685 -0.294 1.00 . A A . 2 ASP HB2 1 1 35 6385 1 1 3 ASP HB3 H -4.277 -5.565 0.972 1.00 . A A . 2 ASP HB3 1 1 35 6386 1 1 3 ASP N N -1.852 -4.955 0.470 1.00 . A A . 2 ASP N 1 1 35 6387 1 1 3 ASP O O -3.213 -2.467 -1.301 1.00 . A A . 2 ASP O 1 1 35 6388 1 1 3 ASP OD1 O -5.392 -5.658 -2.047 1.00 . A A . 2 ASP OD1 1 1 35 6389 1 1 3 ASP OD2 O -6.259 -4.779 -0.281 1.00 . A A . 2 ASP OD2 1 1 35 6390 1 1 4 TYR C C -3.440 -0.530 1.153 1.00 . A A . 3 TYR C 1 1 35 6391 1 1 4 TYR CA C -4.576 -1.510 0.806 1.00 . A A . 3 TYR CA 1 1 35 6392 1 1 4 TYR CB C -5.636 -1.575 1.910 1.00 . A A . 3 TYR CB 1 1 35 6393 1 1 4 TYR CD1 C -4.563 -0.779 4.035 1.00 . A A . 3 TYR CD1 1 1 35 6394 1 1 4 TYR CD2 C -4.840 -3.162 3.692 1.00 . A A . 3 TYR CD2 1 1 35 6395 1 1 4 TYR CE1 C -3.976 -1.023 5.277 1.00 . A A . 3 TYR CE1 1 1 35 6396 1 1 4 TYR CE2 C -4.254 -3.406 4.937 1.00 . A A . 3 TYR CE2 1 1 35 6397 1 1 4 TYR CG C -4.994 -1.847 3.243 1.00 . A A . 3 TYR CG 1 1 35 6398 1 1 4 TYR CZ C -3.822 -2.336 5.728 1.00 . A A . 3 TYR CZ 1 1 35 6399 1 1 4 TYR H H -4.252 -3.563 1.369 1.00 . A A . 3 TYR H 1 1 35 6400 1 1 4 TYR HA H -5.043 -1.200 -0.109 1.00 . A A . 3 TYR HA 1 1 35 6401 1 1 4 TYR HB2 H -6.162 -0.637 1.954 1.00 . A A . 3 TYR HB2 1 1 35 6402 1 1 4 TYR HB3 H -6.337 -2.366 1.683 1.00 . A A . 3 TYR HB3 1 1 35 6403 1 1 4 TYR HD1 H -4.682 0.234 3.686 1.00 . A A . 3 TYR HD1 1 1 35 6404 1 1 4 TYR HD2 H -5.174 -3.986 3.079 1.00 . A A . 3 TYR HD2 1 1 35 6405 1 1 4 TYR HE1 H -3.641 -0.198 5.890 1.00 . A A . 3 TYR HE1 1 1 35 6406 1 1 4 TYR HE2 H -4.133 -4.420 5.288 1.00 . A A . 3 TYR HE2 1 1 35 6407 1 1 4 TYR HH H -3.371 -3.506 7.166 1.00 . A A . 3 TYR HH 1 1 35 6408 1 1 4 TYR N N -4.082 -2.905 0.663 1.00 . A A . 3 TYR N 1 1 35 6409 1 1 4 TYR O O -3.292 0.471 0.491 1.00 . A A . 3 TYR O 1 1 35 6410 1 1 4 TYR OH O -3.248 -2.576 6.959 1.00 . A A . 3 TYR OH 1 1 35 6411 1 1 5 TRP C C -1.162 1.078 1.444 1.00 . A A . 4 TRP C 1 1 35 6412 1 1 5 TRP CA C -1.521 0.117 2.578 1.00 . A A . 4 TRP CA 1 1 35 6413 1 1 5 TRP CB C -0.322 -0.791 2.858 1.00 . A A . 4 TRP CB 1 1 35 6414 1 1 5 TRP CD1 C -1.381 -2.506 4.390 1.00 . A A . 4 TRP CD1 1 1 35 6415 1 1 5 TRP CD2 C 0.258 -1.349 5.390 1.00 . A A . 4 TRP CD2 1 1 35 6416 1 1 5 TRP CE2 C -0.237 -2.261 6.348 1.00 . A A . 4 TRP CE2 1 1 35 6417 1 1 5 TRP CE3 C 1.304 -0.496 5.767 1.00 . A A . 4 TRP CE3 1 1 35 6418 1 1 5 TRP CG C -0.490 -1.520 4.154 1.00 . A A . 4 TRP CG 1 1 35 6419 1 1 5 TRP CH2 C 1.331 -1.468 7.999 1.00 . A A . 4 TRP CH2 1 1 35 6420 1 1 5 TRP CZ2 C 0.289 -2.326 7.636 1.00 . A A . 4 TRP CZ2 1 1 35 6421 1 1 5 TRP CZ3 C 1.839 -0.554 7.064 1.00 . A A . 4 TRP CZ3 1 1 35 6422 1 1 5 TRP H H -2.800 -1.623 2.683 1.00 . A A . 4 TRP H 1 1 35 6423 1 1 5 TRP HA H -1.783 0.665 3.469 1.00 . A A . 4 TRP HA 1 1 35 6424 1 1 5 TRP HB2 H -0.224 -1.502 2.060 1.00 . A A . 4 TRP HB2 1 1 35 6425 1 1 5 TRP HB3 H 0.574 -0.187 2.904 1.00 . A A . 4 TRP HB3 1 1 35 6426 1 1 5 TRP HD1 H -2.089 -2.897 3.679 1.00 . A A . 4 TRP HD1 1 1 35 6427 1 1 5 TRP HE1 H -1.761 -3.656 6.111 1.00 . A A . 4 TRP HE1 1 1 35 6428 1 1 5 TRP HE3 H 1.699 0.205 5.051 1.00 . A A . 4 TRP HE3 1 1 35 6429 1 1 5 TRP HH2 H 1.743 -1.510 8.995 1.00 . A A . 4 TRP HH2 1 1 35 6430 1 1 5 TRP HZ2 H -0.108 -3.034 8.348 1.00 . A A . 4 TRP HZ2 1 1 35 6431 1 1 5 TRP HZ3 H 2.644 0.109 7.344 1.00 . A A . 4 TRP HZ3 1 1 35 6432 1 1 5 TRP N N -2.651 -0.808 2.175 1.00 . A A . 4 TRP N 1 1 35 6433 1 1 5 TRP NE1 N -1.230 -2.948 5.689 1.00 . A A . 4 TRP NE1 1 1 35 6434 1 1 5 TRP O O -1.145 2.281 1.607 1.00 . A A . 4 TRP O 1 1 35 6435 1 1 6 LEU C C -1.401 2.640 -0.927 1.00 . A A . 5 LEU C 1 1 35 6436 1 1 6 LEU CA C -0.525 1.380 -0.881 1.00 . A A . 5 LEU CA 1 1 35 6437 1 1 6 LEU CB C -0.800 0.462 -2.078 1.00 . A A . 5 LEU CB 1 1 35 6438 1 1 6 LEU CD1 C 0.235 1.953 -3.797 1.00 . A A . 5 LEU CD1 1 1 35 6439 1 1 6 LEU CD2 C -1.568 0.346 -4.442 1.00 . A A . 5 LEU CD2 1 1 35 6440 1 1 6 LEU CG C -1.062 1.282 -3.341 1.00 . A A . 5 LEU CG 1 1 35 6441 1 1 6 LEU H H -0.910 -0.437 0.197 1.00 . A A . 5 LEU H 1 1 35 6442 1 1 6 LEU HA H 0.519 1.646 -0.853 1.00 . A A . 5 LEU HA 1 1 35 6443 1 1 6 LEU HB2 H 0.054 -0.178 -2.239 1.00 . A A . 5 LEU HB2 1 1 35 6444 1 1 6 LEU HB3 H -1.665 -0.148 -1.865 1.00 . A A . 5 LEU HB3 1 1 35 6445 1 1 6 LEU HD11 H 0.932 1.985 -2.973 1.00 . A A . 5 LEU HD11 1 1 35 6446 1 1 6 LEU HD12 H 0.666 1.389 -4.611 1.00 . A A . 5 LEU HD12 1 1 35 6447 1 1 6 LEU HD13 H 0.024 2.959 -4.128 1.00 . A A . 5 LEU HD13 1 1 35 6448 1 1 6 LEU HD21 H -1.771 -0.627 -4.020 1.00 . A A . 5 LEU HD21 1 1 35 6449 1 1 6 LEU HD22 H -2.475 0.749 -4.869 1.00 . A A . 5 LEU HD22 1 1 35 6450 1 1 6 LEU HD23 H -0.817 0.255 -5.213 1.00 . A A . 5 LEU HD23 1 1 35 6451 1 1 6 LEU HG H -1.807 2.037 -3.138 1.00 . A A . 5 LEU HG 1 1 35 6452 1 1 6 LEU N N -0.880 0.537 0.293 1.00 . A A . 5 LEU N 1 1 35 6453 1 1 6 LEU O O -0.908 3.747 -1.018 1.00 . A A . 5 LEU O 1 1 35 6454 1 1 7 ALA C C -3.894 4.201 0.483 1.00 . A A . 6 ALA C 1 1 35 6455 1 1 7 ALA CA C -3.599 3.671 -0.925 1.00 . A A . 6 ALA CA 1 1 35 6456 1 1 7 ALA CB C -4.885 3.157 -1.575 1.00 . A A . 6 ALA CB 1 1 35 6457 1 1 7 ALA H H -3.076 1.580 -0.808 1.00 . A A . 6 ALA H 1 1 35 6458 1 1 7 ALA HA H -3.165 4.445 -1.537 1.00 . A A . 6 ALA HA 1 1 35 6459 1 1 7 ALA HB1 H -4.701 2.192 -2.024 1.00 . A A . 6 ALA HB1 1 1 35 6460 1 1 7 ALA HB2 H -5.655 3.063 -0.823 1.00 . A A . 6 ALA HB2 1 1 35 6461 1 1 7 ALA HB3 H -5.207 3.853 -2.335 1.00 . A A . 6 ALA HB3 1 1 35 6462 1 1 7 ALA N N -2.697 2.481 -0.874 1.00 . A A . 6 ALA N 1 1 35 6463 1 1 7 ALA O O -4.628 5.155 0.651 1.00 . A A . 6 ALA O 1 1 35 6464 1 1 8 HIS C C -2.312 4.474 3.568 1.00 . A A . 7 HIS C 1 1 35 6465 1 1 8 HIS CA C -3.618 4.065 2.883 1.00 . A A . 7 HIS CA 1 1 35 6466 1 1 8 HIS CB C -4.251 2.867 3.604 1.00 . A A . 7 HIS CB 1 1 35 6467 1 1 8 HIS CD2 C -5.362 1.881 1.427 1.00 . A A . 7 HIS CD2 1 1 35 6468 1 1 8 HIS CE1 C -7.293 1.370 2.252 1.00 . A A . 7 HIS CE1 1 1 35 6469 1 1 8 HIS CG C -5.333 2.253 2.749 1.00 . A A . 7 HIS CG 1 1 35 6470 1 1 8 HIS H H -2.764 2.815 1.347 1.00 . A A . 7 HIS H 1 1 35 6471 1 1 8 HIS HA H -4.310 4.891 2.868 1.00 . A A . 7 HIS HA 1 1 35 6472 1 1 8 HIS HB2 H -3.489 2.127 3.803 1.00 . A A . 7 HIS HB2 1 1 35 6473 1 1 8 HIS HB3 H -4.679 3.199 4.537 1.00 . A A . 7 HIS HB3 1 1 35 6474 1 1 8 HIS HD1 H -6.886 2.052 4.178 1.00 . A A . 7 HIS HD1 1 1 35 6475 1 1 8 HIS HD2 H -4.549 1.987 0.737 1.00 . A A . 7 HIS HD2 1 1 35 6476 1 1 8 HIS HE1 H -8.292 0.987 2.354 1.00 . A A . 7 HIS HE1 1 1 35 6477 1 1 8 HIS HE2 H -6.892 0.985 0.254 1.00 . A A . 7 HIS HE2 1 1 35 6478 1 1 8 HIS N N -3.344 3.589 1.496 1.00 . A A . 7 HIS N 1 1 35 6479 1 1 8 HIS ND1 N -6.580 1.917 3.257 1.00 . A A . 7 HIS ND1 1 1 35 6480 1 1 8 HIS NE2 N -6.595 1.330 1.121 1.00 . A A . 7 HIS NE2 1 1 35 6481 1 1 8 HIS O O -1.939 3.930 4.590 1.00 . A A . 7 HIS O 1 1 35 6482 1 1 9 LYS C C -0.448 7.329 4.097 1.00 . A A . 8 LYS C 1 1 35 6483 1 1 9 LYS CA C -0.334 5.872 3.637 1.00 . A A . 8 LYS CA 1 1 35 6484 1 1 9 LYS CB C 0.711 5.738 2.529 1.00 . A A . 8 LYS CB 1 1 35 6485 1 1 9 LYS CD C 2.226 3.830 1.972 1.00 . A A . 8 LYS CD 1 1 35 6486 1 1 9 LYS CE C 2.278 2.315 1.759 1.00 . A A . 8 LYS CE 1 1 35 6487 1 1 9 LYS CG C 0.767 4.285 2.052 1.00 . A A . 8 LYS CG 1 1 35 6488 1 1 9 LYS H H -1.934 5.853 2.192 1.00 . A A . 8 LYS H 1 1 35 6489 1 1 9 LYS HA H -0.076 5.233 4.467 1.00 . A A . 8 LYS HA 1 1 35 6490 1 1 9 LYS HB2 H 0.443 6.379 1.701 1.00 . A A . 8 LYS HB2 1 1 35 6491 1 1 9 LYS HB3 H 1.679 6.028 2.910 1.00 . A A . 8 LYS HB3 1 1 35 6492 1 1 9 LYS HD2 H 2.714 4.327 1.145 1.00 . A A . 8 LYS HD2 1 1 35 6493 1 1 9 LYS HD3 H 2.732 4.079 2.892 1.00 . A A . 8 LYS HD3 1 1 35 6494 1 1 9 LYS HE2 H 1.327 1.957 1.389 1.00 . A A . 8 LYS HE2 1 1 35 6495 1 1 9 LYS HE3 H 3.071 2.058 1.075 1.00 . A A . 8 LYS HE3 1 1 35 6496 1 1 9 LYS HG2 H 0.231 3.657 2.749 1.00 . A A . 8 LYS HG2 1 1 35 6497 1 1 9 LYS HG3 H 0.315 4.209 1.075 1.00 . A A . 8 LYS HG3 1 1 35 6498 1 1 9 LYS HZ1 H 1.820 2.049 3.772 1.00 . A A . 8 LYS HZ1 1 1 35 6499 1 1 9 LYS HZ2 H 2.577 0.710 3.049 1.00 . A A . 8 LYS HZ2 1 1 35 6500 1 1 9 LYS HZ3 H 3.485 2.088 3.439 1.00 . A A . 8 LYS HZ3 1 1 35 6501 1 1 9 LYS N N -1.615 5.428 3.016 1.00 . A A . 8 LYS N 1 1 35 6502 1 1 9 LYS NZ N 2.561 1.747 3.107 1.00 . A A . 8 LYS NZ 1 1 35 6503 1 1 9 LYS O O -1.531 7.847 4.283 1.00 . A A . 8 LYS O 1 1 35 6504 1 1 10 ALA C C 0.106 10.308 3.594 1.00 . A A . 9 ALA C 1 1 35 6505 1 1 10 ALA CA C 0.612 9.413 4.729 1.00 . A A . 9 ALA CA 1 1 35 6506 1 1 10 ALA CB C 2.057 9.765 5.085 1.00 . A A . 9 ALA CB 1 1 35 6507 1 1 10 ALA H H 1.524 7.555 4.125 1.00 . A A . 9 ALA H 1 1 35 6508 1 1 10 ALA HA H -0.017 9.513 5.598 1.00 . A A . 9 ALA HA 1 1 35 6509 1 1 10 ALA HB1 H 2.597 8.863 5.332 1.00 . A A . 9 ALA HB1 1 1 35 6510 1 1 10 ALA HB2 H 2.528 10.248 4.242 1.00 . A A . 9 ALA HB2 1 1 35 6511 1 1 10 ALA HB3 H 2.065 10.433 5.934 1.00 . A A . 9 ALA HB3 1 1 35 6512 1 1 10 ALA N N 0.661 7.991 4.281 1.00 . A A . 9 ALA N 1 1 35 6513 1 1 10 ALA O O 0.807 11.177 3.116 1.00 . A A . 9 ALA O 1 1 35 6514 1 1 11 LEU C C -3.161 11.155 2.251 1.00 . A A . 10 LEU C 1 1 35 6515 1 1 11 LEU CA C -1.658 10.944 2.057 1.00 . A A . 10 LEU CA 1 1 35 6516 1 1 11 LEU CB C -1.388 10.146 0.779 1.00 . A A . 10 LEU CB 1 1 35 6517 1 1 11 LEU CD1 C 0.117 11.358 -0.803 1.00 . A A . 10 LEU CD1 1 1 35 6518 1 1 11 LEU CD2 C -2.076 10.465 -1.600 1.00 . A A . 10 LEU CD2 1 1 35 6519 1 1 11 LEU CG C -1.339 11.098 -0.416 1.00 . A A . 10 LEU CG 1 1 35 6520 1 1 11 LEU H H -1.658 9.397 3.559 1.00 . A A . 10 LEU H 1 1 35 6521 1 1 11 LEU HA H -1.145 11.891 2.014 1.00 . A A . 10 LEU HA 1 1 35 6522 1 1 11 LEU HB2 H -0.443 9.632 0.870 1.00 . A A . 10 LEU HB2 1 1 35 6523 1 1 11 LEU HB3 H -2.178 9.425 0.632 1.00 . A A . 10 LEU HB3 1 1 35 6524 1 1 11 LEU HD11 H 0.720 10.504 -0.532 1.00 . A A . 10 LEU HD11 1 1 35 6525 1 1 11 LEU HD12 H 0.182 11.521 -1.870 1.00 . A A . 10 LEU HD12 1 1 35 6526 1 1 11 LEU HD13 H 0.476 12.233 -0.283 1.00 . A A . 10 LEU HD13 1 1 35 6527 1 1 11 LEU HD21 H -1.861 9.407 -1.633 1.00 . A A . 10 LEU HD21 1 1 35 6528 1 1 11 LEU HD22 H -3.139 10.615 -1.484 1.00 . A A . 10 LEU HD22 1 1 35 6529 1 1 11 LEU HD23 H -1.745 10.928 -2.519 1.00 . A A . 10 LEU HD23 1 1 35 6530 1 1 11 LEU HG H -1.815 12.032 -0.152 1.00 . A A . 10 LEU HG 1 1 35 6531 1 1 11 LEU N N -1.108 10.102 3.160 1.00 . A A . 10 LEU N 1 1 35 6532 1 1 11 LEU O O -3.975 10.518 1.611 1.00 . A A . 10 LEU O 1 1 35 6533 1 1 12 ALA C C -5.649 11.055 3.972 1.00 . A A . 11 ALA C 1 1 35 6534 1 1 12 ALA CA C -4.988 12.295 3.364 1.00 . A A . 11 ALA CA 1 1 35 6535 1 1 12 ALA CB C -5.567 12.587 1.980 1.00 . A A . 11 ALA CB 1 1 35 6536 1 1 12 ALA H H -2.864 12.546 3.636 1.00 . A A . 11 ALA H 1 1 35 6537 1 1 12 ALA HA H -5.123 13.149 4.008 1.00 . A A . 11 ALA HA 1 1 35 6538 1 1 12 ALA HB1 H -4.809 13.042 1.361 1.00 . A A . 11 ALA HB1 1 1 35 6539 1 1 12 ALA HB2 H -5.898 11.665 1.526 1.00 . A A . 11 ALA HB2 1 1 35 6540 1 1 12 ALA HB3 H -6.406 13.262 2.076 1.00 . A A . 11 ALA HB3 1 1 35 6541 1 1 12 ALA N N -3.536 12.044 3.130 1.00 . A A . 11 ALA N 1 1 35 6542 1 1 12 ALA O O -5.204 9.944 3.759 1.00 . A A . 11 ALA O 1 1 35 6543 1 1 13 NH2 HN1 H -7.061 12.095 4.904 1.00 . A A . 12 NH2 HN1 1 1 35 6544 1 1 13 NH2 HN2 H -7.132 10.413 5.125 1.00 . A A . 12 NH2 HN2 1 1 35 6545 1 1 13 NH2 N N -6.701 11.200 4.731 1.00 . A A . 12 NH2 N 1 1 36 6546 1 1 2 ILE C C -2.023 -4.988 1.645 1.00 . A A . 1 ILE C 1 1 36 6547 1 1 2 ILE CA C -0.892 -5.227 2.646 1.00 . A A . 1 ILE CA 1 1 36 6548 1 1 2 ILE CB C 0.453 -4.711 2.114 1.00 . A A . 1 ILE CB 1 1 36 6549 1 1 2 ILE CD1 C 2.551 -3.544 2.832 1.00 . A A . 1 ILE CD1 1 1 36 6550 1 1 2 ILE CG1 C 1.324 -4.316 3.312 1.00 . A A . 1 ILE CG1 1 1 36 6551 1 1 2 ILE CG2 C 0.243 -3.492 1.196 1.00 . A A . 1 ILE CG2 1 1 36 6552 1 1 2 ILE H H 0.203 -7.071 2.846 1.00 . A A . 1 ILE H 1 1 36 6553 1 1 2 ILE HA H -1.114 -4.749 3.583 1.00 . A A . 1 ILE HA 1 1 36 6554 1 1 2 ILE HB H 0.941 -5.496 1.560 1.00 . A A . 1 ILE HB 1 1 36 6555 1 1 2 ILE HD11 H 2.661 -3.670 1.766 1.00 . A A . 1 ILE HD11 1 1 36 6556 1 1 2 ILE HD12 H 2.426 -2.495 3.059 1.00 . A A . 1 ILE HD12 1 1 36 6557 1 1 2 ILE HD13 H 3.431 -3.919 3.334 1.00 . A A . 1 ILE HD13 1 1 36 6558 1 1 2 ILE HG12 H 0.749 -3.694 3.984 1.00 . A A . 1 ILE HG12 1 1 36 6559 1 1 2 ILE HG13 H 1.645 -5.208 3.832 1.00 . A A . 1 ILE HG13 1 1 36 6560 1 1 2 ILE HG21 H -0.764 -3.117 1.316 1.00 . A A . 1 ILE HG21 1 1 36 6561 1 1 2 ILE HG22 H 0.941 -2.712 1.451 1.00 . A A . 1 ILE HG22 1 1 36 6562 1 1 2 ILE HG23 H 0.392 -3.786 0.167 1.00 . A A . 1 ILE HG23 1 1 36 6563 1 1 2 ILE N N -0.699 -6.688 2.849 1.00 . A A . 1 ILE N 1 1 36 6564 1 1 2 ILE O O -3.154 -4.746 2.014 1.00 . A A . 1 ILE O 1 1 36 6565 1 1 3 ASP C C -3.295 -3.385 -0.544 1.00 . A A . 2 ASP C 1 1 36 6566 1 1 3 ASP CA C -2.752 -4.810 -0.659 1.00 . A A . 2 ASP CA 1 1 36 6567 1 1 3 ASP CB C -3.851 -5.834 -0.370 1.00 . A A . 2 ASP CB 1 1 36 6568 1 1 3 ASP CG C -3.792 -6.954 -1.411 1.00 . A A . 2 ASP CG 1 1 36 6569 1 1 3 ASP H H -0.794 -5.240 0.117 1.00 . A A . 2 ASP H 1 1 36 6570 1 1 3 ASP HA H -2.346 -4.971 -1.643 1.00 . A A . 2 ASP HA 1 1 36 6571 1 1 3 ASP HB2 H -3.705 -6.249 0.616 1.00 . A A . 2 ASP HB2 1 1 36 6572 1 1 3 ASP HB3 H -4.815 -5.351 -0.419 1.00 . A A . 2 ASP HB3 1 1 36 6573 1 1 3 ASP N N -1.715 -5.047 0.380 1.00 . A A . 2 ASP N 1 1 36 6574 1 1 3 ASP O O -3.077 -2.555 -1.404 1.00 . A A . 2 ASP O 1 1 36 6575 1 1 3 ASP OD1 O -3.865 -6.645 -2.589 1.00 . A A . 2 ASP OD1 1 1 36 6576 1 1 3 ASP OD2 O -3.674 -8.100 -1.012 1.00 . A A . 2 ASP OD2 1 1 36 6577 1 1 4 TYR C C -3.516 -0.712 1.097 1.00 . A A . 3 TYR C 1 1 36 6578 1 1 4 TYR CA C -4.582 -1.736 0.665 1.00 . A A . 3 TYR CA 1 1 36 6579 1 1 4 TYR CB C -5.700 -1.884 1.704 1.00 . A A . 3 TYR CB 1 1 36 6580 1 1 4 TYR CD1 C -4.872 -3.477 3.471 1.00 . A A . 3 TYR CD1 1 1 36 6581 1 1 4 TYR CD2 C -4.860 -1.099 3.940 1.00 . A A . 3 TYR CD2 1 1 36 6582 1 1 4 TYR CE1 C -4.349 -3.729 4.744 1.00 . A A . 3 TYR CE1 1 1 36 6583 1 1 4 TYR CE2 C -4.338 -1.350 5.212 1.00 . A A . 3 TYR CE2 1 1 36 6584 1 1 4 TYR CG C -5.126 -2.162 3.070 1.00 . A A . 3 TYR CG 1 1 36 6585 1 1 4 TYR CZ C -4.083 -2.664 5.614 1.00 . A A . 3 TYR CZ 1 1 36 6586 1 1 4 TYR H H -4.183 -3.789 1.177 1.00 . A A . 3 TYR H 1 1 36 6587 1 1 4 TYR HA H -5.011 -1.419 -0.267 1.00 . A A . 3 TYR HA 1 1 36 6588 1 1 4 TYR HB2 H -6.277 -0.975 1.739 1.00 . A A . 3 TYR HB2 1 1 36 6589 1 1 4 TYR HB3 H -6.344 -2.702 1.416 1.00 . A A . 3 TYR HB3 1 1 36 6590 1 1 4 TYR HD1 H -5.078 -4.297 2.798 1.00 . A A . 3 TYR HD1 1 1 36 6591 1 1 4 TYR HD2 H -5.056 -0.084 3.628 1.00 . A A . 3 TYR HD2 1 1 36 6592 1 1 4 TYR HE1 H -4.152 -4.744 5.056 1.00 . A A . 3 TYR HE1 1 1 36 6593 1 1 4 TYR HE2 H -4.133 -0.530 5.884 1.00 . A A . 3 TYR HE2 1 1 36 6594 1 1 4 TYR HH H -3.953 -3.734 7.191 1.00 . A A . 3 TYR HH 1 1 36 6595 1 1 4 TYR N N -4.012 -3.101 0.503 1.00 . A A . 3 TYR N 1 1 36 6596 1 1 4 TYR O O -3.362 0.297 0.450 1.00 . A A . 3 TYR O 1 1 36 6597 1 1 4 TYR OH O -3.571 -2.914 6.871 1.00 . A A . 3 TYR OH 1 1 36 6598 1 1 5 TRP C C -1.351 1.012 1.600 1.00 . A A . 4 TRP C 1 1 36 6599 1 1 5 TRP CA C -1.735 -0.011 2.673 1.00 . A A . 4 TRP CA 1 1 36 6600 1 1 5 TRP CB C -0.514 -0.878 2.986 1.00 . A A . 4 TRP CB 1 1 36 6601 1 1 5 TRP CD1 C -1.590 -2.703 4.385 1.00 . A A . 4 TRP CD1 1 1 36 6602 1 1 5 TRP CD2 C -0.030 -1.550 5.511 1.00 . A A . 4 TRP CD2 1 1 36 6603 1 1 5 TRP CE2 C -0.538 -2.518 6.404 1.00 . A A . 4 TRP CE2 1 1 36 6604 1 1 5 TRP CE3 C 0.970 -0.687 5.969 1.00 . A A . 4 TRP CE3 1 1 36 6605 1 1 5 TRP CG C -0.720 -1.679 4.237 1.00 . A A . 4 TRP CG 1 1 36 6606 1 1 5 TRP CH2 C 0.935 -1.759 8.154 1.00 . A A . 4 TRP CH2 1 1 36 6607 1 1 5 TRP CZ2 C -0.064 -2.628 7.711 1.00 . A A . 4 TRP CZ2 1 1 36 6608 1 1 5 TRP CZ3 C 1.454 -0.790 7.284 1.00 . A A . 4 TRP CZ3 1 1 36 6609 1 1 5 TRP H H -2.949 -1.792 2.662 1.00 . A A . 4 TRP H 1 1 36 6610 1 1 5 TRP HA H -2.068 0.489 3.569 1.00 . A A . 4 TRP HA 1 1 36 6611 1 1 5 TRP HB2 H -0.339 -1.542 2.164 1.00 . A A . 4 TRP HB2 1 1 36 6612 1 1 5 TRP HB3 H 0.348 -0.239 3.112 1.00 . A A . 4 TRP HB3 1 1 36 6613 1 1 5 TRP HD1 H -2.257 -3.081 3.628 1.00 . A A . 4 TRP HD1 1 1 36 6614 1 1 5 TRP HE1 H -2.009 -3.942 6.036 1.00 . A A . 4 TRP HE1 1 1 36 6615 1 1 5 TRP HE3 H 1.372 0.053 5.302 1.00 . A A . 4 TRP HE3 1 1 36 6616 1 1 5 TRP HH2 H 1.309 -1.835 9.164 1.00 . A A . 4 TRP HH2 1 1 36 6617 1 1 5 TRP HZ2 H -0.469 -3.379 8.374 1.00 . A A . 4 TRP HZ2 1 1 36 6618 1 1 5 TRP HZ3 H 2.227 -0.119 7.627 1.00 . A A . 4 TRP HZ3 1 1 36 6619 1 1 5 TRP N N -2.794 -0.968 2.175 1.00 . A A . 4 TRP N 1 1 36 6620 1 1 5 TRP NE1 N -1.483 -3.200 5.671 1.00 . A A . 4 TRP NE1 1 1 36 6621 1 1 5 TRP O O -1.399 2.207 1.811 1.00 . A A . 4 TRP O 1 1 36 6622 1 1 6 LEU C C -1.437 2.700 -0.702 1.00 . A A . 5 LEU C 1 1 36 6623 1 1 6 LEU CA C -0.571 1.429 -0.670 1.00 . A A . 5 LEU CA 1 1 36 6624 1 1 6 LEU CB C -0.799 0.559 -1.913 1.00 . A A . 5 LEU CB 1 1 36 6625 1 1 6 LEU CD1 C 0.237 2.149 -3.541 1.00 . A A . 5 LEU CD1 1 1 36 6626 1 1 6 LEU CD2 C -1.501 0.519 -4.297 1.00 . A A . 5 LEU CD2 1 1 36 6627 1 1 6 LEU CG C -1.051 1.424 -3.148 1.00 . A A . 5 LEU CG 1 1 36 6628 1 1 6 LEU H H -0.943 -0.440 0.323 1.00 . A A . 5 LEU H 1 1 36 6629 1 1 6 LEU HA H 0.473 1.687 -0.593 1.00 . A A . 5 LEU HA 1 1 36 6630 1 1 6 LEU HB2 H 0.073 -0.054 -2.081 1.00 . A A . 5 LEU HB2 1 1 36 6631 1 1 6 LEU HB3 H -1.654 -0.079 -1.747 1.00 . A A . 5 LEU HB3 1 1 36 6632 1 1 6 LEU HD11 H 1.052 1.796 -2.926 1.00 . A A . 5 LEU HD11 1 1 36 6633 1 1 6 LEU HD12 H 0.459 1.952 -4.580 1.00 . A A . 5 LEU HD12 1 1 36 6634 1 1 6 LEU HD13 H 0.111 3.212 -3.395 1.00 . A A . 5 LEU HD13 1 1 36 6635 1 1 6 LEU HD21 H -1.563 -0.502 -3.946 1.00 . A A . 5 LEU HD21 1 1 36 6636 1 1 6 LEU HD22 H -2.470 0.837 -4.650 1.00 . A A . 5 LEU HD22 1 1 36 6637 1 1 6 LEU HD23 H -0.785 0.576 -5.104 1.00 . A A . 5 LEU HD23 1 1 36 6638 1 1 6 LEU HG H -1.824 2.148 -2.934 1.00 . A A . 5 LEU HG 1 1 36 6639 1 1 6 LEU N N -0.969 0.531 0.452 1.00 . A A . 5 LEU N 1 1 36 6640 1 1 6 LEU O O -0.927 3.802 -0.768 1.00 . A A . 5 LEU O 1 1 36 6641 1 1 7 ALA C C -3.922 4.282 0.703 1.00 . A A . 6 ALA C 1 1 36 6642 1 1 7 ALA CA C -3.618 3.769 -0.709 1.00 . A A . 6 ALA CA 1 1 36 6643 1 1 7 ALA CB C -4.903 3.288 -1.384 1.00 . A A . 6 ALA CB 1 1 36 6644 1 1 7 ALA H H -3.131 1.665 -0.623 1.00 . A A . 6 ALA H 1 1 36 6645 1 1 7 ALA HA H -3.164 4.546 -1.303 1.00 . A A . 6 ALA HA 1 1 36 6646 1 1 7 ALA HB1 H -5.227 2.366 -0.925 1.00 . A A . 6 ALA HB1 1 1 36 6647 1 1 7 ALA HB2 H -5.672 4.037 -1.267 1.00 . A A . 6 ALA HB2 1 1 36 6648 1 1 7 ALA HB3 H -4.718 3.121 -2.435 1.00 . A A . 6 ALA HB3 1 1 36 6649 1 1 7 ALA N N -2.735 2.561 -0.667 1.00 . A A . 6 ALA N 1 1 36 6650 1 1 7 ALA O O -4.799 5.101 0.897 1.00 . A A . 6 ALA O 1 1 36 6651 1 1 8 HIS C C -2.213 4.805 3.720 1.00 . A A . 7 HIS C 1 1 36 6652 1 1 8 HIS CA C -3.494 4.258 3.085 1.00 . A A . 7 HIS CA 1 1 36 6653 1 1 8 HIS CB C -3.975 3.008 3.835 1.00 . A A . 7 HIS CB 1 1 36 6654 1 1 8 HIS CD2 C -4.988 1.849 1.696 1.00 . A A . 7 HIS CD2 1 1 36 6655 1 1 8 HIS CE1 C -6.863 1.183 2.545 1.00 . A A . 7 HIS CE1 1 1 36 6656 1 1 8 HIS CG C -4.992 2.260 3.006 1.00 . A A . 7 HIS CG 1 1 36 6657 1 1 8 HIS H H -2.525 3.133 1.523 1.00 . A A . 7 HIS H 1 1 36 6658 1 1 8 HIS HA H -4.267 5.010 3.089 1.00 . A A . 7 HIS HA 1 1 36 6659 1 1 8 HIS HB2 H -3.131 2.364 4.031 1.00 . A A . 7 HIS HB2 1 1 36 6660 1 1 8 HIS HB3 H -4.424 3.304 4.770 1.00 . A A . 7 HIS HB3 1 1 36 6661 1 1 8 HIS HD1 H -6.517 1.954 4.450 1.00 . A A . 7 HIS HD1 1 1 36 6662 1 1 8 HIS HD2 H -4.191 2.015 0.998 1.00 . A A . 7 HIS HD2 1 1 36 6663 1 1 8 HIS HE1 H -7.830 0.722 2.659 1.00 . A A . 7 HIS HE1 1 1 36 6664 1 1 8 HIS HE2 H -6.430 0.777 0.556 1.00 . A A . 7 HIS HE2 1 1 36 6665 1 1 8 HIS N N -3.221 3.802 1.692 1.00 . A A . 7 HIS N 1 1 36 6666 1 1 8 HIS ND1 N -6.202 1.823 3.530 1.00 . A A . 7 HIS ND1 1 1 36 6667 1 1 8 HIS NE2 N -6.166 1.175 1.412 1.00 . A A . 7 HIS NE2 1 1 36 6668 1 1 8 HIS O O -1.380 5.389 3.055 1.00 . A A . 7 HIS O 1 1 36 6669 1 1 9 LYS C C -0.706 6.639 5.469 1.00 . A A . 8 LYS C 1 1 36 6670 1 1 9 LYS CA C -0.824 5.130 5.674 1.00 . A A . 8 LYS CA 1 1 36 6671 1 1 9 LYS CB C 0.331 4.395 4.992 1.00 . A A . 8 LYS CB 1 1 36 6672 1 1 9 LYS CD C 0.254 2.416 6.515 1.00 . A A . 8 LYS CD 1 1 36 6673 1 1 9 LYS CE C -1.100 1.961 7.063 1.00 . A A . 8 LYS CE 1 1 36 6674 1 1 9 LYS CG C 0.091 2.886 5.069 1.00 . A A . 8 LYS CG 1 1 36 6675 1 1 9 LYS H H -2.724 4.151 5.520 1.00 . A A . 8 LYS H 1 1 36 6676 1 1 9 LYS HA H -0.842 4.892 6.724 1.00 . A A . 8 LYS HA 1 1 36 6677 1 1 9 LYS HB2 H 0.390 4.699 3.956 1.00 . A A . 8 LYS HB2 1 1 36 6678 1 1 9 LYS HB3 H 1.256 4.636 5.492 1.00 . A A . 8 LYS HB3 1 1 36 6679 1 1 9 LYS HD2 H 0.951 1.590 6.549 1.00 . A A . 8 LYS HD2 1 1 36 6680 1 1 9 LYS HD3 H 0.629 3.229 7.118 1.00 . A A . 8 LYS HD3 1 1 36 6681 1 1 9 LYS HE2 H -1.551 2.750 7.650 1.00 . A A . 8 LYS HE2 1 1 36 6682 1 1 9 LYS HE3 H -1.755 1.671 6.256 1.00 . A A . 8 LYS HE3 1 1 36 6683 1 1 9 LYS HG2 H -0.910 2.663 4.727 1.00 . A A . 8 LYS HG2 1 1 36 6684 1 1 9 LYS HG3 H 0.808 2.375 4.443 1.00 . A A . 8 LYS HG3 1 1 36 6685 1 1 9 LYS HZ1 H 0.163 0.880 8.314 1.00 . A A . 8 LYS HZ1 1 1 36 6686 1 1 9 LYS HZ2 H -1.482 0.728 8.695 1.00 . A A . 8 LYS HZ2 1 1 36 6687 1 1 9 LYS HZ3 H -0.845 -0.085 7.346 1.00 . A A . 8 LYS HZ3 1 1 36 6688 1 1 9 LYS N N -2.047 4.621 5.001 1.00 . A A . 8 LYS N 1 1 36 6689 1 1 9 LYS NZ N -0.794 0.782 7.919 1.00 . A A . 8 LYS NZ 1 1 36 6690 1 1 9 LYS O O -1.681 7.363 5.510 1.00 . A A . 8 LYS O 1 1 36 6691 1 1 10 ALA C C 0.012 9.003 3.724 1.00 . A A . 9 ALA C 1 1 36 6692 1 1 10 ALA CA C 0.675 8.578 5.034 1.00 . A A . 9 ALA CA 1 1 36 6693 1 1 10 ALA CB C 2.189 8.773 4.959 1.00 . A A . 9 ALA CB 1 1 36 6694 1 1 10 ALA H H 1.245 6.510 5.215 1.00 . A A . 9 ALA H 1 1 36 6695 1 1 10 ALA HA H 0.270 9.138 5.863 1.00 . A A . 9 ALA HA 1 1 36 6696 1 1 10 ALA HB1 H 2.648 7.883 4.552 1.00 . A A . 9 ALA HB1 1 1 36 6697 1 1 10 ALA HB2 H 2.412 9.616 4.322 1.00 . A A . 9 ALA HB2 1 1 36 6698 1 1 10 ALA HB3 H 2.578 8.958 5.949 1.00 . A A . 9 ALA HB3 1 1 36 6699 1 1 10 ALA N N 0.482 7.116 5.246 1.00 . A A . 9 ALA N 1 1 36 6700 1 1 10 ALA O O 0.332 8.501 2.664 1.00 . A A . 9 ALA O 1 1 36 6701 1 1 11 LEU C C -2.375 11.661 2.791 1.00 . A A . 10 LEU C 1 1 36 6702 1 1 11 LEU CA C -1.595 10.366 2.539 1.00 . A A . 10 LEU CA 1 1 36 6703 1 1 11 LEU CB C -2.540 9.215 2.184 1.00 . A A . 10 LEU CB 1 1 36 6704 1 1 11 LEU CD1 C -5.001 9.651 2.240 1.00 . A A . 10 LEU CD1 1 1 36 6705 1 1 11 LEU CD2 C -4.007 7.894 3.713 1.00 . A A . 10 LEU CD2 1 1 36 6706 1 1 11 LEU CG C -3.780 9.268 3.080 1.00 . A A . 10 LEU CG 1 1 36 6707 1 1 11 LEU H H -1.162 10.310 4.649 1.00 . A A . 10 LEU H 1 1 36 6708 1 1 11 LEU HA H -0.878 10.507 1.747 1.00 . A A . 10 LEU HA 1 1 36 6709 1 1 11 LEU HB2 H -2.838 9.299 1.150 1.00 . A A . 10 LEU HB2 1 1 36 6710 1 1 11 LEU HB3 H -2.030 8.274 2.337 1.00 . A A . 10 LEU HB3 1 1 36 6711 1 1 11 LEU HD11 H -4.829 9.381 1.209 1.00 . A A . 10 LEU HD11 1 1 36 6712 1 1 11 LEU HD12 H -5.870 9.126 2.609 1.00 . A A . 10 LEU HD12 1 1 36 6713 1 1 11 LEU HD13 H -5.167 10.716 2.311 1.00 . A A . 10 LEU HD13 1 1 36 6714 1 1 11 LEU HD21 H -3.071 7.357 3.752 1.00 . A A . 10 LEU HD21 1 1 36 6715 1 1 11 LEU HD22 H -4.394 8.017 4.713 1.00 . A A . 10 LEU HD22 1 1 36 6716 1 1 11 LEU HD23 H -4.717 7.336 3.118 1.00 . A A . 10 LEU HD23 1 1 36 6717 1 1 11 LEU HG H -3.633 10.004 3.856 1.00 . A A . 10 LEU HG 1 1 36 6718 1 1 11 LEU N N -0.913 9.920 3.785 1.00 . A A . 10 LEU N 1 1 36 6719 1 1 11 LEU O O -2.449 12.146 3.903 1.00 . A A . 10 LEU O 1 1 36 6720 1 1 12 ALA C C -5.115 13.359 1.310 1.00 . A A . 11 ALA C 1 1 36 6721 1 1 12 ALA CA C -3.730 13.487 1.952 1.00 . A A . 11 ALA CA 1 1 36 6722 1 1 12 ALA CB C -2.908 14.561 1.241 1.00 . A A . 11 ALA CB 1 1 36 6723 1 1 12 ALA H H -2.887 11.819 0.879 1.00 . A A . 11 ALA H 1 1 36 6724 1 1 12 ALA HA H -3.821 13.724 3.000 1.00 . A A . 11 ALA HA 1 1 36 6725 1 1 12 ALA HB1 H -2.556 14.179 0.295 1.00 . A A . 11 ALA HB1 1 1 36 6726 1 1 12 ALA HB2 H -3.525 15.432 1.071 1.00 . A A . 11 ALA HB2 1 1 36 6727 1 1 12 ALA HB3 H -2.063 14.835 1.857 1.00 . A A . 11 ALA HB3 1 1 36 6728 1 1 12 ALA N N -2.958 12.225 1.768 1.00 . A A . 11 ALA N 1 1 36 6729 1 1 12 ALA O O -5.235 13.010 0.153 1.00 . A A . 11 ALA O 1 1 36 6730 1 1 13 NH2 HN1 H -6.079 13.911 2.956 1.00 . A A . 12 NH2 HN1 1 1 36 6731 1 1 13 NH2 HN2 H -7.065 13.552 1.622 1.00 . A A . 12 NH2 HN2 1 1 36 6732 1 1 13 NH2 N N -6.175 13.629 2.022 1.00 . A A . 12 NH2 N 1 1 37 6733 1 1 2 ILE C C -1.998 -4.993 1.621 1.00 . A A . 1 ILE C 1 1 37 6734 1 1 2 ILE CA C -0.829 -5.218 2.581 1.00 . A A . 1 ILE CA 1 1 37 6735 1 1 2 ILE CB C 0.493 -4.673 2.012 1.00 . A A . 1 ILE CB 1 1 37 6736 1 1 2 ILE CD1 C 1.902 -5.342 3.962 1.00 . A A . 1 ILE CD1 1 1 37 6737 1 1 2 ILE CG1 C 1.349 -4.157 3.168 1.00 . A A . 1 ILE CG1 1 1 37 6738 1 1 2 ILE CG2 C 0.240 -3.516 1.027 1.00 . A A . 1 ILE CG2 1 1 37 6739 1 1 2 ILE H H 0.302 -7.045 2.733 1.00 . A A . 1 ILE H 1 1 37 6740 1 1 2 ILE HA H -1.030 -4.759 3.528 1.00 . A A . 1 ILE HA 1 1 37 6741 1 1 2 ILE HB H 1.015 -5.466 1.505 1.00 . A A . 1 ILE HB 1 1 37 6742 1 1 2 ILE HD11 H 1.082 -5.933 4.341 1.00 . A A . 1 ILE HD11 1 1 37 6743 1 1 2 ILE HD12 H 2.517 -5.951 3.317 1.00 . A A . 1 ILE HD12 1 1 37 6744 1 1 2 ILE HD13 H 2.495 -4.977 4.786 1.00 . A A . 1 ILE HD13 1 1 37 6745 1 1 2 ILE HG12 H 2.167 -3.571 2.776 1.00 . A A . 1 ILE HG12 1 1 37 6746 1 1 2 ILE HG13 H 0.743 -3.543 3.820 1.00 . A A . 1 ILE HG13 1 1 37 6747 1 1 2 ILE HG21 H -0.758 -3.128 1.168 1.00 . A A . 1 ILE HG21 1 1 37 6748 1 1 2 ILE HG22 H 0.958 -2.729 1.203 1.00 . A A . 1 ILE HG22 1 1 37 6749 1 1 2 ILE HG23 H 0.343 -3.875 0.014 1.00 . A A . 1 ILE HG23 1 1 37 6750 1 1 2 ILE N N -0.606 -6.678 2.761 1.00 . A A . 1 ILE N 1 1 37 6751 1 1 2 ILE O O -3.107 -4.722 2.032 1.00 . A A . 1 ILE O 1 1 37 6752 1 1 3 ASP C C -3.360 -3.456 -0.545 1.00 . A A . 2 ASP C 1 1 37 6753 1 1 3 ASP CA C -2.821 -4.881 -0.655 1.00 . A A . 2 ASP CA 1 1 37 6754 1 1 3 ASP CB C -3.906 -5.901 -0.307 1.00 . A A . 2 ASP CB 1 1 37 6755 1 1 3 ASP CG C -4.289 -6.687 -1.561 1.00 . A A . 2 ASP CG 1 1 37 6756 1 1 3 ASP H H -0.838 -5.316 0.055 1.00 . A A . 2 ASP H 1 1 37 6757 1 1 3 ASP HA H -2.450 -5.059 -1.650 1.00 . A A . 2 ASP HA 1 1 37 6758 1 1 3 ASP HB2 H -3.531 -6.579 0.445 1.00 . A A . 2 ASP HB2 1 1 37 6759 1 1 3 ASP HB3 H -4.775 -5.386 0.073 1.00 . A A . 2 ASP HB3 1 1 37 6760 1 1 3 ASP N N -1.744 -5.098 0.349 1.00 . A A . 2 ASP N 1 1 37 6761 1 1 3 ASP O O -3.146 -2.632 -1.412 1.00 . A A . 2 ASP O 1 1 37 6762 1 1 3 ASP OD1 O -5.082 -6.179 -2.337 1.00 . A A . 2 ASP OD1 1 1 37 6763 1 1 3 ASP OD2 O -3.784 -7.786 -1.726 1.00 . A A . 2 ASP OD2 1 1 37 6764 1 1 4 TYR C C -3.545 -0.777 1.070 1.00 . A A . 3 TYR C 1 1 37 6765 1 1 4 TYR CA C -4.626 -1.792 0.659 1.00 . A A . 3 TYR CA 1 1 37 6766 1 1 4 TYR CB C -5.742 -1.914 1.705 1.00 . A A . 3 TYR CB 1 1 37 6767 1 1 4 TYR CD1 C -4.980 -3.603 3.414 1.00 . A A . 3 TYR CD1 1 1 37 6768 1 1 4 TYR CD2 C -4.858 -1.244 3.965 1.00 . A A . 3 TYR CD2 1 1 37 6769 1 1 4 TYR CE1 C -4.466 -3.921 4.675 1.00 . A A . 3 TYR CE1 1 1 37 6770 1 1 4 TYR CE2 C -4.342 -1.563 5.223 1.00 . A A . 3 TYR CE2 1 1 37 6771 1 1 4 TYR CG C -5.176 -2.263 3.059 1.00 . A A . 3 TYR CG 1 1 37 6772 1 1 4 TYR CZ C -4.147 -2.900 5.578 1.00 . A A . 3 TYR CZ 1 1 37 6773 1 1 4 TYR H H -4.234 -3.842 1.190 1.00 . A A . 3 TYR H 1 1 37 6774 1 1 4 TYR HA H -5.057 -1.481 -0.275 1.00 . A A . 3 TYR HA 1 1 37 6775 1 1 4 TYR HB2 H -6.270 -0.977 1.775 1.00 . A A . 3 TYR HB2 1 1 37 6776 1 1 4 TYR HB3 H -6.432 -2.687 1.400 1.00 . A A . 3 TYR HB3 1 1 37 6777 1 1 4 TYR HD1 H -5.225 -4.389 2.716 1.00 . A A . 3 TYR HD1 1 1 37 6778 1 1 4 TYR HD2 H -5.007 -0.212 3.689 1.00 . A A . 3 TYR HD2 1 1 37 6779 1 1 4 TYR HE1 H -4.314 -4.954 4.951 1.00 . A A . 3 TYR HE1 1 1 37 6780 1 1 4 TYR HE2 H -4.096 -0.776 5.921 1.00 . A A . 3 TYR HE2 1 1 37 6781 1 1 4 TYR HH H -3.143 -2.459 7.142 1.00 . A A . 3 TYR HH 1 1 37 6782 1 1 4 TYR N N -4.066 -3.161 0.506 1.00 . A A . 3 TYR N 1 1 37 6783 1 1 4 TYR O O -3.367 0.207 0.393 1.00 . A A . 3 TYR O 1 1 37 6784 1 1 4 TYR OH O -3.644 -3.215 6.825 1.00 . A A . 3 TYR OH 1 1 37 6785 1 1 5 TRP C C -1.369 0.941 1.559 1.00 . A A . 4 TRP C 1 1 37 6786 1 1 5 TRP CA C -1.760 -0.068 2.641 1.00 . A A . 4 TRP CA 1 1 37 6787 1 1 5 TRP CB C -0.547 -0.947 2.955 1.00 . A A . 4 TRP CB 1 1 37 6788 1 1 5 TRP CD1 C -1.627 -2.763 4.355 1.00 . A A . 4 TRP CD1 1 1 37 6789 1 1 5 TRP CD2 C -0.092 -1.589 5.494 1.00 . A A . 4 TRP CD2 1 1 37 6790 1 1 5 TRP CE2 C -0.606 -2.557 6.386 1.00 . A A . 4 TRP CE2 1 1 37 6791 1 1 5 TRP CE3 C 0.896 -0.714 5.964 1.00 . A A . 4 TRP CE3 1 1 37 6792 1 1 5 TRP CG C -0.762 -1.736 4.211 1.00 . A A . 4 TRP CG 1 1 37 6793 1 1 5 TRP CH2 C 0.833 -1.775 8.154 1.00 . A A . 4 TRP CH2 1 1 37 6794 1 1 5 TRP CZ2 C -0.152 -2.655 7.699 1.00 . A A . 4 TRP CZ2 1 1 37 6795 1 1 5 TRP CZ3 C 1.357 -0.806 7.287 1.00 . A A . 4 TRP CZ3 1 1 37 6796 1 1 5 TRP H H -3.008 -1.826 2.669 1.00 . A A . 4 TRP H 1 1 37 6797 1 1 5 TRP HA H -2.080 0.443 3.534 1.00 . A A . 4 TRP HA 1 1 37 6798 1 1 5 TRP HB2 H -0.382 -1.622 2.137 1.00 . A A . 4 TRP HB2 1 1 37 6799 1 1 5 TRP HB3 H 0.324 -0.319 3.076 1.00 . A A . 4 TRP HB3 1 1 37 6800 1 1 5 TRP HD1 H -2.277 -3.151 3.589 1.00 . A A . 4 TRP HD1 1 1 37 6801 1 1 5 TRP HE1 H -2.056 -3.996 6.005 1.00 . A A . 4 TRP HE1 1 1 37 6802 1 1 5 TRP HE3 H 1.304 0.030 5.301 1.00 . A A . 4 TRP HE3 1 1 37 6803 1 1 5 TRP HH2 H 1.189 -1.843 9.170 1.00 . A A . 4 TRP HH2 1 1 37 6804 1 1 5 TRP HZ2 H -0.561 -3.405 8.359 1.00 . A A . 4 TRP HZ2 1 1 37 6805 1 1 5 TRP HZ3 H 2.119 -0.127 7.639 1.00 . A A . 4 TRP HZ3 1 1 37 6806 1 1 5 TRP N N -2.835 -1.017 2.160 1.00 . A A . 4 TRP N 1 1 37 6807 1 1 5 TRP NE1 N -1.531 -3.253 5.643 1.00 . A A . 4 TRP NE1 1 1 37 6808 1 1 5 TRP O O -1.424 2.138 1.752 1.00 . A A . 4 TRP O 1 1 37 6809 1 1 6 LEU C C -1.421 2.602 -0.760 1.00 . A A . 5 LEU C 1 1 37 6810 1 1 6 LEU CA C -0.561 1.328 -0.705 1.00 . A A . 5 LEU CA 1 1 37 6811 1 1 6 LEU CB C -0.780 0.447 -1.940 1.00 . A A . 5 LEU CB 1 1 37 6812 1 1 6 LEU CD1 C 0.327 2.003 -3.552 1.00 . A A . 5 LEU CD1 1 1 37 6813 1 1 6 LEU CD2 C -1.415 0.391 -4.342 1.00 . A A . 5 LEU CD2 1 1 37 6814 1 1 6 LEU CG C -0.983 1.302 -3.190 1.00 . A A . 5 LEU CG 1 1 37 6815 1 1 6 LEU H H -0.935 -0.527 0.309 1.00 . A A . 5 LEU H 1 1 37 6816 1 1 6 LEU HA H 0.483 1.583 -0.623 1.00 . A A . 5 LEU HA 1 1 37 6817 1 1 6 LEU HB2 H 0.082 -0.188 -2.081 1.00 . A A . 5 LEU HB2 1 1 37 6818 1 1 6 LEU HB3 H -1.654 -0.168 -1.786 1.00 . A A . 5 LEU HB3 1 1 37 6819 1 1 6 LEU HD11 H 1.161 1.391 -3.241 1.00 . A A . 5 LEU HD11 1 1 37 6820 1 1 6 LEU HD12 H 0.371 2.154 -4.621 1.00 . A A . 5 LEU HD12 1 1 37 6821 1 1 6 LEU HD13 H 0.375 2.958 -3.052 1.00 . A A . 5 LEU HD13 1 1 37 6822 1 1 6 LEU HD21 H -1.985 -0.439 -3.948 1.00 . A A . 5 LEU HD21 1 1 37 6823 1 1 6 LEU HD22 H -2.025 0.949 -5.036 1.00 . A A . 5 LEU HD22 1 1 37 6824 1 1 6 LEU HD23 H -0.540 0.015 -4.852 1.00 . A A . 5 LEU HD23 1 1 37 6825 1 1 6 LEU HG H -1.750 2.040 -3.004 1.00 . A A . 5 LEU HG 1 1 37 6826 1 1 6 LEU N N -0.970 0.445 0.423 1.00 . A A . 5 LEU N 1 1 37 6827 1 1 6 LEU O O -0.909 3.697 -0.894 1.00 . A A . 5 LEU O 1 1 37 6828 1 1 7 ALA C C -3.851 4.271 0.660 1.00 . A A . 6 ALA C 1 1 37 6829 1 1 7 ALA CA C -3.594 3.686 -0.737 1.00 . A A . 6 ALA CA 1 1 37 6830 1 1 7 ALA CB C -4.901 3.190 -1.353 1.00 . A A . 6 ALA CB 1 1 37 6831 1 1 7 ALA H H -3.118 1.585 -0.575 1.00 . A A . 6 ALA H 1 1 37 6832 1 1 7 ALA HA H -3.151 4.431 -1.378 1.00 . A A . 6 ALA HA 1 1 37 6833 1 1 7 ALA HB1 H -4.684 2.514 -2.167 1.00 . A A . 6 ALA HB1 1 1 37 6834 1 1 7 ALA HB2 H -5.481 2.674 -0.602 1.00 . A A . 6 ALA HB2 1 1 37 6835 1 1 7 ALA HB3 H -5.465 4.033 -1.727 1.00 . A A . 6 ALA HB3 1 1 37 6836 1 1 7 ALA N N -2.718 2.473 -0.673 1.00 . A A . 6 ALA N 1 1 37 6837 1 1 7 ALA O O -4.792 5.014 0.861 1.00 . A A . 6 ALA O 1 1 37 6838 1 1 8 HIS C C -1.963 5.096 3.541 1.00 . A A . 7 HIS C 1 1 37 6839 1 1 8 HIS CA C -3.261 4.491 3.000 1.00 . A A . 7 HIS CA 1 1 37 6840 1 1 8 HIS CB C -3.694 3.295 3.861 1.00 . A A . 7 HIS CB 1 1 37 6841 1 1 8 HIS CD2 C -4.632 1.873 1.862 1.00 . A A . 7 HIS CD2 1 1 37 6842 1 1 8 HIS CE1 C -6.522 1.280 2.731 1.00 . A A . 7 HIS CE1 1 1 37 6843 1 1 8 HIS CG C -4.680 2.437 3.108 1.00 . A A . 7 HIS CG 1 1 37 6844 1 1 8 HIS H H -2.284 3.342 1.455 1.00 . A A . 7 HIS H 1 1 37 6845 1 1 8 HIS HA H -4.043 5.235 2.984 1.00 . A A . 7 HIS HA 1 1 37 6846 1 1 8 HIS HB2 H -2.826 2.704 4.113 1.00 . A A . 7 HIS HB2 1 1 37 6847 1 1 8 HIS HB3 H -4.155 3.657 4.768 1.00 . A A . 7 HIS HB3 1 1 37 6848 1 1 8 HIS HD1 H -6.241 2.284 4.537 1.00 . A A . 7 HIS HD1 1 1 37 6849 1 1 8 HIS HD2 H -3.818 1.979 1.170 1.00 . A A . 7 HIS HD2 1 1 37 6850 1 1 8 HIS HE1 H -7.486 0.819 2.874 1.00 . A A . 7 HIS HE1 1 1 37 6851 1 1 8 HIS HE2 H -6.022 0.645 0.820 1.00 . A A . 7 HIS HE2 1 1 37 6852 1 1 8 HIS N N -3.036 3.945 1.627 1.00 . A A . 7 HIS N 1 1 37 6853 1 1 8 HIS ND1 N -5.898 2.047 3.650 1.00 . A A . 7 HIS ND1 1 1 37 6854 1 1 8 HIS NE2 N -5.791 1.148 1.628 1.00 . A A . 7 HIS NE2 1 1 37 6855 1 1 8 HIS O O -1.967 6.129 4.179 1.00 . A A . 7 HIS O 1 1 37 6856 1 1 9 LYS C C 0.745 6.344 3.134 1.00 . A A . 8 LYS C 1 1 37 6857 1 1 9 LYS CA C 0.446 4.994 3.791 1.00 . A A . 8 LYS CA 1 1 37 6858 1 1 9 LYS CB C 1.488 3.954 3.383 1.00 . A A . 8 LYS CB 1 1 37 6859 1 1 9 LYS CD C 2.827 3.130 1.441 1.00 . A A . 8 LYS CD 1 1 37 6860 1 1 9 LYS CE C 2.738 1.663 1.867 1.00 . A A . 8 LYS CE 1 1 37 6861 1 1 9 LYS CG C 1.549 3.862 1.857 1.00 . A A . 8 LYS CG 1 1 37 6862 1 1 9 LYS H H -0.872 3.624 2.775 1.00 . A A . 8 LYS H 1 1 37 6863 1 1 9 LYS HA H 0.425 5.094 4.864 1.00 . A A . 8 LYS HA 1 1 37 6864 1 1 9 LYS HB2 H 2.456 4.243 3.766 1.00 . A A . 8 LYS HB2 1 1 37 6865 1 1 9 LYS HB3 H 1.214 2.990 3.787 1.00 . A A . 8 LYS HB3 1 1 37 6866 1 1 9 LYS HD2 H 2.942 3.188 0.368 1.00 . A A . 8 LYS HD2 1 1 37 6867 1 1 9 LYS HD3 H 3.678 3.590 1.920 1.00 . A A . 8 LYS HD3 1 1 37 6868 1 1 9 LYS HE2 H 3.547 1.419 2.541 1.00 . A A . 8 LYS HE2 1 1 37 6869 1 1 9 LYS HE3 H 1.786 1.462 2.333 1.00 . A A . 8 LYS HE3 1 1 37 6870 1 1 9 LYS HG2 H 0.688 3.320 1.494 1.00 . A A . 8 LYS HG2 1 1 37 6871 1 1 9 LYS HG3 H 1.554 4.857 1.436 1.00 . A A . 8 LYS HG3 1 1 37 6872 1 1 9 LYS HZ1 H 3.413 1.432 -0.088 1.00 . A A . 8 LYS HZ1 1 1 37 6873 1 1 9 LYS HZ2 H 3.340 -0.015 0.792 1.00 . A A . 8 LYS HZ2 1 1 37 6874 1 1 9 LYS HZ3 H 1.911 0.701 0.217 1.00 . A A . 8 LYS HZ3 1 1 37 6875 1 1 9 LYS N N -0.853 4.457 3.292 1.00 . A A . 8 LYS N 1 1 37 6876 1 1 9 LYS NZ N 2.860 0.887 0.601 1.00 . A A . 8 LYS NZ 1 1 37 6877 1 1 9 LYS O O -0.144 7.130 2.872 1.00 . A A . 8 LYS O 1 1 37 6878 1 1 10 ALA C C 1.358 8.253 1.113 1.00 . A A . 9 ALA C 1 1 37 6879 1 1 10 ALA CA C 2.351 7.919 2.230 1.00 . A A . 9 ALA CA 1 1 37 6880 1 1 10 ALA CB C 3.751 7.704 1.655 1.00 . A A . 9 ALA CB 1 1 37 6881 1 1 10 ALA H H 2.694 5.972 3.089 1.00 . A A . 9 ALA H 1 1 37 6882 1 1 10 ALA HA H 2.372 8.708 2.965 1.00 . A A . 9 ALA HA 1 1 37 6883 1 1 10 ALA HB1 H 3.769 6.790 1.080 1.00 . A A . 9 ALA HB1 1 1 37 6884 1 1 10 ALA HB2 H 4.009 8.535 1.015 1.00 . A A . 9 ALA HB2 1 1 37 6885 1 1 10 ALA HB3 H 4.465 7.636 2.462 1.00 . A A . 9 ALA HB3 1 1 37 6886 1 1 10 ALA N N 1.993 6.620 2.869 1.00 . A A . 9 ALA N 1 1 37 6887 1 1 10 ALA O O 0.808 9.335 1.061 1.00 . A A . 9 ALA O 1 1 37 6888 1 1 11 LEU C C -1.123 8.217 -0.345 1.00 . A A . 10 LEU C 1 1 37 6889 1 1 11 LEU CA C 0.165 7.598 -0.893 1.00 . A A . 10 LEU CA 1 1 37 6890 1 1 11 LEU CB C -0.118 6.227 -1.509 1.00 . A A . 10 LEU CB 1 1 37 6891 1 1 11 LEU CD1 C 1.241 5.350 -3.412 1.00 . A A . 10 LEU CD1 1 1 37 6892 1 1 11 LEU CD2 C -1.181 5.865 -3.739 1.00 . A A . 10 LEU CD2 1 1 37 6893 1 1 11 LEU CG C 0.102 6.292 -3.021 1.00 . A A . 10 LEU CG 1 1 37 6894 1 1 11 LEU H H 1.577 6.465 0.278 1.00 . A A . 10 LEU H 1 1 37 6895 1 1 11 LEU HA H 0.613 8.247 -1.629 1.00 . A A . 10 LEU HA 1 1 37 6896 1 1 11 LEU HB2 H 0.550 5.495 -1.078 1.00 . A A . 10 LEU HB2 1 1 37 6897 1 1 11 LEU HB3 H -1.140 5.946 -1.306 1.00 . A A . 10 LEU HB3 1 1 37 6898 1 1 11 LEU HD11 H 1.572 4.803 -2.542 1.00 . A A . 10 LEU HD11 1 1 37 6899 1 1 11 LEU HD12 H 0.892 4.655 -4.162 1.00 . A A . 10 LEU HD12 1 1 37 6900 1 1 11 LEU HD13 H 2.064 5.926 -3.810 1.00 . A A . 10 LEU HD13 1 1 37 6901 1 1 11 LEU HD21 H -1.801 5.295 -3.061 1.00 . A A . 10 LEU HD21 1 1 37 6902 1 1 11 LEU HD22 H -1.719 6.743 -4.067 1.00 . A A . 10 LEU HD22 1 1 37 6903 1 1 11 LEU HD23 H -0.929 5.257 -4.595 1.00 . A A . 10 LEU HD23 1 1 37 6904 1 1 11 LEU HG H 0.357 7.303 -3.305 1.00 . A A . 10 LEU HG 1 1 37 6905 1 1 11 LEU N N 1.124 7.331 0.219 1.00 . A A . 10 LEU N 1 1 37 6906 1 1 11 LEU O O -2.023 7.523 0.084 1.00 . A A . 10 LEU O 1 1 37 6907 1 1 12 ALA C C -3.136 10.972 -0.953 1.00 . A A . 11 ALA C 1 1 37 6908 1 1 12 ALA CA C -2.450 10.180 0.163 1.00 . A A . 11 ALA CA 1 1 37 6909 1 1 12 ALA CB C -1.959 11.121 1.263 1.00 . A A . 11 ALA CB 1 1 37 6910 1 1 12 ALA H H -0.481 10.061 -0.708 1.00 . A A . 11 ALA H 1 1 37 6911 1 1 12 ALA HA H -3.125 9.448 0.577 1.00 . A A . 11 ALA HA 1 1 37 6912 1 1 12 ALA HB1 H -1.007 11.545 0.978 1.00 . A A . 11 ALA HB1 1 1 37 6913 1 1 12 ALA HB2 H -2.678 11.915 1.406 1.00 . A A . 11 ALA HB2 1 1 37 6914 1 1 12 ALA HB3 H -1.845 10.569 2.185 1.00 . A A . 11 ALA HB3 1 1 37 6915 1 1 12 ALA N N -1.219 9.519 -0.357 1.00 . A A . 11 ALA N 1 1 37 6916 1 1 12 ALA O O -3.252 12.179 -0.882 1.00 . A A . 11 ALA O 1 1 37 6917 1 1 13 NH2 HN1 H -3.511 9.361 -2.052 1.00 . A A . 12 NH2 HN1 1 1 37 6918 1 1 13 NH2 HN2 H -4.044 10.831 -2.713 1.00 . A A . 12 NH2 HN2 1 1 37 6919 1 1 13 NH2 N N -3.603 10.335 -1.993 1.00 . A A . 12 NH2 N 1 1 38 6920 1 1 2 ILE C C -2.038 -4.999 1.620 1.00 . A A . 1 ILE C 1 1 38 6921 1 1 2 ILE CA C -0.885 -5.247 2.594 1.00 . A A . 1 ILE CA 1 1 38 6922 1 1 2 ILE CB C 0.452 -4.744 2.028 1.00 . A A . 1 ILE CB 1 1 38 6923 1 1 2 ILE CD1 C 2.580 -3.596 2.687 1.00 . A A . 1 ILE CD1 1 1 38 6924 1 1 2 ILE CG1 C 1.363 -4.364 3.200 1.00 . A A . 1 ILE CG1 1 1 38 6925 1 1 2 ILE CG2 C 0.230 -3.518 1.119 1.00 . A A . 1 ILE CG2 1 1 38 6926 1 1 2 ILE H H 0.201 -7.099 2.768 1.00 . A A . 1 ILE H 1 1 38 6927 1 1 2 ILE HA H -1.078 -4.764 3.533 1.00 . A A . 1 ILE HA 1 1 38 6928 1 1 2 ILE HB H 0.913 -5.532 1.456 1.00 . A A . 1 ILE HB 1 1 38 6929 1 1 2 ILE HD11 H 2.536 -3.534 1.610 1.00 . A A . 1 ILE HD11 1 1 38 6930 1 1 2 ILE HD12 H 2.576 -2.600 3.105 1.00 . A A . 1 ILE HD12 1 1 38 6931 1 1 2 ILE HD13 H 3.481 -4.110 2.984 1.00 . A A . 1 ILE HD13 1 1 38 6932 1 1 2 ILE HG12 H 0.814 -3.743 3.895 1.00 . A A . 1 ILE HG12 1 1 38 6933 1 1 2 ILE HG13 H 1.694 -5.262 3.702 1.00 . A A . 1 ILE HG13 1 1 38 6934 1 1 2 ILE HG21 H -0.771 -3.136 1.264 1.00 . A A . 1 ILE HG21 1 1 38 6935 1 1 2 ILE HG22 H 0.941 -2.745 1.360 1.00 . A A . 1 ILE HG22 1 1 38 6936 1 1 2 ILE HG23 H 0.352 -3.809 0.086 1.00 . A A . 1 ILE HG23 1 1 38 6937 1 1 2 ILE N N -0.698 -6.708 2.799 1.00 . A A . 1 ILE N 1 1 38 6938 1 1 2 ILE O O -3.157 -4.754 2.017 1.00 . A A . 1 ILE O 1 1 38 6939 1 1 3 ASP C C -3.345 -3.375 -0.532 1.00 . A A . 2 ASP C 1 1 38 6940 1 1 3 ASP CA C -2.818 -4.803 -0.667 1.00 . A A . 2 ASP CA 1 1 38 6941 1 1 3 ASP CB C -3.920 -5.819 -0.357 1.00 . A A . 2 ASP CB 1 1 38 6942 1 1 3 ASP CG C -3.896 -6.935 -1.405 1.00 . A A . 2 ASP CG 1 1 38 6943 1 1 3 ASP H H -0.846 -5.248 0.061 1.00 . A A . 2 ASP H 1 1 38 6944 1 1 3 ASP HA H -2.434 -4.963 -1.660 1.00 . A A . 2 ASP HA 1 1 38 6945 1 1 3 ASP HB2 H -3.754 -6.240 0.623 1.00 . A A . 2 ASP HB2 1 1 38 6946 1 1 3 ASP HB3 H -4.880 -5.326 -0.382 1.00 . A A . 2 ASP HB3 1 1 38 6947 1 1 3 ASP N N -1.760 -5.052 0.348 1.00 . A A . 2 ASP N 1 1 38 6948 1 1 3 ASP O O -3.142 -2.543 -1.394 1.00 . A A . 2 ASP O 1 1 38 6949 1 1 3 ASP OD1 O -3.280 -6.738 -2.439 1.00 . A A . 2 ASP OD1 1 1 38 6950 1 1 3 ASP OD2 O -4.495 -7.967 -1.154 1.00 . A A . 2 ASP OD2 1 1 38 6951 1 1 4 TYR C C -3.489 -0.708 1.131 1.00 . A A . 3 TYR C 1 1 38 6952 1 1 4 TYR CA C -4.579 -1.718 0.723 1.00 . A A . 3 TYR CA 1 1 38 6953 1 1 4 TYR CB C -5.672 -1.861 1.792 1.00 . A A . 3 TYR CB 1 1 38 6954 1 1 4 TYR CD1 C -4.827 -3.439 3.567 1.00 . A A . 3 TYR CD1 1 1 38 6955 1 1 4 TYR CD2 C -4.747 -1.053 3.986 1.00 . A A . 3 TYR CD2 1 1 38 6956 1 1 4 TYR CE1 C -4.272 -3.678 4.829 1.00 . A A . 3 TYR CE1 1 1 38 6957 1 1 4 TYR CE2 C -4.191 -1.291 5.245 1.00 . A A . 3 TYR CE2 1 1 38 6958 1 1 4 TYR CG C -5.064 -2.127 3.146 1.00 . A A . 3 TYR CG 1 1 38 6959 1 1 4 TYR CZ C -3.955 -2.603 5.667 1.00 . A A . 3 TYR CZ 1 1 38 6960 1 1 4 TYR H H -4.185 -3.777 1.215 1.00 . A A . 3 TYR H 1 1 38 6961 1 1 4 TYR HA H -5.031 -1.391 -0.195 1.00 . A A . 3 TYR HA 1 1 38 6962 1 1 4 TYR HB2 H -6.251 -0.954 1.835 1.00 . A A . 3 TYR HB2 1 1 38 6963 1 1 4 TYR HB3 H -6.320 -2.684 1.527 1.00 . A A . 3 TYR HB3 1 1 38 6964 1 1 4 TYR HD1 H -5.073 -4.267 2.919 1.00 . A A . 3 TYR HD1 1 1 38 6965 1 1 4 TYR HD2 H -4.930 -0.040 3.659 1.00 . A A . 3 TYR HD2 1 1 38 6966 1 1 4 TYR HE1 H -4.089 -4.691 5.156 1.00 . A A . 3 TYR HE1 1 1 38 6967 1 1 4 TYR HE2 H -3.945 -0.463 5.893 1.00 . A A . 3 TYR HE2 1 1 38 6968 1 1 4 TYR HH H -2.775 -2.141 7.095 1.00 . A A . 3 TYR HH 1 1 38 6969 1 1 4 TYR N N -4.028 -3.089 0.538 1.00 . A A . 3 TYR N 1 1 38 6970 1 1 4 TYR O O -3.333 0.298 0.480 1.00 . A A . 3 TYR O 1 1 38 6971 1 1 4 TYR OH O -3.408 -2.838 6.913 1.00 . A A . 3 TYR OH 1 1 38 6972 1 1 5 TRP C C -1.297 0.997 1.590 1.00 . A A . 4 TRP C 1 1 38 6973 1 1 5 TRP CA C -1.666 -0.029 2.668 1.00 . A A . 4 TRP CA 1 1 38 6974 1 1 5 TRP CB C -0.447 -0.912 2.944 1.00 . A A . 4 TRP CB 1 1 38 6975 1 1 5 TRP CD1 C -1.511 -2.725 4.370 1.00 . A A . 4 TRP CD1 1 1 38 6976 1 1 5 TRP CD2 C 0.110 -1.610 5.446 1.00 . A A . 4 TRP CD2 1 1 38 6977 1 1 5 TRP CE2 C -0.387 -2.573 6.353 1.00 . A A . 4 TRP CE2 1 1 38 6978 1 1 5 TRP CE3 C 1.145 -0.771 5.875 1.00 . A A . 4 TRP CE3 1 1 38 6979 1 1 5 TRP CG C -0.626 -1.717 4.197 1.00 . A A . 4 TRP CG 1 1 38 6980 1 1 5 TRP CH2 C 1.161 -1.855 8.055 1.00 . A A . 4 TRP CH2 1 1 38 6981 1 1 5 TRP CZ2 C 0.128 -2.699 7.642 1.00 . A A . 4 TRP CZ2 1 1 38 6982 1 1 5 TRP CZ3 C 1.670 -0.892 7.173 1.00 . A A . 4 TRP CZ3 1 1 38 6983 1 1 5 TRP H H -2.905 -1.793 2.685 1.00 . A A . 4 TRP H 1 1 38 6984 1 1 5 TRP HA H -1.969 0.469 3.574 1.00 . A A . 4 TRP HA 1 1 38 6985 1 1 5 TRP HB2 H -0.303 -1.574 2.115 1.00 . A A . 4 TRP HB2 1 1 38 6986 1 1 5 TRP HB3 H 0.426 -0.284 3.047 1.00 . A A . 4 TRP HB3 1 1 38 6987 1 1 5 TRP HD1 H -2.210 -3.084 3.636 1.00 . A A . 4 TRP HD1 1 1 38 6988 1 1 5 TRP HE1 H -1.901 -3.961 6.030 1.00 . A A . 4 TRP HE1 1 1 38 6989 1 1 5 TRP HE3 H 1.542 -0.035 5.199 1.00 . A A . 4 TRP HE3 1 1 38 6990 1 1 5 TRP HH2 H 1.567 -1.946 9.051 1.00 . A A . 4 TRP HH2 1 1 38 6991 1 1 5 TRP HZ2 H -0.270 -3.444 8.315 1.00 . A A . 4 TRP HZ2 1 1 38 6992 1 1 5 TRP HZ3 H 2.470 -0.240 7.491 1.00 . A A . 4 TRP HZ3 1 1 38 6993 1 1 5 TRP N N -2.749 -0.972 2.193 1.00 . A A . 4 TRP N 1 1 38 6994 1 1 5 TRP NE1 N -1.372 -3.229 5.650 1.00 . A A . 4 TRP NE1 1 1 38 6995 1 1 5 TRP O O -1.350 2.191 1.801 1.00 . A A . 4 TRP O 1 1 38 6996 1 1 6 LEU C C -1.410 2.681 -0.716 1.00 . A A . 5 LEU C 1 1 38 6997 1 1 6 LEU CA C -0.535 1.417 -0.685 1.00 . A A . 5 LEU CA 1 1 38 6998 1 1 6 LEU CB C -0.762 0.548 -1.926 1.00 . A A . 5 LEU CB 1 1 38 6999 1 1 6 LEU CD1 C 0.344 2.058 -3.583 1.00 . A A . 5 LEU CD1 1 1 38 7000 1 1 6 LEU CD2 C -1.494 0.522 -4.301 1.00 . A A . 5 LEU CD2 1 1 38 7001 1 1 6 LEU CG C -0.979 1.412 -3.168 1.00 . A A . 5 LEU CG 1 1 38 7002 1 1 6 LEU H H -0.891 -0.453 0.310 1.00 . A A . 5 LEU H 1 1 38 7003 1 1 6 LEU HA H 0.507 1.683 -0.612 1.00 . A A . 5 LEU HA 1 1 38 7004 1 1 6 LEU HB2 H 0.100 -0.084 -2.080 1.00 . A A . 5 LEU HB2 1 1 38 7005 1 1 6 LEU HB3 H -1.633 -0.073 -1.770 1.00 . A A . 5 LEU HB3 1 1 38 7006 1 1 6 LEU HD11 H 1.147 1.345 -3.460 1.00 . A A . 5 LEU HD11 1 1 38 7007 1 1 6 LEU HD12 H 0.288 2.361 -4.618 1.00 . A A . 5 LEU HD12 1 1 38 7008 1 1 6 LEU HD13 H 0.533 2.922 -2.964 1.00 . A A . 5 LEU HD13 1 1 38 7009 1 1 6 LEU HD21 H -1.032 -0.453 -4.229 1.00 . A A . 5 LEU HD21 1 1 38 7010 1 1 6 LEU HD22 H -2.566 0.419 -4.219 1.00 . A A . 5 LEU HD22 1 1 38 7011 1 1 6 LEU HD23 H -1.246 0.967 -5.253 1.00 . A A . 5 LEU HD23 1 1 38 7012 1 1 6 LEU HG H -1.706 2.182 -2.955 1.00 . A A . 5 LEU HG 1 1 38 7013 1 1 6 LEU N N -0.922 0.517 0.439 1.00 . A A . 5 LEU N 1 1 38 7014 1 1 6 LEU O O -0.909 3.788 -0.779 1.00 . A A . 5 LEU O 1 1 38 7015 1 1 7 ALA C C -3.905 4.239 0.686 1.00 . A A . 6 ALA C 1 1 38 7016 1 1 7 ALA CA C -3.600 3.729 -0.728 1.00 . A A . 6 ALA CA 1 1 38 7017 1 1 7 ALA CB C -4.883 3.232 -1.396 1.00 . A A . 6 ALA CB 1 1 38 7018 1 1 7 ALA H H -3.093 1.631 -0.642 1.00 . A A . 6 ALA H 1 1 38 7019 1 1 7 ALA HA H -3.156 4.510 -1.322 1.00 . A A . 6 ALA HA 1 1 38 7020 1 1 7 ALA HB1 H -4.788 2.178 -1.616 1.00 . A A . 6 ALA HB1 1 1 38 7021 1 1 7 ALA HB2 H -5.719 3.385 -0.728 1.00 . A A . 6 ALA HB2 1 1 38 7022 1 1 7 ALA HB3 H -5.048 3.778 -2.311 1.00 . A A . 6 ALA HB3 1 1 38 7023 1 1 7 ALA N N -2.706 2.530 -0.684 1.00 . A A . 6 ALA N 1 1 38 7024 1 1 7 ALA O O -4.782 5.058 0.882 1.00 . A A . 6 ALA O 1 1 38 7025 1 1 8 HIS C C -2.194 4.786 3.693 1.00 . A A . 7 HIS C 1 1 38 7026 1 1 8 HIS CA C -3.472 4.203 3.068 1.00 . A A . 7 HIS CA 1 1 38 7027 1 1 8 HIS CB C -3.932 2.939 3.806 1.00 . A A . 7 HIS CB 1 1 38 7028 1 1 8 HIS CD2 C -5.020 1.830 1.680 1.00 . A A . 7 HIS CD2 1 1 38 7029 1 1 8 HIS CE1 C -6.890 1.196 2.562 1.00 . A A . 7 HIS CE1 1 1 38 7030 1 1 8 HIS CG C -4.984 2.222 2.996 1.00 . A A . 7 HIS CG 1 1 38 7031 1 1 8 HIS H H -2.508 3.085 1.498 1.00 . A A . 7 HIS H 1 1 38 7032 1 1 8 HIS HA H -4.261 4.940 3.076 1.00 . A A . 7 HIS HA 1 1 38 7033 1 1 8 HIS HB2 H -3.087 2.283 3.955 1.00 . A A . 7 HIS HB2 1 1 38 7034 1 1 8 HIS HB3 H -4.345 3.215 4.766 1.00 . A A . 7 HIS HB3 1 1 38 7035 1 1 8 HIS HD1 H -6.483 1.934 4.469 1.00 . A A . 7 HIS HD1 1 1 38 7036 1 1 8 HIS HD2 H -4.236 1.990 0.966 1.00 . A A . 7 HIS HD2 1 1 38 7037 1 1 8 HIS HE1 H -7.866 0.760 2.691 1.00 . A A . 7 HIS HE1 1 1 38 7038 1 1 8 HIS HE2 H -6.512 0.809 0.559 1.00 . A A . 7 HIS HE2 1 1 38 7039 1 1 8 HIS N N -3.203 3.753 1.673 1.00 . A A . 7 HIS N 1 1 38 7040 1 1 8 HIS ND1 N -6.192 1.807 3.541 1.00 . A A . 7 HIS ND1 1 1 38 7041 1 1 8 HIS NE2 N -6.220 1.188 1.414 1.00 . A A . 7 HIS NE2 1 1 38 7042 1 1 8 HIS O O -1.675 5.782 3.231 1.00 . A A . 7 HIS O 1 1 38 7043 1 1 9 LYS C C -0.674 6.151 5.859 1.00 . A A . 8 LYS C 1 1 38 7044 1 1 9 LYS CA C -0.441 4.719 5.370 1.00 . A A . 8 LYS CA 1 1 38 7045 1 1 9 LYS CB C 0.614 4.693 4.264 1.00 . A A . 8 LYS CB 1 1 38 7046 1 1 9 LYS CD C 2.081 2.799 3.547 1.00 . A A . 8 LYS CD 1 1 38 7047 1 1 9 LYS CE C 2.116 1.459 2.808 1.00 . A A . 8 LYS CE 1 1 38 7048 1 1 9 LYS CG C 0.639 3.308 3.613 1.00 . A A . 8 LYS CG 1 1 38 7049 1 1 9 LYS H H -2.105 3.380 5.102 1.00 . A A . 8 LYS H 1 1 38 7050 1 1 9 LYS HA H -0.133 4.086 6.187 1.00 . A A . 8 LYS HA 1 1 38 7051 1 1 9 LYS HB2 H 0.374 5.438 3.519 1.00 . A A . 8 LYS HB2 1 1 38 7052 1 1 9 LYS HB3 H 1.583 4.906 4.687 1.00 . A A . 8 LYS HB3 1 1 38 7053 1 1 9 LYS HD2 H 2.692 3.517 3.021 1.00 . A A . 8 LYS HD2 1 1 38 7054 1 1 9 LYS HD3 H 2.461 2.665 4.549 1.00 . A A . 8 LYS HD3 1 1 38 7055 1 1 9 LYS HE2 H 2.122 0.641 3.516 1.00 . A A . 8 LYS HE2 1 1 38 7056 1 1 9 LYS HE3 H 1.273 1.374 2.140 1.00 . A A . 8 LYS HE3 1 1 38 7057 1 1 9 LYS HG2 H 0.041 2.624 4.199 1.00 . A A . 8 LYS HG2 1 1 38 7058 1 1 9 LYS HG3 H 0.235 3.372 2.614 1.00 . A A . 8 LYS HG3 1 1 38 7059 1 1 9 LYS HZ1 H 4.181 1.677 2.666 1.00 . A A . 8 LYS HZ1 1 1 38 7060 1 1 9 LYS HZ2 H 3.528 0.560 1.570 1.00 . A A . 8 LYS HZ2 1 1 38 7061 1 1 9 LYS HZ3 H 3.331 2.226 1.302 1.00 . A A . 8 LYS HZ3 1 1 38 7062 1 1 9 LYS N N -1.680 4.181 4.735 1.00 . A A . 8 LYS N 1 1 38 7063 1 1 9 LYS NZ N 3.385 1.482 2.027 1.00 . A A . 8 LYS NZ 1 1 38 7064 1 1 9 LYS O O -1.604 6.815 5.445 1.00 . A A . 8 LYS O 1 1 38 7065 1 1 10 ALA C C -0.263 8.990 6.100 1.00 . A A . 9 ALA C 1 1 38 7066 1 1 10 ALA CA C -0.015 8.019 7.258 1.00 . A A . 9 ALA CA 1 1 38 7067 1 1 10 ALA CB C 1.300 8.349 7.964 1.00 . A A . 9 ALA CB 1 1 38 7068 1 1 10 ALA H H 0.903 6.079 7.063 1.00 . A A . 9 ALA H 1 1 38 7069 1 1 10 ALA HA H -0.831 8.057 7.963 1.00 . A A . 9 ALA HA 1 1 38 7070 1 1 10 ALA HB1 H 1.697 7.455 8.421 1.00 . A A . 9 ALA HB1 1 1 38 7071 1 1 10 ALA HB2 H 2.010 8.730 7.244 1.00 . A A . 9 ALA HB2 1 1 38 7072 1 1 10 ALA HB3 H 1.124 9.095 8.725 1.00 . A A . 9 ALA HB3 1 1 38 7073 1 1 10 ALA N N 0.161 6.631 6.740 1.00 . A A . 9 ALA N 1 1 38 7074 1 1 10 ALA O O 0.659 9.478 5.478 1.00 . A A . 9 ALA O 1 1 38 7075 1 1 11 LEU C C -2.883 11.218 5.125 1.00 . A A . 10 LEU C 1 1 38 7076 1 1 11 LEU CA C -1.810 10.214 4.691 1.00 . A A . 10 LEU CA 1 1 38 7077 1 1 11 LEU CB C -2.333 9.326 3.561 1.00 . A A . 10 LEU CB 1 1 38 7078 1 1 11 LEU CD1 C -2.227 9.733 1.097 1.00 . A A . 10 LEU CD1 1 1 38 7079 1 1 11 LEU CD2 C -4.369 10.089 2.332 1.00 . A A . 10 LEU CD2 1 1 38 7080 1 1 11 LEU CG C -2.845 10.202 2.416 1.00 . A A . 10 LEU CG 1 1 38 7081 1 1 11 LEU H H -2.233 8.870 6.322 1.00 . A A . 10 LEU H 1 1 38 7082 1 1 11 LEU HA H -0.918 10.728 4.373 1.00 . A A . 10 LEU HA 1 1 38 7083 1 1 11 LEU HB2 H -1.534 8.693 3.202 1.00 . A A . 10 LEU HB2 1 1 38 7084 1 1 11 LEU HB3 H -3.140 8.712 3.930 1.00 . A A . 10 LEU HB3 1 1 38 7085 1 1 11 LEU HD11 H -1.157 9.647 1.212 1.00 . A A . 10 LEU HD11 1 1 38 7086 1 1 11 LEU HD12 H -2.639 8.770 0.830 1.00 . A A . 10 LEU HD12 1 1 38 7087 1 1 11 LEU HD13 H -2.451 10.448 0.321 1.00 . A A . 10 LEU HD13 1 1 38 7088 1 1 11 LEU HD21 H -4.676 9.107 2.658 1.00 . A A . 10 LEU HD21 1 1 38 7089 1 1 11 LEU HD22 H -4.821 10.837 2.967 1.00 . A A . 10 LEU HD22 1 1 38 7090 1 1 11 LEU HD23 H -4.686 10.245 1.312 1.00 . A A . 10 LEU HD23 1 1 38 7091 1 1 11 LEU HG H -2.567 11.231 2.597 1.00 . A A . 10 LEU HG 1 1 38 7092 1 1 11 LEU N N -1.503 9.274 5.808 1.00 . A A . 10 LEU N 1 1 38 7093 1 1 11 LEU O O -4.036 10.874 5.291 1.00 . A A . 10 LEU O 1 1 38 7094 1 1 12 ALA C C -3.220 14.819 5.061 1.00 . A A . 11 ALA C 1 1 38 7095 1 1 12 ALA CA C -3.512 13.478 5.737 1.00 . A A . 11 ALA CA 1 1 38 7096 1 1 12 ALA CB C -3.342 13.593 7.252 1.00 . A A . 11 ALA CB 1 1 38 7097 1 1 12 ALA H H -1.575 12.712 5.175 1.00 . A A . 11 ALA H 1 1 38 7098 1 1 12 ALA HA H -4.511 13.146 5.503 1.00 . A A . 11 ALA HA 1 1 38 7099 1 1 12 ALA HB1 H -3.282 12.606 7.685 1.00 . A A . 11 ALA HB1 1 1 38 7100 1 1 12 ALA HB2 H -2.436 14.139 7.472 1.00 . A A . 11 ALA HB2 1 1 38 7101 1 1 12 ALA HB3 H -4.189 14.120 7.670 1.00 . A A . 11 ALA HB3 1 1 38 7102 1 1 12 ALA N N -2.512 12.455 5.313 1.00 . A A . 11 ALA N 1 1 38 7103 1 1 12 ALA O O -2.452 14.892 4.121 1.00 . A A . 11 ALA O 1 1 38 7104 1 1 13 NH2 HN1 H -4.425 15.842 6.262 1.00 . A A . 12 NH2 HN1 1 1 38 7105 1 1 13 NH2 HN2 H -3.628 16.763 5.080 1.00 . A A . 12 NH2 HN2 1 1 38 7106 1 1 13 NH2 N N -3.806 15.898 5.505 1.00 . A A . 12 NH2 N 1 1 39 7107 1 1 2 ILE C C -2.018 -4.892 1.703 1.00 . A A . 1 ILE C 1 1 39 7108 1 1 2 ILE CA C -0.826 -5.126 2.632 1.00 . A A . 1 ILE CA 1 1 39 7109 1 1 2 ILE CB C 0.492 -4.646 2.001 1.00 . A A . 1 ILE CB 1 1 39 7110 1 1 2 ILE CD1 C 1.935 -5.333 3.921 1.00 . A A . 1 ILE CD1 1 1 39 7111 1 1 2 ILE CG1 C 1.418 -4.145 3.109 1.00 . A A . 1 ILE CG1 1 1 39 7112 1 1 2 ILE CG2 C 0.245 -3.499 1.003 1.00 . A A . 1 ILE CG2 1 1 39 7113 1 1 2 ILE H H 0.243 -6.992 2.772 1.00 . A A . 1 ILE H 1 1 39 7114 1 1 2 ILE HA H -0.978 -4.628 3.569 1.00 . A A . 1 ILE HA 1 1 39 7115 1 1 2 ILE HB H 0.960 -5.469 1.489 1.00 . A A . 1 ILE HB 1 1 39 7116 1 1 2 ILE HD11 H 2.368 -6.064 3.252 1.00 . A A . 1 ILE HD11 1 1 39 7117 1 1 2 ILE HD12 H 2.686 -4.994 4.618 1.00 . A A . 1 ILE HD12 1 1 39 7118 1 1 2 ILE HD13 H 1.117 -5.782 4.463 1.00 . A A . 1 ILE HD13 1 1 39 7119 1 1 2 ILE HG12 H 2.252 -3.616 2.670 1.00 . A A . 1 ILE HG12 1 1 39 7120 1 1 2 ILE HG13 H 0.870 -3.479 3.761 1.00 . A A . 1 ILE HG13 1 1 39 7121 1 1 2 ILE HG21 H -0.738 -3.079 1.167 1.00 . A A . 1 ILE HG21 1 1 39 7122 1 1 2 ILE HG22 H 0.989 -2.730 1.146 1.00 . A A . 1 ILE HG22 1 1 39 7123 1 1 2 ILE HG23 H 0.308 -3.877 -0.005 1.00 . A A . 1 ILE HG23 1 1 39 7124 1 1 2 ILE N N -0.645 -6.586 2.857 1.00 . A A . 1 ILE N 1 1 39 7125 1 1 2 ILE O O -3.107 -4.584 2.141 1.00 . A A . 1 ILE O 1 1 39 7126 1 1 3 ASP C C -3.405 -3.362 -0.457 1.00 . A A . 2 ASP C 1 1 39 7127 1 1 3 ASP CA C -2.908 -4.804 -0.552 1.00 . A A . 2 ASP CA 1 1 39 7128 1 1 3 ASP CB C -4.009 -5.784 -0.148 1.00 . A A . 2 ASP CB 1 1 39 7129 1 1 3 ASP CG C -3.963 -7.008 -1.065 1.00 . A A . 2 ASP CG 1 1 39 7130 1 1 3 ASP H H -0.916 -5.277 0.108 1.00 . A A . 2 ASP H 1 1 39 7131 1 1 3 ASP HA H -2.572 -5.014 -1.552 1.00 . A A . 2 ASP HA 1 1 39 7132 1 1 3 ASP HB2 H -3.857 -6.094 0.876 1.00 . A A . 2 ASP HB2 1 1 39 7133 1 1 3 ASP HB3 H -4.971 -5.304 -0.241 1.00 . A A . 2 ASP HB3 1 1 39 7134 1 1 3 ASP N N -1.807 -5.029 0.425 1.00 . A A . 2 ASP N 1 1 39 7135 1 1 3 ASP O O -3.202 -2.563 -1.348 1.00 . A A . 2 ASP O 1 1 39 7136 1 1 3 ASP OD1 O -4.440 -6.904 -2.183 1.00 . A A . 2 ASP OD1 1 1 39 7137 1 1 3 ASP OD2 O -3.453 -8.029 -0.633 1.00 . A A . 2 ASP OD2 1 1 39 7138 1 1 4 TYR C C -3.475 -0.642 1.116 1.00 . A A . 3 TYR C 1 1 39 7139 1 1 4 TYR CA C -4.590 -1.644 0.762 1.00 . A A . 3 TYR CA 1 1 39 7140 1 1 4 TYR CB C -5.661 -1.734 1.856 1.00 . A A . 3 TYR CB 1 1 39 7141 1 1 4 TYR CD1 C -4.770 -3.291 3.623 1.00 . A A . 3 TYR CD1 1 1 39 7142 1 1 4 TYR CD2 C -4.703 -0.902 4.024 1.00 . A A . 3 TYR CD2 1 1 39 7143 1 1 4 TYR CE1 C -4.187 -3.516 4.872 1.00 . A A . 3 TYR CE1 1 1 39 7144 1 1 4 TYR CE2 C -4.122 -1.127 5.274 1.00 . A A . 3 TYR CE2 1 1 39 7145 1 1 4 TYR CG C -5.027 -1.984 3.199 1.00 . A A . 3 TYR CG 1 1 39 7146 1 1 4 TYR CZ C -3.863 -2.433 5.698 1.00 . A A . 3 TYR CZ 1 1 39 7147 1 1 4 TYR H H -4.224 -3.693 1.314 1.00 . A A . 3 TYR H 1 1 39 7148 1 1 4 TYR HA H -5.053 -1.340 -0.158 1.00 . A A . 3 TYR HA 1 1 39 7149 1 1 4 TYR HB2 H -6.215 -0.811 1.890 1.00 . A A . 3 TYR HB2 1 1 39 7150 1 1 4 TYR HB3 H -6.337 -2.546 1.625 1.00 . A A . 3 TYR HB3 1 1 39 7151 1 1 4 TYR HD1 H -5.020 -4.126 2.984 1.00 . A A . 3 TYR HD1 1 1 39 7152 1 1 4 TYR HD2 H -4.903 0.107 3.695 1.00 . A A . 3 TYR HD2 1 1 39 7153 1 1 4 TYR HE1 H -3.986 -4.526 5.202 1.00 . A A . 3 TYR HE1 1 1 39 7154 1 1 4 TYR HE2 H -3.870 -0.292 5.912 1.00 . A A . 3 TYR HE2 1 1 39 7155 1 1 4 TYR HH H -3.984 -2.939 7.535 1.00 . A A . 3 TYR HH 1 1 39 7156 1 1 4 TYR N N -4.066 -3.028 0.613 1.00 . A A . 3 TYR N 1 1 39 7157 1 1 4 TYR O O -3.327 0.348 0.441 1.00 . A A . 3 TYR O 1 1 39 7158 1 1 4 TYR OH O -3.291 -2.655 6.935 1.00 . A A . 3 TYR OH 1 1 39 7159 1 1 5 TRP C C -1.240 1.026 1.453 1.00 . A A . 4 TRP C 1 1 39 7160 1 1 5 TRP CA C -1.593 0.045 2.575 1.00 . A A . 4 TRP CA 1 1 39 7161 1 1 5 TRP CB C -0.379 -0.846 2.851 1.00 . A A . 4 TRP CB 1 1 39 7162 1 1 5 TRP CD1 C -1.426 -2.591 4.363 1.00 . A A . 4 TRP CD1 1 1 39 7163 1 1 5 TRP CD2 C 0.207 -1.434 5.375 1.00 . A A . 4 TRP CD2 1 1 39 7164 1 1 5 TRP CE2 C -0.280 -2.360 6.324 1.00 . A A . 4 TRP CE2 1 1 39 7165 1 1 5 TRP CE3 C 1.247 -0.579 5.759 1.00 . A A . 4 TRP CE3 1 1 39 7166 1 1 5 TRP CG C -0.543 -1.594 4.139 1.00 . A A . 4 TRP CG 1 1 39 7167 1 1 5 TRP CH2 C 1.285 -1.575 7.980 1.00 . A A . 4 TRP CH2 1 1 39 7168 1 1 5 TRP CZ2 C 0.248 -2.435 7.611 1.00 . A A . 4 TRP CZ2 1 1 39 7169 1 1 5 TRP CZ3 C 1.785 -0.648 7.054 1.00 . A A . 4 TRP CZ3 1 1 39 7170 1 1 5 TRP H H -2.853 -1.705 2.673 1.00 . A A . 4 TRP H 1 1 39 7171 1 1 5 TRP HA H -1.867 0.580 3.470 1.00 . A A . 4 TRP HA 1 1 39 7172 1 1 5 TRP HB2 H -0.268 -1.545 2.047 1.00 . A A . 4 TRP HB2 1 1 39 7173 1 1 5 TRP HB3 H 0.506 -0.230 2.908 1.00 . A A . 4 TRP HB3 1 1 39 7174 1 1 5 TRP HD1 H -2.131 -2.979 3.649 1.00 . A A . 4 TRP HD1 1 1 39 7175 1 1 5 TRP HE1 H -1.797 -3.762 6.072 1.00 . A A . 4 TRP HE1 1 1 39 7176 1 1 5 TRP HE3 H 1.637 0.131 5.051 1.00 . A A . 4 TRP HE3 1 1 39 7177 1 1 5 TRP HH2 H 1.701 -1.625 8.976 1.00 . A A . 4 TRP HH2 1 1 39 7178 1 1 5 TRP HZ2 H -0.143 -3.153 8.316 1.00 . A A . 4 TRP HZ2 1 1 39 7179 1 1 5 TRP HZ3 H 2.587 0.016 7.340 1.00 . A A . 4 TRP HZ3 1 1 39 7180 1 1 5 TRP N N -2.703 -0.895 2.159 1.00 . A A . 4 TRP N 1 1 39 7181 1 1 5 TRP NE1 N -1.271 -3.045 5.658 1.00 . A A . 4 TRP NE1 1 1 39 7182 1 1 5 TRP O O -1.259 2.228 1.627 1.00 . A A . 4 TRP O 1 1 39 7183 1 1 6 LEU C C -1.416 2.634 -0.894 1.00 . A A . 5 LEU C 1 1 39 7184 1 1 6 LEU CA C -0.562 1.355 -0.863 1.00 . A A . 5 LEU CA 1 1 39 7185 1 1 6 LEU CB C -0.858 0.452 -2.067 1.00 . A A . 5 LEU CB 1 1 39 7186 1 1 6 LEU CD1 C 0.173 1.906 -3.820 1.00 . A A . 5 LEU CD1 1 1 39 7187 1 1 6 LEU CD2 C -1.706 0.363 -4.404 1.00 . A A . 5 LEU CD2 1 1 39 7188 1 1 6 LEU CG C -1.132 1.282 -3.322 1.00 . A A . 5 LEU CG 1 1 39 7189 1 1 6 LEU H H -0.920 -0.474 0.205 1.00 . A A . 5 LEU H 1 1 39 7190 1 1 6 LEU HA H 0.486 1.603 -0.840 1.00 . A A . 5 LEU HA 1 1 39 7191 1 1 6 LEU HB2 H -0.008 -0.191 -2.244 1.00 . A A . 5 LEU HB2 1 1 39 7192 1 1 6 LEU HB3 H -1.722 -0.157 -1.849 1.00 . A A . 5 LEU HB3 1 1 39 7193 1 1 6 LEU HD11 H 0.941 1.148 -3.864 1.00 . A A . 5 LEU HD11 1 1 39 7194 1 1 6 LEU HD12 H 0.020 2.322 -4.804 1.00 . A A . 5 LEU HD12 1 1 39 7195 1 1 6 LEU HD13 H 0.478 2.689 -3.142 1.00 . A A . 5 LEU HD13 1 1 39 7196 1 1 6 LEU HD21 H -1.457 -0.663 -4.173 1.00 . A A . 5 LEU HD21 1 1 39 7197 1 1 6 LEU HD22 H -2.779 0.473 -4.437 1.00 . A A . 5 LEU HD22 1 1 39 7198 1 1 6 LEU HD23 H -1.285 0.627 -5.363 1.00 . A A . 5 LEU HD23 1 1 39 7199 1 1 6 LEU HG H -1.843 2.061 -3.095 1.00 . A A . 5 LEU HG 1 1 39 7200 1 1 6 LEU N N -0.922 0.501 0.304 1.00 . A A . 5 LEU N 1 1 39 7201 1 1 6 LEU O O -0.899 3.729 -0.989 1.00 . A A . 5 LEU O 1 1 39 7202 1 1 7 ALA C C -3.857 4.252 0.540 1.00 . A A . 6 ALA C 1 1 39 7203 1 1 7 ALA CA C -3.590 3.715 -0.871 1.00 . A A . 6 ALA CA 1 1 39 7204 1 1 7 ALA CB C -4.893 3.229 -1.505 1.00 . A A . 6 ALA CB 1 1 39 7205 1 1 7 ALA H H -3.114 1.611 -0.763 1.00 . A A . 6 ALA H 1 1 39 7206 1 1 7 ALA HA H -3.146 4.479 -1.487 1.00 . A A . 6 ALA HA 1 1 39 7207 1 1 7 ALA HB1 H -4.701 2.341 -2.090 1.00 . A A . 6 ALA HB1 1 1 39 7208 1 1 7 ALA HB2 H -5.607 2.999 -0.727 1.00 . A A . 6 ALA HB2 1 1 39 7209 1 1 7 ALA HB3 H -5.293 4.001 -2.143 1.00 . A A . 6 ALA HB3 1 1 39 7210 1 1 7 ALA N N -2.714 2.503 -0.829 1.00 . A A . 6 ALA N 1 1 39 7211 1 1 7 ALA O O -4.673 5.133 0.730 1.00 . A A . 6 ALA O 1 1 39 7212 1 1 8 HIS C C -2.134 4.708 3.545 1.00 . A A . 7 HIS C 1 1 39 7213 1 1 8 HIS CA C -3.439 4.205 2.922 1.00 . A A . 7 HIS CA 1 1 39 7214 1 1 8 HIS CB C -3.965 2.982 3.684 1.00 . A A . 7 HIS CB 1 1 39 7215 1 1 8 HIS CD2 C -5.095 1.890 1.568 1.00 . A A . 7 HIS CD2 1 1 39 7216 1 1 8 HIS CE1 C -6.980 1.322 2.463 1.00 . A A . 7 HIS CE1 1 1 39 7217 1 1 8 HIS CG C -5.042 2.293 2.880 1.00 . A A . 7 HIS CG 1 1 39 7218 1 1 8 HIS H H -2.550 3.006 1.366 1.00 . A A . 7 HIS H 1 1 39 7219 1 1 8 HIS HA H -4.182 4.987 2.925 1.00 . A A . 7 HIS HA 1 1 39 7220 1 1 8 HIS HB2 H -3.153 2.292 3.859 1.00 . A A . 7 HIS HB2 1 1 39 7221 1 1 8 HIS HB3 H -4.375 3.300 4.631 1.00 . A A . 7 HIS HB3 1 1 39 7222 1 1 8 HIS HD1 H -6.543 2.065 4.360 1.00 . A A . 7 HIS HD1 1 1 39 7223 1 1 8 HIS HD2 H -4.308 2.017 0.850 1.00 . A A . 7 HIS HD2 1 1 39 7224 1 1 8 HIS HE1 H -7.965 0.912 2.600 1.00 . A A . 7 HIS HE1 1 1 39 7225 1 1 8 HIS HE2 H -6.621 0.905 0.462 1.00 . A A . 7 HIS HE2 1 1 39 7226 1 1 8 HIS N N -3.196 3.725 1.532 1.00 . A A . 7 HIS N 1 1 39 7227 1 1 8 HIS ND1 N -6.260 1.920 3.434 1.00 . A A . 7 HIS ND1 1 1 39 7228 1 1 8 HIS NE2 N -6.315 1.284 1.312 1.00 . A A . 7 HIS NE2 1 1 39 7229 1 1 8 HIS O O -2.075 5.020 4.717 1.00 . A A . 7 HIS O 1 1 39 7230 1 1 9 LYS C C 0.285 6.802 3.220 1.00 . A A . 8 LYS C 1 1 39 7231 1 1 9 LYS CA C 0.210 5.276 3.317 1.00 . A A . 8 LYS CA 1 1 39 7232 1 1 9 LYS CB C 1.279 4.630 2.433 1.00 . A A . 8 LYS CB 1 1 39 7233 1 1 9 LYS CD C 2.716 2.640 2.900 1.00 . A A . 8 LYS CD 1 1 39 7234 1 1 9 LYS CE C 3.632 3.204 1.812 1.00 . A A . 8 LYS CE 1 1 39 7235 1 1 9 LYS CG C 1.283 3.117 2.658 1.00 . A A . 8 LYS CG 1 1 39 7236 1 1 9 LYS H H -1.158 4.535 1.825 1.00 . A A . 8 LYS H 1 1 39 7237 1 1 9 LYS HA H 0.334 4.955 4.338 1.00 . A A . 8 LYS HA 1 1 39 7238 1 1 9 LYS HB2 H 1.062 4.841 1.395 1.00 . A A . 8 LYS HB2 1 1 39 7239 1 1 9 LYS HB3 H 2.248 5.032 2.688 1.00 . A A . 8 LYS HB3 1 1 39 7240 1 1 9 LYS HD2 H 3.051 2.983 3.867 1.00 . A A . 8 LYS HD2 1 1 39 7241 1 1 9 LYS HD3 H 2.746 1.562 2.869 1.00 . A A . 8 LYS HD3 1 1 39 7242 1 1 9 LYS HE2 H 3.064 3.417 0.917 1.00 . A A . 8 LYS HE2 1 1 39 7243 1 1 9 LYS HE3 H 4.131 4.093 2.163 1.00 . A A . 8 LYS HE3 1 1 39 7244 1 1 9 LYS HG2 H 0.673 2.880 3.519 1.00 . A A . 8 LYS HG2 1 1 39 7245 1 1 9 LYS HG3 H 0.883 2.621 1.787 1.00 . A A . 8 LYS HG3 1 1 39 7246 1 1 9 LYS HZ1 H 5.010 1.785 2.459 1.00 . A A . 8 LYS HZ1 1 1 39 7247 1 1 9 LYS HZ2 H 4.170 1.343 1.050 1.00 . A A . 8 LYS HZ2 1 1 39 7248 1 1 9 LYS HZ3 H 5.403 2.504 0.970 1.00 . A A . 8 LYS HZ3 1 1 39 7249 1 1 9 LYS N N -1.089 4.790 2.769 1.00 . A A . 8 LYS N 1 1 39 7250 1 1 9 LYS NZ N 4.629 2.128 1.553 1.00 . A A . 8 LYS NZ 1 1 39 7251 1 1 9 LYS O O -0.720 7.476 3.112 1.00 . A A . 8 LYS O 1 1 39 7252 1 1 10 ALA C C 0.957 9.345 1.876 1.00 . A A . 9 ALA C 1 1 39 7253 1 1 10 ALA CA C 1.604 8.834 3.167 1.00 . A A . 9 ALA CA 1 1 39 7254 1 1 10 ALA CB C 3.110 9.093 3.151 1.00 . A A . 9 ALA CB 1 1 39 7255 1 1 10 ALA H H 2.267 6.790 3.344 1.00 . A A . 9 ALA H 1 1 39 7256 1 1 10 ALA HA H 1.157 9.307 4.026 1.00 . A A . 9 ALA HA 1 1 39 7257 1 1 10 ALA HB1 H 3.611 8.338 3.739 1.00 . A A . 9 ALA HB1 1 1 39 7258 1 1 10 ALA HB2 H 3.472 9.055 2.134 1.00 . A A . 9 ALA HB2 1 1 39 7259 1 1 10 ALA HB3 H 3.312 10.068 3.568 1.00 . A A . 9 ALA HB3 1 1 39 7260 1 1 10 ALA N N 1.468 7.351 3.257 1.00 . A A . 9 ALA N 1 1 39 7261 1 1 10 ALA O O 1.497 9.194 0.798 1.00 . A A . 9 ALA O 1 1 39 7262 1 1 11 LEU C C -2.173 11.182 1.136 1.00 . A A . 10 LEU C 1 1 39 7263 1 1 11 LEU CA C -0.876 10.465 0.755 1.00 . A A . 10 LEU CA 1 1 39 7264 1 1 11 LEU CB C -1.176 9.224 -0.087 1.00 . A A . 10 LEU CB 1 1 39 7265 1 1 11 LEU CD1 C 0.123 9.752 -2.154 1.00 . A A . 10 LEU CD1 1 1 39 7266 1 1 11 LEU CD2 C -2.056 8.543 -2.322 1.00 . A A . 10 LEU CD2 1 1 39 7267 1 1 11 LEU CG C -1.280 9.620 -1.560 1.00 . A A . 10 LEU CG 1 1 39 7268 1 1 11 LEU H H -0.616 10.057 2.856 1.00 . A A . 10 LEU H 1 1 39 7269 1 1 11 LEU HA H -0.222 11.130 0.213 1.00 . A A . 10 LEU HA 1 1 39 7270 1 1 11 LEU HB2 H -0.381 8.504 0.038 1.00 . A A . 10 LEU HB2 1 1 39 7271 1 1 11 LEU HB3 H -2.110 8.790 0.234 1.00 . A A . 10 LEU HB3 1 1 39 7272 1 1 11 LEU HD11 H 0.697 10.456 -1.570 1.00 . A A . 10 LEU HD11 1 1 39 7273 1 1 11 LEU HD12 H 0.613 8.790 -2.141 1.00 . A A . 10 LEU HD12 1 1 39 7274 1 1 11 LEU HD13 H 0.051 10.105 -3.173 1.00 . A A . 10 LEU HD13 1 1 39 7275 1 1 11 LEU HD21 H -2.200 7.684 -1.684 1.00 . A A . 10 LEU HD21 1 1 39 7276 1 1 11 LEU HD22 H -3.017 8.934 -2.621 1.00 . A A . 10 LEU HD22 1 1 39 7277 1 1 11 LEU HD23 H -1.498 8.251 -3.199 1.00 . A A . 10 LEU HD23 1 1 39 7278 1 1 11 LEU HG H -1.797 10.565 -1.643 1.00 . A A . 10 LEU HG 1 1 39 7279 1 1 11 LEU N N -0.196 9.947 1.977 1.00 . A A . 10 LEU N 1 1 39 7280 1 1 11 LEU O O -3.020 10.635 1.815 1.00 . A A . 10 LEU O 1 1 39 7281 1 1 12 ALA C C -4.180 13.779 -0.223 1.00 . A A . 11 ALA C 1 1 39 7282 1 1 12 ALA CA C -3.581 13.152 1.040 1.00 . A A . 11 ALA CA 1 1 39 7283 1 1 12 ALA CB C -3.135 14.239 2.018 1.00 . A A . 11 ALA CB 1 1 39 7284 1 1 12 ALA H H -1.643 12.825 0.156 1.00 . A A . 11 ALA H 1 1 39 7285 1 1 12 ALA HA H -4.298 12.500 1.514 1.00 . A A . 11 ALA HA 1 1 39 7286 1 1 12 ALA HB1 H -2.201 14.664 1.682 1.00 . A A . 11 ALA HB1 1 1 39 7287 1 1 12 ALA HB2 H -3.887 15.014 2.063 1.00 . A A . 11 ALA HB2 1 1 39 7288 1 1 12 ALA HB3 H -3.003 13.809 3.000 1.00 . A A . 11 ALA HB3 1 1 39 7289 1 1 12 ALA N N -2.337 12.401 0.703 1.00 . A A . 11 ALA N 1 1 39 7290 1 1 12 ALA O O -3.755 13.489 -1.324 1.00 . A A . 11 ALA O 1 1 39 7291 1 1 13 NH2 HN1 H -5.501 14.870 0.779 1.00 . A A . 12 NH2 HN1 1 1 39 7292 1 1 13 NH2 HN2 H -5.547 15.043 -0.910 1.00 . A A . 12 NH2 HN2 1 1 39 7293 1 1 13 NH2 N N -5.158 14.634 -0.109 1.00 . A A . 12 NH2 N 1 1 40 7294 1 1 2 ILE C C -2.017 -5.004 1.614 1.00 . A A . 1 ILE C 1 1 40 7295 1 1 2 ILE CA C -0.856 -5.266 2.575 1.00 . A A . 1 ILE CA 1 1 40 7296 1 1 2 ILE CB C 0.476 -4.735 2.021 1.00 . A A . 1 ILE CB 1 1 40 7297 1 1 2 ILE CD1 C 2.569 -3.528 2.691 1.00 . A A . 1 ILE CD1 1 1 40 7298 1 1 2 ILE CG1 C 1.344 -4.284 3.201 1.00 . A A . 1 ILE CG1 1 1 40 7299 1 1 2 ILE CG2 C 0.240 -3.548 1.064 1.00 . A A . 1 ILE CG2 1 1 40 7300 1 1 2 ILE H H 0.233 -7.124 2.637 1.00 . A A . 1 ILE H 1 1 40 7301 1 1 2 ILE HA H -1.052 -4.813 3.528 1.00 . A A . 1 ILE HA 1 1 40 7302 1 1 2 ILE HB H 0.978 -5.527 1.490 1.00 . A A . 1 ILE HB 1 1 40 7303 1 1 2 ILE HD11 H 2.542 -3.490 1.612 1.00 . A A . 1 ILE HD11 1 1 40 7304 1 1 2 ILE HD12 H 2.559 -2.523 3.087 1.00 . A A . 1 ILE HD12 1 1 40 7305 1 1 2 ILE HD13 H 3.464 -4.035 3.013 1.00 . A A . 1 ILE HD13 1 1 40 7306 1 1 2 ILE HG12 H 0.763 -3.635 3.844 1.00 . A A . 1 ILE HG12 1 1 40 7307 1 1 2 ILE HG13 H 1.667 -5.151 3.761 1.00 . A A . 1 ILE HG13 1 1 40 7308 1 1 2 ILE HG21 H -0.755 -3.154 1.213 1.00 . A A . 1 ILE HG21 1 1 40 7309 1 1 2 ILE HG22 H 0.960 -2.770 1.257 1.00 . A A . 1 ILE HG22 1 1 40 7310 1 1 2 ILE HG23 H 0.339 -3.884 0.043 1.00 . A A . 1 ILE HG23 1 1 40 7311 1 1 2 ILE N N -0.659 -6.733 2.736 1.00 . A A . 1 ILE N 1 1 40 7312 1 1 2 ILE O O -3.121 -4.716 2.027 1.00 . A A . 1 ILE O 1 1 40 7313 1 1 3 ASP C C -3.354 -3.414 -0.539 1.00 . A A . 2 ASP C 1 1 40 7314 1 1 3 ASP CA C -2.813 -4.837 -0.681 1.00 . A A . 2 ASP CA 1 1 40 7315 1 1 3 ASP CB C -3.910 -5.868 -0.405 1.00 . A A . 2 ASP CB 1 1 40 7316 1 1 3 ASP CG C -3.437 -7.251 -0.854 1.00 . A A . 2 ASP CG 1 1 40 7317 1 1 3 ASP H H -0.850 -5.323 0.051 1.00 . A A . 2 ASP H 1 1 40 7318 1 1 3 ASP HA H -2.418 -4.979 -1.673 1.00 . A A . 2 ASP HA 1 1 40 7319 1 1 3 ASP HB2 H -4.132 -5.889 0.651 1.00 . A A . 2 ASP HB2 1 1 40 7320 1 1 3 ASP HB3 H -4.801 -5.601 -0.953 1.00 . A A . 2 ASP HB3 1 1 40 7321 1 1 3 ASP N N -1.756 -5.094 0.339 1.00 . A A . 2 ASP N 1 1 40 7322 1 1 3 ASP O O -3.153 -2.578 -1.397 1.00 . A A . 2 ASP O 1 1 40 7323 1 1 3 ASP OD1 O -2.295 -7.582 -0.579 1.00 . A A . 2 ASP OD1 1 1 40 7324 1 1 3 ASP OD2 O -4.223 -7.956 -1.465 1.00 . A A . 2 ASP OD2 1 1 40 7325 1 1 4 TYR C C -3.513 -0.759 1.113 1.00 . A A . 3 TYR C 1 1 40 7326 1 1 4 TYR CA C -4.601 -1.769 0.704 1.00 . A A . 3 TYR CA 1 1 40 7327 1 1 4 TYR CB C -5.698 -1.905 1.769 1.00 . A A . 3 TYR CB 1 1 40 7328 1 1 4 TYR CD1 C -4.860 -3.522 3.509 1.00 . A A . 3 TYR CD1 1 1 40 7329 1 1 4 TYR CD2 C -4.791 -1.146 3.985 1.00 . A A . 3 TYR CD2 1 1 40 7330 1 1 4 TYR CE1 C -4.311 -3.789 4.768 1.00 . A A . 3 TYR CE1 1 1 40 7331 1 1 4 TYR CE2 C -4.244 -1.413 5.244 1.00 . A A . 3 TYR CE2 1 1 40 7332 1 1 4 TYR CG C -5.099 -2.200 3.119 1.00 . A A . 3 TYR CG 1 1 40 7333 1 1 4 TYR CZ C -4.004 -2.734 5.634 1.00 . A A . 3 TYR CZ 1 1 40 7334 1 1 4 TYR H H -4.201 -3.826 1.201 1.00 . A A . 3 TYR H 1 1 40 7335 1 1 4 TYR HA H -5.046 -1.446 -0.218 1.00 . A A . 3 TYR HA 1 1 40 7336 1 1 4 TYR HB2 H -6.260 -0.985 1.822 1.00 . A A . 3 TYR HB2 1 1 40 7337 1 1 4 TYR HB3 H -6.363 -2.711 1.491 1.00 . A A . 3 TYR HB3 1 1 40 7338 1 1 4 TYR HD1 H -5.097 -4.335 2.839 1.00 . A A . 3 TYR HD1 1 1 40 7339 1 1 4 TYR HD2 H -4.976 -0.127 3.682 1.00 . A A . 3 TYR HD2 1 1 40 7340 1 1 4 TYR HE1 H -4.124 -4.809 5.071 1.00 . A A . 3 TYR HE1 1 1 40 7341 1 1 4 TYR HE2 H -4.006 -0.599 5.914 1.00 . A A . 3 TYR HE2 1 1 40 7342 1 1 4 TYR HH H -2.815 -2.317 7.070 1.00 . A A . 3 TYR HH 1 1 40 7343 1 1 4 TYR N N -4.043 -3.135 0.525 1.00 . A A . 3 TYR N 1 1 40 7344 1 1 4 TYR O O -3.351 0.238 0.448 1.00 . A A . 3 TYR O 1 1 40 7345 1 1 4 TYR OH O -3.466 -2.997 6.878 1.00 . A A . 3 TYR OH 1 1 40 7346 1 1 5 TRP C C -1.328 0.945 1.570 1.00 . A A . 4 TRP C 1 1 40 7347 1 1 5 TRP CA C -1.696 -0.068 2.654 1.00 . A A . 4 TRP CA 1 1 40 7348 1 1 5 TRP CB C -0.477 -0.950 2.937 1.00 . A A . 4 TRP CB 1 1 40 7349 1 1 5 TRP CD1 C -1.535 -2.775 4.348 1.00 . A A . 4 TRP CD1 1 1 40 7350 1 1 5 TRP CD2 C 0.045 -1.630 5.453 1.00 . A A . 4 TRP CD2 1 1 40 7351 1 1 5 TRP CE2 C -0.452 -2.600 6.352 1.00 . A A . 4 TRP CE2 1 1 40 7352 1 1 5 TRP CE3 C 1.057 -0.772 5.900 1.00 . A A . 4 TRP CE3 1 1 40 7353 1 1 5 TRP CG C -0.665 -1.754 4.189 1.00 . A A . 4 TRP CG 1 1 40 7354 1 1 5 TRP CH2 C 1.051 -1.850 8.083 1.00 . A A . 4 TRP CH2 1 1 40 7355 1 1 5 TRP CZ2 C 0.042 -2.716 7.652 1.00 . A A . 4 TRP CZ2 1 1 40 7356 1 1 5 TRP CZ3 C 1.559 -0.880 7.207 1.00 . A A . 4 TRP CZ3 1 1 40 7357 1 1 5 TRP H H -2.939 -1.831 2.682 1.00 . A A . 4 TRP H 1 1 40 7358 1 1 5 TRP HA H -2.000 0.437 3.557 1.00 . A A . 4 TRP HA 1 1 40 7359 1 1 5 TRP HB2 H -0.325 -1.614 2.109 1.00 . A A . 4 TRP HB2 1 1 40 7360 1 1 5 TRP HB3 H 0.395 -0.321 3.048 1.00 . A A . 4 TRP HB3 1 1 40 7361 1 1 5 TRP HD1 H -2.214 -3.148 3.599 1.00 . A A . 4 TRP HD1 1 1 40 7362 1 1 5 TRP HE1 H -1.932 -4.019 6.001 1.00 . A A . 4 TRP HE1 1 1 40 7363 1 1 5 TRP HE3 H 1.452 -0.030 5.230 1.00 . A A . 4 TRP HE3 1 1 40 7364 1 1 5 TRP HH2 H 1.440 -1.929 9.088 1.00 . A A . 4 TRP HH2 1 1 40 7365 1 1 5 TRP HZ2 H -0.355 -3.465 8.319 1.00 . A A . 4 TRP HZ2 1 1 40 7366 1 1 5 TRP HZ3 H 2.339 -0.211 7.540 1.00 . A A . 4 TRP HZ3 1 1 40 7367 1 1 5 TRP N N -2.779 -1.014 2.184 1.00 . A A . 4 TRP N 1 1 40 7368 1 1 5 TRP NE1 N -1.409 -3.277 5.631 1.00 . A A . 4 TRP NE1 1 1 40 7369 1 1 5 TRP O O -1.382 2.143 1.767 1.00 . A A . 4 TRP O 1 1 40 7370 1 1 6 LEU C C -1.415 2.615 -0.746 1.00 . A A . 5 LEU C 1 1 40 7371 1 1 6 LEU CA C -0.570 1.331 -0.715 1.00 . A A . 5 LEU CA 1 1 40 7372 1 1 6 LEU CB C -0.848 0.459 -1.940 1.00 . A A . 5 LEU CB 1 1 40 7373 1 1 6 LEU CD1 C 0.468 2.007 -3.389 1.00 . A A . 5 LEU CD1 1 1 40 7374 1 1 6 LEU CD2 C -1.158 0.399 -4.405 1.00 . A A . 5 LEU CD2 1 1 40 7375 1 1 6 LEU CG C -0.881 1.311 -3.205 1.00 . A A . 5 LEU CG 1 1 40 7376 1 1 6 LEU H H -0.924 -0.521 0.310 1.00 . A A . 5 LEU H 1 1 40 7377 1 1 6 LEU HA H 0.479 1.571 -0.669 1.00 . A A . 5 LEU HA 1 1 40 7378 1 1 6 LEU HB2 H -0.070 -0.285 -2.032 1.00 . A A . 5 LEU HB2 1 1 40 7379 1 1 6 LEU HB3 H -1.801 -0.034 -1.817 1.00 . A A . 5 LEU HB3 1 1 40 7380 1 1 6 LEU HD11 H 1.260 1.275 -3.343 1.00 . A A . 5 LEU HD11 1 1 40 7381 1 1 6 LEU HD12 H 0.490 2.503 -4.348 1.00 . A A . 5 LEU HD12 1 1 40 7382 1 1 6 LEU HD13 H 0.606 2.737 -2.604 1.00 . A A . 5 LEU HD13 1 1 40 7383 1 1 6 LEU HD21 H -1.496 -0.566 -4.052 1.00 . A A . 5 LEU HD21 1 1 40 7384 1 1 6 LEU HD22 H -1.922 0.842 -5.026 1.00 . A A . 5 LEU HD22 1 1 40 7385 1 1 6 LEU HD23 H -0.252 0.273 -4.979 1.00 . A A . 5 LEU HD23 1 1 40 7386 1 1 6 LEU HG H -1.663 2.051 -3.123 1.00 . A A . 5 LEU HG 1 1 40 7387 1 1 6 LEU N N -0.954 0.451 0.425 1.00 . A A . 5 LEU N 1 1 40 7388 1 1 6 LEU O O -0.892 3.707 -0.841 1.00 . A A . 5 LEU O 1 1 40 7389 1 1 7 ALA C C -3.858 4.263 0.679 1.00 . A A . 6 ALA C 1 1 40 7390 1 1 7 ALA CA C -3.581 3.715 -0.729 1.00 . A A . 6 ALA CA 1 1 40 7391 1 1 7 ALA CB C -4.884 3.243 -1.376 1.00 . A A . 6 ALA CB 1 1 40 7392 1 1 7 ALA H H -3.123 1.607 -0.619 1.00 . A A . 6 ALA H 1 1 40 7393 1 1 7 ALA HA H -3.125 4.475 -1.343 1.00 . A A . 6 ALA HA 1 1 40 7394 1 1 7 ALA HB1 H -4.844 2.174 -1.525 1.00 . A A . 6 ALA HB1 1 1 40 7395 1 1 7 ALA HB2 H -5.714 3.486 -0.729 1.00 . A A . 6 ALA HB2 1 1 40 7396 1 1 7 ALA HB3 H -5.013 3.736 -2.328 1.00 . A A . 6 ALA HB3 1 1 40 7397 1 1 7 ALA N N -2.715 2.495 -0.684 1.00 . A A . 6 ALA N 1 1 40 7398 1 1 7 ALA O O -4.776 5.033 0.877 1.00 . A A . 6 ALA O 1 1 40 7399 1 1 8 HIS C C -2.071 4.988 3.629 1.00 . A A . 7 HIS C 1 1 40 7400 1 1 8 HIS CA C -3.346 4.375 3.040 1.00 . A A . 7 HIS CA 1 1 40 7401 1 1 8 HIS CB C -3.782 3.147 3.851 1.00 . A A . 7 HIS CB 1 1 40 7402 1 1 8 HIS CD2 C -4.800 1.863 1.793 1.00 . A A . 7 HIS CD2 1 1 40 7403 1 1 8 HIS CE1 C -6.669 1.241 2.685 1.00 . A A . 7 HIS CE1 1 1 40 7404 1 1 8 HIS CG C -4.800 2.349 3.075 1.00 . A A . 7 HIS CG 1 1 40 7405 1 1 8 HIS H H -2.358 3.241 1.492 1.00 . A A . 7 HIS H 1 1 40 7406 1 1 8 HIS HA H -4.140 5.106 3.030 1.00 . A A . 7 HIS HA 1 1 40 7407 1 1 8 HIS HB2 H -2.922 2.526 4.054 1.00 . A A . 7 HIS HB2 1 1 40 7408 1 1 8 HIS HB3 H -4.218 3.471 4.784 1.00 . A A . 7 HIS HB3 1 1 40 7409 1 1 8 HIS HD1 H -6.318 2.124 4.540 1.00 . A A . 7 HIS HD1 1 1 40 7410 1 1 8 HIS HD2 H -4.005 1.997 1.083 1.00 . A A . 7 HIS HD2 1 1 40 7411 1 1 8 HIS HE1 H -7.636 0.787 2.829 1.00 . A A . 7 HIS HE1 1 1 40 7412 1 1 8 HIS HE2 H -6.240 0.720 0.723 1.00 . A A . 7 HIS HE2 1 1 40 7413 1 1 8 HIS N N -3.091 3.870 1.659 1.00 . A A . 7 HIS N 1 1 40 7414 1 1 8 HIS ND1 N -6.006 1.939 3.630 1.00 . A A . 7 HIS ND1 1 1 40 7415 1 1 8 HIS NE2 N -5.975 1.169 1.553 1.00 . A A . 7 HIS NE2 1 1 40 7416 1 1 8 HIS O O -1.954 6.190 3.758 1.00 . A A . 7 HIS O 1 1 40 7417 1 1 9 LYS C C -0.175 5.809 5.579 1.00 . A A . 8 LYS C 1 1 40 7418 1 1 9 LYS CA C 0.142 4.714 4.563 1.00 . A A . 8 LYS CA 1 1 40 7419 1 1 9 LYS CB C 0.908 5.290 3.372 1.00 . A A . 8 LYS CB 1 1 40 7420 1 1 9 LYS CD C 1.725 3.020 2.727 1.00 . A A . 8 LYS CD 1 1 40 7421 1 1 9 LYS CE C 2.465 2.388 1.546 1.00 . A A . 8 LYS CE 1 1 40 7422 1 1 9 LYS CG C 0.957 4.254 2.249 1.00 . A A . 8 LYS CG 1 1 40 7423 1 1 9 LYS H H -1.220 3.214 3.877 1.00 . A A . 8 LYS H 1 1 40 7424 1 1 9 LYS HA H 0.716 3.926 5.024 1.00 . A A . 8 LYS HA 1 1 40 7425 1 1 9 LYS HB2 H 0.407 6.182 3.021 1.00 . A A . 8 LYS HB2 1 1 40 7426 1 1 9 LYS HB3 H 1.914 5.538 3.677 1.00 . A A . 8 LYS HB3 1 1 40 7427 1 1 9 LYS HD2 H 2.437 3.311 3.485 1.00 . A A . 8 LYS HD2 1 1 40 7428 1 1 9 LYS HD3 H 1.032 2.303 3.140 1.00 . A A . 8 LYS HD3 1 1 40 7429 1 1 9 LYS HE2 H 2.574 1.323 1.699 1.00 . A A . 8 LYS HE2 1 1 40 7430 1 1 9 LYS HE3 H 1.942 2.585 0.623 1.00 . A A . 8 LYS HE3 1 1 40 7431 1 1 9 LYS HG2 H -0.049 3.971 1.976 1.00 . A A . 8 LYS HG2 1 1 40 7432 1 1 9 LYS HG3 H 1.458 4.677 1.390 1.00 . A A . 8 LYS HG3 1 1 40 7433 1 1 9 LYS HZ1 H 4.172 3.106 2.497 1.00 . A A . 8 LYS HZ1 1 1 40 7434 1 1 9 LYS HZ2 H 4.453 2.502 0.937 1.00 . A A . 8 LYS HZ2 1 1 40 7435 1 1 9 LYS HZ3 H 3.702 4.012 1.138 1.00 . A A . 8 LYS HZ3 1 1 40 7436 1 1 9 LYS N N -1.114 4.174 3.987 1.00 . A A . 8 LYS N 1 1 40 7437 1 1 9 LYS NZ N 3.798 3.052 1.528 1.00 . A A . 8 LYS NZ 1 1 40 7438 1 1 9 LYS O O -1.258 5.876 6.126 1.00 . A A . 8 LYS O 1 1 40 7439 1 1 10 ALA C C -0.026 8.998 6.095 1.00 . A A . 9 ALA C 1 1 40 7440 1 1 10 ALA CA C 0.539 7.766 6.808 1.00 . A A . 9 ALA CA 1 1 40 7441 1 1 10 ALA CB C 1.919 8.069 7.391 1.00 . A A . 9 ALA CB 1 1 40 7442 1 1 10 ALA H H 1.625 6.582 5.371 1.00 . A A . 9 ALA H 1 1 40 7443 1 1 10 ALA HA H -0.130 7.444 7.590 1.00 . A A . 9 ALA HA 1 1 40 7444 1 1 10 ALA HB1 H 2.671 7.531 6.833 1.00 . A A . 9 ALA HB1 1 1 40 7445 1 1 10 ALA HB2 H 2.112 9.129 7.329 1.00 . A A . 9 ALA HB2 1 1 40 7446 1 1 10 ALA HB3 H 1.949 7.759 8.426 1.00 . A A . 9 ALA HB3 1 1 40 7447 1 1 10 ALA N N 0.766 6.665 5.830 1.00 . A A . 9 ALA N 1 1 40 7448 1 1 10 ALA O O 0.517 10.081 6.183 1.00 . A A . 9 ALA O 1 1 40 7449 1 1 11 LEU C C -3.052 10.383 5.286 1.00 . A A . 10 LEU C 1 1 40 7450 1 1 11 LEU CA C -1.706 10.001 4.666 1.00 . A A . 10 LEU CA 1 1 40 7451 1 1 11 LEU CB C -1.897 9.520 3.228 1.00 . A A . 10 LEU CB 1 1 40 7452 1 1 11 LEU CD1 C 0.311 9.570 2.064 1.00 . A A . 10 LEU CD1 1 1 40 7453 1 1 11 LEU CD2 C -1.706 10.541 0.956 1.00 . A A . 10 LEU CD2 1 1 40 7454 1 1 11 LEU CG C -0.995 10.329 2.295 1.00 . A A . 10 LEU CG 1 1 40 7455 1 1 11 LEU H H -1.532 7.957 5.324 1.00 . A A . 10 LEU H 1 1 40 7456 1 1 11 LEU HA H -1.030 10.842 4.685 1.00 . A A . 10 LEU HA 1 1 40 7457 1 1 11 LEU HB2 H -1.639 8.473 3.161 1.00 . A A . 10 LEU HB2 1 1 40 7458 1 1 11 LEU HB3 H -2.928 9.657 2.936 1.00 . A A . 10 LEU HB3 1 1 40 7459 1 1 11 LEU HD11 H 0.776 9.354 3.014 1.00 . A A . 10 LEU HD11 1 1 40 7460 1 1 11 LEU HD12 H 0.104 8.645 1.546 1.00 . A A . 10 LEU HD12 1 1 40 7461 1 1 11 LEU HD13 H 0.979 10.175 1.466 1.00 . A A . 10 LEU HD13 1 1 40 7462 1 1 11 LEU HD21 H -2.758 10.711 1.130 1.00 . A A . 10 LEU HD21 1 1 40 7463 1 1 11 LEU HD22 H -1.282 11.398 0.455 1.00 . A A . 10 LEU HD22 1 1 40 7464 1 1 11 LEU HD23 H -1.581 9.664 0.339 1.00 . A A . 10 LEU HD23 1 1 40 7465 1 1 11 LEU HG H -0.779 11.287 2.746 1.00 . A A . 10 LEU HG 1 1 40 7466 1 1 11 LEU N N -1.110 8.839 5.386 1.00 . A A . 10 LEU N 1 1 40 7467 1 1 11 LEU O O -3.582 9.682 6.126 1.00 . A A . 10 LEU O 1 1 40 7468 1 1 12 ALA C C -4.818 12.078 6.961 1.00 . A A . 11 ALA C 1 1 40 7469 1 1 12 ALA CA C -4.920 11.924 5.442 1.00 . A A . 11 ALA CA 1 1 40 7470 1 1 12 ALA CB C -5.898 10.805 5.081 1.00 . A A . 11 ALA CB 1 1 40 7471 1 1 12 ALA H H -3.162 12.041 4.201 1.00 . A A . 11 ALA H 1 1 40 7472 1 1 12 ALA HA H -5.236 12.849 4.990 1.00 . A A . 11 ALA HA 1 1 40 7473 1 1 12 ALA HB1 H -5.348 9.947 4.722 1.00 . A A . 11 ALA HB1 1 1 40 7474 1 1 12 ALA HB2 H -6.467 10.528 5.956 1.00 . A A . 11 ALA HB2 1 1 40 7475 1 1 12 ALA HB3 H -6.569 11.150 4.309 1.00 . A A . 11 ALA HB3 1 1 40 7476 1 1 12 ALA N N -3.608 11.491 4.879 1.00 . A A . 11 ALA N 1 1 40 7477 1 1 12 ALA O O -3.781 11.833 7.545 1.00 . A A . 11 ALA O 1 1 40 7478 1 1 13 NH2 HN1 H -6.700 12.674 7.165 1.00 . A A . 12 NH2 HN1 1 1 40 7479 1 1 13 NH2 HN2 H -5.810 12.578 8.607 1.00 . A A . 12 NH2 HN2 1 1 40 7480 1 1 13 NH2 N N -5.863 12.477 7.633 1.00 . A A . 12 NH2 N 1 1 stop_ save_
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